#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3o n LYS 4 N 0.00 0.00 -0.23 5.31 4.76 -1.26 -4.63 118.16 122.12 3h3o n LYS 4 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3h3o n LYS 4 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 3h3o n LYS 4 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3h3o n ASN 5 N 0.00 0.00 -3.89 4.39 3.02 -1.26 -4.77 115.26 112.75 3h3o n ASN 5 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.44 3h3o n ASN 5 Cb 0.00 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.07 3h3o n ASN 5 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3h3o s TYR 6 N -2.58 0.08 -0.00 3.10 2.02 -1.19 -3.61 117.35 115.17 3h3o s TYR 6 Ca 0.00 -0.23 0.03 0.00 -0.37 0.00 0.00 57.07 56.50 3h3o s TYR 6 Cb 0.00 -0.07 -0.01 0.00 -0.40 0.00 0.00 41.96 41.48 3h3o s TYR 6 CO 0.00 -0.30 -0.08 0.14 -1.57 0.00 0.00 175.55 173.74 3h3o s VAL 7 N -1.64 0.65 -0.02 0.71 -7.23 -0.92 0.13 120.40 112.07 3h3o s VAL 7 Ca -0.13 -0.41 -0.01 0.00 -1.81 0.00 0.00 61.98 59.62 3h3o s VAL 7 Cb -0.06 -0.56 -0.04 0.00 0.56 0.00 0.00 36.38 36.28 3h3o s VAL 7 CO 0.00 0.14 0.08 -0.32 -0.31 0.00 0.00 175.10 174.70 3h3o s MET 8 N -0.30 3.09 -0.10 4.82 1.75 0.31 -1.44 119.30 127.42 3h3o s MET 8 Ca 0.02 -0.46 0.01 0.00 -1.25 0.00 0.00 55.69 54.01 3h3o s MET 8 Cb -0.04 -2.88 0.02 0.00 2.84 0.00 0.00 34.83 34.77 3h3o s MET 8 CO -0.00 0.66 -0.11 0.00 -0.65 0.00 0.00 175.02 174.92 3h3o s ALA 9 N -1.17 1.41 -0.22 4.11 0.00 0.18 -0.37 121.76 125.71 3h3o s ALA 9 Ca 0.22 -0.57 -0.05 0.00 0.00 0.00 0.00 51.96 51.56 3h3o s ALA 9 Cb -0.12 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.16 3h3o s ALA 9 CO 0.13 -0.21 0.01 0.42 0.00 0.00 0.00 175.76 176.11 3h3o s ILE 10 N 1.28 3.98 -0.35 0.00 1.01 -0.20 -0.96 121.20 125.97 3h3o s ILE 10 Ca -0.02 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.34 3h3o s ILE 10 Cb -0.14 -2.82 0.09 0.00 0.01 0.00 0.00 42.46 39.61 3h3o s ILE 10 CO -0.04 0.41 0.07 -0.62 0.00 0.00 0.00 174.94 174.76 3h3o s ASP 11 N 1.21 4.89 -0.75 3.58 2.15 0.38 -0.93 116.67 127.20 3h3o s ASP 11 Ca 0.03 -1.95 -0.19 0.00 0.43 0.00 0.00 52.55 50.87 3h3o s ASP 11 Cb -0.15 -1.69 0.12 0.00 -0.30 0.00 0.00 42.92 40.90 3h3o s ASP 11 CO 0.01 -0.40 0.93 -1.58 -0.17 0.00 0.00 175.17 173.96 3h3o s GLN 12 N 1.03 3.31 0.32 4.34 -0.44 0.05 -1.61 119.66 126.65 3h3o s GLN 12 Ca 0.06 -1.46 -0.02 0.00 -2.50 0.00 0.00 55.36 51.44 3h3o s GLN 12 Cb -0.20 -4.50 0.07 0.00 -1.64 0.00 0.00 33.01 26.73 3h3o s GLN 12 CO -0.06 -1.67 0.44 0.41 0.50 0.00 0.00 175.29 174.91 3h3o n GLY 13 N 5.25 0.06 0.10 2.59 0.00 0.23 -1.44 105.19 111.98 3h3o n GLY 13 Ca 0.06 -1.89 -0.12 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.75 1.22 -0.00 2.61 2.02 -1.96 -3.35 112.91 112.70 3h3o h THR 14 Ca -0.14 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.35 3h3o h THR 14 Cb 0.48 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 3h3o h THR 14 CO 0.13 0.20 -0.24 0.35 0.37 0.00 0.00 175.52 176.34 3h3o n THR 15 N -4.83 0.00 -3.84 3.16 -2.24 -1.26 -5.01 114.28 100.26 3h3o n THR 15 Ca -0.06 -0.38 -0.07 0.00 -2.27 0.00 0.00 64.05 61.27 3h3o n THR 15 Cb 0.17 1.08 -0.01 0.00 -2.10 0.00 0.00 70.33 69.48 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 -1.40 -0.18 0.11 3.42 1.04 -1.26 -3.09 113.70 112.34 3h3o s SER 16 Ca 0.06 -0.73 0.08 0.00 0.48 0.00 0.00 55.95 55.84 3h3o s SER 16 Cb 0.07 0.74 -0.04 0.00 0.10 0.00 0.00 66.02 66.90 3h3o s SER 16 CO 0.26 -1.40 -0.20 -0.44 0.98 0.00 0.00 173.24 172.43 3h3o s SER 17 N -2.97 2.50 -0.03 7.02 0.01 0.13 -0.60 113.70 119.76 3h3o s SER 17 Ca 0.12 -0.70 -0.06 0.00 1.31 0.00 0.00 55.95 56.62 3h3o s SER 17 Cb -0.05 -0.14 0.01 0.00 0.21 0.00 0.00 66.02 66.05 3h3o s SER 17 CO 0.08 0.04 0.13 0.00 0.41 0.00 0.00 173.24 173.90 3h3o s ARG 18 N -2.00 0.29 0.01 12.44 1.70 -0.63 -0.71 118.95 130.05 3h3o s ARG 18 Ca 0.07 -0.06 0.07 0.00 -0.47 0.00 0.00 55.73 55.34 3h3o s ARG 18 Cb -0.09 0.13 -0.02 0.00 -0.57 0.00 0.00 34.95 34.39 3h3o s ARG 18 CO 0.04 -0.06 -0.22 0.00 -1.08 0.00 0.00 175.30 173.99 3h3o s ALA 19 N -0.54 1.84 -0.01 7.88 0.00 -0.81 -0.47 121.76 129.66 3h3o s ALA 19 Ca -0.06 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.90 3h3o s ALA 19 Cb -0.04 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.66 3h3o s ALA 19 CO 0.01 0.44 -0.01 0.42 0.00 0.00 0.00 175.76 176.62 3h3o s ILE 20 N -0.62 0.08 -0.19 0.00 1.01 -0.13 -2.25 121.20 119.11 3h3o s ILE 20 Ca 0.08 -0.01 -0.05 0.00 0.00 0.00 0.00 60.65 60.68 3h3o s ILE 20 Cb -0.09 -0.10 -0.03 0.00 0.01 0.00 0.00 42.46 42.26 3h3o s ILE 20 CO 0.00 0.04 0.00 -0.63 0.00 0.00 0.00 174.94 174.36 3h3o s ILE 21 N 0.18 4.11 0.27 2.92 1.01 -0.34 -0.64 121.20 128.72 3h3o s ILE 21 Ca -0.01 -0.27 0.11 0.00 0.00 0.00 0.00 60.65 60.48 3h3o s ILE 21 Cb -0.03 -2.84 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 3h3o s ILE 21 CO -0.01 0.45 -0.13 -0.36 0.00 0.00 0.00 174.94 174.89 3h3o s PHE 22 N 0.71 2.44 0.54 3.97 0.08 -0.52 -0.29 117.98 124.90 3h3o s PHE 22 Ca 0.00 -0.29 0.03 0.00 0.12 0.00 0.00 56.93 56.80 3h3o s PHE 22 Cb -0.14 -1.08 0.02 0.00 -0.57 0.00 0.00 43.02 41.25 3h3o s PHE 22 CO 0.02 0.67 0.24 0.16 -0.10 0.00 0.00 175.22 176.21 3h3o s ASP 23 N -3.50 4.43 0.48 1.36 1.47 -1.05 -2.17 116.67 117.68 3h3o s ASP 23 Ca 0.30 -1.43 0.32 0.00 1.18 0.00 0.00 52.55 52.91 3h3o s ASP 23 Cb -0.06 0.52 1.42 0.00 -0.34 0.00 0.00 42.92 44.46 3h3o s ASP 23 CO 0.16 -1.03 1.73 -0.09 0.68 0.00 0.00 175.17 176.63 3h3o h ARG 24 N 0.97 0.13 -0.09 2.11 