#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3o s TYR 6 N 0.00 1.15 -0.07 3.10 2.02 -0.86 -4.22 117.35 118.47 3h3o s TYR 6 Ca 0.00 -0.73 0.03 0.00 -0.37 0.00 0.00 57.07 56.00 3h3o s TYR 6 Cb 0.00 -0.61 0.01 0.00 -0.40 0.00 0.00 41.96 40.96 3h3o s TYR 6 CO 0.00 0.02 -0.16 0.08 -1.57 0.00 0.00 175.55 173.92 3h3o s VAL 7 N -2.99 1.43 -0.13 0.71 1.01 -0.18 0.23 120.40 120.49 3h3o s VAL 7 Ca 0.12 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 3h3o s VAL 7 Cb 0.01 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 3h3o s VAL 7 CO -0.00 0.42 -0.08 -0.32 0.00 0.00 0.00 175.10 175.12 3h3o s MET 8 N 0.40 3.40 -0.25 2.72 1.75 -0.62 0.20 119.30 126.90 3h3o s MET 8 Ca -0.12 -0.58 -0.01 0.00 -1.25 0.00 0.00 55.69 53.73 3h3o s MET 8 Cb -0.15 -2.75 0.03 0.00 2.84 0.00 0.00 34.83 34.80 3h3o s MET 8 CO 0.04 0.31 -0.08 0.00 -0.65 0.00 0.00 175.02 174.65 3h3o s ALA 9 N 0.13 2.66 -0.22 4.11 0.00 -0.47 -0.10 121.76 127.87 3h3o s ALA 9 Ca -0.03 -1.49 -0.11 0.00 0.00 0.00 0.00 51.96 50.32 3h3o s ALA 9 Cb -0.14 -1.65 -0.05 0.00 0.00 0.00 0.00 23.12 21.28 3h3o s ALA 9 CO 0.04 -0.84 0.17 -1.50 0.00 0.00 0.00 175.76 173.62 3h3o s ILE 10 N 1.29 5.36 -0.34 0.00 -1.16 0.73 -1.85 121.20 125.23 3h3o s ILE 10 Ca -0.01 0.23 0.01 0.00 -0.51 0.00 0.00 60.65 60.37 3h3o s ILE 10 Cb -0.17 -3.51 0.09 0.00 0.61 0.00 0.00 42.46 39.48 3h3o s ILE 10 CO -0.05 0.37 0.06 -0.62 -2.81 0.00 0.00 174.94 171.89 3h3o s ASP 11 N 0.83 4.89 -0.58 4.50 2.15 0.15 -1.39 116.67 127.22 3h3o s ASP 11 Ca 0.09 -1.85 -0.20 0.00 0.43 0.00 0.00 52.55 51.01 3h3o s ASP 11 Cb -0.13 -1.69 0.07 0.00 -0.30 0.00 0.00 42.92 40.88 3h3o s ASP 11 CO 0.03 -0.38 0.77 -1.58 -0.17 0.00 0.00 175.17 173.84 3h3o s GLN 12 N 1.06 3.12 0.35 4.34 -0.44 -0.64 -0.46 119.66 126.98 3h3o s GLN 12 Ca 0.04 -0.95 0.00 0.00 -2.50 0.00 0.00 55.36 51.95 3h3o s GLN 12 Cb -0.20 -4.18 0.07 0.00 -1.64 0.00 0.00 33.01 27.05 3h3o s GLN 12 CO -0.05 -1.50 0.48 0.41 0.50 0.00 0.00 175.29 175.12 3h3o n GLY 13 N 5.24 0.76 0.14 2.59 0.00 0.63 -1.93 105.19 112.61 3h3o n GLY 13 Ca -0.06 -2.00 -0.11 0.00 0.00 0.00 0.00 46.02 43.85 3h3o n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3h3o h THR 14 N -0.47 1.24 0.00 2.61 2.02 -1.96 -3.35 112.91 113.00 3h3o h THR 14 Ca -0.16 -0.82 0.00 0.00 0.77 0.00 0.00 66.41 66.20 3h3o h THR 14 Cb 0.59 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 3h3o h THR 14 CO 0.17 0.25 -0.53 0.35 0.37 0.00 0.00 175.52 176.14 3h3o n THR 15 N -4.69 0.00 -3.70 3.16 -2.24 -1.26 -4.98 114.28 100.57 3h3o n THR 15 Ca -0.04 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.37 3h3o n THR 15 Cb 0.21 0.95 -0.04 0.00 -2.10 0.00 0.00 70.33 69.35 3h3o n THR 15 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3h3o s SER 16 N -1.99 -0.29 -0.02 3.42 1.04 -1.26 -2.59 113.70 112.01 3h3o s SER 16 Ca 0.03 -0.42 0.08 0.00 0.48 0.00 0.00 55.95 56.12 3h3o s SER 16 Cb 0.07 0.57 -0.02 0.00 0.10 0.00 0.00 66.02 66.74 3h3o s SER 16 CO 0.39 -1.03 -0.25 -0.44 0.98 0.00 0.00 173.24 172.89 3h3o s SER 17 N -2.85 2.98 0.05 7.02 0.01 0.97 -0.27 113.70 121.61 3h3o s SER 17 Ca 0.08 -0.46 0.03 0.00 1.31 0.00 0.00 55.95 56.91 3h3o s SER 17 Cb -0.01 -0.33 -0.03 0.00 0.21 0.00 0.00 66.02 65.87 3h3o s SER 17 CO -0.05 0.31 -0.10 -0.60 0.41 0.00 0.00 173.24 173.21 3h3o s ARG 18 N -0.60 0.65 -0.04 12.44 3.52 0.39 -0.77 118.95 134.54 3h3o s ARG 18 Ca 0.10 -0.81 0.02 0.00 -0.13 0.00 0.00 55.73 54.90 3h3o s ARG 18 Cb -0.10 -0.52 0.01 0.00 -1.56 0.00 0.00 34.95 32.78 3h3o s ARG 18 CO -0.01 0.11 -0.08 0.00 -0.81 0.00 0.00 175.30 174.51 3h3o s ALA 19 N -1.28 0.89 0.06 6.12 0.00 -0.45 0.31 121.76 127.41 3h3o s ALA 19 Ca -0.06 -0.26 0.06 0.00 0.00 0.00 0.00 51.96 51.70 3h3o s ALA 19 Cb -0.10 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.59 3h3o s ALA 19 CO 0.01 0.09 -0.17 0.42 0.00 0.00 0.00 175.76 176.11 3h3o s ILE 20 N 0.53 1.35 -0.17 0.00 1.01 -0.77 -1.25 121.20 121.90 3h3o s ILE 20 Ca -0.09 -1.19 -0.00 0.00 0.00 0.00 0.00 60.65 59.37 3h3o s ILE 20 Cb -0.12 -1.22 0.00 0.00 0.01 0.00 0.00 42.46 41.13 3h3o s ILE 20 CO 0.01 0.01 -0.14 -0.63 0.00 0.00 0.00 174.94 174.19 3h3o s ILE 21 N -0.96 2.68 0.30 2.92 1.01 -0.09 -1.37 121.20 125.70 3h3o s ILE 21 Ca 0.03 -0.75 0.09 0.00 0.00 0.00 0.00 60.65 60.02 3h3o s ILE 21 Cb -0.09 -2.15 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 3h3o s ILE 21 CO 0.02 0.50 0.07 -0.36 0.00 0.00 0.00 174.94 175.18 3h3o s PHE 22 N 1.03 2.71 0.48 3.97 0.08 0.13 -0.33 117.98 126.06 3h3o s PHE 22 Ca -0.01 -0.30 0.05 0.00 0.12 0.00 0.00 56.93 56.79 3h3o s PHE 22 Cb -0.15 -1.42 -0.01 0.00 -0.57 0.00 0.00 43.02 40.87 3h3o s PHE 22 CO -0.03 0.48 0.23 0.16 -0.10 0.00 0.00 175.22 175.95 3h3o s ASP 23 N -3.76 4.44 0.56 1.36 1.47 -1.12 -1.01 116.67 118.61 3h3o s ASP 23 Ca 0.34 -1.27 0.35 0.00 1.18 0.00 0.00 52.55 53.15 3h3o s ASP 23 Cb -0.04 0.08 1.50 0.00 -0.34 0.00 0.00 42.92 44.11 3h3o s ASP 23 CO 0.21 -0.82 1.78 -0.09 0.68 0.00 0.00 175.17 176.93 3h3o h ARG 24 N 1.15 0.00 -0.14 2.11 9.65 -1.93 0.24 114.38 125.46 3h3o h ARG 24 Ca -0.41 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.47 3h3o h ARG 24 Cb 1.29 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 3h3o h ARG 24 CO 0.66 0.00 0.00 0.09 2.80 0.00 0.00 179.97 183.52 3h3o n ASN 25 N -4.03 1.45 -1.10 -3.80 3.02 -1.26 -4.91 115.26 104.64 3h3o n ASN 25 Ca 0.23 -1.67 -0.09 0.00 -0.03 0.00 0.00 54.58 53.02 3h3o n ASN 25 Cb 1.18 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 40.26 3h3o n ASN 25 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h3o n GLY 26 N 1.09 0.05 3.72 7.41 0.00 0.84 -5.01 105.19 113.28 3h3o n GLY 26 Ca 0.16 -0.49 -0.35 0.00 0.00 0.00 0.00 46.02 45.34 3h3o n GLY 26 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h3o s LYS 27 N -4.58 4.13 -0.09 1.61 2.20 -1.25 -4.88 119.74 116.89 3h3o s LYS 27 Ca 0.03 -0.24 -0.29 0.00 -0.36 0.00 0.00 55.97 55.11 3h3o s LYS 27 Cb -0.01 -3.38 -0.06 0.00 -1.51 0.00 0.00 37.83 32.87 3h3o s LYS 27 CO 0.04 0.31 1.92 0.21 -0.36 0.00 0.00 175.35 177.47 3h3o s LYS 28 N 0.33 3.83 -0.15 4.03 2.20 -1.26 -2.81 119.74 125.92 3h3o s LYS 28 Ca 0.07 2.24 0.13 0.00 -0.36 0.00 0.00 55.97 58.05 3h3o s LYS 28 Cb -0.11 -4.17 -0.24 0.00 -1.51 0.00 0.00 37.83 31.80 3h3o s LYS 28 CO -0.02 -1.29 0.24 -0.89 -0.36 0.00 0.00 175.35 173.04 3h3o n ILE 29 N 6.24 1.49 -3.62 5.43 2.08 0.55 -5.01 119.36 126.53 3h3o n ILE 29 Ca 0.22 -0.80 -0.04 0.00 0.56 0.00 0.00 62.75 62.69 3h3o n ILE 29 Cb 0.43 -0.82 -0.01 0.00 -0.75 0.00 0.00 39.64 38.48 3h3o n ILE 29 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 3h3o s GLY 30 N -5.49 -0.35 -0.17 7.39 0.00 -1.19 -4.55 107.32 102.97 3h3o s GLY 30 Ca -0.12 0.86 -0.33 0.00 0.00 0.00 0.00 44.72 45.14 3h3o s GLY 30 CO 0.80 0.25 1.15 -1.35 0.00 0.00 0.00 173.10 173.95 3h3o s SER 31 N -2.65 -0.19 0.07 1.64 1.04 -1.26 -0.91 113.70 111.45 3h3o s SER 31 Ca 0.10 0.05 0.01 0.00 0.48 0.00 0.00 55.95 56.59 3h3o s SER 31 Cb 0.00 0.19 -0.04 0.00 0.10 0.00 0.00 66.02 66.27 3h3o s SER 31 CO -0.04 -0.28 -0.05 -0.55 0.98 0.00 0.00 173.24 173.30 3h3o s SER 32 N -1.97 0.81 -0.11 7.02 0.15 -0.38 -4.57 113.70 114.65 3h3o s SER 32 Ca 0.07 -0.90 -0.09 0.00 0.70 0.00 0.00 55.95 55.74 3h3o s SER 32 Cb -0.01 0.12 0.03 0.00 -1.71 0.00 0.00 66.02 64.46 3h3o s SER 32 CO -0.05 -0.46 0.29 -1.58 1.20 0.00 0.00 173.24 172.64 3h3o s GLN 33 N -3.34 0.31 -0.04 5.44 0.74 -1.26 -1.34 119.66 120.17 3h3o s GLN 33 Ca 0.05 0.47 -0.08 0.00 0.05 0.00 0.00 55.36 55.84 3h3o s GLN 33 Cb 0.03 0.08 0.01 0.00 1.10 0.00 0.00 33.01 34.24 3h3o s GLN 33 CO -0.05 -0.08 0.19 0.21 -0.55 0.00 0.00 175.29 175.01 3h3o s LYS 34 N 0.51 0.38 0.26 1.67 2.20 0.05 -4.99 119.74 119.83 3h3o s LYS 34 Ca -0.03 -0.02 0.01 0.00 -0.36 0.00 0.00 55.97 55.57 3h3o s LYS 34 Cb -0.04 0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.41 3h3o s LYS 34 CO -0.03 -0.08 0.45 -1.21 -0.36 0.00 0.00 175.35 174.12 3h3o s GLU 35 N -0.60 3.50 0.13 4.03 2.02 -1.26 -0.02 118.70 126.50 3h3o s GLU 35 Ca -0.07 -0.40 0.04 0.00 0.02 0.00 0.00 54.97 54.56 3h3o s GLU 35 Cb -0.04 -2.78 -0.04 0.00 0.10 0.00 0.00 34.13 31.37 3h3o s GLU 35 CO 0.01 0.31 -0.11 -0.59 0.02 0.00 0.00 175.26 174.91 3h3o s PHE 36 N -2.05 1.23 0.21 1.61 -0.12 -1.07 -4.93 117.98 112.85 3h3o s PHE 36 Ca 0.38 -0.71 -0.32 0.00 -0.05 0.00 0.00 56.93 56.23 3h3o s PHE 36 Cb -0.10 -0.64 -0.14 0.00 -0.63 0.00 0.00 43.02 41.51 3h3o s PHE 36 CO 0.31 0.07 1.36 -2.30 -0.05 0.00 0.00 175.22 174.61 3h3o n PRO 37 N 0.06 1.79 -4.66 1.99 -0.02 -1.26 -4.84 135.00 128.06 3h3o n PRO 37 Ca -0.12 0.64 -0.33 0.00 -2.02 0.00 0.00 63.50 61.66 3h3o n PRO 37 Cb 0.60 -2.27 -0.13 0.00 -0.02 0.00 0.00 33.50 31.68 3h3o n PRO 37 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3h3o s GLN 38 N -0.21 3.13 -0.04 -0.52 -1.52 -1.26 -4.61 119.66 114.63 3h3o s GLN 38 Ca 0.71 -0.60 0.05 0.00 -1.95 0.00 0.00 55.36 53.57 3h3o s GLN 38 Cb -0.72 -2.65 -0.02 0.00 -0.22 0.00 0.00 33.01 29.40 3h3o s GLN 38 CO 0.49 0.42 -0.19 0.71 -0.25 0.00 0.00 175.29 176.47 3h3o s TYR 39 N -0.17 2.56 -0.47 0.91 2.02 -0.88 -5.00 117.35 116.32 3h3o s TYR 39 Ca 0.01 -0.27 0.05 0.00 -0.37 0.00 0.00 57.07 56.49 3h3o s TYR 39 Cb -0.13 -1.58 0.19 0.00 -0.40 0.00 0.00 41.96 40.03 3h3o s TYR 39 CO 0.03 0.09 0.43 1.19 -1.57 0.00 0.00 175.55 175.72 3h3o n PHE 40 N 2.38 0.19 0.24 2.71 3.72 -1.26 -1.62 117.46 123.82 3h3o n PHE 40 Ca -0.17 -3.58 0.11 0.00 -0.05 0.00 0.00 57.45 53.76 3h3o n PHE 40 Cb 0.52 -0.05 0.62 0.00 -0.94 0.00 0.00 39.48 39.62 3h3o n PHE 40 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3h3o h PRO 41 N 5.20 0.00 -2.69 -1.08 0.13 -1.98 -3.44 132.00 128.15 3h3o h PRO 41 Ca 0.21 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.23 3h3o h PRO 41 Cb 0.86 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 31.78 3h3o h PRO 41 CO 0.48 0.17 -0.15 0.15 -0.23 0.00 0.00 178.00 178.42 3h3o s LYS 42 N -4.03 0.69 0.13 0.86 1.02 -1.26 -5.06 119.74 112.09 3h3o s LYS 42 Ca -0.02 0.20 -0.35 0.00 0.02 0.00 0.00 55.97 55.82 3h3o s LYS 42 Cb 0.12 0.32 -0.17 0.00 -0.52 0.00 0.00 37.83 37.59 3h3o s LYS 42 CO 0.61 -0.17 1.15 0.45 -0.92 0.00 0.00 175.35 176.48 3h3o n SER 43 N 1.77 1.05 0.00 2.83 2.88 -1.26 0.32 113.62 121.21 3h3o n SER 43 Ca -0.18 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 3h3o n SER 43 Cb 0.56 -1.15 0.00 0.00 -0.75 0.00 0.00 64.21 62.88 3h3o n SER 43 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3h3o n GLY 44 N 2.07 2.53 3.71 0.46 0.00 -1.26 -5.00 105.19 107.70 3h3o n GLY 44 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3h3o n GLY 44 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h3o s TRP 45 N -2.36 3.46 -0.11 1.61 0.52 0.15 -1.15 118.94 121.06 3h3o s TRP 45 Ca 0.00 0.75 -0.01 0.00 0.02 0.00 0.00 56.10 56.86 3h3o s TRP 45 Cb 0.00 -2.50 0.03 0.00 -1.15 0.00 0.00 33.47 29.85 3h3o s TRP 45 CO 0.00 0.13 -0.06 0.08 0.02 0.00 0.00 176.95 177.12 3h3o s VAL 46 N 0.80 0.90 0.23 4.03 1.01 -1.26 -4.17 120.40 121.94 3h3o s VAL 46 Ca 0.22 -0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.05 3h3o s VAL 46 Cb -0.14 -0.95 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 3h3o s VAL 46 CO 0.08 0.34 -0.09 -1.61 0.00 0.00 0.00 175.10 173.82 3h3o s GLU 47 N 1.76 1.37 0.06 2.72 2.02 -0.64 -1.67 118.70 124.32 3h3o s GLU 47 Ca 0.05 -1.65 0.03 0.00 0.02 0.00 0.00 54.97 53.42 3h3o s GLU 47 Cb -0.13 -1.02 -0.03 0.00 0.10 0.00 0.00 34.13 33.06 3h3o s GLU 47 CO -0.08 0.09 -0.10 -1.01 0.02 0.00 0.00 175.26 174.18 3h3o s HIS 48 N -3.08 0.89 -0.51 1.61 3.76 -0.56 -2.06 115.29 115.34 3h3o s HIS 48 Ca 0.25 -0.52 -0.16 0.00 -0.15 0.00 0.00 55.06 54.49 3h3o s HIS 48 Cb 0.02 -0.51 0.11 0.00 1.11 0.00 0.00 32.58 33.30 3h3o s HIS 48 CO 0.08 -0.03 0.45 1.21 -0.85 0.00 0.00 174.74 175.60 3h3o s ASN 49 N -1.77 6.16 0.42 1.40 3.84 -1.26 0.32 114.94 124.05 3h3o s ASN 49 Ca -0.05 -1.60 0.21 0.00 0.21 0.00 0.00 52.86 51.64 3h3o s ASN 49 Cb -0.09 -2.19 1.18 0.00 -0.55 0.00 0.00 41.25 39.60 3h3o s ASN 49 CO 0.01 -0.76 1.77 0.00 -2.79 0.00 0.00 177.10 175.33 3h3o h ALA 50 N 8.82 2.37 0.00 1.71 0.00 -1.94 0.42 119.26 130.65 3h3o h ALA 50 Ca -0.29 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 3h3o h ALA 50 Cb 1.10 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 3h3o h ALA 50 CO 0.97 -0.77 -0.18 -0.91 0.00 0.00 0.00 179.25 178.36 3h3o h ASN 51 N 0.32 0.00 0.70 0.00 2.35 -1.99 -0.43 115.58 116.53 3h3o h ASN 51 Ca 0.59 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 56.08 3h3o h ASN 51 Cb 1.64 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 40.00 3h3o h ASN 51 CO -0.26 0.18 -1.24 -0.33 -1.65 0.00 0.00 177.43 174.13 3h3o h GLU 52 N 0.00 0.18 -0.52 0.81 5.08 -0.60 -2.44 114.58 117.09 3h3o h GLU 52 Ca -0.00 -0.30 -0.04 0.00 -1.00 0.00 0.00 59.36 58.01 3h3o h GLU 52 Cb 0.37 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 3h3o h GLU 52 CO 0.02 1.11 0.16 0.82 -1.00 0.00 0.00 179.01 180.12 3h3o h ILE 53 N 0.05 1.23 -0.27 3.13 2.04 -0.71 -0.51 117.51 122.47 3h3o h ILE 53 Ca -0.12 -0.78 0.01 0.00 1.00 0.00 0.00 64.86 64.97 3h3o h ILE 53 Cb 1.92 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 38.74 3h3o h ILE 53 CO 0.17 0.29 0.15 -0.25 0.00 0.00 0.00 178.15 178.50 3h3o h TRP 54 N 0.72 0.27 -0.44 1.37 -0.00 -1.12 -2.27 115.95 114.48 3h3o h TRP 54 Ca 0.17 0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 59.06 3h3o h TRP 54 Cb 0.28 -0.08 -0.02 0.00 -0.00 0.00 0.00 29.16 29.33 3h3o h TRP 54 CO 0.02 0.16 0.23 -0.91 -0.00 0.00 0.00 178.44 177.94 3h3o h ASN 55 N 0.30 0.53 0.18 2.65 4.21 -1.09 0.38 115.58 122.75 3h3o h ASN 55 Ca 0.11 -0.04 -0.12 0.00 1.21 0.00 0.00 56.30 57.46 3h3o h ASN 55 Cb 0.01 -0.13 -0.01 0.00 -1.12 0.00 0.00 38.32 37.06 3h3o h ASN 55 CO -0.06 0.44 -0.43 0.77 -1.29 0.00 0.00 177.43 176.86 3h3o h SER 56 N 0.61 0.34 -0.14 5.81 4.64 -0.66 -1.53 113.55 122.63 3h3o h SER 56 Ca 0.16 -0.15 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 3h3o h SER 56 Cb 0.03 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.02 3h3o h SER 56 CO -0.03 0.74 -0.20 0.58 -0.87 0.00 0.00 176.83 177.05 3h3o h VAL 57 N 0.27 1.36 -0.80 0.95 2.07 -0.78 -1.39 116.25 117.93 3h3o h VAL 57 Ca 0.02 -1.43 0.11 0.00 0.82 0.00 0.00 66.70 66.22 3h3o h VAL 57 Cb 0.88 1.97 -0.08 0.00 -1.52 0.00 0.00 31.29 32.54 3h3o h VAL 57 CO 0.07 0.42 0.43 1.56 0.02 0.00 0.00 177.57 180.08 3h3o h GLN 58 N -0.02 0.68 -0.01 1.57 4.20 -0.80 -0.49 115.11 120.24 3h3o h GLN 58 Ca 0.01 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 3h3o h GLN 58 Cb 0.77 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.39 3h3o h GLN 58 CO 0.05 0.45 0.01 0.77 -0.67 0.00 0.00 178.83 179.43 3h3o h SER 59 N 0.70 0.02 0.64 1.46 0.02 -1.11 -2.38 113.55 112.90 3h3o h SER 59 Ca 0.40 -0.16 -0.06 0.00 -0.84 0.00 0.00 61.79 61.13 3h3o h SER 59 Cb 0.44 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 3h3o h SER 59 CO -0.28 0.18 -0.28 -0.37 -1.14 0.00 0.00 176.83 174.93 3h3o h VAL 60 N -0.14 0.82 -0.18 2.27 -1.51 -0.85 0.30 116.25 116.97 3h3o h VAL 60 Ca 0.00 -1.15 -0.04 0.00 -1.23 0.00 0.00 66.70 64.28 3h3o h VAL 60 Cb 0.16 1.70 -0.01 0.00 -2.13 0.00 0.00 31.29 31.02 3h3o h VAL 60 CO -0.00 0.28 -0.06 0.40 -1.23 0.00 0.00 177.57 176.96 3h3o h ILE 61 N 0.00 1.29 -0.14 7.19 2.04 -0.97 -1.16 117.51 125.77 3h3o h ILE 61 Ca -0.00 -1.05 -0.04 0.00 1.00 0.00 0.00 64.86 64.77 3h3o h ILE 61 Cb 0.68 1.62 -0.00 0.00 -0.74 0.00 0.00 36.82 38.38 3h3o h ILE 61 CO 0.04 0.31 -0.05 0.00 0.00 0.00 0.00 178.15 178.45 3h3o h ALA 62 N 0.71 0.19 -0.80 1.87 0.00 -1.16 -2.86 119.26 117.22 3h3o h ALA 62 Ca 0.04 -0.25 0.13 0.00 0.00 0.00 0.00 54.91 54.84 3h3o h ALA 62 Cb 0.51 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.16 3h3o h ALA 62 CO 0.02 -0.03 0.39 0.78 0.00 0.00 0.00 179.25 180.41 3h3o h GLY 63 N -0.05 1.26 0.99 0.00 0.00 -0.38 -1.04 103.07 103.85 3h3o h GLY 63 Ca 0.03 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.11 3h3o h GLY 63 CO 0.02 -0.03 0.24 0.00 0.00 0.00 0.00 176.54 176.77 3h3o h ALA 64 N 1.53 0.77 -0.45 3.60 0.00 -1.14 -0.36 119.26 123.22 3h3o h ALA 64 Ca 0.43 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 3h3o h ALA 64 Cb 0.59 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3h3o h ALA 64 CO -0.35 0.38 -0.02 0.74 0.00 0.00 0.00 179.25 179.99 3h3o h PHE 65 N 0.82 0.88 -0.59 0.00 0.04 -1.18 -0.94 116.94 115.98 3h3o h PHE 65 Ca 0.20 -0.16 -0.08 0.00 2.80 0.00 0.00 57.97 60.72 3h3o h PHE 65 Cb 0.19 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.09 3h3o h PHE 65 CO 0.01 0.87 0.04 0.82 -0.60 0.00 0.00 178.31 179.45 3h3o h ILE 66 N 0.64 1.26 -0.18 -0.55 2.04 -1.06 0.14 117.51 119.80 3h3o h ILE 66 Ca 0.12 -1.06 -0.18 0.00 1.00 0.00 0.00 64.86 64.74 3h3o h ILE 66 Cb 0.53 0.76 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 3h3o h ILE 66 CO 0.03 0.39 -0.63 -0.08 0.00 0.00 0.00 178.15 177.85 3h3o h GLU 67 N 0.92 0.65 0.14 2.37 4.57 -0.97 -3.31 114.58 118.95 3h3o h GLU 67 Ca 0.18 -0.46 -0.29 0.00 -1.18 0.00 0.00 59.36 57.61 3h3o h GLU 67 Cb 0.48 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 3h3o h GLU 67 CO 0.02 1.08 -1.33 0.66 -1.18 0.00 0.00 179.01 178.26 3h3o h SER 68 N 0.48 0.45 0.00 1.04 4.64 -1.02 -3.47 113.55 115.67 3h3o h SER 68 Ca -0.01 -0.51 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 