9.65 -1.93 0.62 114.38 125.84 3h3o h ARG 24 Ca -0.40 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.48 3h3o h ARG 24 Cb 1.31 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.86 3h3o h ARG 24 CO 0.64 0.08 0.00 0.09 2.80 0.00 0.00 179.97 183.58 3h3o n ASN 25 N -4.38 1.33 -0.32 -3.80 3.02 -1.26 -4.89 115.26 104.95 3h3o n ASN 25 Ca 0.30 -1.56 -0.04 0.00 -0.03 0.00 0.00 54.58 53.25 3h3o n ASN 25 Cb 1.26 -0.05 -0.01 0.00 -0.61 0.00 0.00 39.78 40.37 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 1.10 0.57 3.70 7.41 0.00 0.22 -5.01 105.19 113.19 3h3o n GLY 26 Ca 0.18 -0.87 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.72 4.36 -0.08 1.61 2.20 -1.25 -4.79 119.74 119.07 3h3o s LYS 27 Ca 0.00 0.74 -0.29 0.00 -0.36 0.00 0.00 55.97 56.05 3h3o s LYS 27 Cb 0.00 -3.48 -0.06 0.00 -1.51 0.00 0.00 37.83 32.78 3h3o s LYS 27 CO 0.00 -0.00 1.90 0.21 -0.36 0.00 0.00 175.35 177.10 3h3o s LYS 28 N 1.07 3.88 -0.16 4.03 2.20 -1.26 -2.54 119.74 126.96 3h3o s LYS 28 Ca 0.33 2.26 0.17 0.00 -0.36 0.00 0.00 55.97 58.37 3h3o s LYS 28 Cb -0.17 -4.15 -0.25 0.00 -1.51 0.00 0.00 37.83 31.75 3h3o s LYS 28 CO 0.14 -1.23 0.21 -0.89 -0.36 0.00 0.00 175.35 173.22 3h3o n ILE 29 N 6.13 1.40 -3.54 5.43 2.08 0.60 -5.00 119.36 126.46 3h3o n ILE 29 Ca 0.21 -0.84 -0.11 0.00 0.56 0.00 0.00 62.75 62.58 3h3o n ILE 29 Cb 0.43 -0.56 -0.04 0.00 -0.75 0.00 0.00 39.64 38.71 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 -5.38 -0.40 0.24 7.39 0.00 -1.20 -4.47 107.32 103.50 3h3o s GLY 30 Ca -0.09 1.50 -0.18 0.00 0.00 0.00 0.00 44.72 45.95 3h3o s GLY 30 CO 0.83 0.74 0.59 -1.35 0.00 0.00 0.00 173.10 173.92 3h3o s SER 31 N -1.66 -0.23 -0.28 1.64 1.04 -1.26 -1.19 113.70 111.75 3h3o s SER 31 Ca -0.01 -0.63 -0.19 0.00 0.48 0.00 0.00 55.95 55.60 3h3o s SER 31 Cb -0.01 0.64 0.10 0.00 0.10 0.00 0.00 66.02 66.85 3h3o s SER 31 CO -0.01 -1.19 0.81 -0.55 0.98 0.00 0.00 173.24 173.27 3h3o s SER 32 N -2.92 -0.74 0.03 7.02 0.15 -0.95 -4.47 113.70 111.81 3h3o s SER 32 Ca 0.13 1.26 0.07 0.00 0.70 0.00 0.00 55.95 58.11 3h3o s SER 32 Cb -0.03 1.29 -0.02 0.00 -1.71 0.00 0.00 66.02 65.55 3h3o s SER 32 CO 0.04 -0.20 -0.20 -1.58 1.20 0.00 0.00 173.24 172.49 3h3o s GLN 33 N 1.09 1.42 -0.18 5.44 0.74 -1.26 -1.93 119.66 124.98 3h3o s GLN 33 Ca -0.06 -0.88 -0.13 0.00 0.05 0.00 0.00 55.36 54.34 3h3o s GLN 33 Cb -0.05 -1.49 0.05 0.00 1.10 0.00 0.00 33.01 32.62 3h3o s GLN 33 CO -0.12 0.39 0.45 0.21 -0.55 0.00 0.00 175.29 175.66 3h3o s LYS 34 N -1.02 0.48 0.46 1.67 2.20 0.11 -4.97 119.74 118.67 3h3o s LYS 34 Ca 0.07 0.73 -0.09 0.00 -0.36 0.00 0.00 55.97 56.32 3h3o s LYS 34 Cb -0.09 0.14 -0.05 0.00 -1.51 0.00 0.00 37.83 36.32 3h3o s LYS 34 CO 0.01 -0.11 0.81 -1.21 -0.36 0.00 0.00 175.35 174.49 3h3o s GLU 35 N 0.79 3.68 0.10 4.03 2.02 -1.26 -0.70 118.70 127.36 3h3o s GLU 35 Ca -0.04 0.41 0.02 0.00 0.02 0.00 0.00 54.97 55.38 3h3o s GLU 35 Cb -0.05 -2.35 -0.04 0.00 0.10 0.00 0.00 34.13 31.79 3h3o s GLU 35 CO -0.06 -0.16 -0.08 -0.59 0.02 0.00 0.00 175.26 174.40 3h3o s PHE 36 N -2.59 0.93 0.45 1.61 -0.12 -1.18 -4.94 117.98 112.14 3h3o s PHE 36 Ca 0.50 -0.81 -0.24 0.00 -0.05 0.00 0.00 56.93 56.33 3h3o s PHE 36 Cb -0.10 -0.53 -0.09 0.00 -0.63 0.00 0.00 43.02 41.67 3h3o s PHE 36 CO 0.38 -0.09 1.17 -2.30 -0.05 0.00 0.00 175.22 174.33 3h3o n PRO 37 N 0.19 1.63 -5.08 1.99 -0.02 -1.26 -4.86 135.00 127.60 3h3o n PRO 37 Ca -0.14 0.59 -0.32 0.00 -2.02 0.00 0.00 63.50 61.61 3h3o n PRO 37 Cb 0.60 -2.27 -0.16 0.00 -0.02 0.00 0.00 33.50 31.65 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 -2.25 2.88 -0.09 -0.52 -1.52 -1.26 -4.68 119.66 112.23 3h3o s GLN 38 Ca 0.64 -0.81 0.04 0.00 -1.95 0.00 0.00 55.36 53.27 3h3o s GLN 38 Cb -0.51 -2.35 -0.01 0.00 -0.22 0.00 0.00 33.01 29.93 3h3o s GLN 38 CO 0.56 0.32 -0.22 0.71 -0.25 0.00 0.00 175.29 176.42 3h3o s TYR 39 N 0.01 2.58 -0.61 0.91 2.02 -0.50 -4.98 117.35 116.77 3h3o s TYR 39 Ca -0.07 -0.81 0.05 0.00 -0.37 0.00 0.00 57.07 55.88 3h3o s TYR 39 Cb -0.15 -1.69 0.20 0.00 -0.40 0.00 0.00 41.96 39.92 3h3o s TYR 39 CO 0.05 -0.27 0.54 1.19 -1.57 0.00 0.00 175.55 175.49 3h3o n PHE 40 N 3.25 2.31 0.03 2.71 3.72 -1.26 -0.61 117.46 127.61 3h3o n PHE 40 Ca -0.18 -4.03 -0.14 0.00 -0.05 0.00 0.00 57.45 53.04 3h3o n PHE 40 Cb 0.53 -0.43 -0.08 0.00 -0.94 0.00 0.00 39.48 38.55 3h3o n PHE 40 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 3h3o h PRO 41 N 4.98 -0.57 -5.51 -1.08 0.11 -1.98 -3.44 132.00 124.52 3h3o h PRO 41 Ca 0.18 0.04 -0.43 0.00 0.11 0.00 0.00 66.00 65.89 3h3o h PRO 41 Cb 0.77 0.13 -0.15 0.00 0.11 0.00 0.00 31.00 31.86 3h3o h PRO 41 CO 0.67 -0.38 -0.73 0.15 -0.21 0.00 0.00 178.00 177.49 3h3o s LYS 42 N -5.80 1.28 0.39 1.05 1.02 -1.26 -5.06 119.74 111.36 3h3o s LYS 42 Ca -0.16 -1.56 -0.25 0.00 0.02 0.00 0.00 55.97 54.02 3h3o s LYS 42 Cb 0.08 -1.05 -0.11 0.00 -0.52 0.00 0.00 37.83 36.22 3h3o s LYS 42 CO 0.62 0.17 1.06 0.45 -0.92 0.00 0.00 175.35 176.74 3h3o n SER 43 N -0.31 1.53 0.00 2.83 2.88 -1.26 -1.07 113.62 118.22 3h3o n SER 43 Ca -0.09 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.54 3h3o n SER 43 Cb 0.60 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 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 1.12 2.98 3.86 0.46 0.00 -1.26 -4.95 105.19 107.39 3h3o n GLY 44 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.83 3.47 -0.13 1.61 0.52 -0.23 -1.09 118.94 121.26 3h3o s TRP 45 Ca 0.00 1.00 -0.05 0.00 0.02 0.00 0.00 56.10 57.07 3h3o s TRP 45 Cb 0.00 -2.35 0.06 0.00 -1.15 0.00 0.00 33.47 30.04 3h3o s TRP 45 CO 0.00 0.29 0.28 0.08 0.02 0.00 0.00 176.95 177.62 3h3o s VAL 46 N -1.73 -0.37 0.11 4.03 1.01 -1.26 -4.43 120.40 117.76 3h3o s VAL 46 Ca 0.46 0.25 0.03 0.00 0.00 0.00 0.00 61.98 62.71 3h3o s VAL 46 Cb -0.12 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 3h3o s VAL 46 CO 0.20 0.10 -0.08 -1.61 0.00 0.00 0.00 175.10 173.71 3h3o s GLU 47 N 2.23 0.90 0.09 2.72 2.02 0.21 -1.97 118.70 124.91 3h3o s GLU 47 Ca -0.01 -1.35 0.04 0.00 0.02 0.00 0.00 54.97 53.68 3h3o s GLU 47 Cb -0.12 -0.37 -0.03 0.00 0.10 0.00 0.00 34.13 33.71 3h3o s GLU 47 CO -0.09 0.02 -0.12 -1.01 0.02 0.00 0.00 175.26 174.08 3h3o s HIS 48 N -3.39 1.13 -0.37 1.61 3.76 -0.35 -1.41 115.29 116.28 3h3o s HIS 48 Ca 0.12 -0.55 -0.17 0.00 -0.15 0.00 0.00 55.06 54.31 3h3o s HIS 48 Cb 0.03 -0.62 -0.00 0.00 1.11 0.00 0.00 32.58 33.10 3h3o s HIS 48 CO -0.03 0.04 0.42 1.21 -0.85 0.00 0.00 174.74 175.54 3h3o s ASN 49 N -2.12 6.22 0.53 1.40 3.84 -1.26 0.12 114.94 123.66 3h3o s ASN 49 Ca 0.02 -0.30 0.22 0.00 0.21 0.00 0.00 52.86 53.01 3h3o s ASN 49 Cb -0.06 -2.22 1.36 0.00 -0.55 0.00 0.00 41.25 39.78 3h3o s ASN 49 CO 0.01 -0.45 2.06 0.00 -2.79 0.00 0.00 177.10 175.93 3h3o h ALA 50 N 8.54 2.30 -0.43 1.71 0.00 -1.93 -1.60 119.26 127.84 3h3o h ALA 50 Ca -0.28 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.47 3h3o h ALA 50 Cb 1.13 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 3h3o h ALA 50 CO 0.74 -0.41 -0.29 -0.91 0.00 0.00 0.00 179.25 178.39 3h3o h ASN 51 N 0.00 0.99 0.55 0.00 2.35 -1.97 0.21 115.58 117.72 3h3o h ASN 51 Ca 0.16 -0.41 -0.11 0.00 -0.55 0.00 0.00 56.30 55.39 3h3o h ASN 51 Cb 0.63 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 3h3o h ASN 51 CO -0.00 1.20 -0.53 -0.33 -1.65 0.00 0.00 177.43 176.12 3h3o h GLU 52 N 0.80 0.00 -0.43 0.81 5.08 -1.77 0.62 114.58 119.69 3h3o h GLU 52 Ca 0.09 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 3h3o h GLU 52 Cb 0.87 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 3h3o h GLU 52 CO 0.08 0.53 -0.12 0.82 -1.00 0.00 0.00 179.01 179.32 3h3o h ILE 53 N 0.00 1.27 -0.09 3.13 2.04 -0.96 -1.40 117.51 121.50 3h3o h ILE 53 Ca -0.01 -1.24 0.01 0.00 1.00 0.00 0.00 64.86 64.63 3h3o h ILE 53 Cb 0.95 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 3h3o h ILE 53 CO 0.07 0.42 0.00 -0.25 0.00 0.00 0.00 178.15 178.39 3h3o h TRP 54 N 0.68 -0.00 -0.47 1.37 -0.00 0.19 -2.27 115.95 115.45 3h3o h TRP 54 Ca 0.11 0.01 0.01 0.00 -0.00 0.00 0.00 58.89 59.01 3h3o h TRP 54 Cb 0.66 0.01 -0.02 0.00 -0.00 0.00 0.00 29.16 29.81 3h3o h TRP 54 CO 0.05 -0.01 0.31 -0.91 -0.00 0.00 0.00 178.44 177.88 3h3o h ASN 55 N 0.03 0.53 0.41 2.65 4.21 -0.81 -0.94 115.58 121.65 3h3o h ASN 55 Ca 0.04 -0.01 -0.09 0.00 1.21 0.00 0.00 56.30 57.45 3h3o h ASN 55 Cb 0.05 -0.13 -0.01 0.00 -1.12 0.00 0.00 38.32 37.10 3h3o h ASN 55 CO -0.07 0.38 -0.43 0.77 -1.29 0.00 0.00 177.43 176.79 3h3o h SER 56 N 0.62 0.03 -0.07 5.81 4.64 -0.76 -0.63 113.55 123.20 3h3o h SER 56 Ca 0.17 -0.01 -0.24 0.00 -0.47 0.00 0.00 61.79 61.24 3h3o h SER 56 Cb -0.06 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.04 3h3o h SER 56 CO -0.04 0.46 -0.89 0.58 -0.87 0.00 0.00 176.83 176.07 3h3o h VAL 57 N 0.03 1.28 -0.66 0.95 2.07 -0.67 -2.21 116.25 117.05 3h3o h VAL 57 Ca -0.00 -2.09 -0.08 0.00 0.82 0.00 0.00 66.70 65.34 3h3o h VAL 57 Cb 0.77 2.14 -0.03 0.00 -1.52 0.00 0.00 31.29 32.66 3h3o h VAL 57 CO 0.06 0.66 0.08 1.56 0.02 0.00 0.00 177.57 179.94 3h3o h GLN 58 N 0.48 1.10 0.18 1.57 4.20 -1.05 -1.63 115.11 119.96 3h3o h GLN 58 Ca -0.08 -0.31 0.01 0.00 0.06 0.00 0.00 58.65 58.32 3h3o h GLN 58 Cb 1.52 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 29.17 3h3o h GLN 58 CO 0.18 1.03 -0.19 0.77 -0.67 0.00 0.00 178.83 179.94 3h3o h SER 59 N 1.02 -0.52 0.91 1.46 0.02 -1.06 -1.40 113.55 113.98 3h3o h SER 59 Ca 0.20 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.17 3h3o h SER 59 Cb 0.48 0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.20 3h3o h SER 59 CO 0.02 -0.29 -0.10 -0.37 -1.14 0.00 0.00 176.83 174.95 3h3o h VAL 60 N -0.41 0.28 -0.15 2.27 -1.51 -1.29 0.79 116.25 116.24 3h3o h VAL 60 Ca 0.00 -0.76 -0.11 0.00 -1.23 0.00 0.00 66.70 64.60 3h3o h VAL 60 Cb 0.39 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 3h3o h VAL 60 CO -0.05 0.10 -0.34 0.40 -1.23 0.00 0.00 177.57 176.44 3h3o h ILE 61 N 0.00 1.36 -0.07 7.19 2.04 -0.92 -1.41 117.51 125.70 3h3o h ILE 61 Ca -0.00 -1.61 -0.01 0.00 1.00 0.00 0.00 64.86 64.23 3h3o h ILE 61 Cb 0.59 2.00 -0.00 0.00 -0.74 0.00 0.00 36.82 38.66 3h3o h ILE 61 CO 0.01 0.49 -0.01 0.00 0.00 0.00 0.00 178.15 178.64 3h3o h ALA 62 N 0.55 0.09 -0.01 1.87 0.00 -0.96 -2.77 119.26 118.04 3h3o h ALA 62 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3h3o h ALA 62 Cb 0.95 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 3h3o h ALA 62 CO 0.08 -0.20 0.03 0.78 0.00 0.00 0.00 179.25 179.93 3h3o h GLY 63 N -0.20 0.00 1.34 0.00 0.00 -0.86 -1.50 103.07 101.85 3h3o h GLY 63 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.03 3h3o h GLY 63 CO 0.01 0.00 -1.45 0.00 0.00 0.00 0.00 176.54 175.10 3h3o h ALA 64 N 1.96 0.00 -0.17 3.60 0.00 -0.98 -2.71 119.26 120.97 3h3o h ALA 64 Ca 0.00 -0.93 -0.02 0.00 0.00 0.00 0.00 54.91 53.96 3h3o h ALA 64 Cb 0.05 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3h3o h ALA 64 CO -0.00 0.87 0.01 0.74 0.00 0.00 0.00 179.25 180.87 3h3o h PHE 65 N 0.11 0.32 -0.47 0.00 0.04 -1.14 -2.79 116.94 113.01 3h3o h PHE 65 Ca -0.23 -0.05 0.06 0.00 2.80 0.00 