3h3o h SER 68 Cb 1.22 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 3h3o h SER 68 CO 0.12 1.41 0.00 0.61 -0.87 0.00 0.00 176.83 178.10 3h3o n GLY 69 N 1.58 0.82 3.86 -0.77 0.00 0.48 -4.96 105.19 106.21 3h3o n GLY 69 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 3h3o n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3o s ILE 70 N -2.88 4.67 0.05 -0.61 -1.09 -1.22 -5.04 121.20 115.09 3h3o s ILE 70 Ca 0.00 0.89 -0.01 0.00 -2.23 0.00 0.00 60.65 59.31 3h3o s ILE 70 Cb 0.00 -3.78 -0.04 0.00 -1.58 0.00 0.00 42.46 37.06 3h3o s ILE 70 CO 0.00 -0.80 0.22 -0.13 -1.23 0.00 0.00 174.94 172.99 3h3o s ARG 71 N -4.41 3.46 0.49 2.79 0.52 -1.26 -4.77 118.95 115.75 3h3o s ARG 71 Ca 0.55 -0.39 0.22 0.00 -0.52 0.00 0.00 55.73 55.60 3h3o s ARG 71 Cb -0.10 -3.04 1.26 0.00 0.52 0.00 0.00 34.95 33.59 3h3o s ARG 71 CO 0.39 0.61 1.94 -1.35 0.02 0.00 0.00 175.30 176.91 3h3o h PRO 72 N 3.21 0.18 0.00 3.54 0.11 -1.93 -0.42 132.00 136.69 3h3o h PRO 72 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3h3o h PRO 72 Cb 1.17 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3h3o h PRO 72 CO 0.74 0.12 0.00 -0.85 -0.21 0.00 0.00 178.00 177.80 3h3o n GLU 73 N -4.41 1.00 0.00 1.05 0.28 -1.26 -2.87 120.64 114.43 3h3o n GLU 73 Ca 0.14 0.00 0.10 0.00 -0.16 0.00 0.00 57.16 57.24 3h3o n GLU 73 Cb 0.65 -1.44 -0.05 0.00 1.43 0.00 0.00 31.44 32.03 3h3o n GLU 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3h3o n ALA 74 N -0.94 4.05 -2.64 -1.84 0.00 -0.17 -4.91 120.51 114.06 3h3o n ALA 74 Ca 0.21 -0.62 -0.43 0.00 0.00 0.00 0.00 53.44 52.60 3h3o n ALA 74 Cb 0.10 -0.77 -0.02 0.00 0.00 0.00 0.00 19.45 18.76 3h3o n ALA 74 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3h3o s ILE 75 N -2.67 4.56 0.17 0.00 -1.09 -1.14 -1.10 121.20 119.92 3h3o s ILE 75 Ca 0.14 1.82 0.07 0.00 -2.23 0.00 0.00 60.65 60.45 3h3o s ILE 75 Cb 0.17 -4.38 -0.16 0.00 -1.58 0.00 0.00 42.46 36.51 3h3o s ILE 75 CO 0.69 -0.39 1.38 0.00 -1.23 0.00 0.00 174.94 175.39 3h3o h ALA 76 N 7.90 0.53 -2.68 9.38 0.00 -0.57 -3.44 119.26 130.39 3h3o h ALA 76 Ca -0.20 -0.79 0.04 0.00 0.00 0.00 0.00 54.91 53.96 3h3o h ALA 76 Cb 1.06 -0.13 -0.13 0.00 0.00 0.00 0.00 17.79 18.59 3h3o h ALA 76 CO 1.02 1.07 0.34 0.20 0.00 0.00 0.00 179.25 181.88 3h3o s GLY 77 N -4.62 -0.53 -0.15 0.00 0.00 -1.25 -4.48 107.32 96.29 3h3o s GLY 77 Ca -0.00 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.41 3h3o s GLY 77 CO 0.81 0.22 -0.15 -0.42 0.00 0.00 0.00 173.10 173.56 3h3o s ILE 78 N -3.47 1.62 -0.15 0.90 1.01 -0.84 -1.58 121.20 118.68 3h3o s ILE 78 Ca 0.03 -0.66 -0.07 0.00 0.00 0.00 0.00 60.65 59.95 3h3o s ILE 78 Cb -0.01 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 3h3o s ILE 78 CO -0.10 0.47 0.08 -0.83 0.00 0.00 0.00 174.94 174.56 3h3o s GLY 79 N 1.45 1.99 -0.18 6.18 0.00 0.86 -2.43 107.32 115.19 3h3o s GLY 79 Ca 0.04 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 44.05 3h3o s GLY 79 CO -0.11 -0.18 -0.18 -0.42 0.00 0.00 0.00 173.10 172.21 3h3o s ILE 80 N -0.29 2.23 0.07 0.90 1.01 -0.56 -0.19 121.20 124.37 3h3o s ILE 80 Ca 0.09 -0.88 0.09 0.00 0.00 0.00 0.00 60.65 59.95 3h3o s ILE 80 Cb -0.12 -1.95 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 3h3o s ILE 80 CO 0.01 0.53 -0.25 0.28 0.00 0.00 0.00 174.94 175.51 3h3o s THR 81 N 1.28 2.06 0.19 2.92 -1.32 -0.49 -1.52 115.64 118.76 3h3o s THR 81 Ca 0.04 -1.46 -0.10 0.00 -1.21 0.00 0.00 61.69 58.97 3h3o s THR 81 Cb -0.13 -1.79 -0.01 0.00 -1.51 0.00 0.00 72.50 69.06 3h3o s THR 81 CO -0.11 0.24 0.34 0.54 -2.21 0.00 0.00 174.62 173.42 3h3o s ASN 82 N -1.48 -0.00 -0.10 8.08 4.22 -0.98 -1.63 114.94 123.05 3h3o s ASN 82 Ca 0.11 -0.91 -0.30 0.00 -2.14 0.00 0.00 52.86 49.62 3h3o s ASN 82 Cb -0.10 0.48 -0.03 0.00 1.28 0.00 0.00 41.25 42.88 3h3o s ASN 82 CO 0.03 -0.97 1.32 0.00 -2.04 0.00 0.00 177.10 175.44 3h3o s GLN 83 N -3.99 4.26 1.00 3.55 -2.07 -0.81 0.37 119.66 121.97 3h3o s GLN 83 Ca 0.20 1.78 -0.14 0.00 -1.82 0.00 0.00 55.36 55.38 3h3o s GLN 83 Cb 0.02 -3.71 0.19 0.00 -1.09 0.00 0.00 33.01 28.42 3h3o s GLN 83 CO 0.03 -0.64 1.14 1.03 -1.32 0.00 0.00 175.29 175.54 3h3o s ARG 84 N 3.06 0.41 0.00 9.60 0.52 -1.26 -4.29 118.95 126.99 3h3o s ARG 84 Ca 0.59 0.17 0.00 0.00 -0.52 0.00 0.00 55.73 55.97 3h3o s ARG 84 Cb -0.25 -1.77 0.00 0.00 0.52 0.00 0.00 34.95 33.45 3h3o s ARG 84 CO 0.20 -2.67 0.00 0.39 0.02 0.00 0.00 175.30 173.24 3h3o n GLU 85 N -4.07 0.00 -1.52 3.54 4.71 -1.26 -4.50 120.64 117.54 3h3o n GLU 85 Ca 0.09 0.00 -0.61 0.00 -0.01 0.00 0.00 57.16 56.63 3h3o n GLU 85 Cb 0.59 -0.08 -0.10 0.00 -1.01 0.00 0.00 31.44 30.84 3h3o n GLU 85 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 3h3o n THR 86 N 0.00 0.00 -3.87 2.62 -1.04 -1.26 -4.24 114.28 106.49 3h3o n THR 86 Ca 0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 3h3o n THR 86 Cb 0.00 -0.46 -0.04 0.00 -1.82 0.00 0.00 70.33 68.01 3h3o n THR 86 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 3h3o s THR 87 N 3.28 5.33 -0.01 12.58 2.01 -0.62 -3.63 115.64 134.58 3h3o s THR 87 Ca 0.99 -0.39 -0.03 0.00 0.31 0.00 0.00 61.69 62.57 3h3o s THR 87 Cb -1.38 -3.66 -0.00 0.00 0.01 0.00 0.00 72.50 67.47 3h3o s THR 87 CO 0.73 0.05 0.06 -0.69 -0.69 0.00 0.00 174.62 174.08 3h3o s VAL 88 N -1.61 0.05 -0.05 3.82 1.01 -0.89 -2.35 120.40 120.37 3h3o s VAL 88 Ca 0.36 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.93 3h3o s VAL 88 Cb -0.12 -0.22 0.03 0.00 0.00 0.00 0.00 36.38 36.06 3h3o s VAL 88 CO 0.28 -0.22 0.02 -0.69 0.00 0.00 0.00 175.10 174.48 3h3o s VAL 89 N -0.69 0.20 0.19 2.92 1.01 -1.26 -1.90 120.40 120.87 3h3o s VAL 89 Ca -0.08 0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 3h3o s VAL 89 Cb -0.05 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 3h3o s VAL 89 CO 0.00 0.21 0.11 -1.66 0.00 0.00 0.00 175.10 173.76 3h3o s TRP 90 N 1.74 1.12 -0.03 5.22 -2.14 -0.15 -0.81 118.94 123.90 3h3o s TRP 90 Ca 0.01 -1.33 -0.29 0.00 2.66 0.00 0.00 56.10 57.15 3h3o s TRP 90 Cb -0.13 -0.57 -0.03 0.00 -3.10 0.00 0.00 33.47 29.65 3h3o s TRP 90 CO -0.03 -0.58 0.94 0.34 -2.66 0.00 0.00 176.95 174.95 3h3o s ASP 91 N -3.15 7.29 0.42 -2.66 -1.08 -0.76 -0.26 116.67 116.46 3h3o s ASP 91 Ca 0.35 1.56 0.23 0.00 -0.52 0.00 0.00 52.55 54.18 3h3o s ASP 91 Cb 0.07 -2.54 0.49 0.00 -1.46 0.00 0.00 42.92 39.48 3h3o s ASP 91 CO 0.10 -0.28 1.65 0.07 0.52 0.00 0.00 175.17 177.23 3h3o h LYS 92 N 6.86 0.00 0.03 4.34 2.10 -1.84 0.33 116.57 128.38 3h3o h LYS 92 Ca -0.39 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.26 3h3o h LYS 92 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 3h3o h LYS 92 CO 0.77 0.14 -0.01 1.15 -2.00 0.00 0.00 179.45 179.50 3h3o h THR 93 N 0.00 0.02 0.06 0.07 2.02 -1.93 -3.38 112.91 109.77 3h3o h THR 93 Ca -0.00 -0.99 -0.25 0.00 0.77 0.00 0.00 66.41 65.94 3h3o h THR 93 Cb 0.99 0.03 0.01 0.00 -1.74 0.00 0.00 68.15 67.44 3h3o h THR 93 CO 0.02 0.01 -1.09 0.71 0.37 0.00 0.00 175.52 175.53 3h3o h THR 94 N -1.01 1.43 0.00 3.16 1.35 -1.97 -3.48 112.91 112.39 3h3o h THR 94 Ca -0.00 -2.68 0.00 0.00 -0.55 0.00 0.00 66.41 63.17 3h3o h THR 94 Cb 0.04 2.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 3h3o h THR 94 CO 0.01 0.79 0.00 0.61 -0.25 0.00 0.00 175.52 176.68 3h3o n GLY 95 N 1.21 1.96 3.75 5.82 0.00 0.12 -5.03 105.19 113.03 3h3o n GLY 95 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 3h3o n GLY 95 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h3o s GLN 96 N -0.62 4.42 0.54 1.61 -1.52 -1.25 -4.59 119.66 118.25 3h3o s GLN 96 Ca 0.00 2.06 -0.20 0.00 -1.95 0.00 0.00 55.36 55.27 3h3o s GLN 96 Cb 0.00 -3.15 -0.06 0.00 -0.22 0.00 0.00 33.01 29.58 3h3o s GLN 96 CO 0.00 -0.14 1.15 -2.14 -0.25 0.00 0.00 175.29 173.91 3h3o s PRO 97 N -0.92 3.35 0.45 2.91 0.02 -1.26 -1.84 135.00 137.71 3h3o s PRO 97 Ca 0.52 1.69 0.25 0.00 0.02 0.00 0.00 61.00 63.48 3h3o s PRO 97 Cb -0.37 -2.06 0.60 0.00 0.02 0.00 0.00 34.50 32.69 3h3o s PRO 97 CO 0.44 -0.87 1.70 -0.84 -0.33 0.00 0.00 177.00 177.10 3h3o h ILE 98 N 1.26 0.13 -1.32 2.83 3.07 -1.32 -3.47 117.51 118.69 3h3o h ILE 98 Ca -0.50 -1.01 0.33 0.00 1.55 0.00 0.00 64.86 65.23 3h3o h ILE 98 Cb 1.27 1.91 -0.14 0.00 -0.27 0.00 0.00 36.82 39.58 3h3o h ILE 98 CO 0.57 0.07 0.88 0.00 -1.05 0.00 0.00 178.15 178.61 3h3o s ALA 99 N -3.33 -2.28 0.72 0.16 0.00 -1.26 -5.06 121.76 110.71 3h3o s ALA 99 Ca 0.05 0.98 -0.16 0.00 0.00 0.00 0.00 51.96 52.83 3h3o s ALA 99 Cb 0.07 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.36 3h3o s ALA 99 CO 0.64 -0.95 0.65 0.09 0.00 0.00 0.00 175.76 176.19 3h3o n ASN 100 N -0.40 -0.75 -4.78 0.00 3.02 -1.26 -4.74 115.26 106.36 3h3o n ASN 100 Ca -0.07 0.62 -0.37 0.00 -0.03 0.00 0.00 54.58 54.73 3h3o n ASN 100 Cb 0.62 -1.27 -0.04 0.00 -0.61 0.00 0.00 39.78 38.48 3h3o n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h3o s ALA 101 N -1.89 3.15 -0.30 5.41 0.00 0.15 -4.85 121.76 123.44 3h3o s ALA 101 Ca 0.68 0.72 -0.17 0.00 0.00 0.00 0.00 51.96 53.18 3h3o s ALA 101 Cb -0.35 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.48 3h3o s ALA 101 CO 0.56 -0.17 0.47 0.42 0.00 0.00 0.00 175.76 177.05 3h3o s ILE 102 N -1.57 5.08 0.69 0.00 1.09 -0.99 -1.50 121.20 124.00 3h3o s ILE 102 Ca 0.55 0.59 -0.11 0.00 -1.10 0.00 0.00 60.65 60.57 3h3o s ILE 102 Cb -0.23 -3.84 0.01 0.00 -1.06 0.00 0.00 42.46 37.33 3h3o s ILE 102 CO 0.30 -0.01 1.06 -0.69 -0.10 0.00 0.00 174.94 175.50 3h3o s VAL 103 N 2.27 3.96 -0.35 2.92 1.01 -0.67 -1.59 120.40 127.95 3h3o s VAL 103 Ca 0.18 0.67 0.23 0.00 0.00 0.00 0.00 61.98 63.06 3h3o s VAL 103 Cb -0.16 -3.37 0.24 0.00 0.00 0.00 0.00 36.38 33.09 3h3o s VAL 103 CO 0.11 -0.80 1.69 -2.67 0.00 0.00 0.00 175.10 173.43 3h3o n TRP 104 N -3.02 0.79 0.14 5.22 4.27 -1.26 -1.83 117.44 121.74 3h3o n TRP 104 Ca 0.08 0.35 0.07 0.00 -3.89 0.00 0.00 57.50 54.11 3h3o n TRP 104 Cb 0.53 -1.06 0.04 0.00 -1.36 0.00 0.00 31.31 29.46 3h3o n TRP 104 CO 0.00 0.00 0.00 1.96 -2.29 0.00 0.00 177.69 177.36 3h3o h GLN 105 N 0.00 0.00 -7.06 -2.67 4.20 -1.90 -3.43 115.11 104.25 3h3o h GLN 105 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 3h3o h GLN 105 Cb 0.21 0.00 0.11 0.00 0.30 0.00 0.00 27.48 28.10 3h3o h GLN 105 CO 0.00 0.21 0.51 0.45 -0.67 0.00 0.00 178.83 179.33 3h3o s SER 106 N -6.04 5.46 -0.05 1.46 0.15 -0.76 -4.76 113.70 109.16 3h3o s SER 106 Ca 0.03 2.45 0.07 0.00 0.70 0.00 0.00 55.95 59.20 3h3o s SER 106 Cb 0.07 -2.61 0.11 0.00 -1.71 0.00 0.00 66.02 61.89 3h3o s SER 106 CO 0.74 -1.42 1.06 0.54 1.20 0.00 0.00 173.24 175.37 3h3o n ARG 107 N -1.19 2.40 0.27 5.44 5.12 -0.30 -4.64 116.66 123.77 3h3o n ARG 107 Ca 0.11 -1.89 0.18 0.00 -1.93 0.00 0.00 57.85 54.32 3h3o n ARG 107 Cb 0.48 -1.18 0.84 0.00 -1.16 0.00 0.00 32.46 31.43 3h3o n ARG 107 CO 0.00 0.00 0.00 -0.56 -1.93 0.00 0.00 177.63 175.14 3h3o h GLN 108 N 0.05 0.00 -0.55 5.56 3.07 -1.93 -1.28 115.11 120.02 3h3o h GLN 108 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3h3o h GLN 108 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.24 3h3o h GLN 108 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 178.83 177.79 3h3o n SER 109 N -2.90 4.65 -0.04 0.06 3.41 -1.26 -4.54 113.62 112.99 3h3o n SER 109 Ca -0.01 -2.57 0.01 0.00 -0.26 0.00 0.00 58.87 56.04 3h3o n SER 109 Cb 0.19 -0.56 0.33 0.00 -0.26 0.00 0.00 64.21 63.91 3h3o n SER 109 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 3h3o h SER 110 N 3.55 0.56 0.21 4.04 0.87 -1.58 -2.68 113.55 118.52 3h3o h SER 110 Ca 0.00 -0.05 -0.12 0.00 -1.23 0.00 0.00 61.79 60.38 3h3o h SER 110 Cb 1.48 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 63.28 3h3o h SER 110 CO 0.25 0.50 -0.45 1.55 -0.53 0.00 0.00 176.83 178.15 3h3o h PRO 111 N 0.62 0.30 -0.30 2.24 0.13 -1.81 -1.67 132.00 131.51 3h3o h PRO 111 Ca 0.15 -0.16 -0.10 0.00 -0.87 0.00 0.00 66.00 65.03 3h3o h PRO 111 Cb 0.11 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.23 3h3o h PRO 111 CO -0.02 0.70 -0.22 0.82 -0.23 0.00 0.00 178.00 179.05 3h3o h ILE 112 N 0.24 1.26 0.01 -3.56 2.04 -1.82 -2.58 117.51 113.10 3h3o h ILE 112 Ca 0.02 -1.25 -0.00 0.00 1.00 0.00 0.00 64.86 64.63 3h3o h ILE 112 Cb 0.90 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 3h3o h ILE 112 CO 0.07 0.41 -0.00 0.00 0.00 0.00 0.00 178.15 178.63 3h3o h ALA 113 N 1.26 -0.01 -0.91 1.87 0.00 -1.27 -3.00 119.26 117.19 3h3o h ALA 113 Ca 0.08 -0.27 0.20 0.00 0.00 0.00 0.00 54.91 54.92 3h3o h ALA 113 Cb 0.66 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.34 3h3o h ALA 113 CO 0.05 -0.23 0.46 -0.44 0.00 0.00 0.00 179.25 179.09 3h3o h ASP 114 N -0.55 0.49 0.12 0.00 3.32 -1.24 0.46 116.42 119.01 3h3o h ASP 114 Ca -0.00 0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 3h3o h ASP 114 Cb 0.54 0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 3h3o h ASP 114 CO 0.00 0.10 -0.12 -0.61 -1.72 0.00 0.00 179.24 176.90 3h3o h GLN 115 N 0.53 -0.22 -1.26 3.56 5.75 -1.45 -0.77 115.11 121.25 3h3o h GLN 115 Ca 0.55 0.02 0.37 0.00 -0.15 0.00 0.00 58.65 59.43 3h3o h GLN 115 Cb 0.97 0.05 -0.08 0.00 1.07 0.00 0.00 27.48 29.49 3h3o h GLN 115 CO -0.46 -0.15 0.86 -0.07 -2.65 0.00 0.00 178.83 176.36 3h3o h LEU 116 N -0.23 0.19 -0.93 -2.39 3.38 -1.21 0.71 115.31 114.82 3h3o h LEU 116 Ca -0.01 0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 3h3o h LEU 116 Cb 0.20 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3h3o h LEU 116 CO -0.01 -0.01 -0.49 0.50 0.09 0.00 0.00 178.44 178.52 3h3o h LYS 117 N 0.14 0.00 -0.47 1.13 3.11 -0.14 -2.86 116.57 117.48 3h3o h LYS 117 Ca 0.67 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.51 3h3o h LYS 117 Cb 2.27 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 33.50 3h3o h LYS 117 CO -0.18 0.49 0.00 0.28 -2.81 0.00 0.00 179.45 177.22 3h3o n VAL 118 N -3.76 0.63 -1.26 2.00 0.31 0.24 -3.81 118.33 112.68 3h3o n VAL 118 Ca -0.01 -0.67 0.04 0.00 -0.01 0.00 0.00 64.34 63.69 3h3o n VAL 118 Cb 0.54 0.41 0.20 0.00 -0.91 0.00 0.00 33.84 34.08 3h3o n VAL 118 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3h3o n ASP 119 N 1.00 2.73 -2.27 4.52 2.03 -1.02 -4.96 116.55 118.58 3h3o n ASP 119 Ca 0.17 -3.43 -0.14 0.00 0.52 0.00 0.00 54.79 51.91 3h3o n ASP 119 Cb 0.44 -0.55 -0.02 0.00 -0.72 0.00 0.00 41.12 40.28 3h3o n ASP 119 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h3o n GLY 120 N -1.02 -0.20 0.28 0.27 0.00 -1.25 -4.84 105.19 98.43 3h3o n GLY 120 Ca 0.24 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.41 3h3o n GLY 120 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3h3o n HIS 121 N -3.26 0.00 0.19 1.61 8.25 -1.16 -4.15 115.22 116.70 3h3o n HIS 121 Ca -0.16 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.15 3h3o n HIS 121 Cb 0.60 -0.01 -0.08 0.00 1.12 0.00 0.00 29.99 31.62 3h3o n HIS 121 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3h3o h THR 122 N 1.38 0.71 -0.14 1.59 2.02 -1.87 -2.33 112.91 114.27 3h3o h THR 122 Ca 0.00 -0.09 0.03 0.00 0.77 0.00 0.00 66.41 67.12 3h3o h THR 122 Cb 0.31 0.76 -0.06 0.00 -1.74 0.00 0.00 68.15 67.41 3h3o h THR 122 CO 0.00 0.02 -0.54 -0.33 0.37 0.00 0.00 175.52 175.04 3h3o h GLU 123 N -0.46 -0.55 0.00 6.66 4.39 -1.99 -1.49 114.58 121.13 3h3o h GLU 123 Ca -0.04 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3h3o h GLU 123 Cb 0.35 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 3h3o h GLU 123 CO 0.07 -0.37 0.00 -0.12 -1.16 0.00 0.00 179.01 177.43 3h3o n MET 124 N -5.40 0.00 -0.44 2.33 1.56 -1.21 -2.62 117.12 111.34 3h3o n MET 124 Ca -0.06 0.31 0.38 0.00 -0.27 0.00 0.00 57.70 58.06 3h3o n MET 124 Cb 0.37 -1.10 0.65 0.00 2.15 0.00 0.00 33.22 35.30 3h3o n MET 124 CO 0.00 0.00 0.00 -0.89 -0.73 0.00 0.00 175.97 174.35 3h3o n ILE 125 N -1.05 -0.27 0.24 1.12 5.41 -0.88 -0.10 119.36 123.83 3h3o n ILE 125 Ca 0.00 1.80 -0.15 0.00 1.00 0.00 0.00 62.75 65.40 3h3o n ILE 125 Cb 0.00 -2.94 -0.08 0.00 -0.71 0.00 0.00 39.64 35.90 3h3o n ILE 125 CO 0.00 0.00 0.00 -0.74 0.00 0.00 0.00 176.55 175.81 3h3o h HIS 126 N 0.00 -0.54 -0.47 1.39 2.76 -1.13 -1.56 115.15 115.59 3h3o h HIS 126 Ca 0.86 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 59.07 3h3o h HIS 126 Cb 2.71 0.18 -0.08 0.00 1.55 0.00 0.00 27.41 31.77 3h3o h HIS 126 CO -0.01 -0.28 -0.50 0.93 -1.30 0.00 0.00 177.93 176.78 3h3o h GLU 127 N -0.70 -0.26 0.00 5.26 5.08 -0.26 2.00 114.58 125.70 3h3o h GLU 127 Ca -0.06 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 3h3o h GLU 127 Cb 0.51 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 3h3o h GLU 127 CO 0.10 -0.18 -0.18 1.57 -1.00 0.00 0.00 179.01 179.32 3h3o h LYS 128 N -0.27 0.00 0.00 2.33 2.10 -1.59 -3.36 116.57 115.77 3h3o h LYS 128 Ca 0.08 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.54 3h3o h LYS 128 Cb 0.49 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.78 3h3o h LYS 128 CO -0.59 0.18 -1.71 0.25 -2.00 0.00 0.00 179.45 175.59 3h3o n THR 129 N -3.34 0.71 -0.42 0.07 -2.24 -0.59 -0.15 114.28 108.32 3h3o n THR 129 Ca 0.00 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3h3o n THR 129 Cb 0.41 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.71 3h3o n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h3o n GLY 130 N 2.89 0.76 3.60 3.38 0.00 0.67 -4.66 105.19 111.83 3h3o n GLY 130 Ca -0.22 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 3h3o