0.00 57.97 60.55 3h3o h PHE 65 Cb 2.09 -0.08 -0.05 0.00 2.20 0.00 0.00 35.95 40.10 3h3o h PHE 65 CO 0.10 0.49 0.18 0.82 -0.60 0.00 0.00 178.31 179.29 3h3o h ILE 66 N 0.06 0.87 0.00 -0.55 2.04 -1.39 0.27 117.51 118.81 3h3o h ILE 66 Ca 0.05 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3h3o h ILE 66 Cb 0.35 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 3h3o h ILE 66 CO 0.01 0.07 0.00 -0.08 0.00 0.00 0.00 178.15 178.14 3h3o h GLU 67 N 0.37 0.00 0.00 2.37 4.81 -1.45 -3.24 114.58 117.43 3h3o h GLU 67 Ca 0.22 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 59.18 3h3o h GLU 67 Cb 0.20 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.53 3h3o h GLU 67 CO -0.21 0.00 -2.24 -1.13 -0.73 0.00 0.00 179.01 174.70 3h3o n SER 68 N -3.07 0.20 0.00 1.04 3.41 -0.59 -4.84 113.62 109.77 3h3o n SER 68 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3h3o n SER 68 Cb 0.26 1.22 0.00 0.00 -0.26 0.00 0.00 64.21 65.43 3h3o n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h3o n GLY 69 N 1.68 1.83 3.77 5.00 0.00 0.85 -4.99 105.19 113.32 3h3o n GLY 69 Ca -0.25 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.58 3.16 0.07 -0.61 1.09 -1.25 -5.02 121.20 115.07 3h3o s ILE 70 Ca 0.00 0.95 -0.13 0.00 -1.10 0.00 0.00 60.65 60.37 3h3o s ILE 70 Cb 0.00 -3.52 -0.06 0.00 -1.06 0.00 0.00 42.46 37.82 3h3o s ILE 70 CO 0.00 0.06 0.45 -0.60 -0.10 0.00 0.00 174.94 174.75 3h3o s ARG 71 N -2.40 3.88 0.53 2.79 3.52 -1.26 -4.83 118.95 121.17 3h3o s ARG 71 Ca 0.59 0.34 0.25 0.00 -0.13 0.00 0.00 55.73 56.78 3h3o s ARG 71 Cb -0.30 -3.05 1.40 0.00 -1.56 0.00 0.00 34.95 31.44 3h3o s ARG 71 CO 0.37 0.58 2.00 -1.00 -0.81 0.00 0.00 175.30 176.44 3h3o h PRO 72 N 3.98 0.00 0.00 5.12 0.13 -1.94 0.09 132.00 139.38 3h3o h PRO 72 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3h3o h PRO 72 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3h3o h PRO 72 CO 0.65 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.57 3h3o n GLU 73 N -4.36 0.49 -0.39 0.86 0.00 -1.26 -2.26 120.64 113.71 3h3o n GLU 73 Ca 0.10 0.05 0.11 0.00 0.00 0.00 0.00 57.16 57.41 3h3o n GLU 73 Cb 0.60 -1.50 0.32 0.00 0.00 0.00 0.00 31.44 30.87 3h3o n GLU 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3h3o n ALA 74 N -1.16 2.45 -2.59 -1.84 0.00 0.02 -4.76 120.51 112.63 3h3o n ALA 74 Ca 0.13 -1.29 -0.40 0.00 0.00 0.00 0.00 53.44 51.88 3h3o n ALA 74 Cb 0.13 -0.95 -0.08 0.00 0.00 0.00 0.00 19.45 18.55 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 -1.12 5.07 0.14 0.00 -1.09 -0.96 -3.15 121.20 120.09 3h3o s ILE 75 Ca 0.48 0.64 -0.02 0.00 -2.23 0.00 0.00 60.65 59.53 3h3o s ILE 75 Cb 0.26 -3.85 -0.17 0.00 -1.58 0.00 0.00 42.46 37.12 3h3o s ILE 75 CO 0.32 -0.00 1.33 0.00 -1.23 0.00 0.00 174.94 175.36 3h3o h ALA 76 N 8.20 0.42 -2.36 9.38 0.00 0.65 -3.45 119.26 132.10 3h3o h ALA 76 Ca -0.29 -0.72 0.14 0.00 0.00 0.00 0.00 54.91 54.05 3h3o h ALA 76 Cb 1.14 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.78 3h3o h ALA 76 CO 0.72 0.86 0.47 0.20 0.00 0.00 0.00 179.25 181.50 3h3o s GLY 77 N -4.46 -0.33 -0.07 0.00 0.00 -1.25 -4.48 107.32 96.75 3h3o s GLY 77 Ca -0.05 0.45 0.05 0.00 0.00 0.00 0.00 44.72 45.17 3h3o s GLY 77 CO 0.85 0.13 -0.21 -0.42 0.00 0.00 0.00 173.10 173.45 3h3o s ILE 78 N -3.26 1.78 -0.03 0.90 1.01 -0.36 -0.53 121.20 120.70 3h3o s ILE 78 Ca 0.09 -0.89 0.05 0.00 0.00 0.00 0.00 60.65 59.90 3h3o s ILE 78 Cb -0.01 -1.53 -0.02 0.00 0.01 0.00 0.00 42.46 40.91 3h3o s ILE 78 CO -0.02 0.50 -0.19 -0.83 0.00 0.00 0.00 174.94 174.40 3h3o s GLY 79 N 0.12 1.44 -0.06 6.18 0.00 0.51 -1.57 107.32 113.93 3h3o s GLY 79 Ca -0.09 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.62 3h3o s GLY 79 CO 0.05 -0.84 -0.13 -0.42 0.00 0.00 0.00 173.10 171.76 3h3o s ILE 80 N -0.70 1.18 0.10 0.90 1.01 0.46 -1.03 121.20 123.11 3h3o s ILE 80 Ca 0.11 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.30 3h3o s ILE 80 Cb -0.10 -1.07 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 3h3o s ILE 80 CO 0.00 0.36 -0.12 0.42 0.00 0.00 0.00 174.94 175.61 3h3o s THR 81 N 0.62 1.04 0.20 2.92 -4.23 -0.11 -2.04 115.64 114.04 3h3o s THR 81 Ca -0.14 -1.57 -0.14 0.00 -1.18 0.00 0.00 61.69 58.66 3h3o s THR 81 Cb -0.16 -1.31 0.01 0.00 1.34 0.00 0.00 72.50 72.38 3h3o s THR 81 CO 0.04 -0.46 0.44 0.54 -0.54 0.00 0.00 174.62 174.64 3h3o s ASN 82 N -2.29 -0.13 0.21 3.99 4.22 -1.20 -0.77 114.94 118.96 3h3o s ASN 82 Ca 0.04 -0.70 -0.31 0.00 -2.14 0.00 0.00 52.86 49.75 3h3o s ASN 82 Cb -0.05 0.54 -0.11 0.00 1.28 0.00 0.00 41.25 42.91 3h3o s ASN 82 CO 0.01 -1.03 1.59 0.00 -2.04 0.00 0.00 177.10 175.64 3h3o s GLN 83 N -3.94 4.19 0.37 3.55 -2.07 -0.52 -0.47 119.66 120.76 3h3o s GLN 83 Ca 0.15 2.45 0.20 0.00 -1.82 0.00 0.00 55.36 56.33 3h3o s GLN 83 Cb 0.00 -3.11 0.45 0.00 -1.09 0.00 0.00 33.01 29.26 3h3o s GLN 83 CO 0.01 -0.62 1.62 0.00 -1.32 0.00 0.00 175.29 174.98 3h3o h ARG 84 N 6.28 0.00 0.00 9.60 3.08 -1.96 -3.40 114.38 127.97 3h3o h ARG 84 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.61 3h3o h ARG 84 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3h3o h ARG 84 CO 0.89 0.32 -0.93 0.39 -1.07 0.00 0.00 179.97 179.57 3h3o n GLU 85 N -3.27 1.74 -1.57 0.04 4.71 -1.26 -4.87 120.64 116.16 3h3o n GLU 85 Ca 0.02 -0.03 -0.58 0.00 -0.01 0.00 0.00 57.16 56.56 3h3o n GLU 85 Cb 0.58 -1.00 -0.08 0.00 -1.01 0.00 0.00 31.44 29.93 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 -1.51 0.02 -4.89 2.62 -1.04 -1.26 -4.07 114.28 104.15 3h3o n THR 86 Ca -0.00 -0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.68 3h3o n THR 86 Cb 0.12 -0.39 -0.13 0.00 -1.82 0.00 0.00 70.33 68.10 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 0.72 3.03 -0.01 12.58 2.01 0.02 -3.76 115.64 130.24 3h3o s THR 87 Ca 0.91 -0.73 0.01 0.00 0.31 0.00 0.00 61.69 62.19 3h3o s THR 87 Cb -1.18 -2.19 -0.00 0.00 0.01 0.00 0.00 72.50 69.13 3h3o s THR 87 CO 0.57 0.58 -0.04 0.54 -0.69 0.00 0.00 174.62 175.59 3h3o s VAL 88 N -0.59 0.32 -0.04 3.82 0.11 -0.84 -1.17 120.40 122.01 3h3o s VAL 88 Ca 0.08 -0.16 0.05 0.00 -2.93 0.00 0.00 61.98 59.02 3h3o s VAL 88 Cb -0.11 -0.28 -0.00 0.00 -1.53 0.00 0.00 36.38 34.45 3h3o s VAL 88 CO 0.01 0.10 -0.18 -0.69 -3.33 0.00 0.00 175.10 171.01 3h3o s VAL 89 N -0.02 1.49 0.15 2.04 1.01 -1.26 -1.73 120.40 122.09 3h3o s VAL 89 Ca 0.01 -0.76 -0.03 0.00 0.00 0.00 0.00 61.98 61.19 3h3o s VAL 89 Cb -0.02 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 3h3o s VAL 89 CO -0.00 0.43 0.14 -1.66 0.00 0.00 0.00 175.10 174.01 3h3o s TRP 90 N -0.02 0.78 -0.12 5.22 -2.14 -0.39 -1.25 118.94 121.02 3h3o s TRP 90 Ca -0.03 -1.12 -0.29 0.00 2.66 0.00 0.00 56.10 57.32 3h3o s TRP 90 Cb -0.11 -0.36 -0.01 0.00 -3.10 0.00 0.00 33.47 29.88 3h3o s TRP 90 CO 0.02 -0.61 1.00 0.34 -2.66 0.00 0.00 176.95 175.04 3h3o s ASP 91 N -3.05 7.22 0.37 -2.66 3.68 0.47 -0.39 116.67 122.31 3h3o s ASP 91 Ca 0.25 1.50 0.16 0.00 2.13 0.00 0.00 52.55 56.59 3h3o s ASP 91 Cb 0.06 -2.55 0.70 0.00 -1.45 0.00 0.00 42.92 39.69 3h3o s ASP 91 CO 0.03 -0.46 1.77 0.07 0.13 0.00 0.00 175.17 176.71 3h3o h LYS 92 N 7.14 0.00 0.00 4.34 2.10 -1.67 0.62 116.57 129.10 3h3o h LYS 92 Ca -0.30 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.35 3h3o h LYS 92 Cb 1.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.47 3h3o h LYS 92 CO 0.87 0.40 0.00 2.41 -2.00 0.00 0.00 179.45 181.13 3h3o n THR 93 N -3.79 0.00 0.28 0.07 -1.04 -1.26 -4.06 114.28 104.47 3h3o n THR 93 Ca -0.01 0.37 0.18 0.00 -2.04 0.00 0.00 64.05 62.55 3h3o n THR 93 Cb 0.47 -0.79 0.95 0.00 -1.82 0.00 0.00 70.33 69.13 3h3o n THR 93 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3h3o h THR 94 N 0.00 0.00 -0.04 12.58 1.35 -1.97 -3.45 112.91 121.38 3h3o h THR 94 Ca 0.00 -0.04 -0.02 0.00 -0.55 0.00 0.00 66.41 65.80 3h3o h THR 94 Cb 0.00 0.85 -0.01 0.00 -1.73 0.00 0.00 68.15 67.27 3h3o h THR 94 CO 0.00 0.00 -0.02 0.61 -0.25 0.00 0.00 175.52 175.86 3h3o n GLY 95 N -1.04 0.39 3.84 5.82 0.00 0.21 -5.02 105.19 109.39 3h3o n GLY 95 Ca -0.02 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.94 3.92 0.51 1.61 -1.52 -1.22 -4.77 119.66 117.24 3h3o s GLN 96 Ca 0.00 0.41 -0.20 0.00 -1.95 0.00 0.00 55.36 53.61 3h3o s GLN 96 Cb 0.00 -3.15 -0.07 0.00 -0.22 0.00 0.00 33.01 29.57 3h3o s GLN 96 CO 0.00 0.64 1.11 -2.14 -0.25 0.00 0.00 175.29 174.65 3h3o s PRO 97 N -1.32 3.56 0.00 2.91 0.02 -1.26 -0.39 135.00 138.51 3h3o s PRO 97 Ca 0.27 1.57 0.30 0.00 0.02 0.00 0.00 61.00 63.16 3h3o s PRO 97 Cb -0.16 -2.10 1.45 0.00 0.02 0.00 0.00 34.50 33.70 3h3o s PRO 97 CO 0.15 -0.67 2.00 0.44 -0.33 0.00 0.00 177.00 178.59 3h3o n ILE 98 N -1.05 0.00 0.00 2.83 -5.35 -0.38 -4.84 119.36 110.56 3h3o n ILE 98 Ca 0.10 -0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.56 3h3o n ILE 98 Cb 0.51 -0.36 0.00 0.00 -1.74 0.00 0.00 39.64 38.05 3h3o n ILE 98 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h3o n ALA 99 N -1.16 0.00 -1.14 -1.28 0.00 -1.26 -5.04 120.51 110.63 3h3o n ALA 99 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.26 3h3o n ALA 99 Cb 0.24 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.82 3h3o n ALA 99 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3h3o s ASN 100 N 0.00 3.68 0.31 0.00 0.01 -1.26 -4.79 114.94 112.89 3h3o s ASN 100 Ca 0.00 2.35 -0.24 0.00 -0.71 0.00 0.00 52.86 54.25 3h3o s ASN 100 Cb 0.00 -2.59 -0.10 0.00 0.41 0.00 0.00 41.25 38.98 3h3o s ASN 100 CO 0.00 -2.61 0.90 0.00 -1.51 0.00 0.00 177.10 173.89 3h3o s ALA 101 N -2.15 3.23 -0.22 0.60 0.00 0.31 -4.86 121.76 118.67 3h3o s ALA 101 Ca 0.73 0.44 -0.16 0.00 0.00 0.00 0.00 51.96 52.97 3h3o s ALA 101 Cb -0.28 -3.11 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 3h3o s ALA 101 CO 0.50 0.20 0.42 0.42 0.00 0.00 0.00 175.76 177.30 3h3o s ILE 102 N -1.65 5.17 0.67 0.00 1.01 -0.32 -1.21 121.20 124.88 3h3o s ILE 102 Ca 0.50 0.73 -0.11 0.00 0.00 0.00 0.00 60.65 61.77 3h3o s ILE 102 Cb -0.17 -3.75 -0.01 0.00 0.01 0.00 0.00 42.46 38.54 3h3o s ILE 102 CO 0.22 0.21 1.05 -0.69 0.00 0.00 0.00 174.94 175.74 3h3o s VAL 103 N 1.56 4.23 0.51 2.92 1.01 -0.83 -0.80 120.40 129.00 3h3o s VAL 103 Ca 0.19 0.73 0.29 0.00 0.00 0.00 0.00 61.98 63.19 3h3o s VAL 103 Cb -0.15 -3.54 0.33 0.00 0.00 0.00 0.00 36.38 33.02 3h3o s VAL 103 CO 0.09 -0.94 2.18 4.11 0.00 0.00 0.00 175.10 180.53 3h3o h TRP 104 N -0.59 0.00 -0.01 5.22 5.08 -1.85 -2.07 115.95 121.73 3h3o h TRP 104 Ca -0.44 0.00 -0.15 0.00 1.08 0.00 0.00 58.89 59.38 3h3o h TRP 104 Cb 1.20 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.35 3h3o h TRP 104 CO 0.63 0.05 -0.71 1.96 -1.28 0.00 0.00 178.44 179.10 3h3o h GLN 105 N 0.00 0.08 -6.82 0.12 4.20 -1.91 -3.41 115.11 107.36 3h3o h GLN 105 Ca -0.00 -0.07 -0.55 0.00 0.06 0.00 0.00 58.65 58.10 3h3o h GLN 105 Cb 0.16 0.01 0.10 0.00 0.30 0.00 0.00 27.48 28.05 3h3o h GLN 105 CO 0.01 0.75 0.75 0.45 -0.67 0.00 0.00 178.83 180.12 3h3o n SER 106 N -3.73 3.55 -0.84 1.46 2.88 -0.78 -4.88 113.62 111.29 3h3o n SER 106 Ca -0.02 1.19 0.08 0.00 -1.33 0.00 0.00 58.87 58.80 3h3o n SER 106 Cb 0.69 -1.57 0.16 