n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3o s LEU 131 N 0.00 3.05 0.67 0.99 1.43 -1.26 -2.06 118.68 121.51 3h3o s LEU 131 Ca 0.00 -0.63 -0.05 0.00 -1.03 0.00 0.00 54.13 52.42 3h3o s LEU 131 Cb 0.00 -1.66 0.05 0.00 0.03 0.00 0.00 46.19 44.61 3h3o s LEU 131 CO 0.00 0.06 0.96 0.68 0.23 0.00 0.00 176.35 178.28 3h3o s VAL 132 N -2.02 2.51 -0.02 -1.59 -7.23 -1.26 -3.94 120.40 106.86 3h3o s VAL 132 Ca 0.28 -0.29 -0.24 0.00 -1.81 0.00 0.00 61.98 59.92 3h3o s VAL 132 Cb -0.08 -3.06 -0.05 0.00 0.56 0.00 0.00 36.38 33.76 3h3o s VAL 132 CO 0.17 -0.06 0.71 -0.63 -0.31 0.00 0.00 175.10 174.98 3h3o s ILE 133 N -3.14 4.91 -0.13 -0.62 1.01 -1.26 -4.99 121.20 116.98 3h3o s ILE 133 Ca 0.59 1.49 -0.31 0.00 0.00 0.00 0.00 60.65 62.42 3h3o s ILE 133 Cb -0.11 -4.05 0.13 0.00 0.01 0.00 0.00 42.46 38.44 3h3o s ILE 133 CO 0.44 0.32 1.06 -0.62 0.00 0.00 0.00 174.94 176.14 3h3o s ASP 134 N 0.34 -0.26 0.00 3.58 2.15 -1.26 -5.00 116.67 116.21 3h3o s ASP 134 Ca 0.37 0.11 0.17 0.00 0.43 0.00 0.00 52.55 53.63 3h3o s ASP 134 Cb -0.19 0.25 0.84 0.00 -0.30 0.00 0.00 42.92 43.53 3h3o s ASP 134 CO 0.20 -0.37 1.51 0.00 -0.17 0.00 0.00 175.17 176.34 3h3o n ALA 135 N 0.13 1.91 -0.16 3.66 0.00 -1.26 -3.18 120.51 121.60 3h3o n ALA 135 Ca -0.05 -0.08 -0.08 0.00 0.00 0.00 0.00 53.44 53.23 3h3o n ALA 135 Cb 0.59 -1.28 0.01 0.00 0.00 0.00 0.00 19.45 18.77 3h3o n ALA 135 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 3h3o h TYR 136 N 0.00 0.71 -4.13 0.00 3.20 -1.83 -3.45 116.97 111.47 3h3o h TYR 136 Ca 0.00 -0.04 -0.46 0.00 3.14 0.00 0.00 58.73 61.36 3h3o h TYR 136 Cb 0.18 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.24 3h3o h TYR 136 CO 0.00 0.58 0.35 -0.06 -1.64 0.00 0.00 178.16 177.40 3h3o s PHE 137 N -5.63 3.40 0.47 -3.82 0.08 -1.19 -4.73 117.98 106.56 3h3o s PHE 137 Ca -0.13 1.50 0.22 0.00 0.12 0.00 0.00 56.93 58.65 3h3o s PHE 137 Cb 0.11 -2.80 1.23 0.00 -0.57 0.00 0.00 43.02 40.99 3h3o s PHE 137 CO 0.76 -0.27 1.88 0.77 -0.10 0.00 0.00 175.22 178.26 3h3o h SER 138 N 1.27 0.25 -0.00 1.36 0.02 -1.61 -3.26 113.55 111.57 3h3o h SER 138 Ca -0.48 0.03 0.03 0.00 -0.84 0.00 0.00 61.79 60.53 3h3o h SER 138 Cb 1.18 -0.02 -0.06 0.00 0.14 0.00 0.00 62.40 63.65 3h3o h SER 138 CO 0.61 0.10 -0.48 0.00 -1.14 0.00 0.00 176.83 175.92 3h3o h ALA 139 N 1.61 -0.81 0.00 3.77 0.00 -0.98 -1.50 119.26 121.35 3h3o h ALA 139 Ca 0.43 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 3h3o h ALA 139 Cb 1.30 0.85 -0.00 0.00 0.00 0.00 0.00 17.79 19.93 3h3o h ALA 139 CO -0.11 -1.03 -0.06 1.79 0.00 0.00 0.00 179.25 179.84 3h3o h THR 140 N -0.63 0.90 -0.07 0.00 1.35 -1.85 -1.51 112.91 111.10 3h3o h THR 140 Ca 0.03 -0.22 -0.17 0.00 -0.55 0.00 0.00 66.41 65.51 3h3o h THR 140 Cb 0.69 1.12 -0.01 0.00 -1.73 0.00 0.00 68.15 68.23 3h3o h THR 140 CO -0.34 0.06 -0.68 0.11 -0.25 0.00 0.00 175.52 174.42 3h3o h LYS 141 N 0.00 0.32 -0.16 4.72 1.57 -1.56 -0.29 116.57 121.17 3h3o h LYS 141 Ca -0.00 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.52 3h3o h LYS 141 Cb 0.12 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3h3o h LYS 141 CO 0.01 0.88 0.03 0.28 -0.57 0.00 0.00 179.45 180.08 3h3o h VAL 142 N 0.22 1.21 0.40 0.50 2.07 -0.28 -1.98 116.25 118.40 3h3o h VAL 142 Ca -0.02 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 3h3o h VAL 142 Cb 1.23 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.34 3h3o h VAL 142 CO 0.11 0.20 -0.26 -0.09 0.02 0.00 0.00 177.57 177.55 3h3o h ARG 143 N 0.06 -0.61 -0.78 1.57 9.65 -1.32 -2.47 114.38 120.47 3h3o h ARG 143 Ca 0.05 0.04 0.12 0.00 -1.10 0.00 0.00 59.98 59.09 3h3o h ARG 143 Cb 0.28 0.14 -0.13 0.00 -1.39 0.00 0.00 29.97 28.87 3h3o h ARG 143 CO 0.00 -0.41 -0.41 2.35 2.80 0.00 0.00 179.97 184.31 3h3o h TRP 144 N -0.64 -1.18 -0.82 2.20 7.01 -0.94 0.13 115.95 121.72 3h3o h TRP 144 Ca -0.04 0.09 0.09 0.00 2.11 0.00 0.00 58.89 61.14 3h3o h TRP 144 Cb 0.53 0.63 -0.06 0.00 -2.10 0.00 0.00 29.16 28.16 3h3o h TRP 144 CO -0.10 -0.40 0.53 -0.07 -2.79 0.00 0.00 178.44 175.61 3h3o h LEU 145 N -0.10 0.70 -0.41 0.65 3.38 -1.12 -0.19 115.31 118.22 3h3o h LEU 145 Ca 0.26 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.24 3h3o h LEU 145 Cb 0.56 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3h3o h LEU 145 CO -0.83 0.42 -0.01 0.18 0.09 0.00 0.00 178.44 178.29 3h3o n LEU 146 N -4.51 0.66 -0.01 1.67 4.77 0.34 -2.00 117.00 117.92 3h3o n LEU 146 Ca 0.14 -0.20 0.04 0.00 -0.03 0.00 0.00 56.01 55.96 3h3o n LEU 146 Cb 0.31 -0.02 -0.08 0.00 -2.33 0.00 0.00 43.42 41.29 3h3o n LEU 146 CO 0.32 0.11 -0.65 0.47 -1.33 0.00 0.00 177.39 176.31 3h3o n ASP 147 N -0.52 2.50 -0.04 -1.43 9.92 -0.29 -4.08 116.55 122.61 3h3o n ASP 147 Ca 0.21 0.00 0.02 0.00 -0.53 0.00 0.00 54.79 54.49 3h3o n ASP 147 Cb 0.23 1.42 -0.01 0.00 -0.64 0.00 0.00 41.12 42.11 3h3o n ASP 147 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3h3o n ASN 148 N -1.93 0.45 -4.47 -2.24 3.02 -0.24 -4.96 115.26 104.89 3h3o n ASN 148 Ca -0.04 -0.72 -0.36 0.00 -0.03 0.00 0.00 54.58 53.43 3h3o n ASN 148 Cb 0.35 0.78 -0.12 0.00 -0.61 0.00 0.00 39.78 40.17 3h3o n ASN 148 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h3o s ILE 149 N -1.15 4.22 -0.04 2.41 -1.09 -0.85 -5.06 121.20 119.64 3h3o s ILE 149 Ca 0.02 -0.21 -0.30 0.00 -2.23 0.00 0.00 60.65 57.93 3h3o s ILE 149 Cb 0.03 -2.94 -0.05 0.00 -1.58 0.00 0.00 42.46 37.92 3h3o s ILE 149 CO 0.14 0.39 1.56 -1.83 -1.23 0.00 0.00 174.94 173.96 3h3o s GLU 150 N 1.23 4.21 0.00 2.79 1.03 -1.26 -2.38 118.70 124.32 3h3o s GLU 150 Ca 0.04 2.10 0.00 0.00 0.03 0.00 0.00 54.97 57.14 3h3o s GLU 150 Cb -0.15 -3.83 0.00 0.00 -0.80 0.00 0.00 34.13 29.36 3h3o s GLU 150 CO 0.02 -0.76 0.00 0.41 -1.33 0.00 0.00 175.26 173.60 3h3o n GLY 151 N 3.95 2.92 0.00 -3.83 0.00 -1.26 -5.01 105.19 101.97 3h3o n GLY 151 Ca 0.16 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3h3o n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3o n ALA 152 N 0.00 0.00 -0.30 4.61 0.00 -1.00 -0.06 120.51 123.76 3h3o n ALA 152 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3h3o n ALA 152 Cb 0.00 0.01 0.28 0.00 0.00 0.00 0.00 19.45 19.75 3h3o n ALA 152 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3h3o h GLN 153 N 0.00 0.16 0.28 0.00 5.75 -1.80 0.15 115.11 119.65 3h3o h GLN 153 Ca 0.00 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 3h3o h GLN 153 Cb 0.00 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 3h3o h GLN 153 CO 0.00 0.11 -0.29 1.49 -2.65 0.00 0.00 178.83 177.49 3h3o h GLU 154 N 0.17 -0.58 0.00 1.69 4.57 -1.54 -0.94 114.58 117.96 3h3o h GLU 154 Ca 0.55 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.77 3h3o h GLU 154 Cb 1.12 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 3h3o h GLU 154 CO -0.69 -0.39 0.00 1.63 -1.18 0.00 0.00 179.01 178.38 3h3o n LYS 155 N -5.40 0.13 0.00 1.92 5.02 0.92 -1.32 118.16 119.43 3h3o n LYS 155 Ca -0.09 0.37 0.13 0.00 -2.02 0.00 0.00 58.31 56.70 3h3o n LYS 155 Cb 0.31 -1.75 0.37 0.00 -0.02 0.00 0.00 35.03 33.94 3h3o n LYS 155 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h3o n ALA 156 N -1.68 3.19 0.07 7.82 0.00 0.39 -1.99 120.51 128.31 3h3o n ALA 156 Ca 0.02 -0.33 -0.03 0.00 0.00 0.00 0.00 53.44 53.10 3h3o n ALA 156 Cb 0.20 -1.18 -0.01 0.00 0.00 0.00 0.00 19.45 18.45 3h3o n ALA 156 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3h3o h ASP 157 N 0.44 -0.17 -0.04 0.00 3.32 -0.00 -3.32 116.42 116.64 3h3o h ASP 157 Ca 0.00 0.01 -0.41 0.00 0.02 0.00 0.00 57.03 56.64 3h3o h ASP 157 Cb 0.48 0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 3h3o h ASP 157 CO 0.00 -0.05 1.51 -0.46 -1.72 0.00 0.00 179.24 178.52 3h3o n ASN 158 N -2.92 6.84 -3.61 6.45 6.94 -1.26 -4.77 115.26 122.94 3h3o n ASN 158 Ca -0.02 -2.55 -0.19 0.00 -0.02 0.00 0.00 54.58 51.80 3h3o n ASN 158 Cb 0.08 -1.48 -0.03 0.00 -2.36 0.00 0.00 39.78 36.00 3h3o n ASN 158 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3h3o n GLY 159 N 2.92 -0.20 0.02 4.83 0.00 -1.25 -4.81 105.19 106.71 3h3o n GLY 159 Ca 0.59 0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.81 3h3o n GLY 159 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h3o n GLU 160 N -2.92 0.66 -4.30 1.61 2.13 -0.84 -4.97 120.64 112.01 3h3o n GLU 160 Ca -0.13 -0.17 -0.31 0.00 0.66 0.00 0.00 57.16 57.22 3h3o n GLU 160 Cb 0.33 -1.51 -0.10 0.00 0.27 0.00 0.00 31.44 30.43 3h3o n GLU 160 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3h3o s LEU 161 N -4.65 3.19 -0.01 4.31 1.43 -1.18 -2.55 118.68 119.22 3h3o s LEU 161 Ca -0.08 -0.24 0.07 0.00 -1.03 0.00 0.00 54.13 52.85 3h3o s LEU 161 Cb 0.13 -1.91 -0.02 0.00 0.03 0.00 0.00 46.19 44.41 3h3o s LEU 161 CO 0.89 0.22 -0.23 -0.76 0.23 0.00 0.00 176.35 176.70 3h3o s LEU 162 N -1.91 2.26 0.17 1.79 1.43 0.64 -4.33 118.68 118.72 3h3o s LEU 162 Ca 0.21 -0.43 0.06 0.00 -1.03 0.00 0.00 54.13 52.94 3h3o s LEU 162 Cb -0.11 -1.39 -0.04 0.00 0.03 0.00 0.00 46.19 44.68 3h3o s LEU 162 CO 0.12 0.31 0.10 0.12 0.23 0.00 0.00 176.35 177.23 3h3o s PHE 163 N -0.69 3.06 0.00 0.29 5.36 -0.76 -0.97 117.98 124.26 3h3o s PHE 163 Ca 0.11 -0.05 0.00 0.00 -0.96 0.00 0.00 56.93 56.03 3h3o s PHE 163 Cb -0.10 -1.47 0.00 0.00 -0.34 0.00 0.00 43.02 41.10 3h3o s PHE 163 CO 0.00 0.52 0.00 0.41 -1.46 0.00 0.00 175.22 174.69 3h3o n GLY 164 N -0.27 1.38 1.79 13.12 0.00 -0.80 -4.55 105.19 115.87 3h3o n GLY 164 Ca -0.09 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 3h3o n GLY 164 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h3o n THR 165 N -0.07 0.00 -0.11 2.61 -2.24 -1.26 -2.11 114.28 111.11 3h3o n THR 165 Ca 0.00 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.41 3h3o n THR 165 Cb 0.00 -1.18 -0.02 0.00 -2.10 0.00 0.00 70.33 67.03 3h3o n THR 165 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 3h3o h ILE 166 N -2.05 1.20 -0.53 2.28 1.08 -1.82 -1.40 117.51 116.28 3h3o h ILE 166 Ca -0.21 -0.65 0.08 0.00 -0.39 0.00 0.00 64.86 63.68 3h3o h ILE 166 Cb 0.63 1.01 -0.06 0.00 -3.07 0.00 0.00 36.82 35.33 3h3o h ILE 166 CO 0.14 0.22 0.18 -2.24 -0.69 0.00 0.00 178.15 175.76 3h3o h ASP 167 N 0.38 0.16 -0.71 1.72 2.03 -1.92 0.67 116.42 118.75 3h3o h ASP 167 Ca 0.11 0.07 -0.01 0.00 -0.73 0.00 0.00 57.03 56.47 3h3o h ASP 167 Cb 0.24 0.06 -0.03 0.00 -0.83 0.00 0.00 39.33 38.77 3h3o h ASP 167 CO -0.00 0.11 0.41 -1.28 -1.03 0.00 0.00 179.24 177.45 3h3o h SER 168 N 0.35 0.87 -0.53 4.15 0.87 -1.68 0.18 113.55 117.75 3h3o h SER 168 Ca 0.26 -0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 3h3o h SER 168 Cb 0.30 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.02 3h3o h SER 168 CO -0.27 0.69 0.21 -0.25 -0.53 0.00 0.00 176.83 176.68 3h3o h TRP 169 N 0.97 0.80 -0.40 2.24 2.91 -0.03 -0.10 115.95 122.34 3h3o h TRP 169 Ca 0.25 -0.06 -0.04 0.00 1.13 0.00 0.00 58.89 60.18 3h3o h TRP 169 Cb 0.00 -0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 28.40 3h3o h TRP 169 CO -0.01 0.66 0.11 -0.07 -1.03 0.00 0.00 178.44 178.10 3h3o h LEU 170 N 0.71 0.59 -0.16 0.65 3.38 0.79 -2.12 115.31 119.16 3h3o h LEU 170 Ca 0.17 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 3h3o h LEU 170 Cb 0.20 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3h3o h LEU 170 CO -0.01 0.66 0.00 0.58 0.09 0.00 0.00 178.44 179.76 3h3o h VAL 171 N 0.50 1.25 -0.84 1.22 2.07 -0.88 -0.26 116.25 119.31 3h3o h VAL 171 Ca 0.13 -0.83 0.22 0.00 0.82 0.00 0.00 66.70 67.04 3h3o h VAL 171 Cb 0.29 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 3h3o h VAL 171 CO -0.00 0.25 0.59 -0.25 0.02 0.00 0.00 177.57 178.17 3h3o h TRP 172 N 0.02 0.19 0.11 1.57 7.01 -0.95 -1.01 115.95 122.90 3h3o h TRP 172 Ca 0.04 0.01 -0.20 0.00 2.11 0.00 0.00 58.89 60.85 3h3o h TRP 172 Cb 0.37 -0.06 0.02 0.00 -2.10 0.00 0.00 29.16 27.40 3h3o h TRP 172 CO 0.03 0.05 -0.86 0.87 -2.79 0.00 0.00 178.44 175.75 3h3o h LYS 173 N 0.14 0.38 -0.44 2.65 1.79 -0.80 0.19 116.57 120.47 3h3o h LYS 173 Ca 0.41 -0.56 -0.06 0.00 -2.18 0.00 0.00 60.65 58.26 3h3o h LYS 173 Cb 1.41 0.20 -0.02 0.00 -1.58 0.00 0.00 32.23 32.24 3h3o h LYS 173 CO -0.06 1.24 0.02 -0.07 -1.08 0.00 0.00 179.45 179.49 3h3o h LEU 174 N -0.21 0.67 -1.07 2.94 3.38 0.08 -2.65 115.31 118.45 3h3o h LEU 174 Ca -0.14 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3h3o h LEU 174 Cb 1.63 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.20 3h3o h LEU 174 CO 0.16 0.73 -0.08 0.35 0.09 0.00 0.00 178.44 179.69 3h3o n THR 175 N -4.24 0.00 -3.34 0.22 -2.24 -0.49 -2.01 114.28 102.18 3h3o n THR 175 Ca 0.02 -0.28 -0.16 0.00 -2.27 0.00 0.00 64.05 61.36 3h3o n THR 175 Cb 0.27 0.73 0.08 0.00 -2.10 0.00 0.00 70.33 69.31 3h3o n THR 175 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3h3o n ASP 176 N 0.24 -4.76 0.00 3.42 -0.08 -0.97 -2.85 116.55 111.56 3h3o n ASP 176 Ca 0.16 -0.69 0.00 0.00 -1.51 0.00 0.00 54.79 52.75 3h3o n ASP 176 Cb 0.41 -5.11 0.00 0.00 2.34 0.00 0.00 41.12 38.76 3h3o n ASP 176 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3h3o n GLY 177 N -1.21 0.35 0.11 0.27 0.00 0.63 -4.87 105.19 100.47 3h3o n GLY 177 Ca -0.16 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.87 3h3o n GLY 177 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3h3o h GLN 178 N 0.78 0.00 -4.42 1.61 4.15 -1.76 -3.46 115.11 112.01 3h3o h GLN 178 Ca 0.00 0.00 -0.38 0.00 0.77 0.00 0.00 58.65 59.04 3h3o h GLN 178 Cb 0.33 0.00 -0.30 0.00 0.21 0.00 0.00 27.48 27.72 3h3o h GLN 178 CO 0.00 0.40 -0.77 0.08 -1.93 0.00 0.00 178.83 176.61 3h3o s VAL 179 N -2.94 0.58 -0.40 2.39 1.01 -1.26 -5.10 120.40 114.69 3h3o s VAL 179 Ca 0.00 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.72 3h3o s VAL 179 Cb 0.08 -0.52 0.13 0.00 0.00 0.00 0.00 36.38 36.07 3h3o s VAL 179 CO 0.78 0.18 0.20 -2.28 0.00 0.00 0.00 175.10 173.98 3h3o s HIS 180 N 0.11 1.79 0.16 5.22 2.46 -1.26 -3.77 115.29 120.00 3h3o s HIS 180 Ca -0.01 -2.17 0.01 0.00 0.47 0.00 0.00 55.06 53.36 3h3o s HIS 180 Cb -0.06 -1.75 -0.04 0.00 -0.13 0.00 0.00 32.58 30.60 3h3o s HIS 180 CO -0.00 -0.81 0.00 0.54 -2.47 0.00 0.00 174.74 172.00 3h3o s VAL 181 N 0.76 0.59 0.33 0.89 0.11 -1.26 -2.41 120.40 119.41 3h3o s VAL 181 Ca 0.16 -1.96 0.03 0.00 -2.93 0.00 0.00 61.98 57.27 3h3o s VAL 181 Cb -0.23 -2.06 -0.01 0.00 -1.53 0.00 0.00 36.38 32.55 3h3o s VAL 181 CO -0.06 -0.51 0.37 1.07 -3.33 0.00 0.00 175.10 172.63 3h3o n THR 182 N -0.20 0.00 -4.37 5.04 5.66 -0.73 -4.13 114.28 115.56 3h3o n THR 182 Ca -0.07 -2.07 -0.19 0.00 -3.05 0.00 0.00 64.05 58.67 3h3o n THR 182 Cb 0.63 1.13 -0.10 0.00 -1.55 0.00 0.00 70.33 70.44 3h3o n THR 182 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 3h3o s ASP 183 N -3.19 2.62 0.35 1.09 1.47 -1.26 -2.48 116.67 115.27 3h3o s ASP 183 Ca 0.34 -1.06 0.13 0.00 1.18 0.00 0.00 52.55 53.14 3h3o s ASP 183 Cb 0.01 -0.14 0.97 0.00 -0.34 0.00 0.00 42.92 43.41 3h3o s ASP 183 CO 0.24 -0.21 1.75 1.88 0.68 0.00 0.00 175.17 179.51 3h3o h TYR 184 N 2.49 0.88 -0.19 2.11 0.05 -1.81 0.15 116.97 120.65 3h3o h TYR 184 Ca -0.38 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.34 3h3o h TYR 184 Cb 1.22 -0.25 -0.00 0.00 1.01 0.00 0.00 36.73 38.71 3h3o h TYR 184 CO 0.71 0.07 -0.21 0.66 -1.05 0.00 0.00 178.16 178.34 3h3o h SER 185 N 0.51 0.51 0.31 3.88 4.64 -1.84 -1.69 113.55 119.88 3h3o h SER 185 Ca 0.63 -0.49 -0.19 0.00 -0.47 0.00 0.00 61.79 61.27 3h3o h SER 185 Cb 1.33 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3h3o h SER 185 CO -0.40 0.90 -0.77 0.78 -0.87 0.00 0.00 176.83 176.47 3h3o h ASN 186 N 0.14 0.45 -0.45 4.97 2.35 -1.69 -3.27 115.58 118.08 3h3o h ASN 186 Ca 0.03 -0.31 -0.11 0.00 -0.55 0.00 0.00 56.30 55.35 3h3o h ASN 186 Cb 0.76 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.99 3h3o h ASN 186 CO 0.05 1.06 -0.15 0.00 -1.65 0.00 0.00 177.43 176.74 3h3o h ALA 187 N 0.93 0.63 0.00 -0.83 0.00 -0.77 -2.93 119.26 116.28 3h3o h ALA 187 Ca -0.04 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3h3o h ALA 187 Cb 1.35 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3h3o h ALA 187 CO 0.13 0.56 0.00 -1.13 0.00 0.00 0.00 179.25 178.81 3h3o n SER 188 N -4.22 0.00 -0.56 0.00 3.41 -0.64 -1.79 113.62 109.83 3h3o n SER 188 Ca -0.00 0.04 0.05 0.00 -0.26 0.00 0.00 58.87 58.70 3h3o n SER 188 Cb 0.41 -0.20 0.11 0.00 -0.26 0.00 0.00 64.21 64.27 3h3o n SER 188 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h3o n ARG 189 N -1.20 2.09 0.07 4.33 5.12 -1.11 -4.45 116.66 121.51 3h3o n ARG 189 Ca 0.05 -1.74 0.12 0.00 -1.93 0.00 0.00 57.85 54.35 3h3o n ARG 189 Cb 0.06 -1.24 0.14 0.00 -1.16 0.00 0.00 32.46 30.26 3h3o n ARG 189 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 3h3o h THR 190 N 2.03 0.00 -0.38 0.55 1.35 -1.45 -3.27 112.91 111.74 3h3o h THR 190 Ca 0.00 -0.57 -0.16 0.00 -0.55 0.00 0.00 66.41 65.13 3h3o h THR 190 Cb 0.63 1.14 -0.06 0.00 -1.73 0.00 0.00 68.15 68.13 3h3o h THR 190 CO 0.00 0.00 -0.15 0.80 -0.25 0.00 0.00 175.52 175.92 3h3o n MET 191 N -2.21 -0.87 0.00 4.72 1.56 -1.26 -0.31 117.12 118.76 3h3o n MET 191 Ca 0.03 0.71 0.00 0.00 -0.27 0.00 0.00 57.70 58.17 3h3o n MET 191 Cb 0.46 -4.64 0.00 0.00 2.15 0.00 0.00 33.22 31.19 3h3o n MET 191 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 3h3o n LEU 192 N -0.91 1.04 -4.27 -0.89 4.77 -1.26 -4.86 117.00 110.63 3h3o n LEU 192 Ca -0.08 -1.04 -0.32 0.00 -0.03 0.00 0.00 56.01 54.53 3h3o n LEU 192 Cb 0.34 