0.00 -0.75 0.00 0.00 64.21 62.74 3h3o n SER 106 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3h3o n ARG 107 N 1.20 2.18 0.32 -1.46 5.12 -0.25 -4.58 116.66 119.20 3h3o n ARG 107 Ca 0.05 -1.98 0.19 0.00 -1.93 0.00 0.00 57.85 54.19 3h3o n ARG 107 Cb 0.37 -1.37 1.03 0.00 -1.16 0.00 0.00 32.46 31.34 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 3.14 0.00 -0.70 5.56 3.07 -1.93 -0.22 115.11 124.03 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 0.78 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.34 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 -3.15 3.82 -0.22 0.06 3.41 -1.26 -4.55 113.62 111.74 3h3o n SER 109 Ca -0.02 -2.04 0.00 0.00 -0.26 0.00 0.00 58.87 56.55 3h3o n SER 109 Cb 0.20 -0.48 0.12 0.00 -0.26 0.00 0.00 64.21 63.79 3h3o n SER 109 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3h3o h SER 110 N 4.07 0.37 -1.00 4.04 0.02 -1.38 -2.23 113.55 117.44 3h3o h SER 110 Ca 0.00 0.06 0.10 0.00 -0.84 0.00 0.00 61.79 61.11 3h3o h SER 110 Cb 0.98 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.45 3h3o h SER 110 CO 0.02 0.22 0.64 -0.65 -1.14 0.00 0.00 176.83 175.92 3h3o h PRO 111 N 0.52 1.04 -0.47 3.45 0.11 -1.82 0.15 132.00 134.98 3h3o h PRO 111 Ca 0.32 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.35 3h3o h PRO 111 Cb 0.34 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.19 3h3o h PRO 111 CO -0.27 0.69 0.21 0.82 -0.21 0.00 0.00 178.00 179.25 3h3o h ILE 112 N 1.07 1.19 -0.47 4.15 2.04 -1.75 -1.95 117.51 121.79 3h3o h ILE 112 Ca 0.47 -0.57 -0.11 0.00 1.00 0.00 0.00 64.86 65.65 3h3o h ILE 112 Cb 0.36 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 3h3o h ILE 112 CO -0.23 0.22 -0.16 0.00 0.00 0.00 0.00 178.15 177.98 3h3o h ALA 113 N 1.06 0.84 -0.82 1.87 0.00 -0.89 -2.84 119.26 118.48 3h3o h ALA 113 Ca 0.16 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3h3o h ALA 113 Cb 0.14 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3h3o h ALA 113 CO -0.02 0.65 0.42 -0.44 0.00 0.00 0.00 179.25 179.86 3h3o h ASP 114 N 0.79 1.03 -0.47 0.00 3.32 -0.54 -1.77 116.42 118.78 3h3o h ASP 114 Ca 0.12 -0.10 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 3h3o h ASP 114 Cb 0.70 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 3h3o h ASP 114 CO 0.05 0.85 0.15 -0.61 -1.72 0.00 0.00 179.24 177.96 3h3o h GLN 115 N 1.15 0.79 -0.31 3.56 5.75 -1.19 -1.16 115.11 123.70 3h3o h GLN 115 Ca 0.29 -0.14 -0.15 0.00 -0.15 0.00 0.00 58.65 58.49 3h3o h GLN 115 Cb 0.06 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.48 3h3o h GLN 115 CO -0.04 0.70 -0.40 -0.07 -2.65 0.00 0.00 178.83 176.36 3h3o h LEU 116 N 0.77 0.81 -0.62 -2.39 3.38 -1.11 -1.26 115.31 114.90 3h3o h LEU 116 Ca 0.18 -0.37 -0.11 0.00 0.09 0.00 0.00 57.88 57.66 3h3o h LEU 116 Cb 0.24 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3h3o h LEU 116 CO -0.01 1.12 -0.54 0.07 0.09 0.00 0.00 178.44 179.16 3h3o h LYS 117 N 0.62 0.00 -0.26 1.13 5.09 -1.13 -2.38 116.57 119.65 3h3o h LYS 117 Ca 0.05 0.00 -0.06 0.00 0.09 0.00 0.00 60.65 60.73 3h3o h LYS 117 Cb 0.96 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.28 3h3o h LYS 117 CO 0.09 0.54 -0.08 0.28 -2.09 0.00 0.00 179.45 178.19 3h3o h VAL 118 N 0.00 1.29 0.00 0.07 2.07 -1.02 -2.39 116.25 116.27 3h3o h VAL 118 Ca -0.01 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 66.39 3h3o h VAL 118 Cb 1.14 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.39 3h3o h VAL 118 CO 0.07 0.35 0.00 0.47 0.02 0.00 0.00 177.57 178.48 3h3o n ASP 119 N -4.51 0.78 -3.61 0.57 8.00 -0.49 -4.88 116.55 112.40 3h3o n ASP 119 Ca -0.04 -1.74 -0.25 0.00 0.71 0.00 0.00 54.79 53.47 3h3o n ASP 119 Cb 0.32 -0.39 0.04 0.00 -0.02 0.00 0.00 41.12 41.08 3h3o n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h3o n GLY 120 N 0.10 -0.82 0.57 0.44 0.00 -0.90 -4.94 105.19 99.64 3h3o n GLY 120 Ca 0.00 0.39 0.07 0.00 0.00 0.00 0.00 46.02 46.47 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 -4.02 0.11 0.05 1.61 8.25 -0.90 -4.76 115.22 115.56 3h3o n HIS 121 Ca -0.15 -0.10 -0.13 0.00 -0.26 0.00 0.00 57.72 57.07 3h3o n HIS 121 Cb 0.62 -0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.66 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 2.54 0.13 -0.37 1.59 2.02 -1.87 -1.87 112.91 115.08 3h3o h THR 122 Ca 0.00 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.19 3h3o h THR 122 Cb 0.59 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 3h3o h THR 122 CO 0.00 0.00 0.25 -0.33 0.37 0.00 0.00 175.52 175.81 3h3o h GLU 123 N -0.57 0.45 0.31 6.66 3.07 -1.97 -1.66 114.58 120.87 3h3o h GLU 123 Ca 0.05 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.87 3h3o h GLU 123 Cb 0.66 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.47 3h3o h GLU 123 CO -0.34 0.30 -0.15 1.98 -1.40 0.00 0.00 179.01 179.40 3h3o h MET 124 N 0.46 -0.40 -0.52 2.33 4.05 -1.79 -0.35 114.93 118.71 3h3o h MET 124 Ca 0.14 0.03 0.08 0.00 -0.28 0.00 0.00 59.70 59.67 3h3o h MET 124 Cb 0.01 0.09 -0.07 0.00 -0.80 0.00 0.00 31.60 30.84 3h3o h MET 124 CO -0.03 -0.06 0.13 0.82 0.23 0.00 0.00 176.91 178.00 3h3o h ILE 125 N -0.88 0.74 -0.26 1.77 1.08 -1.24 -0.69 117.51 118.02 3h3o h ILE 125 Ca -0.04 -0.10 0.02 0.00 -0.39 0.00 0.00 64.86 64.35 3h3o h ILE 125 Cb 0.52 0.44 -0.02 0.00 -3.07 0.00 0.00 36.82 34.68 3h3o h ILE 125 CO 0.07 0.05 0.11 -0.74 -0.69 0.00 0.00 178.15 176.95 3h3o h HIS 126 N 0.28 0.20 -0.01 1.37 2.76 -1.31 0.39 115.15 118.82 3h3o h HIS 126 Ca 0.26 