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.27 3h3o n LEU 192 CO 0.12 0.26 -0.52 -0.47 -1.33 0.00 0.00 177.39 175.46 3h3o s TYR 193 N -0.20 2.67 -0.38 -1.77 5.04 -1.26 -2.76 117.35 118.68 3h3o s TYR 193 Ca 0.00 -0.94 -0.29 0.00 -2.44 0.00 0.00 57.07 53.40 3h3o s TYR 193 Cb 0.00 -1.77 0.02 0.00 0.35 0.00 0.00 41.96 40.56 3h3o s TYR 193 CO 0.00 -0.37 1.10 1.21 -1.34 0.00 0.00 175.55 176.14 3h3o s ASN 194 N 0.42 6.81 -0.08 4.32 3.84 -0.54 -4.32 114.94 125.39 3h3o s ASN 194 Ca -0.14 0.82 0.06 0.00 0.21 0.00 0.00 52.86 53.81 3h3o s ASN 194 Cb -0.17 -2.55 0.33 0.00 -0.55 0.00 0.00 41.25 38.31 3h3o s ASN 194 CO 0.06 -1.03 1.06 2.30 -2.79 0.00 0.00 177.10 176.71 3h3o n ILE 195 N 6.26 1.00 0.00 -5.21 -5.35 0.79 -0.86 119.36 115.99 3h3o n ILE 195 Ca 0.12 -0.55 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 3h3o n ILE 195 Cb 0.48 -0.29 0.00 0.00 -1.74 0.00 0.00 39.64 38.09 3h3o n ILE 195 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 3h3o n HIS 196 N 0.29 0.00 0.04 4.28 8.25 -1.26 -4.67 115.22 122.14 3h3o n HIS 196 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 3h3o n HIS 196 Cb 0.57 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.60 3h3o n HIS 196 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 3h3o h LYS 197 N 0.00 0.00 -3.99 -0.41 1.79 -1.92 -3.49 116.57 108.56 3h3o h LYS 197 Ca 0.00 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.31 3h3o h LYS 197 Cb 0.99 0.00 0.09 0.00 -1.58 0.00 0.00 32.23 31.73 3h3o h LYS 197 CO 0.00 0.30 -0.41 1.28 -1.08 0.00 0.00 179.45 179.54 3h3o n LEU 198 N -2.90 -3.29 -3.58 2.94 4.32 -0.04 -5.07 117.00 109.38 3h3o n LEU 198 Ca -0.09 -0.33 -0.11 0.00 -0.02 0.00 0.00 56.01 55.46 3h3o n LEU 198 Cb 0.83 -1.86 -0.04 0.00 -1.62 0.00 0.00 43.42 40.72 3h3o n LEU 198 CO 0.43 0.15 0.22 -1.83 -1.22 0.00 0.00 177.39 175.14 3h3o s GLU 199 N -4.41 1.11 -0.63 3.23 -1.05 -1.14 -4.98 118.70 110.82 3h3o s GLU 199 Ca 0.07 -0.61 -0.26 0.00 -0.15 0.00 0.00 54.97 54.02 3h3o s GLU 199 Cb -0.01 0.49 -0.06 0.00 -0.44 0.00 0.00 34.13 34.12 3h3o s GLU 199 CO 0.38 -0.44 2.16 -1.58 0.95 0.00 0.00 175.26 176.72 3h3o s TRP 200 N -3.66 1.38 -0.11 4.83 0.23 -1.26 -1.46 118.94 118.89 3h3o s TRP 200 Ca 0.02 1.24 -0.37 0.00 -2.03 0.00 0.00 56.10 54.96 3h3o s TRP 200 Cb 0.01 -3.80 -0.14 0.00 0.03 0.00 0.00 33.47 29.57 3h3o s TRP 200 CO -0.11 -2.21 1.73 -3.47 0.96 0.00 0.00 176.95 173.85 3h3o n ASP 201 N 14.99 2.81 0.02 2.95 -0.08 -1.11 -4.91 116.55 131.22 3h3o n ASP 201 Ca 0.33 1.04 -0.11 0.00 -1.51 0.00 0.00 54.79 54.54 3h3o n ASP 201 Cb 0.51 -1.27 0.02 0.00 2.34 0.00 0.00 41.12 42.72 3h3o n ASP 201 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 3h3o h GLN 202 N 7.54 0.53 0.22 -0.67 1.08 -1.90 -2.92 115.11 118.98 3h3o h GLN 202 Ca -0.47 -0.40 -0.00 0.00 -1.45 0.00 0.00 58.65 56.33 3h3o h GLN 202 Cb 1.29 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.77 3h3o h GLN 202 CO 0.93 1.02 -0.35 0.93 -0.95 0.00 0.00 178.83 180.40 3h3o h GLU 203 N 0.38 -0.58 -0.12 1.46 5.08 -2.00 -1.76 114.58 117.04 3h3o h GLU 203 Ca -0.02 0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.42 3h3o h GLU 203 Cb 1.25 0.13 -0.07 0.00 0.50 0.00 0.00 28.75 30.56 3h3o h GLU 203 CO 0.12 -0.39 -0.46 0.82 -1.00 0.00 0.00 179.01 178.10 3h3o h ILE 204 N -0.60 0.09 -0.88 3.13 1.08 -1.96 0.33 117.51 118.70 3h3o h ILE 204 Ca -0.03 0.00 0.20 0.00 -0.39 0.00 0.00 64.86 64.64 3h3o h ILE 204 Cb 0.56 0.09 -0.16 0.00 -3.07 0.00 0.00 36.82 34.24 3h3o h ILE 204 CO -0.11 0.00 -0.11 -0.07 -0.69 0.00 0.00 178.15 177.16 3h3o h LEU 205 N -0.53 -0.64 -0.44 1.44 -0.00 -1.39 0.32 115.31 114.07 3h3o h LEU 205 Ca 0.06 0.25 -0.16 0.00 -0.00 0.00 0.00 57.88 58.03 3h3o h LEU 205 Cb 0.65 0.49 -0.01 0.00 -0.00 0.00 0.00 40.66 41.80 3h3o h LEU 205 CO -0.41 -0.28 -0.44 0.44 -0.00 0.00 0.00 178.44 177.75 3h3o h ASP 206 N 0.02 0.88 -0.97 -0.43 3.45 -0.63 0.58 116.42 119.32 3h3o h ASP 206 Ca 0.46 -0.42 0.10 0.00 0.43 0.00 0.00 57.03 57.60 3h3o h ASP 206 Cb 0.80 -0.25 -0.08 0.00 -0.56 0.00 0.00 39.33 39.25 3h3o h ASP 206 CO -0.86 1.19 0.61 0.25 -1.57 0.00 0.00 179.24 178.85 3h3o h LEU 207 N 0.65 0.91 -1.72 1.55 5.85 0.17 -0.54 115.31 122.19 3h3o h LEU 207 Ca 0.04 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.80 3h3o h LEU 207 Cb 1.02 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.90 3h3o h LEU 207 CO 0.10 0.52 0.00 0.18 -0.34 0.00 0.00 178.44 178.89 3h3o n LEU 208 N -4.61 2.65 -3.01 2.25 4.77 -0.37 -4.97 117.00 113.71 3h3o n LEU 208 Ca 0.17 -0.93 -0.15 0.00 -0.03 0.00 0.00 56.01 55.07 3h3o n LEU 208 Cb 0.30 -0.03 0.07 0.00 -2.33 0.00 0.00 43.42 41.42 3h3o n LEU 208 CO 0.28 0.46 0.11 -3.20 -1.33 0.00 0.00 177.39 173.72 3h3o n ASN 209 N 1.05 -2.68 -4.35 -1.43 5.15 -0.21 -4.85 115.26 107.94 3h3o n ASN 209 Ca 0.16 -0.50 -0.38 0.00 -0.60 0.00 0.00 54.58 53.26 3h3o n ASN 209 Cb 0.53 -4.29 -0.12 0.00 -0.53 0.00 0.00 39.78 35.37 3h3o n ASN 209 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3h3o s ILE 210 N -3.29 4.13 0.29 -1.44 1.01 0.19 -5.00 121.20 117.09 3h3o s ILE 210 Ca 0.09 -0.77 -0.30 0.00 0.00 0.00 0.00 60.65 59.67 3h3o s ILE 210 Cb -0.04 -3.20 -0.12 0.00 0.01 0.00 0.00 42.46 39.11 3h3o s ILE 210 CO 0.60 -0.03 1.52 -2.65 0.00 0.00 0.00 174.94 174.39 3h3o n PRO 211 N 4.90 2.50 0.12 2.79 -0.02 -1.26 -4.60 135.00 139.43 3h3o n PRO 211 Ca -0.14 0.89 0.11 0.00 -2.02 0.00 0.00 63.50 62.34 3h3o n PRO 211 Cb 0.47 -2.63 0.48 0.00 -0.02 0.00 0.00 33.50 31.81 3h3o n PRO 211 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3h3o n SER 212 N 1.95 0.58 -0.49 2.55 7.64 -1.26 -2.73 113.62 121.86 3h3o n SER 212 Ca 0.09 0.67 0.00 0.00 1.01 0.00 0.00 58.87 60.63 3h3o n SER 212 Cb 0.36 -0.78 0.01 0.00 -1.01 0.00 0.00 64.21 62.78 3h3o n SER 212 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3h3o n SER 213 N -2.17 1.02 -0.01 6.43 3.41 -1.26 -3.03 113.62 118.01 3h3o n SER 213 Ca 0.01 -2.01 -0.01 0.00 -0.26 0.00 0.00 58.87 56.60 3h3o n SER 213 Cb 0.18 -0.48 -0.02 0.00 -0.26 0.00 0.00 64.21 63.64 3h3o n SER 213 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3h3o n MET 214 N -0.02 3.55 -2.27 4.33 2.81 -1.10 -4.78 117.12 119.63 3h3o n MET 214 Ca 0.00 -0.00 -0.37 0.00 -1.81 0.00 0.00 57.70 55.53 3h3o n MET 214 Cb 0.25 -1.06 -0.01 0.00 -0.71 0.00 0.00 33.22 31.69 3h3o n MET 214 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3h3o s LEU 215 N -4.15 3.97 0.25 4.03 1.43 -1.17 -1.83 118.68 121.22 3h3o s LEU 215 Ca -0.01 2.27 0.01 0.00 -1.03 0.00 0.00 54.13 55.37 3h3o s LEU 215 Cb 0.01 -4.30 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 3h3o s LEU 215 CO 0.09 -0.95 0.42 -2.16 0.23 0.00 0.00 176.35 173.99 3h3o s PRO 216 N -2.79 3.48 0.99 1.29 0.04 -1.26 -4.98 135.00 131.77 3h3o s PRO 216 Ca 0.65 -0.47 -0.12 0.00 0.04 0.00 0.00 61.00 61.09 3h3o s PRO 216 Cb -0.27 -2.81 0.13 0.00 0.04 0.00 0.00 34.50 31.59 3h3o s PRO 216 CO 0.33 0.34 0.75 0.39 0.04 0.00 0.00 177.00 178.86 3h3o n GLU 217 N -1.19 -0.86 -3.47 4.56 1.02 -1.01 -4.69 120.64 115.00 3h3o n GLU 217 Ca -0.06 -0.20 -0.27 0.00 -0.02 0.00 0.00 57.16 56.61 3h3o n GLU 217 Cb 0.55 -2.10 -0.09 0.00 -0.02 0.00 0.00 31.44 29.79 3h3o n GLU 217 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3h3o n VAL 218 N -4.18 1.53 -0.85 2.62 0.31 -1.26 -1.77 118.33 114.73 3h3o n VAL 218 Ca 0.08 -4.86 -0.30 0.00 -0.01 0.00 0.00 64.34 59.24 3h3o n VAL 218 Cb 0.54 -2.07 0.26 0.00 -0.91 0.00 0.00 33.84 31.66 3h3o n VAL 218 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3h3o s LYS 219 N -1.95 -1.77 0.00 5.55 3.01 -1.03 -4.70 119.74 118.85 3h3o s LYS 219 Ca 0.36 0.02 0.00 0.00 -1.01 0.00 0.00 55.97 55.34 3h3o s LYS 219 Cb 0.11 -1.52 0.00 0.00 -1.01 0.00 0.00 37.83 35.41 3h3o s LYS 219 CO -0.07 -4.09 0.00 -1.13 0.51 0.00 0.00 175.35 170.58 3h3o n SER 220 N -5.04 0.00 0.01 2.83 3.41 -1.26 -3.26 113.62 110.30 3h3o n SER 220 Ca 0.13 -0.38 0.11 0.00 -0.26 0.00 0.00 58.87 58.47 3h3o n SER 220 Cb 0.59 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.54 3h3o n SER 220 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3h3o n ASN 221 N -1.13 0.68 -3.50 4.04 3.02 -1.12 -4.63 115.26 112.62 3h3o n ASN 221 Ca 0.00 -0.49 -0.29 0.00 -0.03 0.00 0.00 54.58 53.77 3h3o n ASN 221 Cb 0.00 0.88 -0.12 0.00 -0.61 0.00 0.00 39.78 39.93 3h3o n ASN 221 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3h3o s SER 222 N -3.48 3.11 -0.26 6.41 0.15 -1.26 -2.76 113.70 115.62 3h3o s SER 222 Ca 0.05 -2.16 -0.28 0.00 0.70 0.00 0.00 55.95 54.27 3h3o s SER 222 Cb 0.15 -0.48 0.17 0.00 -1.71 0.00 0.00 66.02 64.15 3h3o s SER 222 CO 0.82 -0.32 1.26 -1.83 1.20 0.00 0.00 173.24 174.37 3h3o s GLU 223 N 1.07 0.24 -0.55 5.44 -1.05 -1.07 -4.76 118.70 118.01 3h3o s GLU 223 Ca 0.17 0.14 -0.26 0.00 -0.15 0.00 0.00 54.97 54.87 3h3o s GLU 223 Cb -0.23 0.11 -0.05 0.00 -0.44 0.00 0.00 34.13 33.53 3h3o s GLU 223 CO -0.02 -0.06 2.17 0.08 0.95 0.00 0.00 175.26 178.38 3h3o s VAL 224 N -0.59 3.16 0.09 1.83 1.01 -1.26 -4.28 120.40 120.35 3h3o s VAL 224 Ca 0.05 0.08 0.26 0.00 0.00 0.00 0.00 61.98 62.37 3h3o s VAL 224 Cb -0.02 -3.42 0.27 0.00 0.00 0.00 0.00 36.38 33.20 3h3o s VAL 224 CO -0.08 -0.41 1.84 1.88 0.00 0.00 0.00 175.10 178.34 3h3o h TYR 225 N 17.48 0.00 0.00 5.22 -1.99 -1.36 -3.49 116.97 132.84 3h3o h TYR 225 Ca -0.24 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.49 3h3o h TYR 225 Cb 1.22 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.95 3h3o h TYR 225 CO 1.00 0.17 0.00 0.41 -0.00 0.00 0.00 178.16 179.75 3h3o n GLY 226 N 0.21 -1.08 3.24 3.88 0.00 -1.21 -5.04 105.19 105.19 3h3o n GLY 226 Ca 0.00 -1.20 -0.26 0.00 0.00 0.00 0.00 46.02 44.57 3h3o n GLY 226 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h3o s HIS 227 N -3.00 1.81 0.67 1.61 3.76 -1.26 -1.04 115.29 117.84 3h3o s HIS 227 Ca 0.00 -0.37 -0.14 0.00 -0.15 0.00 0.00 55.06 54.40 3h3o s HIS 227 Cb 0.00 -1.10 0.00 0.00 1.11 0.00 0.00 32.58 32.60 3h3o s HIS 227 CO 0.00 0.07 1.09 0.95 -0.85 0.00 0.00 174.74 176.00 3h3o s THR 228 N -0.74 3.46 0.18 1.30 -4.23 -0.08 -4.65 115.64 110.88 3h3o s THR 228 Ca 0.07 0.62 -0.07 0.00 -1.18 0.00 0.00 61.69 61.13 3h3o s THR 228 Cb -0.09 -3.15 -0.06 0.00 1.34 0.00 0.00 72.50 70.54 3h3o s THR 228 CO 0.01 -0.48 0.45 -0.13 -0.54 0.00 0.00 174.62 173.93 3h3o s ARG 229 N -4.35 3.70 0.08 3.99 0.52 -0.85 -4.21 118.95 117.84 3h3o s ARG 229 Ca 0.64 0.08 -0.19 0.00 -0.52 0.00 0.00 55.73 55.74 3h3o s ARG 229 Cb -0.18 -2.77 -0.05 0.00 0.52 0.00 0.00 34.95 32.47 3h3o s ARG 229 CO 0.45 0.41 1.32 1.03 0.02 0.00 0.00 175.30 178.52 3h3o h SER 230 N 2.73 -1.18 0.00 0.23 0.87 -1.82 -0.53 113.55 113.85 3h3o h SER 230 Ca -0.46 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 3h3o h SER 230 Cb 1.17 0.50 0.00 0.00 -0.44 0.00 0.00 62.40 63.63 3h3o h SER 230 CO 0.71 -0.19 0.00 0.00 -0.53 0.00 0.00 176.83 176.82 3h3o n TYR 231 N -4.29 0.00 -0.11 2.24 0.18 -1.26 -1.68 117.16 112.23 3h3o n TYR 231 Ca -0.01 -0.37 0.00 0.00 1.88 0.00 0.00 57.90 59.40 3h3o n TYR 231 Cb 0.18 -0.24 0.00 0.00 -0.38 0.00 0.00 39.34 38.89 3h3o n TYR 231 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 3h3o n ARG 232 N 0.98 0.47 -3.19 -3.48 5.12 -0.23 -4.96 116.66 111.37 3h3o n ARG 232 Ca 0.00 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.69 3h3o n ARG 232 Cb 0.29 -0.04 -0.07 0.00 -1.16 0.00 0.00 32.46 31.49 3h3o n ARG 232 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 3h3o n PHE 233 N 0.00 -0.32 -2.06 -1.55 -0.00 -0.97 -4.89 117.46 107.68 3h3o n PHE 233 Ca 0.00 -3.59 -0.16 0.00 -0.00 0.00 0.00 57.45 53.70 3h3o n PHE 233 Cb 0.00 -0.36 -0.03 0.00 -0.00 0.00 0.00 39.48 39.09 3h3o n PHE 233 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.76 177.74 3h3o n TYR 234 N 1.30 -0.85 -0.52 -5.13 9.36 -1.26 -1.67 117.16 118.39 3h3o n TYR 234 Ca 0.21 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.43 3h3o n TYR 234 Cb 0.54 -3.15 0.00 0.00 -0.63 0.00 0.00 39.34 36.10 3h3o n TYR 234 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3h3o n GLY 235 N -0.67 0.74 2.42 2.98 0.00 -0.67 -4.88 105.19 105.11 3h3o n GLY 235 Ca -0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 3h3o n GLY 235 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h3o n SER 236 N 0.00 2.12 -3.76 1.61 7.64 -0.67 -4.80 113.62 115.76 3h3o n SER 236 Ca 0.00 -2.52 -0.29 0.00 1.01 0.00 0.00 58.87 57.07 3h3o n SER 236 Cb 0.00 0.46 -0.15 0.00 -1.01 0.00 0.00 64.21 63.51 3h3o n SER 236 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3h3o s GLU 237 N -3.18 0.82 0.18 1.43 2.02 -1.26 -2.69 118.70 116.02 3h3o s GLU 237 Ca 0.07 -0.95 0.09 0.00 0.02 0.00 0.00 54.97 54.19 3h3o s GLU 237 Cb 0.00 -2.11 -0.04 0.00 0.10 0.00 0.00 34.13 32.08 3h3o s GLU 237 CO 0.05 -0.87 -0.09 0.08 0.02 0.00 0.00 175.26 174.44 3h3o s VAL 238 N 1.62 3.22 -0.33 2.63 1.01 -1.26 -4.85 120.40 122.45 3h3o s VAL 238 Ca 0.06 -1.64 -0.27 0.00 0.00 0.00 0.00 61.98 60.13 3h3o s VAL 238 Cb -0.17 -2.60 0.01 0.00 0.00 0.00 0.00 36.38 33.62 3h3o s VAL 238 CO -0.19 -0.11 0.98 -2.16 0.00 0.00 0.00 175.10 173.62 3h3o s PRO 239 N -2.84 3.98 -0.61 2.72 0.04 -1.26 -0.91 135.00 136.12 3h3o s PRO 239 Ca 0.25 0.84 -0.28 0.00 0.04 0.00 0.00 61.00 61.85 3h3o s PRO 239 Cb -0.09 -3.75 0.02 0.00 0.04 0.00 0.00 34.50 30.72 3h3o s PRO 239 CO 0.15 -0.88 1.34 0.42 0.04 0.00 0.00 177.00 178.08 3h3o s ILE 240 N 3.48 3.81 -0.10 0.56 1.01 -0.21 -1.99 121.20 127.76 3h3o s ILE 240 Ca 0.41 0.65 0.14 0.00 0.00 0.00 0.00 60.65 61.85 3h3o s ILE 240 Cb -0.12 -4.61 0.27 0.00 0.01 0.00 0.00 42.46 38.00 3h3o s ILE 240 CO 0.16 -1.37 1.13 0.00 0.00 0.00 0.00 174.94 174.86 3h3o n ALA 241 N 9.37 2.51 -3.33 9.38 0.00 -1.02 -0.90 120.51 136.52 3h3o n ALA 241 Ca 0.09 -2.38 -0.14 0.00 0.00 0.00 0.00 53.44 51.01 3h3o n ALA 241 Cb 0.49 -0.44 -0.09 0.00 0.00 0.00 0.00 19.45 19.42 3h3o n ALA 241 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h3o s GLY 242 N -2.45 -0.30 -0.19 0.00 0.00 -1.16 -2.61 107.32 100.61 3h3o s GLY 242 Ca 0.26 0.92 -0.28 0.00 0.00 0.00 0.00 44.72 45.63 3h3o s GLY 242 CO -0.02 0.71 0.90 -0.29 0.00 0.00 0.00 173.10 174.40 3h3o s MET 243 N -0.55 0.70 0.00 2.90 1.75 -1.11 -1.49 119.30 121.50 3h3o s MET 243 Ca -0.07 0.45 0.00 0.00 -1.25 0.00 0.00 55.69 54.82 3h3o s MET 243 Cb -0.03 0.34 0.00 0.00 2.84 0.00 0.00 34.83 37.97 3h3o s MET 243 CO 0.03 -0.16 0.00 0.00 -0.65 0.00 0.00 175.02 174.24 3h3o n ALA 244 N 1.55 0.00 -1.79 4.11 0.00 -0.58 -4.59 120.51 119.21 3h3o n ALA 244 Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 52.97 3h3o n ALA 244 Cb 0.57 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.99 3h3o n ALA 244 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h3o s GLY 245 N 0.00 2.52 0.21 0.00 0.00 -1.26 -2.32 107.32 106.47 3h3o s GLY 245 Ca 0.00 0.64 -0.13 0.00 0.00 0.00 0.00 44.72 45.23 3h3o s GLY 245 CO 0.00 0.97 1.64 1.29 0.00 0.00 0.00 173.10 176.99 3h3o h ASP 246 N 1.46 -0.49 -0.72 1.64 3.04 -0.41 0.93 116.42 121.87 3h3o h ASP 246 Ca -0.50 0.18 -0.03 0.00 -3.24 0.00 0.00 57.03 53.45 3h3o h ASP 246 Cb 1.23 0.35 -0.03 0.00 -1.04 0.00 0.00 39.33 39.84 3h3o h ASP 246 CO 0.59 -0.18 0.36 1.56 -2.04 0.00 0.00 179.24 179.52 3h3o h GLN 247 N 0.03 1.06 -0.08 4.15 1.08 -1.92 -0.02 115.11 119.39 3h3o h GLN 247 Ca 0.31 -0.15 -0.07 0.00 -1.45 0.00 0.00 58.65 57.29 3h3o h GLN 247 Cb 0.48 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 3h3o h GLN 247 CO -0.61 0.81 -0.22 1.96 -0.95 0.00 0.00 178.83 179.82 3h3o h GLN 248 N 1.05 0.30 -0.62 1.46 7.50 -1.68 -2.24 115.11 120.89 3h3o h GLN 248 Ca 0.26 -0.21 0.06 0.00 0.50 0.00 0.00 58.65 59.26 3h3o h GLN 248 Cb 0.11 0.03 -0.04 0.00 0.05 0.00 0.00 27.48 27.63 3h3o h GLN 248 CO -0.03 0.82 0.41 0.00 -1.50 0.00 0.00 178.83 178.53 3h3o h ALA 249 N 0.47 1.80 -0.18 3.87 0.00 -0.64 0.16 119.26 124.74 3h3o h ALA 249 Ca -0.00 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 3h3o h ALA 249 Cb 0.84 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3h3o h ALA 249 CO 0.05 0.10 -0.37 0.00 0.00 0.00 0.00 179.25 179.03 3h3o h ALA 250 N 1.66 1.04 0.22 0.00 0.00 -0.92 0.75 119.26 122.02 3h3o h ALA 250 Ca 0.27 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3h3o h ALA 250 Cb 0.27 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3h3o h ALA 250 CO -0.08 0.59 -0.11 1.25 0.00 0.00 0.00 179.25 180.91 3h3o h LEU 251 N 0.33 -0.25 -0.36 0.00 5.85 -0.10 -1.46 115.31 119.31 3h3o h LEU 251 Ca 0.04 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.75 3h3o h LEU 251 Cb 0.80 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 3h3o h LEU 251 CO 0.06 -0.14 0.18 0.15 -0.34 0.00 0.00 178.44 178.36 3h3o h PHE 252 N -0.35 0.33 -0.92 1.25 3.57 -1.10 -2.45 116.94 117.28 3h3o h PHE 252 Ca -0.03 0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.65 3h3o h PHE 252 Cb 0.27 -0.10 -0.08 0.00 2.79 0.00 0.00 35.95 38.84 3h3o h PHE 252 CO -0.05 0.18 0.59 0.78 -2.23 0.00 0.00 178.31 177.58 3h3o h GLY 253 N 0.37 1.23 1.24 2.40 0.00 -0.49 0.36 103.07 108.18 3h3o h GLY 253 Ca 0.15 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.20 3h3o h GLY 253 CO -0.11 0.04 0.00 -1.06 0.00 0.00 0.00 176.54 175.42 3h3o n GLN 254 N -4.58 0.73 -3.68 4.80 1.13 -0.58 -4.73 117.38 110.46 3h3o n GLN 254 Ca 0.19 0.00 -0.26 0.00 -1.94 0.00 0.00 57.00 55.00 3h3o n GLN 254 Cb 0.54 -1.50 0.06 0.00 0.11 0.00 0.00 30.24 29.46 3h3o n GLN 254 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 3h3o n MET 255 N -1.12 -7.28 -2.08 -1.09 2.81 0.13 -4.87 117.12 103.62 3h3o n MET 255 Ca 0.19 0.76 -0.39 0.00 -1.81 0.00 0.00 57.70 56.45 3h3o n MET 255 Cb 0.16 -5.77 -0.00 0.00 -0.71 0.00 0.00 33.22 26.89 3h3o n MET 255 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h3o n ALA 256 N -4.90 6.64 0.22 3.04 0.00 -1.16 -4.65 120.51 119.70 3h3o n ALA 256 Ca 0.01 -4.11 0.11 0.00 0.00 0.00 0.00 53.44 49.45 3h3o n ALA 256 Cb 0.55 -2.60 0.30 0.00 0.00 0.00 0.00 19.45 17.71 3h3o n ALA 256 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3h3o h PHE 257 N 4.38 0.00 -3.42 0.00 0.04 -1.89 -3.45 116.94 112.59 3h3o h PHE 257 Ca 0.65 0.00 -0.54 0.00 2.80 0.00 0.00 57.97 60.87 3h3o h PHE 257 Cb 0.33 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.44 3h3o h PHE 257 CO 1.54 0.14 0.15 -2.00 -0.60 0.00 0.00 178.31 177.53 3h3o s GLU 258 N -3.34 4.49 0.27 1.51 2.56 -1.26 -4.98 118.70 117.94 3h3o s GLU 258 Ca 0.04 1.05 -0.30 0.00 0.00 0.00 0.00 54.97 55.76 3h3o s GLU 258 Cb 0.07 -3.35 -0.13 0.00 2.00 0.00 0.00 34.13 32.72 3h3o s GLU 258 CO 0.65 0.32 1.35 1.17 -0.56 0.00 0.00 175.26 178.19 3h3o n LYS 259 N 2.69 1.99 0.00 4.30 4.81 -1.26 -1.79 118.16 128.90 3h3o n LYS 259 Ca -0.03 0.71 0.00 0.00 -0.87 0.00 0.00 58.31 58.12 3h3o n LYS 259 Cb 0.50 -2.32 0.00 0.00 0.02 0.00 0.00 35.03 33.23 3h3o n LYS 259 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h3o n GLY 260 N 1.76 3.18 3.73 3.14 0.00 -0.22 -5.00 105.19 111.78 3h3o n GLY 260 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 3h3o n GLY 260 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h3o s MET 261 N -0.85 4.54 -0.03 1.61 -1.94 -0.74 -4.84 119.30 117.05 3h3o s MET 261 Ca 0.00 1.68 0.04 0.00 -1.71 0.00 0.00 55.69 55.70 3h3o s MET 261 Cb 0.00 -3.33 -0.01 0.00 2.01 0.00 0.00 34.83 33.51 3h3o s MET 261 CO 0.00 -0.04 -0.14 -1.50 -0.01 0.00 0.00 175.02 173.33 3h3o s ILE 262 N 0.34 1.18 0.17 2.53 2.07 -1.26 -1.57 121.20 124.65 3h3o s ILE 262 Ca 0.52 -0.60 0.07 0.00 -1.41 0.00 0.00 60.65 59.23 3h3o s ILE 262 Cb -0.28 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.26 3h3o s ILE 262 CO 0.32 0.34 -0.14 -1.59 -1.91 0.00 0.00 174.94 171.96 3h3o s LYS 263 N -0.09 1.18 -0.07 3.50 0.00 0.02 -2.37 119.74 121.91 3h3o s LYS 263 Ca 0.00 -1.45 0.01 0.00 0.00 0.00 0.00 55.97 54.53 3h3o s LYS 263 Cb -0.08 -0.96 0.02 0.00 0.00 0.00 0.00 37.83 36.81 3h3o s LYS 263 CO 0.01 0.16 -0.09 1.21 0.00 0.00 0.00 175.35 176.64 3h3o s ASN 264 N -3.02 1.71 -0.17 0.03 3.84 0.41 -0.42 114.94 117.32 3h3o s ASN 264 Ca 0.17 -0.26 -0.03 0.00 0.21 0.00 0.00 52.86 52.96 3h3o s ASN 264 Cb -0.01 -0.74 -0.02 0.00 -0.55 0.00 0.00 41.25 39.93 3h3o s ASN 264 CO 0.04 -0.04 -0.07 -0.89 -2.79 0.00 0.00 177.10 173.36 3h3o s THR 265 N 1.06 3.45 -0.48 -5.21 2.01 -0.96 -1.61 115.64 113.90 3h3o s THR 265 Ca -0.08 -0.50 -0.12 0.00 0.31 0.00 0.00 61.69 61.30 3h3o s THR 265 Cb -0.14 -2.51 0.11 0.00 0.01 0.00 0.00 72.50 69.96 3h3o s THR 265 CO -0.01 0.48 0.38 -0.31 -0.69 0.00 0.00 174.62 174.47 3h3o s TYR 266 N 0.77 3.33 0.00 4.92 2.02 -0.75 -1.77 117.35 125.87 3h3o s TYR 266 Ca -0.03 -1.48 0.00 0.00 -0.37 0.00 0.00 57.07 55.20 3h3o s TYR 266 Cb -0.15 -3.43 0.00 0.00 -0.40 0.00 0.00 41.96 37.98 3h3o s TYR 266 CO 0.02 -0.94 0.00 0.41 -1.57 0.00 0.00 175.55 173.46 3h3o n GLY 267 N 5.06 4.86 0.30 0.71 0.00 -1.26 -1.87 105.19 112.98 3h3o n GLY 267 Ca -0.11 -0.73 -0.01 0.00 0.00 0.00 0.00 46.02 45.17 3h3o n GLY 267 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3h3o h THR 268 N 0.00 1.07 -0.57 2.61 2.02 -1.94 0.08 112.91 116.18 3h3o h THR 268 Ca 0.00 -0.31 -0.67 0.00 0.77 0.00 0.00 66.41 66.20 3h3o h THR 268 Cb 0.00 0.07 -0.13 0.00 -1.74 0.00 0.00 68.15 66.35 3h3o h THR 268 CO 0.00 0.17 -0.51 -0.83 0.37 0.00 0.00 175.52 174.72 3h3o s GLY 269 N -3.05 3.02 -0.13 2.16 0.00 -1.26 -0.98 107.32 107.08 3h3o s GLY 269 Ca -0.13 -0.33 0.02 0.00 0.00 0.00 0.00 44.72 44.28 3h3o s GLY 269 CO 0.78 -2.16 -0.17 0.00 0.00 0.00 0.00 173.10 171.55 3h3o s ALA 270 N -2.93 1.90 -0.20 3.20 0.00 0.43 -4.48 121.76 119.68 3h3o s ALA 270 Ca 0.06 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.15 3h3o s ALA 270 Cb 0.01 -0.93 0.04 0.00 0.00 0.00 0.00 23.12 22.24 3h3o s ALA 270 CO 0.03 -0.13 -0.11 -0.06 0.00 0.00 0.00 175.76 175.49 3h3o s PHE 271 N 1.04 2.49 -0.13 0.00 0.08 -0.73 -1.72 117.98 119.02 3h3o s PHE 271 Ca -0.04 -1.63 -0.21 0.00 0.12 0.00 0.00 56.93 55.18 3h3o s PHE 271 Cb -0.15 -1.68 -0.04 0.00 -0.57 0.00 0.00 43.02 40.59 3h3o s PHE 271 CO -0.04 -0.75 0.59 0.42 -0.10 0.00 0.00 175.22 175.34 3h3o s ILE 272 N 1.37 5.09 -0.03 0.64 1.09 -0.83 -2.27 121.20 126.27 3h3o s ILE 272 Ca -0.01 1.18 0.02 0.00 -1.10 0.00 0.00 60.65 60.74 3h3o s ILE 272 Cb -0.16 -3.93 0.01 0.00 -1.06 0.00 0.00 42.46 37.32 3h3o s ILE 272 CO -0.08 0.24 -0.07 -0.69 -0.10 0.00 0.00 174.94 174.23 3h3o s VAL 273 N 1.06 0.64 -0.07 2.92 1.01 0.44 -0.66 120.40 125.75 3h3o s VAL 273 Ca 0.30 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 62.08 3h3o s VAL 273 Cb -0.16 -0.59 -0.01 0.00 0.00 0.00 0.00 36.38 35.62 3h3o s VAL 273 CO 0.13 0.22 -0.24 -0.32 0.00 0.00 0.00 175.10 174.89 3h3o s MET 274 N 0.36 2.58 0.06 2.72 0.00 0.14 -0.80 119.30 124.37 3h3o s MET 274 Ca -0.05 -0.85 -0.30 0.00 0.00 0.00 0.00 55.69 54.48 3h3o s MET 274 Cb -0.09 -2.11 -0.05 0.00 0.00 0.00 0.00 34.83 32.57 3h3o s MET 274 CO 0.00 0.30 1.07 1.21 0.00 0.00 0.00 175.02 177.61 3h3o s ASN 275 N 0.01 7.27 0.00 1.11 3.84 -0.61 -1.58 114.94 124.98 3h3o s ASN 275 Ca -0.08 1.86 0.04 0.00 0.21 0.00 0.00 52.86 54.89 3h3o s ASN 275 Cb -0.15 -2.58 0.03 0.00 -0.55 0.00 0.00 41.25 38.01 3h3o s ASN 275 CO 0.05 -0.30 0.64 0.35 -2.79 0.00 0.00 177.10 175.06 3h3o n THR 276 N 3.52 0.06 -1.93 -5.21 -2.24 0.38 -1.05 114.28 107.81 3h3o n THR 276 Ca 0.06 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 3h3o n THR 276 Cb 0.48 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.75 3h3o n THR 276 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h3o n GLY 277 N 0.18 -1.31 0.18 3.38 0.00 -1.23 -4.48 105.19 101.92 3h3o n GLY 277 Ca 0.02 -1.62 -0.02 0.00 0.00 0.00 0.00 46.02 44.40 3h3o n GLY 277 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h3o h GLU 278 N 0.00 0.20 -5.25 1.61 4.39 -1.92 0.24 114.58 113.84 3h3o h GLU 278 Ca 0.00 -0.11 -0.66 0.00 0.34 0.00 0.00 59.36 58.94 3h3o h GLU 278 Cb 0.00 0.00 -0.28 0.00 -0.10 0.00 0.00 28.75 28.38 3h3o h GLU 278 CO 0.00 0.63 -0.77 -1.83 -1.16 0.00 0.00 179.01 175.89 3h3o s GLU 279 N -4.00 3.35 0.00 2.33 1.03 -1.26 -4.76 118.70 115.39 3h3o s GLU 279 Ca -0.04 -0.69 0.00 0.00 0.03 0.00 0.00 54.97 54.27 3h3o s GLU 279 Cb 0.13 -2.68 0.00 0.00 -0.80 0.00 0.00 34.13 30.78 3h3o s GLU 279 CO 0.77 0.12 0.00 -0.35 -1.33 0.00 0.00 175.26 174.47 3h3o n PRO 280 N 3.80 3.45 -3.99 -4.83 -0.04 -1.26 -4.80 135.00 127.33 3h3o n PRO 280 Ca -0.18 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.89 3h3o n PRO 280 Cb 0.52 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.99 3h3o n PRO 280 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 3h3o n GLN 281 N 0.00 -0.94 -0.74 0.54 0.00 -1.26 -4.81 117.38 110.18 3h3o n GLN 281 Ca 0.00 0.21 -0.12 0.00 -0.00 0.00 0.00 57.00 57.10 3h3o n GLN 281 Cb 0.00 -3.32 0.03 0.00 0.00 0.00 0.00 30.24 26.96 3h3o n GLN 281 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 3h3o n LEU 282 N -4.69 5.89 -3.27 1.69 0.00 -1.26 -4.80 117.00 110.56 3h3o n LEU 282 Ca -0.16 -2.95 -0.09 0.00 0.00 0.00 0.00 56.01 52.82 3h3o n LEU 282 Cb 0.60 -1.00 0.01 0.00 0.00 0.00 0.00 43.42 43.03 3h3o n LEU 282 CO 0.74 1.10 0.17 -1.20 0.00 0.00 0.00 177.39 178.19 3h3o n SER 283 N 0.52 -6.92 -4.58 1.96 7.64 -1.26 -4.54 113.62 106.44 3h3o n SER 283 Ca 0.22 -0.39 -0.43 0.00 1.01 0.00 0.00 58.87 59.28 3h3o n SER 283 Cb 0.62 -4.48 -0.03 0.00 -1.01 0.00 0.00 64.21 59.31 3h3o n SER 283 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 3h3o s ASP 284 N -3.09 6.57 -0.18 6.43 -4.77 -1.26 -4.70 116.67 115.67 3h3o s ASP 284 Ca 0.10 0.29 -0.00 0.00 -3.30 0.00 0.00 52.55 49.64 3h3o s ASP 284 Cb -0.02 -2.49 0.01 0.00 -1.09 0.00 0.00 42.92 39.33 3h3o s ASP 284 CO 0.79 -1.11 -0.16 0.20 0.70 0.00 0.00 175.17 175.59 3h3o s ASN 285 N 2.30 3.48 0.00 2.11 0.02 -1.26 -4.53 114.94 117.05 3h3o s ASN 285 Ca 0.41 -0.56 0.00 0.00 -1.02 0.00 0.00 52.86 51.70 3h3o s ASN 285 Cb -0.09 -1.55 0.00 0.00 0.02 0.00 0.00 41.25 39.63 3h3o s ASN 285 CO 0.28 0.02 0.00 0.47 0.02 0.00 0.00 177.10 177.89 3h3o n ASP 286 N 4.49 -4.49 -4.20 -1.22 10.43 -1.26 -4.94 116.55 115.37 3h3o n ASP 286 Ca -0.20 0.00 -0.23 0.00 2.57 0.00 0.00 54.79 56.93 3h3o n ASP 286 Cb 0.51 -2.11 -0.09 0.00 1.84 0.00 0.00 41.12 41.27 3h3o n ASP 286 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3h3o s LEU 287 N 0.00 1.98 -0.05 0.64 1.43 -1.26 -4.46 118.68 116.96 3h3o s LEU 287 Ca 0.00 -1.57 0.04 0.00 -1.03 0.00 0.00 54.13 51.57 3h3o s LEU 287 Cb 0.00 -0.13 -0.03 0.00 0.03 0.00 0.00 46.19 46.06 3h3o s LEU 287 CO 0.00 -0.84 -0.16 -0.76 0.23 0.00 0.00 176.35 174.83 3h3o s LEU 288 N -3.53 2.66 -0.20 1.79 1.43 -0.76 -4.89 118.68 115.18 3h3o s LEU 288 Ca 0.29 -0.22 -0.06 0.00 -1.03 0.00 0.00 54.13 53.10 3h3o s LEU 288 Cb 0.05 -1.53 -0.03 0.00 0.03 0.00 0.00 46.19 44.70 3h3o s LEU 288 CO 0.15 0.34 0.04 -0.89 0.23 0.00 0.00 176.35 176.22 3h3o s THR 289 N -0.72 4.31 0.30 5.49 2.01 -0.87 -0.36 115.64 125.80 3h3o s THR 289 Ca 0.11 -0.19 0.03 0.00 0.31 0.00 0.00 61.69 61.95 3h3o s THR 289 Cb -0.11 -2.96 -0.02 0.00 0.01 0.00 0.00 72.50 69.42 3h3o s THR 289 CO 0.00 0.42 0.30 0.28 -0.69 0.00 0.00 174.62 174.93 3h3o s THR 290 N 0.93 0.00 -0.37 -0.82 -1.32 0.69 -4.44 115.64 110.32 3h3o s THR 290 Ca 0.03 -1.90 -0.18 0.00 -1.21 0.00 0.00 61.69 58.43 3h3o s THR 290 Cb -0.14 -2.52 0.00 0.00 -1.51 0.00 0.00 72.50 68.33 3h3o s THR 290 CO 0.02 0.00 0.48 -0.63 -2.21 0.00 0.00 174.62 172.28 3h3o s ILE 291 N -3.52 5.04 0.01 5.08 1.01 -1.26 0.06 121.20 127.62 3h3o s ILE 291 Ca 0.38 0.14 -0.22 0.00 0.00 0.00 0.00 60.65 60.94 3h3o s ILE 291 Cb 0.03 -3.97 -0.12 0.00 0.01 0.00 0.00 42.46 38.40 3h3o s ILE 291 CO 0.22 -0.26 1.01 1.23 0.00 0.00 0.00 174.94 177.15 3h3o h GLY 292 N 9.06 -0.85 -3.08 6.18 0.00 -1.34 -3.38 103.07 109.67 3h3o h GLY 292 Ca -0.28 0.31 0.16 0.00 0.00 0.00 0.00 47.33 47.52 3h3o h GLY 292 CO 0.77 -0.31 0.55 -2.52 0.00 0.00 0.00 176.54 175.03 3h3o s TYR 293 N -4.27 -0.24 -0.18 5.60 -0.85 -1.12 -4.70 117.35 111.57 3h3o s TYR 293 Ca -0.12 0.07 -0.01 0.00 -0.52 0.00 0.00 57.07 56.49 3h3o s TYR 293 Cb 0.01 0.56 0.05 0.00 0.38 0.00 0.00 41.96 42.97 3h3o s TYR 293 CO 0.36 -0.57 -0.01 0.20 -1.52 0.00 0.00 175.55 174.01 3h3o s GLY 294 N -2.61 0.86 0.07 5.49 0.00 -1.26 -0.29 107.32 109.58 3h3o s GLY 294 Ca 0.08 -0.81 0.02 0.00 0.00 0.00 0.00 44.72 44.01 3h3o s GLY 294 CO -0.05 1.19 -0.06 -0.26 0.00 0.00 0.00 173.10 173.92 3h3o s ILE 295 N 1.73 0.58 -1.46 0.90 -4.36 -0.92 -2.81 121.20 114.87 3h3o s ILE 295 Ca -0.01 -1.65 -0.08 0.00 -0.26 0.00 0.00 60.65 58.66 3h3o s ILE 295 Cb -0.17 -1.32 0.05 0.00 1.25 0.00 0.00 42.46 42.28 3h3o s ILE 295 CO -0.07 -0.74 0.79 0.59 0.24 0.00 0.00 174.94 175.75 3h3o n ASN 296 N 0.45 -2.79 -1.52 4.36 3.02 -1.26 -0.88 115.26 116.64 3h3o n ASN 296 Ca -0.16 -0.85 -0.18 0.00 -0.03 0.00 0.00 54.58 53.36 3h3o n ASN 296 Cb 0.59 -3.72 -0.07 0.00 -0.61 0.00 0.00 39.78 35.97 3h3o n ASN 296 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h3o n GLY 297 N -1.67 1.44 3.50 7.41 0.00 -1.26 -4.98 105.19 109.63 3h3o n GLY 297 Ca -0.12 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.53 3h3o n GLY 297 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3o s LYS 298 N -3.78 1.74 -0.12 1.61 1.02 -0.06 -5.15 119.74 115.00 3h3o s LYS 298 Ca 0.00 -1.97 -0.03 0.00 0.02 0.00 0.00 55.97 53.99 3h3o s LYS 298 Cb 0.00 -1.09 0.05 0.00 -0.52 0.00 0.00 37.83 36.26 3h3o s LYS 298 CO 0.00 -0.14 0.05 0.08 -0.92 0.00 0.00 175.35 174.42 3h3o s VAL 299 N -3.12 0.16 -0.07 3.17 1.01 -1.26 -2.16 120.40 118.13 3h3o s VAL 299 Ca 0.36 -0.05 -0.11 0.00 0.00 0.00 0.00 61.98 62.18 3h3o s VAL 299 Cb 0.09 -0.57 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 3h3o s VAL 299 CO 0.16 -0.03 0.27 -0.31 0.00 0.00 0.00 175.10 175.19 3h3o s TYR 300 N 2.04 3.64 0.40 5.22 2.02 0.60 -4.38 117.35 126.89 3h3o s TYR 300 Ca 0.03 0.74 0.08 0.00 -0.37 0.00 0.00 57.07 57.54 3h3o s TYR 300 Cb -0.14 -2.13 -0.03 0.00 -0.40 0.00 0.00 41.96 39.26 3h3o s TYR 300 CO -0.06 0.66 0.31 0.71 -1.57 0.00 0.00 175.55 175.59 3h3o s TYR 301 N -0.92 2.73 0.11 2.71 2.02 0.83 -1.07 117.35 123.75 3h3o s TYR 301 Ca 0.19 -0.46 -0.16 0.00 -0.37 0.00 0.00 57.07 56.26 3h3o s TYR 301 Cb -0.14 -2.03 0.03 0.00 -0.40 0.00 0.00 41.96 39.42 3h3o s TYR 301 CO 0.08 0.02 0.39 0.00 -1.57 0.00 0.00 175.55 174.47 3h3o s ALA 302 N -2.46 -0.90 -0.21 3.71 0.00 0.11 -0.47 121.76 121.54 3h3o s ALA 302 Ca 0.45 -0.02 -0.07 0.00 0.00 0.00 0.00 51.96 52.32 3h3o s ALA 302 Cb -0.02 0.62 -0.04 0.00 0.00 0.00 0.00 23.12 23.68 3h3o s ALA 302 CO 0.26 -0.60 0.06 -0.51 0.00 0.00 0.00 175.76 174.97 3h3o s LEU 303 N -2.66 3.63 -0.02 0.00 1.43 -0.62 -0.22 118.68 120.23 3h3o s LEU 303 Ca 0.02 -0.05 0.05 0.00 -1.03 0.00 0.00 54.13 53.12 3h3o s LEU 303 Cb 0.02 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 3h3o s LEU 303 CO -0.10 0.09 -0.16 -0.70 0.23 0.00 0.00 176.35 175.70 3h3o s GLU 304 N 0.88 1.41 -0.09 1.70 2.12 0.51 -0.68 118.70 124.55 3h3o s GLU 304 Ca 0.03 -0.58 0.03 0.00 0.36 0.00 0.00 54.97 54.81 3h3o s GLU 304 Cb -0.14 -1.33 -0.02 0.00 0.26 0.00 0.00 34.13 32.91 3h3o s GLU 304 CO 0.02 0.32 -0.18 0.20 -0.54 0.00 0.00 175.26 175.09 3h3o s GLY 305 N -0.28 1.46 -0.08 -1.50 0.00 0.16 -1.83 107.32 105.26 3h3o s GLY 305 Ca 0.04 -0.96 0.00 0.00 0.00 0.00 0.00 44.72 43.80 3h3o s GLY 305 CO -0.00 -0.48 -0.05 -0.56 0.00 0.00 0.00 173.10 172.01 3h3o s SER 306 N -0.07 4.79 -0.42 1.64 0.01 -1.26 -1.97 113.70 116.42 3h3o s SER 306 Ca -0.04 0.01 0.02 0.00 1.31 0.00 0.00 55.95 57.26 3h3o s SER 306 Cb -0.14 -1.27 0.15 0.00 0.21 0.00 0.00 66.02 64.97 3h3o s SER 306 CO 0.04 0.36 0.27 -0.63 0.41 0.00 0.00 173.24 173.69 3h3o s ILE 307 N -0.78 0.83 0.65 1.44 1.01 -0.70 -0.52 121.20 123.12 3h3o s ILE 307 Ca 0.12 -2.40 0.30 0.00 0.00 0.00 0.00 60.65 58.67 3h3o s ILE 307 Cb -0.11 -1.58 0.33 0.00 0.01 0.00 0.00 42.46 41.10 3h3o s ILE 307 CO 0.02 -1.01 1.96 -0.26 0.00 0.00 0.00 174.94 175.64 3h3o h PHE 308 N 6.49 0.00 -3.53 3.97 0.04 -1.93 0.12 116.94 122.11 3h3o h PHE 308 Ca 0.09 0.00 -0.59 0.00 2.80 0.00 0.00 57.97 60.27 3h3o h PHE 308 Cb 0.93 0.00 -0.39 0.00 2.20 0.00 0.00 35.95 38.69 3h3o h PHE 308 CO 0.43 0.00 -0.78 0.08 -0.60 0.00 0.00 178.31 177.45 3h3o s VAL 309 N -4.24 1.25 0.00 -0.55 1.01 -1.26 -4.30 120.40 112.31 3h3o s VAL 309 Ca -0.04 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 60.88 3h3o s VAL 309 Cb 0.11 -1.60 0.00 0.00 0.00 0.00 0.00 36.38 34.89 3h3o s VAL 309 CO 0.36 -0.15 0.00 0.00 0.00 0.00 0.00 175.10 175.31 3h3o n ALA 310 N 4.77 2.67 0.16 5.51 0.00 -0.15 -4.81 120.51 128.66 3h3o n ALA 310 Ca -0.11 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.40 3h3o n ALA 310 Cb 0.45 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.97 3h3o n ALA 310 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3h3o h GLY 311 N 0.00 0.00 2.00 0.00 0.00 0.11 -3.16 103.07 102.02 3h3o h GLY 311 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h3o h GLY 311 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 176.54 178.02 3h3o h SER 312 N 0.00 0.00 -0.03 0.19 4.64 -1.69 -1.97 113.55 114.68 3h3o h SER 312 Ca -0.01 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 3h3o h SER 312 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3h3o h SER 312 CO 0.03 0.00 -0.06 0.00 -0.87 0.00 0.00 176.83 175.93 3h3o h ALA 313 N 2.16 0.05 0.00 5.18 0.00 -1.83 -2.19 119.26 122.62 3h3o h ALA 313 Ca 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 3h3o h ALA 313 Cb 0.41 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3h3o h ALA 313 CO 0.00 -0.12 -0.14 0.82 0.00 0.00 0.00 179.25 179.81 3h3o h ILE 314 N -0.43 0.98 -0.67 0.00 1.08 -1.59 0.51 117.51 117.39 3h3o h ILE 314 Ca 0.00 -0.49 -0.07 0.00 -0.39 0.00 0.00 64.86 63.91 3h3o h ILE 314 Cb 0.63 1.27 -0.03 0.00 -3.07 0.00 0.00 36.82 35.63 3h3o h ILE 314 CO 0.01 0.13 0.15 -0.61 -0.69 0.00 0.00 178.15 177.15 3h3o h GLN 315 N 0.00 1.08 -0.27 2.37 4.15 -1.24 -2.05 115.11 119.14 3h3o h GLN 315 Ca -0.00 -0.27 -0.04 0.00 0.77 0.00 0.00 58.65 59.12 3h3o h GLN 315 Cb 0.26 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 3h3o h GLN 315 CO 0.02 0.97 0.03 2.35 -1.93 0.00 0.00 178.83 180.27 3h3o h TRP 316 N 1.00 0.50 -0.26 3.99 7.01 -0.34 0.56 115.95 128.41 3h3o h TRP 316 Ca 0.21 -0.07 0.08 0.00 2.11 0.00 0.00 58.89 61.21 3h3o h TRP 316 Cb 0.39 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.30 3h3o h TRP 316 CO 0.03 0.58 0.22 -0.07 -2.79 0.00 0.00 178.44 176.41 3h3o h LEU 317 N 0.27 0.00 0.03 0.65 3.38 -0.70 0.33 115.31 119.27 3h3o h LEU 317 Ca 0.08 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.74 3h3o h LEU 317 Cb 0.36 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 3h3o h LEU 317 CO 0.01 0.00 -1.73 -1.14 0.09 0.00 0.00 178.44 175.67 