0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.47 3h3o h HIS 126 Cb 0.34 -0.05 -0.04 0.00 1.55 0.00 0.00 27.41 29.21 3h3o h HIS 126 CO -0.21 0.10 -0.18 1.49 -1.30 0.00 0.00 177.93 177.83 3h3o h GLU 127 N 0.24 -0.28 -0.02 5.26 4.57 -0.16 -0.12 114.58 124.07 3h3o h GLU 127 Ca 0.11 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.30 3h3o h GLU 127 Cb 0.06 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.71 3h3o h GLU 127 CO -0.10 -0.18 -0.02 0.87 -1.18 0.00 0.00 179.01 178.40 3h3o h LYS 128 N -0.29 0.05 0.00 1.92 1.57 -0.89 -3.39 116.57 115.55 3h3o h LYS 128 Ca 0.06 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3h3o h LYS 128 Cb 0.37 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 3h3o h LYS 128 CO -0.18 0.49 -1.79 0.25 -0.57 0.00 0.00 179.45 177.64 3h3o n THR 129 N -4.83 0.00 -0.78 -0.16 -2.24 0.14 -1.95 114.28 104.46 3h3o n THR 129 Ca -0.08 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 3h3o n THR 129 Cb 0.25 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 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 1.32 0.84 3.92 3.38 0.00 -0.06 -4.67 105.19 109.92 3h3o n GLY 130 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 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 2.79 0.27 0.99 1.43 -1.26 -1.70 118.68 121.21 3h3o s LEU 131 Ca 0.00 -1.16 0.08 0.00 -1.03 0.00 0.00 54.13 52.02 3h3o s LEU 131 Cb 0.00 -1.30 -0.04 0.00 0.03 0.00 0.00 46.19 44.89 3h3o s LEU 131 CO 0.00 -1.11 0.13 0.68 0.23 0.00 0.00 176.35 176.28 3h3o s VAL 132 N -2.74 3.92 -0.23 -1.59 -7.23 -1.26 -3.40 120.40 107.86 3h3o s VAL 132 Ca 0.39 -1.61 -0.27 0.00 -1.81 0.00 0.00 61.98 58.68 3h3o s VAL 132 Cb -0.03 -3.15 0.00 0.00 0.56 0.00 0.00 36.38 33.76 3h3o s VAL 132 CO 0.24 -0.33 0.94 -0.63 -0.31 0.00 0.00 175.10 175.00 3h3o s ILE 133 N -2.24 4.76 0.01 -0.62 1.01 -1.26 -4.95 121.20 117.91 3h3o s ILE 133 Ca 0.33 1.81 -0.28 0.00 0.00 0.00 0.00 60.65 62.51 3h3o s ILE 133 Cb -0.07 -4.22 0.08 0.00 0.01 0.00 0.00 42.46 38.27 3h3o s ILE 133 CO 0.23 -0.13 0.73 -0.62 0.00 0.00 0.00 174.94 175.15 3h3o s ASP 134 N 1.27 -0.54 0.24 3.58 2.15 -1.26 -5.00 116.67 117.10 3h3o s ASP 134 Ca 0.40 0.31 0.20 0.00 0.43 0.00 0.00 52.55 53.89 3h3o s ASP 134 Cb -0.15 0.50 0.94 0.00 -0.30 0.00 0.00 42.92 43.91 3h3o s ASP 134 CO 0.07 -0.70 1.61 0.00 -0.17 0.00 0.00 175.17 175.98 3h3o n ALA 135 N 0.26 1.37 -0.19 3.66 0.00 -1.26 -2.98 120.51 121.37 3h3o n ALA 135 Ca -0.15 0.11 -0.02 0.00 0.00 0.00 0.00 53.44 53.38 3h3o n ALA 135 Cb 0.61 -1.32 0.08 0.00 0.00 0.00 0.00 19.45 18.82 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 0.48 -4.20 0.00 3.20 -1.81 -3.45 116.97 111.20 3h3o h TYR 136 Ca 0.00 0.03 -0.49 0.00 3.14 0.00 0.00 58.73 61.41 3h3o h TYR 136 Cb 0.19 -0.13 0.07 0.00 1.54 0.00 0.00 36.73 38.40 3h3o h TYR 136 CO 0.00 0.19 0.34 -0.06 -1.64 0.00 0.00 178.16 176.99 3h3o s PHE 137 N -6.11 3.35 0.27 -3.82 0.08 -1.16 -4.71 117.98 105.88 3h3o s PHE 137 Ca -0.13 0.95 -0.04 0.00 0.12 0.00 0.00 56.93 57.83 3h3o s PHE 137 Cb 0.16 -2.90 0.33 0.00 -0.57 0.00 0.00 43.02 40.03 3h3o s PHE 137 CO 0.74 -0.98 1.90 0.77 -0.10 0.00 0.00 175.22 177.56 3h3o h SER 138 N -0.44 1.02 -0.70 1.36 0.02 -1.64 -3.33 113.55 109.83 3h3o h SER 138 Ca -0.45 -0.07 0.09 0.00 -0.84 0.00 0.00 61.79 60.52 3h3o h SER 138 Cb 1.24 -0.26 -0.11 0.00 0.14 0.00 0.00 62.40 63.41 3h3o h SER 138 CO 0.63 0.80 -0.48 0.00 -1.14 0.00 0.00 176.83 176.63 3h3o h ALA 139 N 1.37 -0.39 0.00 3.77 0.00 -0.80 -0.02 119.26 123.20 3h3o h ALA 139 Ca 0.30 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3h3o h ALA 139 Cb -0.02 1.09 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3h3o h ALA 139 CO -0.05 -0.87 0.00 1.79 0.00 0.00 0.00 179.25 180.12 3h3o h THR 140 N -0.18 0.00 -0.04 0.00 1.35 -1.86 -2.51 112.91 109.68 3h3o h THR 140 Ca 0.18 -0.45 -0.23 0.00 -0.55 0.00 0.00 66.41 65.36 3h3o h THR 140 Cb 0.54 1.36 0.01 0.00 -1.73 0.00 0.00 68.15 68.33 3h3o h THR 140 CO -0.77 0.00 -0.91 0.11 -0.25 0.00 0.00 175.52 173.70 3h3o h LYS 141 N 0.00 0.56 -0.29 4.72 1.57 -1.18 -1.71 116.57 120.24 3h3o h LYS 141 Ca 0.00 -0.55 -0.15 0.00 -1.87 0.00 0.00 60.65 58.08 3h3o h LYS 141 Cb 0.52 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 3h3o h LYS 141 CO 0.00 1.18 -0.43 0.28 -0.57 0.00 0.00 179.45 179.90 3h3o h VAL 142 N 0.34 1.29 -0.70 0.50 2.07 -1.00 -2.15 116.25 116.60 3h3o h VAL 142 Ca -0.08 -1.62 -0.01 0.00 0.82 0.00 0.00 66.70 65.82 3h3o h VAL 142 Cb 1.54 1.53 -0.03 0.00 -1.52 0.00 0.00 31.29 32.80 3h3o h VAL 142 CO 0.17 0.52 0.41 -0.09 0.02 0.00 0.00 177.57 178.60 3h3o h ARG 143 N 0.59 0.95 -0.11 1.57 9.65 -1.40 -2.15 114.38 123.48 3h3o h ARG 143 Ca 0.04 -0.10 0.03 0.00 -1.10 0.00 0.00 59.98 58.85 3h3o h ARG 143 Cb 0.98 -0.20 -0.03 0.00 -1.39 0.00 0.00 29.97 29.34 3h3o h ARG 143 CO 0.09 0.69 -0.05 2.35 2.80 0.00 0.00 179.97 185.85 3h3o h TRP 144 N 0.95 -0.13 -0.66 2.20 7.01 -1.02 -1.27 115.95 123.04 3h3o h TRP 144 Ca 0.25 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.24 3h3o h TRP 144 Cb -0.01 0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.10 3h3o h TRP 144 CO -0.01 -0.09 0.35 -0.07 -2.79 0.00 0.00 178.44 175.83 3h3o h LEU 145 N -0.04 0.82 -0.59 0.65 3.38 -1.17 -0.07 115.31 118.29 3h3o h LEU 145 Ca 0.06 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 3h3o h LEU 145 Cb 0.14 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3h3o h LEU 145 CO -0.14 0.67 -0.59 -0.07 0.09 0.00 0.00 178.44 178.41 3h3o h LEU 146 N 0.92 0.43 -0.16 1.67 3.38 -1.05 -0.59 115.31 