3h3o n ARG 318 N -4.13 0.62 -0.00 1.13 0.63 -0.80 0.27 116.66 114.37 3h3o n ARG 318 Ca 0.03 0.43 -0.16 0.00 -0.92 0.00 0.00 57.85 57.23 3h3o n ARG 318 Cb 0.37 -1.68 -0.14 0.00 0.45 0.00 0.00 32.46 31.46 3h3o n ARG 318 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3h3o h ASP 319 N -0.71 0.25 0.00 6.15 3.32 0.26 -3.24 116.42 122.46 3h3o h ASP 319 Ca -0.45 -0.57 0.00 0.00 0.02 0.00 0.00 57.03 56.04 3h3o h ASP 319 Cb 1.56 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 41.02 3h3o h ASP 319 CO -0.18 1.51 -0.01 1.23 -1.72 0.00 0.00 179.24 180.07 3h3o h GLY 320 N 2.07 0.00 1.83 2.75 0.00 -0.51 -3.39 103.07 105.82 3h3o h GLY 320 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.97 3h3o h GLY 320 CO 0.09 0.00 -0.14 1.41 0.00 0.00 0.00 176.54 177.90 3h3o h LEU 321 N -0.21 0.00 0.13 3.11 3.38 -1.60 -3.47 115.31 116.65 3h3o h LEU 321 Ca 0.00 -0.02 -0.41 0.00 0.09 0.00 0.00 57.88 57.53 3h3o h LEU 321 Cb 0.01 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.78 3h3o h LEU 321 CO 0.00 0.01 -0.64 0.54 0.09 0.00 0.00 178.44 178.44 3h3o n ARG 322 N -2.63 -5.29 0.18 1.13 1.74 -1.07 -4.85 116.66 105.86 3h3o n ARG 322 Ca 0.04 0.73 0.12 0.00 -0.77 0.00 0.00 57.85 57.98 3h3o n ARG 322 Cb 0.48 -5.61 0.24 0.00 -1.02 0.00 0.00 32.46 26.55 3h3o n ARG 322 CO 0.00 0.00 0.00 1.98 -1.52 0.00 0.00 177.63 178.09 3h3o h MET 323 N -1.70 0.00 -5.53 5.56 4.05 -0.41 -3.46 114.93 113.44 3h3o h MET 323 Ca -0.53 0.00 -0.49 0.00 -0.28 0.00 0.00 59.70 58.40 3h3o h MET 323 Cb 1.35 0.00 -0.14 0.00 -0.80 0.00 0.00 31.60 32.01 3h3o h MET 323 CO 0.58 0.00 -0.68 0.42 0.23 0.00 0.00 176.91 177.46 3h3o s ILE 324 N -3.18 1.67 -0.21 1.77 1.01 -0.95 -5.01 121.20 116.30 3h3o s ILE 324 Ca 0.08 -2.13 -0.19 0.00 0.00 0.00 0.00 60.65 58.41 3h3o s ILE 324 Cb 0.07 -2.43 -0.15 0.00 0.01 0.00 0.00 42.46 39.96 3h3o s ILE 324 CO 0.65 -0.31 0.06 1.21 0.00 0.00 0.00 174.94 176.55 3h3o n GLU 325 N -0.58 0.55 -3.87 2.79 4.07 -1.26 -4.62 120.64 117.72 3h3o n GLU 325 Ca -0.06 0.52 -0.11 0.00 -0.06 0.00 0.00 57.16 57.45 3h3o n GLU 325 Cb 0.63 -1.70 -0.12 0.00 -0.06 0.00 0.00 31.44 30.20 3h3o n GLU 325 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 3h3o s THR 326 N -2.38 0.04 0.14 6.31 -4.23 -1.26 -5.02 115.64 109.25 3h3o s THR 326 Ca -0.28 -0.35 -0.17 0.00 -1.18 0.00 0.00 61.69 59.71 3h3o s THR 326 Cb 0.07 -0.24 0.08 0.00 1.34 0.00 0.00 72.50 73.75 3h3o s THR 326 CO 0.52 -0.19 1.11 -1.20 -0.54 0.00 0.00 174.62 174.31 3h3o n SER 327 N 2.36 -0.59 -0.06 3.99 7.64 -1.26 -0.21 113.62 125.49 3h3o n SER 327 Ca -0.17 1.26 0.12 0.00 1.01 0.00 0.00 58.87 61.08 3h3o n SER 327 Cb 0.58 -0.23 0.51 0.00 -1.01 0.00 0.00 64.21 64.05 3h3o n SER 327 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3h3o h PRO 328 N 0.00 0.38 -0.34 1.43 0.13 -1.99 -1.40 132.00 130.21 3h3o h PRO 328 Ca 0.19 -0.02 0.10 0.00 -0.87 0.00 0.00 66.00 65.40 3h3o h PRO 328 Cb 0.37 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.40 3h3o h PRO 328 CO -0.69 0.25 0.32 0.37 -0.23 0.00 0.00 178.00 178.02 3h3o h GLN 329 N 0.39 0.00 -0.58 0.86 4.15 -1.01 -1.83 115.11 117.08 3h3o h GLN 329 Ca 0.26 0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.76 3h3o h GLN 329 Cb 0.51 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 28.14 3h3o h GLN 329 CO -0.07 0.00 0.23 0.66 -1.93 0.00 0.00 178.83 177.72 3h3o h SER 330 N 0.00 0.25 -0.78 -0.69 4.64 -1.32 -1.51 113.55 114.14 3h3o h SER 330 Ca 0.16 0.07 0.09 0.00 -0.47 0.00 0.00 61.79 61.64 3h3o h SER 330 Cb 0.80 0.04 -0.07 0.00 -0.31 0.00 0.00 62.40 62.86 3h3o h SER 330 CO -0.00 0.16 0.43 -0.08 -0.87 0.00 0.00 176.83 176.46 3h3o h GLU 331 N 0.43 0.69 -0.65 4.77 4.81 -1.51 -0.40 114.58 122.72 3h3o h GLU 331 Ca 0.29 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.39 3h3o h GLU 331 Cb 0.32 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 3h3o h GLU 331 CO -0.27 0.46 0.09 1.49 -0.73 0.00 0.00 179.01 180.04 3h3o h GLU 332 N 0.72 1.08 0.12 1.92 4.81 -1.41 -2.59 114.58 119.21 3h3o h GLU 332 Ca 0.38 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 3h3o h GLU 332 Cb 0.37 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.63 3h3o h GLU 332 CO -0.26 1.00 -0.06 -0.07 -0.73 0.00 0.00 179.01 178.90 3h3o h LEU 333 N 1.01 -0.13 -2.61 1.64 3.38 -0.72 -3.00 115.31 114.88 3h3o h LEU 333 Ca 0.20 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3h3o h LEU 333 Cb 0.46 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3h3o h LEU 333 CO 0.02 0.29 0.11 0.00 0.09 0.00 0.00 178.44 178.95 3h3o h ALA 334 N 0.22 1.11 0.09 1.53 0.00 -1.11 -1.62 119.26 119.47 3h3o h ALA 334 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.63 3h3o h ALA 334 Cb 0.46 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3h3o h ALA 334 CO 0.03 -0.11 -1.25 0.00 0.00 0.00 0.00 179.25 177.92 3h3o h ALA 335 N 1.77 0.22 -0.26 0.00 0.00 -1.33 -3.26 119.26 116.40 3h3o h ALA 335 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 53.96 3h3o h ALA 335 Cb 0.22 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3h3o h ALA 335 CO 0.00 1.10 0.00 1.63 0.00 0.00 0.00 179.25 181.98 3h3o n LYS 336 N -3.45 2.00 -2.03 0.00 5.02 -0.62 -4.86 118.16 114.21 3h3o n LYS 336 Ca -0.08 -1.10 -0.43 0.00 -2.02 0.00 0.00 58.31 54.68 3h3o n LYS 336 Cb 1.01 -1.45 -0.03 0.00 -0.02 0.00 0.00 35.03 34.54 3h3o n LYS 336 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h3o s ALA 337 N -1.64 3.15 -2.33 7.82 0.00 -1.20 -4.83 121.76 122.74 3h3o s ALA 337 Ca 0.20 0.48 0.20 0.00 0.00 0.00 0.00 51.96 52.83 3h3o s ALA 337 Cb 0.12 -3.91 0.21 0.00 0.00 0.00 0.00 23.12 19.55 3h3o s ALA 337 CO 0.10 -2.15 1.17 1.63 0.00 0.00 0.00 175.76 176.51 3h3o n LYS 338 N 7.92 1.89 -2.11 0.00 4.01 -1.26 -4.98 118.16 123.63 3h3o n LYS 338 Ca 0.20 -1.79 -0.27 0.00 -0.51 0.00 0.00 58.31 55.94 3h3o n LYS 338 Cb 0.45 -1.39 0.07 0.00 -0.51 0.00 0.00 35.03 33.65 3h3o n LYS 338 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 3h3o s GLY 339 N -1.54 1.64 0.13 0.72 0.00 -1.26 -5.04 107.32 101.97 3h3o s GLY 339 Ca 0.26 -0.74 -0.29 0.00 0.00 0.00 0.00 44.72 43.95 3h3o s GLY 339 CO 0.25 -0.33 0.91 -0.35 0.00 0.00 0.00 173.10 173.58 3h3o s ASP 340 N -4.48 7.48 0.00 1.64 2.15 -1.26 -4.92 116.67 117.28 3h3o s ASP 340 Ca 0.59 1.76 -0.00 0.00 0.43 0.00 0.00 52.55 55.34 3h3o s ASP 340 Cb -0.11 -2.57 -0.01 0.00 -0.30 0.00 0.00 42.92 39.93 3h3o s ASP 340 CO 0.47 0.01 0.45 0.59 -0.17 0.00 0.00 175.17 176.53 3h3o n ASN 341 N 2.43 0.44 -0.88 -0.34 3.02 -1.26 -4.04 115.26 114.64 3h3o n ASN 341 Ca 0.00 -1.34 0.12 0.00 -0.03 0.00 0.00 54.58 53.33 3h3o n ASN 341 Cb 0.49 -0.11 0.08 0.00 -0.61 0.00 0.00 39.78 39.64 3h3o n ASN 341 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 3h3o n GLU 342 N 2.44 2.12 -3.40 3.52 0.28 -1.26 -4.91 120.64 119.44 3h3o n GLU 342 Ca 0.02 -1.77 -0.37 0.00 -0.16 0.00 0.00 57.16 54.87 3h3o n GLU 342 Cb 0.06 -1.45 -0.06 0.00 1.43 0.00 0.00 31.44 31.41 3h3o n GLU 342 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 3h3o s VAL 343 N -2.02 5.23 -0.09 3.84 1.01 -1.26 -4.46 120.40 122.65 3h3o s VAL 343 Ca 0.26 0.80 0.05 0.00 0.00 0.00 0.00 61.98 63.08 3h3o s VAL 343 Cb 0.19 -3.75 -0.00 0.00 0.00 0.00 0.00 36.38 32.82 3h3o s VAL 343 CO 0.33 0.34 -0.24 -0.31 0.00 0.00 0.00 175.10 175.22 3h3o s TYR 344 N 0.63 2.53 -0.11 5.22 2.02 -0.64 -4.76 117.35 122.25 3h3o s TYR 344 Ca 0.22 -0.93 0.01 0.00 -0.37 0.00 0.00 57.07 56.00 3h3o s TYR 344 Cb -0.14 -1.68 -0.02 0.00 -0.40 0.00 0.00 41.96 39.72 3h3o s TYR 344 CO 0.08 -0.35 -0.13 0.08 -1.57 0.00 0.00 175.55 173.66 3h3o s VAL 345 N 0.18 3.12 -0.49 0.71 1.01 -1.26 -0.88 120.40 122.78 3h3o s VAL 345 Ca -0.14 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.22 3h3o s VAL 345 Cb -0.17 -2.29 0.13 0.00 0.00 0.00 0.00 36.38 34.06 3h3o s VAL 345 CO 0.07 0.54 0.25 -0.69 0.00 0.00 0.00 175.10 175.27 3h3o s VAL 346 N -0.00 2.30 0.00 2.92 1.01 -0.20 -4.65 120.40 121.78 3h3o s VAL 346 Ca -0.03 -3.11 -0.02 0.00 0.00 0.00 0.00 61.98 58.82 3h3o s VAL 346 Cb -0.14 -2.61 -0.07 0.00 0.00 0.00 0.00 36.38 33.56 3h3o s VAL 346 CO 0.04 -0.81 1.85 -0.81 0.00 0.00 0.00 175.10 175.37 3h3o n PRO 347 N 3.25 0.95 -0.91 2.72 -0.04 -1.26 -1.67 135.00 138.03 3h3o n PRO 347 Ca 0.06 -0.25 -0.13 0.00 -0.04 0.00 0.00 63.50 63.14 3h3o n PRO 347 Cb 0.33 -1.41 -0.14 0.00 -0.04 0.00 0.00 33.50 32.24 3h3o n PRO 347 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h3o n ALA 348 N 2.02 5.87 -0.38 0.55 0.00 -1.26 -4.63 120.51 122.68 3h3o n ALA 348 Ca 0.11 -1.76 0.30 0.00 0.00 0.00 0.00 53.44 52.09 3h3o n ALA 348 Cb 0.45 -2.40 0.59 0.00 0.00 0.00 0.00 19.45 18.09 3h3o n ALA 348 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3h3o h PHE 349 N 3.51 0.58 0.00 0.00 0.04 -1.86 0.13 116.94 119.34 3h3o h PHE 349 Ca 0.22 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 61.01 3h3o h PHE 349 Cb 1.25 -0.15 -0.00 0.00 2.20 0.00 0.00 35.95 39.25 3h3o h PHE 349 CO 1.72 -0.08 -0.43 0.25 -0.60 0.00 0.00 178.31 179.17 3h3o n THR 350 N -4.66 2.15 0.00 -1.55 -2.24 -1.26 -4.64 114.28 102.08 3h3o n THR 350 Ca 0.31 -3.10 0.00 0.00 -2.27 0.00 0.00 64.05 59.00 3h3o n THR 350 Cb 1.17 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 69.17 3h3o n THR 350 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h3o n GLY 351 N -1.16 1.49 3.86 3.38 0.00 0.45 -4.86 105.19 108.35 3h3o n GLY 351 Ca 0.18 -1.94 -0.31 0.00 0.00 0.00 0.00 46.02 43.95 3h3o n GLY 351 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3o s LEU 352 N -0.20 3.77 0.00 0.99 1.43 0.26 -4.63 118.68 120.29 3h3o s LEU 352 Ca 0.00 1.30 0.00 0.00 -1.03 0.00 0.00 54.13 54.40 3h3o s LEU 352 Cb 0.00 -4.20 0.00 0.00 0.03 0.00 0.00 46.19 42.02 3h3o s LEU 352 CO 0.00 -0.46 0.00 0.61 0.23 0.00 0.00 176.35 176.73 3h3o n GLY 353 N -1.36 2.70 3.77 -3.19 0.00 -1.26 -2.89 105.19 102.96 3h3o n GLY 353 Ca 0.04 -1.80 -0.39 0.00 0.00 0.00 0.00 46.02 43.87 3h3o n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3o s ALA 354 N -2.75 3.29 -0.52 4.61 0.00 0.32 0.69 121.76 127.40 3h3o s ALA 354 Ca 0.00 1.01 0.02 0.00 0.00 0.00 0.00 51.96 52.99 3h3o s ALA 354 Cb 0.00 -3.39 0.60 0.00 0.00 0.00 0.00 23.12 20.33 3h3o s ALA 354 CO 0.00 -0.45 1.95 -0.35 0.00 0.00 0.00 175.76 176.90 3h3o n PRO 355 N 0.50 2.39 -0.12 0.00 -0.04 -1.26 -4.64 135.00 131.83 3h3o n PRO 355 Ca 0.02 -3.11 -0.26 0.00 -0.04 0.00 0.00 63.50 60.11 3h3o n PRO 355 Cb 0.45 -2.21 -0.11 0.00 -0.04 0.00 0.00 33.50 31.60 3h3o n PRO 355 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3h3o n TYR 356 N -1.07 0.40 -3.60 0.54 4.01 0.19 -4.85 117.16 112.78 3h3o n TYR 356 Ca 0.60 0.17 -0.28 0.00 -0.16 0.00 0.00 57.90 58.23 3h3o n TYR 356 Cb 1.34 -1.04 0.05 0.00 -0.31 0.00 0.00 39.34 39.38 3h3o n TYR 356 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 3h3o n TRP 357 N -4.26 -2.02 -3.92 -0.72 7.02 0.22 -4.96 117.44 108.80 3h3o n TRP 357 Ca -0.46 0.53 -0.32 0.00 -1.02 0.00 0.00 57.50 56.23 3h3o n TRP 357 Cb 0.82 -3.56 -0.14 0.00 -2.42 0.00 0.00 31.31 26.02 3h3o n TRP 357 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 3h3o s ASP 358 N -3.44 4.78 0.37 -0.99 -1.08 -1.14 -4.97 116.67 110.19 3h3o s ASP 358 Ca 0.47 -2.46 0.27 0.00 -0.52 0.00 0.00 52.55 50.31 3h3o s ASP 358 Cb -0.15 -1.69 1.15 0.00 -1.46 0.00 0.00 42.92 40.77 3h3o s ASP 358 CO 0.84 -0.36 1.81 0.77 0.52 0.00 0.00 175.17 178.75 3h3o h SER 359 N 7.30 0.00 1.17 -0.34 4.64 -1.89 0.79 113.55 125.21 3h3o h SER 359 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3h3o h SER 359 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3h3o h SER 359 CO 0.62 0.00 -0.66 -0.33 -0.87 0.00 0.00 176.83 175.59 3h3o h GLU 360 N 0.00 0.00 -7.21 4.77 4.39 -1.93 -3.39 114.58 111.21 3h3o h GLU 360 Ca 0.00 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 59.19 3h3o h GLU 360 Cb 0.39 0.00 0.11 0.00 -0.10 0.00 0.00 28.75 29.15 3h3o h GLU 360 CO 0.00 0.00 0.37 0.00 -1.16 0.00 0.00 179.01 178.22 3h3o s ALA 361 N -3.27 2.45 0.31 3.43 0.00 -1.19 -4.89 121.76 118.60 3h3o s ALA 361 Ca 0.03 0.52 0.04 0.00 0.00 0.00 0.00 51.96 52.55 3h3o s ALA 361 Cb 0.10 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 3h3o s ALA 361 CO 0.74 -1.33 0.18 1.03 0.00 0.00 0.00 175.76 176.38 3h3o s ARG 362 N -4.17 1.64 0.33 0.00 1.81 -1.25 -2.30 118.95 115.00 3h3o s ARG 362 Ca 0.66 -1.94 -0.29 0.00 -1.72 0.00 0.00 55.73 52.44 3h3o s ARG 362 Cb -0.20 -0.06 -0.11 0.00 -0.45 0.00 0.00 34.95 34.13 3h3o s ARG 362 CO 0.43 -0.49 1.51 0.20 -0.68 0.00 0.00 175.30 176.27 3h3o s GLY 363 N -3.39 2.56 0.12 -3.53 0.00 -1.15 -4.43 107.32 97.51 3h3o s GLY 363 Ca 0.35 1.52 -0.10 0.00 0.00 0.00 0.00 44.72 46.49 3h3o s GLY 363 CO 0.19 2.34 0.27 0.00 0.00 0.00 0.00 173.10 175.90 3h3o s ALA 364 N -0.57 -0.29 -0.02 3.20 0.00 -0.67 -4.95 121.76 118.46 3h3o s ALA 364 Ca 0.57 -0.60 0.01 0.00 0.00 0.00 0.00 51.96 51.95 3h3o s ALA 364 Cb -0.46 0.65 0.01 0.00 0.00 0.00 0.00 23.12 23.32 3h3o s ALA 364 CO 0.54 -0.59 -0.04 0.08 0.00 0.00 0.00 175.76 175.75 3h3o s VAL 365 N -3.89 0.41 0.19 0.00 1.01 -1.26 -1.04 120.40 115.82 3h3o s VAL 365 Ca 0.09 -0.16 0.06 0.00 0.00 0.00 0.00 61.98 61.96 3h3o s VAL 365 Cb 0.04 -0.39 -0.05 0.00 0.00 0.00 0.00 36.38 35.98 3h3o s VAL 365 CO -0.07 0.15 -0.09 -0.36 0.00 0.00 0.00 175.10 174.72 3h3o s PHE 366 N 0.27 1.52 -0.14 5.22 0.08 -0.06 -4.84 117.98 120.03 3h3o s PHE 366 Ca -0.03 -0.72 0.00 0.00 0.12 0.00 0.00 56.93 56.30 3h3o s PHE 366 Cb -0.07 -0.78 0.00 0.00 -0.57 0.00 0.00 43.02 41.61 3h3o s PHE 366 CO -0.00 0.17 0.00 0.41 -0.10 0.00 0.00 175.22 175.70 3h3o n GLY 367 N -0.33 0.51 3.73 4.36 0.00 -1.26 -1.62 105.19 110.58 3h3o n GLY 367 Ca -0.08 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 3h3o n GLY 367 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3o s LEU 368 N -0.30 4.39 0.32 0.99 1.43 -1.26 -4.54 118.68 119.70 3h3o s LEU 368 Ca 0.00 2.46 0.03 0.00 -1.03 0.00 0.00 54.13 55.59 3h3o s LEU 368 Cb 0.00 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.56 3h3o s LEU 368 CO 0.00 -0.63 0.08 0.42 0.23 0.00 0.00 176.35 176.46 3h3o s THR 369 N 0.45 0.87 0.59 5.49 -4.23 -1.26 -5.03 115.64 112.52 3h3o s THR 369 Ca 0.61 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 59.41 3h3o s THR 369 Cb -0.38 -2.67 0.35 0.00 1.34 0.00 0.00 72.50 71.14 3h3o s THR 369 CO 0.36 0.00 2.21 -0.09 -0.54 0.00 0.00 174.62 176.56 3h3o h ARG 370 N 2.15 0.00 -0.67 3.99 2.43 -2.07 -2.30 114.38 117.91 3h3o h ARG 370 Ca -0.39 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.78 3h3o h ARG 370 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 3h3o h ARG 370 CO 0.64 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 179.51 3h3o n GLY 371 N -1.35 2.60 3.66 2.80 0.00 -1.26 -4.91 105.19 106.74 3h3o n GLY 371 Ca -0.02 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 3h3o n GLY 371 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h3o s THR 372 N -2.31 4.92 0.45 2.61 2.01 -0.87 -4.92 115.64 117.54 3h3o s THR 372 Ca 0.42 1.49 0.08 0.00 0.31 0.00 0.00 61.69 63.99 3h3o s THR 372 Cb 0.32 -4.08 0.03 0.00 0.01 0.00 0.00 72.50 68.78 3h3o s THR 372 CO 0.13 0.04 0.62 0.42 -0.69 0.00 0.00 174.62 175.14 3h3o s THR 373 N 2.17 2.80 0.30 -0.82 -4.23 -1.26 -4.98 115.64 109.62 3h3o s THR 373 Ca 0.35 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.85 3h3o s THR 373 Cb -0.16 -2.81 0.28 0.00 1.34 0.00 0.00 72.50 71.15 3h3o s THR 373 CO 0.11 0.00 1.92 0.50 -0.54 0.00 0.00 174.62 176.61 3h3o h LYS 374 N 0.54 1.01 -0.23 3.99 3.64 -1.99 -1.91 116.57 121.62 3h3o h LYS 374 Ca -0.38 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 58.95 3h3o h LYS 374 Cb 1.28 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.86 3h3o h LYS 374 CO 0.44 0.67 0.12 0.93 -2.27 0.00 0.00 179.45 179.34 3h3o h GLU 375 N 1.04 0.24 -0.49 1.90 3.07 -1.94 -1.60 114.58 116.79 3h3o h GLU 375 Ca 0.38 -0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 59.19 3h3o h GLU 375 Cb 0.17 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.00 3h3o h GLU 375 CO -0.14 0.16 0.15 -0.44 -1.40 0.00 0.00 179.01 177.35 3h3o h ASP 376 N 0.25 0.67 -0.41 1.42 3.32 -1.70 -1.26 116.42 118.71 3h3o h ASP 376 Ca 0.09 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 56.91 3h3o h ASP 376 Cb 0.02 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3h3o h ASP 376 CO -0.06 0.64 -0.24 0.15 -1.72 0.00 0.00 179.24 178.01 3h3o h PHE 377 N 0.71 1.06 -0.25 4.55 3.57 -1.02 -1.97 116.94 123.59 3h3o h PHE 377 Ca 0.17 -0.26 -0.14 0.00 3.53 0.00 0.00 57.97 61.26 3h3o h PHE 377 Cb 0.21 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.70 3h3o h PHE 377 CO 0.01 1.06 -0.39 0.28 -2.23 0.00 0.00 178.31 177.05 3h3o h VAL 378 N 0.79 1.31 -0.55 1.41 2.07 -1.00 -1.91 116.25 118.37 3h3o h VAL 378 Ca 0.10 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.02 3h3o h VAL 378 Cb 0.81 1.71 -0.03 0.00 -1.52 0.00 0.00 31.29 32.26 3h3o h VAL 378 CO 0.07 0.50 0.31 -0.09 0.02 0.00 0.00 177.57 178.38 3h3o h ARG 379 N 0.44 0.77 -0.80 1.57 2.43 -1.20 -1.95 114.38 115.63 3h3o h ARG 379 Ca 0.02 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.07 3h3o h ARG 379 Cb 0.98 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.34 3h3o h ARG 379 CO 0.09 0.59 0.37 0.00 -1.51 0.00 0.00 179.97 179.51 3h3o h ALA 380 N 1.14 1.04 -0.79 2.80 0.00 -1.33 -1.14 119.26 120.97 3h3o h ALA 380 Ca 0.19 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3h3o h ALA 380 Cb 0.04 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 3h3o h ALA 380 CO -0.03 0.62 0.52 1.15 0.00 0.00 0.00 179.25 181.51 3h3o h THR 381 N 1.15 1.18 0.05 0.00 2.02 -0.84 -2.71 112.91 113.76 3h3o h THR 381 Ca 0.27 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 67.09 3h3o h THR 381 Cb 0.15 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.60 3h3o h THR 381 CO -0.03 0.19 -0.02 -0.07 0.37 0.00 0.00 175.52 175.96 3h3o h LEU 382 N 1.05 -0.06 -2.48 2.58 3.38 -0.90 -3.08 115.31 115.79 3h3o h LEU 382 Ca 0.30 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3h3o h LEU 382 Cb -0.09 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3h3o h LEU 382 CO -0.08 0.19 0.08 1.56 0.09 0.00 0.00 178.44 180.28 3h3o h GLN 383 N -0.30 0.00 -0.28 1.13 4.20 -1.02 -2.88 115.11 115.96 3h3o h GLN 383 Ca -0.01 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.77 3h3o h GLN 383 Cb 0.27 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.98 3h3o h GLN 383 CO 0.01 0.00 -0.22 0.00 -0.67 0.00 0.00 178.83 177.96 3h3o h ALA 384 N 1.83 -0.05 -0.26 3.87 0.00 -1.39 -1.06 119.26 122.20 3h3o h ALA 384 Ca 0.00 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3h3o h ALA 384 Cb 0.16 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3h3o h ALA 384 CO 0.00 -0.62 0.17 -0.24 0.00 0.00 0.00 179.25 178.56 3h3o h VAL 385 N -0.20 1.02 -0.11 0.00 3.04 -1.71 -1.40 116.25 116.89 3h3o h VAL 385 Ca 0.15 -0.10 -0.05 0.00 -1.01 0.00 0.00 66.70 65.70 3h3o h VAL 385 Cb 0.43 0.72 -0.00 0.00 -2.01 0.00 0.00 31.29 30.43 3h3o h VAL 385 CO -0.40 0.05 -0.11 0.00 -1.01 0.00 0.00 177.57 176.10 3h3o h ALA 386 N 1.85 0.16 -0.67 3.17 0.00 -1.38 -1.57 119.26 120.82 3h3o h ALA 386 Ca 0.10 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3h3o h ALA 386 Cb 0.08 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3h3o h ALA 386 CO -0.02 0.02 0.43 1.88 0.00 0.00 0.00 179.25 181.56 3h3o h TYR 387 N -0.13 0.86 0.00 0.00 0.05 -0.87 -2.25 116.97 114.63 3h3o h TYR 387 Ca 0.02 0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.70 3h3o h TYR 387 Cb 0.64 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 38.07 3h3o h TYR 387 CO 0.09 0.56 -0.50 0.37 -1.05 0.00 0.00 178.16 177.62 3h3o h GLN 388 N 0.91 0.00 0.00 4.88 4.15 -1.28 -1.80 115.11 121.96 3h3o h GLN 388 Ca 0.24 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.63 3h3o h GLN 388 Cb -0.08 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 3h3o h GLN 388 CO -0.05 0.50 -0.19 0.77 -1.93 0.00 0.00 178.83 177.94 3h3o h SER 389 N 0.00 0.00 1.41 -0.69 0.02 -0.75 -0.22 113.55 113.32 3h3o h SER 389 Ca -0.01 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.83 3h3o h SER 389 Cb 0.95 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.48 3h3o h SER 389 CO 0.07 0.19 -0.54 0.50 -1.14 0.00 0.00 176.83 175.90 3h3o h LYS 390 N 0.00 0.00 -0.28 3.45 3.64 -0.79 -1.49 116.57 121.10 3h3o h LYS 390 Ca -0.00 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 3h3o h LYS 390 Cb 0.36 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 3h3o h LYS 390 CO 0.02 0.54 -0.54 -0.44 -2.27 0.00 0.00 179.45 176.77 3h3o h ASP 391 N 0.00 0.91 -0.11 4.20 3.32 -0.47 -1.46 116.42 122.81 3h3o h ASP 391 Ca -0.01 -0.48 -0.06 0.00 0.02 0.00 0.00 57.03 56.50 3h3o h ASP 391 Cb 1.39 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.68 3h3o h ASP 391 CO 0.07 1.27 -0.17 0.58 -1.72 0.00 0.00 179.24 179.27 3h3o h VAL 392 N 0.63 1.38 -0.26 -1.35 2.07 -1.16 -2.23 116.25 115.34 3h3o h VAL 392 Ca 0.02 -1.41 -0.09 0.00 0.82 0.00 0.00 66.70 66.03 3h3o h VAL 392 Cb 1.13 2.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.92 3h3o h VAL 392 CO 0.12 0.41 -0.24 0.40 0.02 0.00 0.00 177.57 178.28 3h3o h ILE 393 N -0.10 1.26 -0.13 4.57 2.04 -1.31 0.32 117.51 124.16 3h3o h ILE 393 Ca 0.01 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 3h3o h ILE 393 Cb 0.74 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 3h3o h ILE 393 CO 0.04 0.39 0.02 0.44 0.00 0.00 0.00 178.15 179.05 3h3o h ASP 394 N 0.43 0.20 -0.01 1.72 5.19 -1.29 0.17 116.42 122.83 3h3o h ASP 394 Ca 0.07 -0.25 0.00 0.00 -0.62 0.00 0.00 57.03 56.22 3h3o h ASP 394 Cb 0.65 -0.05 -0.00 0.00 0.18 0.00 0.00 39.33 40.10 3h3o h ASP 394 CO 0.05 0.40 0.01 0.74 -3.12 0.00 0.00 179.24 177.32 3h3o h THR 395 N -0.01 1.01 -0.52 0.35 2.02 -1.16 -0.49 112.91 114.11 3h3o h THR 395 Ca 0.04 -0.04 0.11 0.00 0.77 0.00 0.00 66.41 67.29 3h3o h THR 395 Cb 0.28 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 3h3o h THR 395 CO 0.00 0.01 0.36 -0.03 0.37 0.00 0.00 175.52 176.23 3h3o h MET 396 N 0.01 0.23 0.03 6.66 -1.53 -0.24 0.27 114.93 120.36 3h3o h MET 396 Ca 0.01 -0.01 -0.22 0.00 -3.44 0.00 0.00 59.70 56.03 3h3o h MET 396 Cb 0.01 -0.05 -0.01 0.00 -0.55 0.00 0.00 31.60 31.00 3h3o h MET 396 CO -0.00 0.15 -0.97 -0.22 0.14 0.00 0.00 176.91 176.01 3h3o h LYS 397 N 0.24 0.22 -0.00 0.39 3.64 0.08 -3.12 116.57 118.01 3h3o h LYS 397 Ca 0.24 -0.28 -0.13 0.00 -1.27 0.00 0.00 60.65 59.22 3h3o h LYS 397 Cb 0.65 0.09 0.01 0.00 -0.41 0.00 0.00 32.23 32.57 3h3o h LYS 397 CO -0.05 1.03 -0.50 -0.22 -2.27 0.00 0.00 179.45 177.45 3h3o h LYS 398 N 0.11 0.34 0.00 1.90 3.64 0.64 -1.33 116.57 121.87 3h3o h LYS 398 Ca -0.06 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 3h3o h LYS 398 Cb 1.64 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.56 3h3o h LYS 398 CO 0.15 1.05 0.00 -0.25 -2.27 0.00 0.00 179.45 178.13 3h3o n ASP 399 N -4.30 0.00 0.00 4.20 8.00 0.74 -3.52 116.55 121.67 3h3o n ASP 399 Ca -0.10 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.25 3h3o n ASP 399 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.72 3h3o n ASP 399 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3h3o n SER 400 N -0.70 0.00 0.00 -2.24 7.64 -1.18 -4.47 113.62 112.67 3h3o n SER 400 Ca 0.07 -0.33 0.00 0.00 1.01 0.00 0.00 58.87 59.62 3h3o n SER 400 Cb 0.03 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 3h3o n SER 400 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h3o n GLY 401 N 0.01 0.00 3.87 0.23 0.00 -0.50 -4.92 105.19 103.87 3h3o n GLY 401 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3h3o n GLY 401 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3o s ILE 402 N -0.91 1.94 0.15 -0.61 1.01 -1.25 -5.05 121.20 116.48 3h3o s ILE 402 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 60.65 60.76 3h3o s ILE 402 Cb 0.00 -2.91 -0.04 0.00 0.01 0.00 0.00 42.46 39.52 3h3o s ILE 402 CO 0.00 0.00 -0.24 -0.62 0.00 0.00 0.00 174.94 174.08 3h3o s ASP 403 N -4.65 3.20 -0.50 3.58 -1.08 -1.26 -4.85 116.67 111.10 3h3o s ASP 403 Ca 0.72 -0.79 0.03 0.00 -0.52 0.00 0.00 52.55 51.99 3h3o s ASP 403 Cb -0.06 -0.21 0.13 0.00 -1.46 0.00 0.00 42.92 41.32 3h3o s ASP 403 CO 0.53 0.13 0.27 -0.63 0.52 0.00 0.00 175.17 175.98 3h3o s ILE 404 N -1.36 2.23 0.05 4.11 -1.09 -1.26 -4.94 121.20 118.94 3h3o s ILE 404 Ca 0.15 -3.14 -0.14 0.00 -2.23 0.00 0.00 60.65 55.30 3h3o s ILE 404 Cb -0.09 -2.55 -0.31 0.00 -1.58 0.00 0.00 42.46 37.94 3h3o s ILE 404 CO 0.07 -0.84 1.09 1.55 -1.23 0.00 0.00 174.94 175.57 3h3o h PRO 405 N 6.50 0.56 -6.11 2.79 0.13 -1.98 -3.46 132.00 130.44 3h3o h PRO 405 Ca -0.05 -0.81 -0.55 0.00 -0.87 0.00 0.00 66.00 63.72 3h3o h PRO 405 Cb 0.89 0.28 -0.21 0.00 0.13 0.00 0.00 31.00 32.09 3h3o h PRO 405 CO 0.63 1.37 -0.82 -1.17 -0.23 0.00 0.00 178.00 177.78 3h3o s LEU 406 N -7.71 2.32 -0.04 1.56 2.96 -1.26 -1.38 118.68 115.12 3h3o s LEU 406 Ca -0.09 -0.71 -0.01 0.00 -0.22 0.00 0.00 54.13 53.11 3h3o s LEU 406 Cb 0.05 -0.86 0.03 0.00 0.50 0.00 0.00 46.19 45.91 3h3o s LEU 406 CO 0.93 0.04 0.02 -0.22 -1.32 0.00 0.00 176.35 175.80 3h3o s LEU 407 N -2.00 0.69 -0.02 -0.68 2.96 -0.15 -4.77 118.68 114.71 3h3o s LEU 407 Ca 0.07 -0.00 -0.17 0.00 -0.22 0.00 0.00 54.13 53.81 3h3o s LEU 407 Cb -0.09 -0.24 -0.05 0.00 0.50 0.00 0.00 46.19 46.30 3h3o s LEU 407 CO 0.04 -0.17 0.47 -0.54 -1.32 0.00 0.00 176.35 174.83 3h3o s LYS 408 N 1.63 4.12 0.06 1.98 -0.14 -1.00 -1.23 119.74 125.16 3h3o s LYS 408 Ca -0.01 0.51 0.04 0.00 -1.36 0.00 0.00 55.97 55.15 3h3o s LYS 408 Cb -0.13 -3.29 -0.03 0.00 -1.68 0.00 0.00 37.83 32.71 3h3o s LYS 408 CO -0.03 0.51 -0.12 0.14 -0.76 0.00 0.00 175.35 175.10 3h3o s VAL 409 N -0.57 0.89 0.00 3.17 -7.23 -0.96 -0.45 120.40 115.26 3h3o s VAL 409 Ca 0.26 -1.19 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 3h3o s VAL 409 Cb -0.17 -0.88 0.00 0.00 0.56 0.00 0.00 36.38 35.89 3h3o s VAL 409 CO 0.14 -0.26 0.00 -0.90 -0.31 0.00 0.00 175.10 173.77 3h3o n ASP 410 N 1.41 0.00 0.00 4.85 5.75 -0.63 -2.32 116.55 125.61 3h3o n ASP 410 Ca -0.21 -0.57 0.00 0.00 -0.01 0.00 0.00 54.79 54.00 3h3o n ASP 410 Cb 0.54 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 3h3o n ASP 410 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h3o n GLY 411 N 0.00 -0.52 0.23 6.12 0.00 -1.18 -1.80 105.19 108.04 3h3o n GLY 411 Ca 0.00 -1.73 -0.08 0.00 0.00 0.00 0.00 46.02 44.20 3h3o n GLY 411 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h3o h GLY 412 N 0.00 -1.06 0.93 -0.02 0.00 -1.71 -2.60 103.07 98.61 3h3o h GLY 412 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 47.33 47.83 3h3o h GLY 412 CO 0.00 -0.34 0.46 0.00 0.00 0.00 0.00 176.54 176.66 3h3o h ALA 413 N -1.24 1.39 0.00 3.60 0.00 -1.81 0.17 119.26 121.38 3h3o h ALA 413 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h3o h ALA 413 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3h3o h ALA 413 CO -0.07 -0.39 0.00 0.00 0.00 0.00 0.00 179.25 178.78 3h3o n ALA 414 N -1.63 1.52 0.26 0.00 0.00 -0.98 -2.08 120.51 117.61 3h3o n ALA 414 Ca -0.01 0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.65 3h3o n ALA 414 Cb 0.49 -1.35 0.72 0.00 0.00 0.00 0.00 19.45 19.30 3h3o n ALA 414 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3h3o h LYS 415 N 0.00 0.00 -6.44 0.00 1.57 -0.81 -3.41 116.57 107.47 3h3o h LYS 415 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 3h3o h LYS 415 Cb 0.28 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.54 3h3o h LYS 415 CO 0.00 0.12 1.11 1.21 -0.57 0.00 0.00 179.45 181.32 3h3o s ASN 416 N -6.19 6.18 0.12 0.86 3.84 -0.89 -4.89 114.94 113.97 3h3o s ASN 416 Ca -0.03 0.68 -0.17 0.00 0.21 0.00 0.00 52.86 53.54 3h3o s ASN 416 Cb 0.13 -2.54 -0.04 0.00 -0.55 0.00 0.00 41.25 38.26 3h3o s ASN 416 CO 0.59 -1.59 1.67 0.44 -2.79 0.00 0.00 177.10 175.42 3h3o h ASP 417 N 11.23 0.44 -0.42 -4.21 5.19 -1.89 -2.49 116.42 124.27 3h3o h ASP 417 Ca -0.28 -0.16 0.00 0.00 -0.62 0.00 0.00 57.03 55.98 3h3o h ASP 417 Cb 1.11 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 40.48 3h3o h ASP 417 CO 1.12 0.48 0.28 -0.07 -3.12 0.00 0.00 179.24 177.92 3h3o h LEU 418 N 0.38 0.48 -0.23 1.55 3.38 -1.97 -1.09 115.31 117.81 3h3o h LEU 418 Ca 0.11 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.87 3h3o h LEU 418 Cb 0.17 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3h3o h LEU 418 CO -0.01 0.35 -0.90 0.25 0.09 0.00 0.00 178.44 178.22 3h3o h LEU 419 N 0.57 0.10 -0.15 1.67 5.85 -1.89 -1.86 115.31 119.59 3h3o h LEU 419 Ca 0.15 -0.09 -0.18 0.00 0.84 0.00 0.00 57.88 58.61 3h3o h LEU 419 Cb -0.06 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 40.94 3h3o h LEU 419 CO -0.03 0.94 -0.60 0.24 -0.34 0.00 0.00 178.44 178.65 3h3o h MET 420 N 0.03 0.66 -0.26 1.25 2.86 -0.96 0.24 114.93 118.76 3h3o h MET 420 Ca -0.03 -0.52 -0.01 0.00 -2.06 0.00 0.00 59.70 57.09 3h3o h MET 420 Cb 1.57 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 33.31 3h3o h MET 420 CO 0.13 1.14 0.14 0.37 1.06 0.00 0.00 176.91 179.74 3h3o h GLN 421 N 0.34 0.36 -0.47 1.72 5.75 -1.28 0.41 115.11 121.94 3h3o h GLN 421 Ca -0.03 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.42 3h3o h GLN 421 Cb 1.23 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.69 3h3o h GLN 421 CO 0.13 0.32 0.29 0.35 -2.65 0.00 0.00 178.83 177.27 3h3o h PHE 422 N 0.30 0.61 -0.77 3.99 3.57 -1.29 0.71 116.94 124.07 3h3o h PHE 422 Ca 0.09 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.67 3h3o h PHE 422 Cb 0.07 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 38.56 3h3o h PHE 422 CO -0.03 0.42 0.50 0.37 -2.23 0.00 0.00 178.31 177.34 3h3o h GLN 423 N 0.63 0.74 0.01 1.11 5.75 -0.02 0.26 115.11 123.59 3h3o h GLN 423 Ca 0.17 -0.04 -0.27 0.00 -0.15 0.00 0.00 58.65 58.35 3h3o h GLN 423 Cb -0.02 -0.17 0.02 0.00 1.07 0.00 0.00 27.48 28.39 3h3o h GLN 423 CO -0.03 0.49 -1.06 0.00 -2.65 0.00 0.00 178.83 175.58 3h3o h ALA 424 N 1.60 0.12 -0.63 3.38 0.00 0.12 -2.76 119.26 121.09 3h3o h ALA 424 Ca 0.34 -0.70 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 3h3o h ALA 424 Cb 0.33 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3h3o h ALA 424 CO -0.12 0.68 0.38 -0.44 0.00 0.00 0.00 179.25 179.75 3h3o h ASP 425 N 0.39 0.75 -0.30 0.00 3.32 0.13 0.69 116.42 121.40 3h3o h ASP 425 Ca -0.13 -0.06 -0.14 0.00 0.02 0.00 0.00 57.03 56.71 3h3o h ASP 425 Cb 1.71 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 41.07 3h3o h ASP 425 CO 0.21 0.59 -0.37 0.40 -1.72 0.00 0.00 179.24 178.35 3h3o h ILE 426 N 0.85 1.29 0.00 0.35 1.08 -1.05 -3.19 117.51 116.84 3h3o h ILE 426 Ca 0.22 -1.55 -0.10 0.00 -0.39 0.00 0.00 64.86 63.04 3h3o h ILE 426 Cb -0.02 1.57 -0.01 0.00 -3.07 0.00 0.00 36.82 35.28 3h3o h ILE 426 CO -0.04 0.50 -0.49 -0.07 -0.69 0.00 0.00 178.15 177.36 3h3o h LEU 427 N 0.55 0.00 -1.62 1.44 3.38 -1.42 -3.48 115.31 114.16 3h3o h LEU 427 Ca 0.04 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.65 3h3o h LEU 427 Cb 0.96 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.84 3h3o h LEU 427 CO 0.09 0.49 -0.78 -0.67 0.09 0.00 0.00 178.44 177.66 3h3o n ASP 428 N -3.36 -2.13 -4.00 -0.43 2.03 0.23 -5.00 116.55 103.89 3h3o n ASP 428 Ca 0.01 -0.68 -0.09 0.00 0.52 0.00 0.00 54.79 54.55 3h3o n ASP 428 Cb 0.66 -4.77 -0.06 0.00 -0.72 0.00 0.00 41.12 36.23 3h3o n ASP 428 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 3h3o s ILE 429 N -3.45 0.01 0.39 5.18 -4.36 -1.23 -4.97 121.20 112.77 3h3o s ILE 429 Ca 0.06 -1.41 -0.24 0.00 -0.26 0.00 0.00 60.65 58.79 3h3o s ILE 429 Cb -0.03 -2.16 -0.09 0.00 1.25 0.00 0.00 42.46 41.43 3h3o s ILE 429 CO 0.76 -0.03 1.06 -1.81 0.24 0.00 0.00 174.94 175.16 3h3o s ASP 430 N -3.02 6.76 -0.18 4.36 1.11 -0.48 -4.35 116.67 120.88 3h3o s ASP 430 Ca 0.22 2.08 -0.02 0.00 0.18 0.00 0.00 52.55 55.02 3h3o s ASP 430 Cb 0.00 -2.59 0.06 0.00 1.07 0.00 0.00 42.92 41.46 3h3o s ASP 430 CO 0.08 -0.49 0.02 -0.69 1.18 0.00 0.00 175.17 175.27 3h3o s VAL 431 N -1.60 0.65 -0.28 -1.27 1.01 -0.20 -0.98 120.40 117.73 3h3o s VAL 431 Ca 0.57 -0.55 -0.05 0.00 0.00 0.00 0.00 61.98 61.95 3h3o s VAL 431 Cb -0.24 -1.07 0.02 0.00 0.00 0.00 0.00 36.38 35.09 3h3o s VAL 431 CO 0.30 -0.12 0.02 -1.58 0.00 0.00 0.00 175.10 173.72 3h3o s GLN 432 N 1.81 2.96 0.20 2.72 0.74 -0.36 -0.08 119.66 127.65 3h3o s GLN 432 Ca -0.01 -0.93 -0.29 0.00 0.05 0.00 0.00 55.36 54.18 3h3o s GLN 432 Cb -0.17 -3.22 -0.08 0.00 1.10 0.00 0.00 33.01 30.64 3h3o s GLN 432 CO -0.07 -0.44 0.93 0.50 -0.55 0.00 0.00 175.29 175.65 3h3o s ARG 433 N 1.42 4.79 0.74 1.67 3.52 0.29 -2.26 118.95 129.13 3h3o s ARG 433 Ca 0.01 1.44 -0.15 0.00 -0.13 0.00 0.00 55.73 56.90 3h3o s ARG 433 Cb -0.17 -3.30 0.04 0.00 -1.56 0.00 0.00 34.95 29.96 3h3o s ARG 433 CO -0.00 0.46 1.22 0.00 -0.81 0.00 0.00 175.30 176.16 3h3o n ALA 434 N 1.80 0.40 0.26 6.12 0.00 -0.98 -2.55 120.51 125.56 3h3o n ALA 434 Ca -0.01 -0.19 0.13 0.00 0.00 0.00 0.00 53.44 53.36 3h3o n ALA 434 Cb 0.48 -2.27 0.71 0.00 0.00 0.00 0.00 19.45 18.37 3h3o n ALA 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h3o h ALA 435 N -0.31 1.19 -3.11 0.00 0.00 -1.81 -3.38 119.26 111.85 3h3o h ALA 435 Ca -0.48 -0.11 -0.48 0.00 0.00 0.00 0.00 54.91 53.84 3h3o h ALA 435 Cb 1.32 -0.02 -0.41 0.00 0.00 0.00 0.00 17.79 18.68 3h3o h ALA 435 CO 0.49 0.15 -0.75 0.54 0.00 0.00 0.00 179.25 179.67 3h3o s ASN 436 N -6.06 2.53 0.37 0.00 4.22 -1.26 -5.01 114.94 109.74 3h3o s ASN 436 Ca -0.02 -0.69 0.16 0.00 -2.14 0.00 0.00 52.86 50.17 3h3o s ASN 436 Cb 0.12 -0.34 1.03 0.00 1.28 0.00 0.00 41.25 43.34 3h3o s ASN 436 CO 0.58 -0.34 1.76 -0.07 -2.04 0.00 0.00 177.10 176.99 3h3o h LEU 437 N 8.37 0.52 -5.02 3.54 3.38 -1.90 -3.07 115.31 121.12 3h3o h LEU 437 Ca -0.15 0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 3h3o h LEU 437 Cb 1.14 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 3h3o h LEU 437 CO 0.31 0.11 0.79 -0.62 0.09 0.00 0.00 178.44 179.11 3h3o n GLU 438 N -4.69 0.81 0.00 1.13 -0.58 -1.26 -3.09 120.64 112.96 3h3o n GLU 438 Ca 0.25 -0.56 0.12 0.00 -0.42 0.00 0.00 57.16 56.56 3h3o n GLU 438 Cb 0.82 -1.86 0.62 0.00 -0.57 0.00 0.00 31.44 30.45 3h3o n GLU 438 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 3h3o n THR 439 N 3.42 0.21 0.10 2.62 -2.24 -1.16 -3.09 114.28 114.14 3h3o n THR 439 Ca 0.17 0.05 -0.22 0.00 -2.27 0.00 0.00 64.05 61.78 3h3o n THR 439 Cb 0.22 -0.64 -0.15 0.00 -2.10 0.00 0.00 70.33 67.66 3h3o n THR 439 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3h3o h THR 440 N 0.00 1.39 -0.26 4.28 2.02 -1.84 -2.46 112.91 116.03 3h3o h THR 440 Ca 0.00 -2.60 -0.16 0.00 0.77 0.00 0.00 66.41 64.42 3h3o h THR 440 Cb 0.27 3.09 -0.01 0.00 -1.74 0.00 0.00 68.15 69.76 3h3o h THR 440 CO 0.00 0.76 -0.49 0.00 0.37 0.00 0.00 175.52 176.16 3h3o h ALA 441 N 0.13 0.64 0.07 6.16 0.00 -1.90 -2.66 119.26 121.71 3h3o h ALA 441 Ca -0.20 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.22 3h3o h ALA 441 Cb 1.90 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.60 3h3o h ALA 441 CO 0.22 0.68 -0.04 -0.07 0.00 0.00 0.00 179.25 180.04 3h3o h LEU 442 N 0.57 -0.09 -1.18 0.00 3.38 -1.63 0.93 115.31 117.29 3h3o h LEU 442 Ca 0.03 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.18 3h3o h LEU 442 Cb 1.05 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 41.74 3h3o h LEU 442 CO 0.10 -0.06 0.61 1.23 0.09 0.00 0.00 178.44 180.41 3h3o h GLY 443 N -0.10 1.45 1.42 0.83 0.00 -1.38 0.59 103.07 105.89 3h3o h GLY 443 Ca -0.01 -0.31 -0.18 0.00 0.00 0.00 0.00 47.33 46.82 3h3o h GLY 443 CO 0.02 -0.00 -0.64 0.00 0.00 0.00 0.00 176.54 175.91 3h3o h ALA 444 N 1.62 0.57 -0.26 3.60 0.00 -1.01 -2.43 119.26 121.34 3h3o h ALA 444 Ca 0.53 -0.56 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3h3o h ALA 444 Cb 0.91 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3h3o h ALA 444 CO -0.29 0.71 -0.10 0.00 0.00 0.00 0.00 179.25 179.57 3h3o h ALA 445 N 0.86 0.36 0.21 0.00 0.00 0.18 -2.35 119.26 118.52 3h3o h ALA 445 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3h3o h ALA 445 Cb 1.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 3h3o h ALA 445 CO 0.12 0.21 -0.22 1.88 0.00 0.00 0.00 179.25 181.24 3h3o h TYR 446 N 0.26 -0.57 -0.69 0.00 0.05 0.02 0.68 116.97 116.72 3h3o h TYR 446 Ca 0.06 0.00 0.15 0.00 0.05 0.00 0.00 58.73 58.99 3h3o h TYR 446 Cb 0.60 0.22 -0.11 0.00 1.01 0.00 0.00 36.73 38.45 3h3o h TYR 446 CO 0.06 -0.32 0.12 -0.07 -1.05 0.00 0.00 178.16 176.90 3h3o h LEU 447 N -0.46 -0.08 -0.60 3.88 3.38 -1.43 0.17 115.31 120.17 3h3o h LEU 447 Ca 0.00 0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.96 3h3o h LEU 447 Cb 0.43 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 3h3o h LEU 447 CO -0.06 -0.06 -0.68 0.00 0.09 0.00 0.00 178.44 177.74 3h3o h ALA 448 N 1.58 0.83 0.28 1.53 0.00 -0.97 -3.16 119.26 119.34 3h3o h ALA 448 Ca 0.38 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 3h3o h ALA 448 Cb 0.62 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3h3o h ALA 448 CO -0.51 0.81 -0.13 0.78 0.00 0.00 0.00 179.25 180.20 3h3o h GLY 449 N 1.81 -0.39 0.48 0.00 0.00 0.31 -3.04 103.07 102.24 3h3o h GLY 449 Ca -0.01 0.14 0.10 0.00 0.00 0.00 0.00 47.33 47.56 3h3o h GLY 449 CO 0.10 -0.14 0.46 1.41 0.00 0.00 0.00 176.54 178.37 3h3o h LEU 450 N -0.52 0.65 0.00 3.11 3.38 -1.02 -1.32 115.31 119.59 3h3o h LEU 450 Ca -0.04 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3h3o h LEU 450 Cb 0.38 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3h3o h LEU 450 CO 0.06 0.36 0.00 0.00 0.09 0.00 0.00 178.44 178.95 3h3o n ALA 451 N -2.38 1.67 -1.75 1.53 0.00 -1.16 -2.13 120.51 116.29 3h3o n ALA 451 Ca 0.14 -0.05 0.05 0.00 0.00 0.00 0.00 53.44 53.58 3h3o n ALA 451 Cb 0.30 -1.19 0.10 0.00 0.00 0.00 0.00 19.45 18.65 3h3o n ALA 451 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3h3o n VAL 452 N -1.34 1.08 -0.37 0.00 0.24 -0.59 -4.64 118.33 112.71 3h3o n VAL 452 Ca 0.05 -1.67 0.00 0.00 -2.04 0.00 0.00 64.34 60.67 3h3o n VAL 452 Cb 0.11 0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.69 3h3o n VAL 452 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h3o n GLY 453 N -0.57 0.27 0.55 7.63 0.00 -0.91 -4.78 105.19 107.38 3h3o n GLY 453 Ca 0.11 0.00 0.39 0.00 0.00 0.00 0.00 46.02 46.52 3h3o n GLY 453 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3h3o h PHE 454 N 0.00 0.22 -3.65 1.61 3.57 -1.55 -3.34 116.94 113.80 3h3o h PHE 454 Ca 0.00 0.01 -0.25 0.00 3.53 0.00 0.00 57.97 61.26 3h3o h PHE 454 Cb 0.00 -0.06 -0.30 0.00 2.79 0.00 0.00 35.95 38.38 3h3o h PHE 454 CO 0.00 -0.05 -0.71 -1.58 -2.23 0.00 0.00 178.31 173.74 3h3o s TRP 455 N -5.08 -0.00 -0.01 0.41 0.51 -1.24 -5.00 118.94 108.52 3h3o s TRP 455 Ca -0.06 0.06 -0.09 0.00 -2.12 0.00 0.00 56.10 53.89 3h3o s TRP 455 Cb 0.26 -0.07 -0.05 0.00 -0.81 0.00 0.00 33.47 32.81 3h3o s TRP 455 CO 0.84 -0.03 0.64 0.87 -0.51 0.00 0.00 176.95 178.75 3h3o h LYS 456 N 6.48 -0.31 -5.11 4.98 1.79 -1.92 -3.38 116.57 119.10 3h3o h LYS 456 Ca -0.30 0.02 -0.46 0.00 -2.18 0.00 0.00 60.65 57.73 3h3o h LYS 456 Cb 1.18 0.07 -0.14 0.00 -1.58 0.00 0.00 32.23 31.77 3h3o h LYS 456 CO 0.50 -0.21 -0.59 0.34 -1.08 0.00 0.00 179.45 178.41 3h3o s ASP 457 N -3.55 2.16 0.18 0.86 2.15 -1.26 -4.96 116.67 112.25 3h3o s ASP 457 Ca -0.05 -1.44 0.12 0.00 0.43 0.00 0.00 52.55 51.61 3h3o s ASP 457 Cb 0.00 0.09 0.64 0.00 -0.30 0.00 0.00 42.92 43.35 3h3o s ASP 457 CO 0.14 -0.70 1.34 0.18 -0.17 0.00 0.00 175.17 175.96 3h3o n LEU 458 N -0.67 0.30 -0.04 -1.34 4.77 -1.26 -1.34 117.00 117.41 3h3o n LEU 458 Ca -0.02 0.62 -0.14 0.00 -0.03 0.00 0.00 56.01 56.44 3h3o n LEU 458 Cb 0.66 -0.66 -0.08 0.00 -2.33 0.00 0.00 43.42 41.02 3h3o n LEU 458 CO 0.40 -0.73 0.48 -0.78 -1.33 0.00 0.00 177.39 175.43 3h3o h ASP 459 N 0.00 0.47 0.00 -1.43 1.82 -1.99 -1.24 116.42 114.06 3h3o h ASP 459 Ca 0.00 -0.59 -0.09 0.00 -0.39 0.00 0.00 57.03 55.96 3h3o h ASP 459 Cb 0.07 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 39.93 3h3o h ASP 459 CO 0.00 0.97 -0.27 -0.08 -1.61 0.00 0.00 179.24 178.25 3h3o h GLU 460 N -0.01 0.42 0.73 0.28 4.81 -1.61 -1.81 114.58 117.38 3h3o h GLU 460 Ca -0.00 -0.16 -0.04 0.00 -0.13 0.00 0.00 59.36 59.03 3h3o h GLU 460 Cb 0.92 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.28 3h3o h GLU 460 CO 0.07 0.66 -0.35 -0.07 -0.73 0.00 0.00 179.01 178.59 3h3o h LEU 461 N 0.37 -0.83 -1.97 1.64 4.07 -1.51 -2.71 115.31 114.38 3h3o h LEU 461 Ca 0.05 0.03 0.25 0.00 0.08 0.00 0.00 57.88 58.29 3h3o h LEU 461 Cb 0.67 0.21 -0.03 0.00 1.08 0.00 0.00 40.66 42.59 3h3o h LEU 461 CO 0.05 -0.45 0.67 0.50 -1.08 0.00 0.00 178.44 178.12 3h3o h LYS 462 N -1.25 0.00 -0.65 1.13 3.64 -1.19 0.43 116.57 118.69 3h3o h LYS 462 Ca -0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 3h3o h LYS 462 Cb 0.75 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.53 3h3o h LYS 462 CO 0.16 0.00 0.41 1.03 -2.27 0.00 0.00 179.45 178.78 3h3o h SER 463 N 0.00 0.76 -0.84 4.20 0.87 -1.00 -2.67 113.55 114.87 3h3o h SER 463 Ca 0.41 -0.03 -0.46 0.00 -1.23 0.00 0.00 61.79 60.49 3h3o h SER 463 Cb 1.74 -0.19 -0.26 0.00 -0.44 0.00 0.00 62.40 63.25 3h3o h SER 463 CO -0.00 0.57 0.58 1.15 -0.53 0.00 0.00 176.83 178.60 3h3o n MET 464 N -4.42 2.11 -2.70 2.24 0.00 0.14 -4.96 117.12 109.53 3h3o n MET 464 Ca 0.06 -2.56 -0.42 0.00 0.00 0.00 0.00 57.70 54.79 3h3o n MET 464 Cb 0.06 -2.00 -0.03 0.00 0.00 0.00 0.00 33.22 31.24 3h3o n MET 464 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3h3o s ALA 465 N -2.84 3.19 -0.31 3.17 0.00 -1.01 -5.02 121.76 118.94 3h3o s ALA 465 Ca 0.49 0.56 0.03 0.00 0.00 0.00 0.00 51.96 53.04 3h3o s ALA 465 Cb 0.41 -3.33 0.09 0.00 0.00 0.00 0.00 23.12 20.29 3h3o s ALA 465 CO 0.08 -0.19 0.01 -1.83 0.00 0.00 0.00 175.76 173.83 3h3o s GLU 466 N 0.75 1.58 0.45 0.00 4.04 -1.26 -5.10 118.70 119.16 3h3o s GLU 466 Ca 0.51 -1.64 -0.22 0.00 0.04 0.00 0.00 54.97 53.66 3h3o s GLU 466 Cb -0.22 -3.00 -0.11 0.00 0.02 0.00 0.00 34.13 30.82 3h3o s GLU 466 CO 0.29 -0.84 0.64 -0.85 -1.84 0.00 0.00 175.26 172.66 3h3o n GLU 467 N 4.37 0.72 -1.86 -4.83 0.28 -1.26 -4.08 120.64 113.97 3h3o n GLU 467 Ca -0.01 0.26 -0.04 0.00 -0.16 0.00 0.00 57.16 57.20 3h3o n GLU 467 Cb 0.42 -1.66 0.00 0.00 1.43 0.00 0.00 31.44 31.63 3h3o n GLU 467 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3h3o n GLY 468 N 1.65 2.92 3.71 -1.84 0.00 -1.23 -4.58 105.19 105.82 3h3o n GLY 468 Ca 0.11 -2.19 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 3h3o n GLY 468 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3h3o n GLN 469 N -0.77 2.19 -4.69 1.61 -0.06 -1.06 -4.69 117.38 109.92 3h3o n GLN 469 Ca -0.00 0.77 -0.33 0.00 -2.00 0.00 0.00 57.00 55.44 3h3o n GLN 469 Cb 0.11 -2.39 -0.14 0.00 -4.06 0.00 0.00 30.24 23.76 3h3o n GLN 469 CO 0.00 0.00 0.00 1.41 -0.20 0.00 0.00 177.06 178.27 3h3o s MET 470 N -1.96 3.39 -0.12 3.69 -2.45 -1.26 -0.55 119.30 120.05 3h3o s MET 470 Ca 0.56 -0.67 0.01 0.00 -1.25 0.00 0.00 55.69 54.33 3h3o s MET 470 Cb -0.55 -2.67 -0.01 0.00 1.25 0.00 0.00 34.83 32.86 3h3o s MET 470 CO 0.62 0.18 -0.17 -0.06 1.05 0.00 0.00 175.02 176.64 3h3o s PHE 471 N 0.43 2.72 0.09 4.11 0.08 0.89 -4.99 117.98 121.31 3h3o s PHE 471 Ca -0.09 -0.84 0.08 0.00 0.12 0.00 0.00 56.93 56.20 3h3o s PHE 471 Cb -0.16 -1.81 -0.03 0.00 -0.57 0.00 0.00 43.02 40.45 3h3o s PHE 471 CO 0.05 -0.32 -0.20 0.95 -0.10 0.00 0.00 175.22 175.60 3h3o s THR 472 N 0.41 1.62 0.17 0.64 -4.23 -1.26 -1.03 115.64 111.97 3h3o s THR 472 Ca -0.13 -1.48 -0.33 0.00 -1.18 0.00 0.00 61.69 58.57 3h3o s THR 472 Cb -0.17 -1.48 -0.15 0.00 1.34 0.00 0.00 72.50 72.04 3h3o s THR 472 CO 0.06 -0.06 1.26 -2.65 -0.54 0.00 0.00 174.62 172.69 3h3o n PRO 473 N 1.18 1.38 0.00 3.99 -0.02 -1.26 -4.78 135.00 135.49 3h3o n PRO 473 Ca -0.20 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 3h3o n PRO 473 Cb 0.54 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 3h3o n PRO 473 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3h3o n GLU 474 N 2.02 3.21 -2.54 -0.52 1.02 -1.26 -5.01 120.64 117.56 3h3o n GLU 474 Ca 0.15 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.89 3h3o n GLU 474 Cb 0.25 -0.72 -0.05 0.00 -0.02 0.00 0.00 31.44 30.90 3h3o n GLU 474 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 3h3o s MET 475 N -0.93 4.67 0.90 3.49 1.75 -1.26 -5.05 119.30 122.86 3h3o s MET 475 Ca 0.00 1.72 -0.11 0.00 -1.25 0.00 0.00 55.69 56.05 3h3o s MET 475 Cb 0.00 -3.23 0.13 0.00 2.84 0.00 0.00 34.83 34.57 3h3o s MET 475 CO 0.00 0.23 1.09 -1.25 -0.65 0.00 0.00 175.02 174.44 3h3o s PRO 476 N -1.08 1.24 0.02 4.11 0.04 -1.26 -4.88 135.00 133.19 3h3o s PRO 476 Ca 0.45 0.83 -0.11 0.00 0.04 0.00 0.00 61.00 62.22 3h3o s PRO 476 Cb -0.30 -1.81 -0.06 0.00 0.04 0.00 0.00 34.50 32.38 3h3o s PRO 476 CO 0.38 -2.26 1.17 0.00 0.04 0.00 0.00 177.00 176.33 3h3o h ALA 477 N -1.56 -0.97 -0.16 8.56 0.00 -1.99 -2.71 119.26 120.44 3h3o h ALA 477 Ca -0.49 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.39 3h3o h ALA 477 Cb 1.28 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 3h3o h ALA 477 CO 0.54 -0.96 0.13 1.05 0.00 0.00 0.00 179.25 180.02 3h3o h GLU 478 N -0.35 0.00 0.35 0.00 4.11 -1.98 -1.63 114.58 115.09 3h3o h GLU 478 Ca -0.03 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.38 3h3o h GLU 478 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3h3o h GLU 478 CO 0.02 0.00 -0.17 1.49 0.07 0.00 0.00 179.01 180.42 3h3o h GLU 479 N 0.00 -0.46 0.00 1.06 4.81 -1.94 -1.58 114.58 116.47 3h3o h GLU 479 Ca 0.07 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 3h3o h GLU 479 Cb 0.34 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.82 3h3o h GLU 479 CO -0.00 -0.14 0.00 2.89 -0.73 0.00 0.00 179.01 181.03 3h3o n ARG 480 N -5.14 0.01 0.03 1.92 1.85 -1.03 -1.93 116.66 112.38 3h3o n ARG 480 Ca -0.09 0.23 -0.22 0.00 -1.00 0.00 0.00 57.85 56.77 3h3o n ARG 480 Cb 0.28 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.04 3h3o n ARG 480 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 3h3o h ASP 481 N 0.00 0.48 -0.17 2.89 3.45 -1.20 -3.15 116.42 118.73 3h3o h ASP 481 Ca 0.00 -0.91 -0.05 0.00 0.43 0.00 0.00 57.03 56.50 3h3o h ASP 481 Cb 0.26 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 38.86 3h3o h ASP 481 CO 0.00 1.75 -0.09 0.78 -1.57 0.00 0.00 179.24 180.11 3h3o h ASN 482 N -0.06 0.38 -0.11 6.45 2.35 -1.06 -1.25 115.58 122.28 3h3o h ASN 482 Ca -0.35 -0.42 0.04 0.00 -0.55 0.00 0.00 56.30 55.02 3h3o h ASN 482 Cb 1.96 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 40.16 3h3o h ASN 482 CO 0.11 0.71 -0.37 -0.07 -1.65 0.00 0.00 177.43 176.16 3h3o h LEU 483 N 0.04 -1.16 -1.49 1.61 3.38 -1.54 0.07 115.31 116.21 3h3o h LEU 483 Ca 0.04 0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 3h3o h LEU 483 Cb 0.58 0.48 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 3h3o h LEU 483 CO 0.03 -0.40 0.07 0.22 0.09 0.00 0.00 178.44 178.44 3h3o h TYR 484 N -0.46 0.40 0.15 1.13 3.20 -1.56 -2.39 116.97 117.44 3h3o h TYR 484 Ca 0.08 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 3h3o h TYR 484 Cb 0.60 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.74 3h3o h TYR 484 CO -0.44 0.36 -0.07 1.49 -1.64 0.00 0.00 178.16 177.85 3h3o h GLU 485 N 0.40 -0.20 -0.87 1.82 4.57 0.01 -2.25 114.58 118.07 3h3o h GLU 485 Ca 0.10 0.01 0.15 0.00 -1.18 0.00 0.00 59.36 58.43 3h3o h GLU 485 Cb 0.16 0.05 -0.09 0.00 -0.16 0.00 0.00 28.75 28.70 3h3o h GLU 485 CO -0.00 -0.00 0.46 0.78 -1.18 0.00 0.00 179.01 179.07 3h3o h GLY 486 N -0.36 1.42 0.75 1.92 0.00 -0.72 -1.40 103.07 104.68 3h3o h GLY 486 Ca -0.02 -0.27 0.01 0.00 0.00 0.00 0.00 47.33 47.04 3h3o h GLY 486 CO 0.03 -0.02 -0.17 -0.25 0.00 0.00 0.00 176.54 176.14 3h3o h TRP 487 N 0.66 -0.43 -0.50 5.60 2.91 -1.16 0.25 115.95 123.28 3h3o h TRP 487 Ca 0.47 0.01 0.10 0.00 1.13 0.00 0.00 58.89 60.59 3h3o h TRP 487 Cb 0.65 0.17 -0.08 0.00 -0.51 0.00 0.00 29.16 29.39 3h3o h TRP 487 CO -0.08 -0.25 -0.01 0.87 -1.03 0.00 0.00 178.44 177.94 3h3o h LYS 488 N -0.34 0.10 -0.12 2.65 1.57 -0.68 0.18 116.57 119.92 3h3o h LYS 488 Ca 0.01 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 3h3o h LYS 488 Cb 0.34 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 3h3o h LYS 488 CO -0.07 0.07 -0.15 1.96 -0.57 0.00 0.00 179.45 180.69 3h3o h GLN 489 N 0.10 0.19 -0.23 3.15 4.20 -1.11 0.21 115.11 121.62 3h3o h GLN 489 Ca 0.25 -0.04 -0.13 0.00 0.06 0.00 0.00 58.65 58.78 3h3o h GLN 489 Cb 0.38 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 3h3o h GLN 489 CO -0.43 0.35 -0.42 0.00 -0.67 0.00 0.00 178.83 177.66 3h3o h ALA 490 N 1.67 0.84 -0.05 3.87 0.00 0.14 -0.59 119.26 125.14 3h3o h ALA 490 Ca 0.04 -0.44 -0.24 0.00 0.00 0.00 0.00 54.91 54.26 3h3o h ALA 490 Cb 0.38 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.08 3h3o h ALA 490 CO 0.02 0.65 -0.92 0.28 0.00 0.00 0.00 179.25 179.28 3h3o h VAL 491 N 0.46 1.32 -0.96 0.00 2.07 -0.35 -1.89 116.25 116.90 3h3o h VAL 491 Ca 0.04 -2.21 0.01 0.00 0.82 0.00 0.00 66.70 65.36 3h3o h VAL 491 Cb 0.92 2.25 -0.05 0.00 -1.52 0.00 0.00 31.29 32.89 3h3o h VAL 491 CO 0.08 0.68 0.63 0.00 0.02 0.00 0.00 177.57 178.98 3h3o h ALA 492 N 0.58 1.33 -0.24 1.67 0.00 -0.78 -0.38 119.26 121.44 3h3o h ALA 492 Ca -0.09 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.58 3h3o h ALA 492 Cb 1.55 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 3h3o h ALA 492 CO 0.18 0.62 -0.56 0.00 0.00 0.00 0.00 179.25 179.49 3h3o h ALA 493 N 1.41 0.56 -0.27 0.00 0.00 -1.05 -2.92 119.26 116.99 3h3o h ALA 493 Ca 0.36 -0.52 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 3h3o h ALA 493 Cb -0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3h3o h ALA 493 CO -0.08 0.69 -0.17 1.15 0.00 0.00 0.00 179.25 180.83 3h3o h THR 494 N 0.56 1.24 0.00 0.00 2.02 -0.77 -2.33 112.91 113.63 3h3o h THR 494 Ca 0.01 -1.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 3h3o h THR 494 Cb 1.14 1.23 -0.00 0.00 -1.74 0.00 0.00 68.15 68.78 3h3o h THR 494 CO 0.12 0.35 -0.03 1.56 0.37 0.00 0.00 175.52 177.89 3h3o h GLN 495 N 0.43 0.00 0.00 6.66 4.20 -0.96 -2.98 115.11 122.46 3h3o h GLN 495 Ca 0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.78 3h3o h GLN 495 Cb 0.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.33 3h3o h GLN 495 CO 0.04 0.03 -0.19 1.79 -0.67 0.00 0.00 178.83 179.83 3h3o h THR 496 N 0.00 0.00 -2.64 -0.54 1.35 -1.23 -3.42 112.91 106.43 3h3o h THR 496 Ca -0.00 -0.55 -0.64 0.00 -0.55 0.00 0.00 66.41 64.67 3h3o h THR 496 Cb 0.61 1.43 -0.15 0.00 -1.73 0.00 0.00 68.15 68.31 3h3o h THR 496 CO 0.00 0.00 0.54 0.12 -0.25 0.00 0.00 175.52 175.94 3h3o s PHE 497 N -3.14 2.74 -0.39 4.73 5.36 -1.13 -4.88 117.98 121.28 3h3o s PHE 497 Ca 0.09 -0.67 0.10 0.00 -0.96 0.00 0.00 56.93 55.49 3h3o s PHE 497 Cb 0.12 -4.27 0.44 0.00 -0.34 0.00 0.00 43.02 38.96 3h3o s PHE 497 CO 0.64 -1.61 1.05 1.63 -1.46 0.00 0.00 175.22 175.47 3h3o n LYS 498 N 7.49 2.53 -2.18 10.12 4.76 -1.26 -4.70 118.16 134.92 3h3o n LYS 498 Ca -0.01 -4.00 -0.42 0.00 -2.87 0.00 0.00 58.31 51.00 3h3o n LYS 498 Cb 0.46 -1.85 -0.03 0.00 -1.84 0.00 0.00 35.03 31.77 3h3o n LYS 498 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 3h3o s PHE 499 N -3.38 2.47 0.00 2.13 5.36 -1.26 -4.91 117.98 118.38 3h3o s PHE 499 Ca 0.40 0.59 0.00 0.00 -0.96 0.00 0.00 56.93 56.96 3h3o s PHE 499 Cb 0.42 -3.74 0.00 0.00 -0.34 0.00 0.00 43.02 39.37 3h3o s PHE 499 CO -0.09 -2.88 0.00 1.63 -1.46 0.00 0.00 175.22 172.42 3h3o n LYS 500 N 6.45 0.00 -0.79 10.12 4.01 -1.26 -5.17 118.16 131.52 3h3o n LYS 500 Ca 0.15 0.00 0.05 0.00 -0.51 0.00 0.00 58.31 58.01 3h3o n LYS 500 Cb 0.43 0.00 -0.02 0.00 -0.51 0.00 0.00 35.03 34.93 3h3o n LYS 500 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3h3o n ALA 501 N -3.00 -2.32 0.60 7.82 0.00 -1.26 -5.36 120.51 116.99 3h3o n ALA 501 Ca 0.00 0.24 0.07 0.00 0.00 0.00 0.00 53.44 53.75 3h3o n ALA 501 Cb 0.00 -0.80 0.06 0.00 0.00 0.00 0.00 19.45 18.71 3h3o n ALA 501 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13