119.91 3h3o h LEU 146 Ca 0.23 -0.24 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 3h3o h LEU 146 Cb 0.05 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3h3o h LEU 146 CO -0.04 0.92 -0.49 0.44 0.09 0.00 0.00 178.44 179.36 3h3o h ASP 147 N 0.29 0.71 0.16 -0.43 5.19 -0.82 -3.35 116.42 118.17 3h3o h ASP 147 Ca -0.00 -0.59 0.00 0.00 -0.62 0.00 0.00 57.03 55.81 3h3o h ASP 147 Cb 1.11 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 40.41 3h3o h ASP 147 CO 0.10 1.18 -0.96 0.59 -3.12 0.00 0.00 179.24 177.03 3h3o n ASN 148 N -4.19 0.78 -4.55 6.45 3.02 -0.08 -4.86 115.26 111.83 3h3o n ASN 148 Ca -0.07 -0.68 -0.39 0.00 -0.03 0.00 0.00 54.58 53.42 3h3o n ASN 148 Cb 0.59 0.88 -0.11 0.00 -0.61 0.00 0.00 39.78 40.53 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 -3.06 5.20 0.14 2.41 -1.09 -0.23 -5.04 121.20 119.53 3h3o s ILE 149 Ca 0.07 -0.01 -0.32 0.00 -2.23 0.00 0.00 60.65 58.15 3h3o s ILE 149 Cb 0.16 -3.55 -0.12 0.00 -1.58 0.00 0.00 42.46 37.37 3h3o s ILE 149 CO 0.83 0.16 1.74 -0.62 -1.23 0.00 0.00 174.94 175.81 3h3o n GLU 150 N 5.06 2.57 0.00 2.79 4.71 -1.26 -1.93 120.64 132.58 3h3o n GLU 150 Ca -0.14 0.93 0.00 0.00 -0.01 0.00 0.00 57.16 57.94 3h3o n GLU 150 Cb 0.51 -2.77 0.00 0.00 -1.01 0.00 0.00 31.44 28.17 3h3o n GLU 150 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3h3o n GLY 151 N 3.94 2.59 0.35 0.62 0.00 -1.26 -4.93 105.19 106.50 3h3o n GLY 151 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.04 3h3o n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3o h ALA 152 N 0.00 -0.68 -0.77 4.61 0.00 -1.66 -0.56 119.26 120.20 3h3o h ALA 152 Ca 0.00 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 54.90 3h3o h ALA 152 Cb 0.00 0.45 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 3h3o h ALA 152 CO 0.00 -0.92 0.41 0.37 0.00 0.00 0.00 179.25 179.11 3h3o h GLN 153 N -0.67 0.65 -0.28 0.00 5.75 -1.78 0.11 115.11 118.89 3h3o h GLN 153 Ca -0.02 -0.04 -0.06 0.00 -0.15 0.00 0.00 58.65 58.38 3h3o h GLN 153 Cb 0.61 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.00 3h3o h GLN 153 CO -0.05 0.43 -0.07 1.49 -2.65 0.00 0.00 178.83 177.98 3h3o h GLU 154 N 0.67 0.55 -0.05 1.69 4.81 -1.90 0.84 114.58 121.20 3h3o h GLU 154 Ca 0.38 -0.21 -0.05 0.00 -0.13 0.00 0.00 59.36 59.35 3h3o h GLU 154 Cb 0.40 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 3h3o h GLU 154 CO -0.27 0.75 -0.20 0.87 -0.73 0.00 0.00 179.01 179.42 3h3o h LYS 155 N 0.31 0.08 0.17 1.92 1.57 -0.50 0.13 116.57 120.25 3h3o h LYS 155 Ca 0.07 -0.02 -0.29 0.00 -1.87 0.00 0.00 60.65 58.54 3h3o h LYS 155 Cb 0.55 -0.01 0.03 0.00 0.08 0.00 0.00 32.23 32.88 3h3o h LYS 155 CO 0.03 0.28 -1.26 0.00 -0.57 0.00 0.00 179.45 177.93 3h3o h ALA 156 N 1.72 -0.07 -0.06 3.86 0.00 -0.63 0.29 119.26 124.37 3h3o h ALA 156 Ca 0.01 -0.79 -0.04 0.00 0.00 0.00 0.00 54.91 54.10 3h3o h ALA 156 Cb 0.41 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3h3o h ALA 156 CO 0.03 0.64 -0.15 -0.44 0.00 0.00 0.00 179.25 179.32 3h3o h ASP 157 N 0.14 0.09 -0.02 0.00 3.32 -0.49 -1.10 116.42 118.36 3h3o h ASP 157 Ca -0.20 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.83 3h3o h ASP 157 Cb 1.95 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.48 3h3o h ASP 157 CO 0.24 0.25 0.00 0.59 -1.72 0.00 0.00 179.24 178.60 3h3o n ASN 158 N -4.31 0.51 -0.15 6.45 4.13 0.00 -4.93 115.26 116.97 3h3o n ASN 158 Ca -0.02 -1.27 -0.02 0.00 1.68 0.00 0.00 54.58 54.96 3h3o n ASN 158 Cb 0.25 -0.01 -0.01 0.00 -1.54 0.00 0.00 39.78 38.47 3h3o n ASN 158 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3h3o n GLY 159 N 1.01 0.47 0.04 7.41 0.00 -0.42 -4.96 105.19 108.75 3h3o n GLY 159 Ca 0.20 -0.97 0.11 0.00 0.00 0.00 0.00 46.02 45.36 3h3o n GLY 159 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3o n GLU 160 N -2.59 0.56 -4.16 1.61 1.02 0.10 -4.97 120.64 112.22 3h3o n GLU 160 Ca -0.02 -0.07 -0.32 0.00 -0.02 0.00 0.00 57.16 56.74 3h3o n GLU 160 Cb 0.15 -1.62 -0.08 0.00 -0.02 0.00 0.00 31.44 29.87 3h3o n GLU 160 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3h3o s LEU 161 N -4.61 3.68 0.01 -4.62 1.43 -1.20 -1.73 118.68 111.64 3h3o s LEU 161 Ca -0.03 0.01 0.08 0.00 -1.03 0.00 0.00 54.13 53.16 3h3o s LEU 161 Cb 0.13 -2.22 -0.02 0.00 0.03 0.00 0.00 46.19 44.11 3h3o s LEU 161 CO 0.86 0.24 -0.25 -0.76 0.23 0.00 0.00 176.35 176.67 3h3o s LEU 162 N -1.90 2.10 0.07 1.79 1.43 0.47 -4.23 118.68 118.42 3h3o s LEU 162 Ca 0.24 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.86 3h3o s LEU 162 Cb -0.12 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 3h3o s LEU 162 CO 0.15 0.27 0.11 0.12 0.23 0.00 0.00 176.35 177.23 3h3o s PHE 163 N -0.68 3.27 -0.20 0.29 5.36 -0.25 -1.26 117.98 124.50 3h3o s PHE 163 Ca 0.10 0.12 -0.29 0.00 -0.96 0.00 0.00 56.93 55.90 3h3o s PHE 163 Cb -0.09 -1.66 0.13 0.00 -0.34 0.00 0.00 43.02 41.06 3h3o s PHE 163 CO 0.00 0.54 1.05 0.20 -1.46 0.00 0.00 175.22 175.56 3h3o s GLY 164 N -2.39 -0.18 0.77 13.12 0.00 -0.71 -4.47 107.32 113.45 3h3o s GLY 164 Ca 0.30 2.31 -0.07 0.00 0.00 0.00 0.00 44.72 47.26 3h3o s GLY 164 CO 0.23 1.26 1.08 -0.51 0.00 0.00 0.00 173.10 175.16 3h3o s THR 165 N -0.74 2.17 0.40 0.90 -4.23 -1.26 -1.98 115.64 110.90 3h3o s THR 165 Ca 0.01 -0.33 0.15 0.00 -1.18 0.00 0.00 61.69 60.34 3h3o s THR 165 Cb -0.02 -2.85 0.36 0.00 1.34 0.00 0.00 72.50 71.33 3h3o s THR 165 CO -0.02 0.00 1.88 0.40 -0.54 0.00 0.00 174.62 176.34 3h3o h ILE 166 N -0.82 0.76 -0.59 2.99 1.08 -1.81 -1.60 117.51 117.53 3h3o h ILE 166 Ca -0.42 -0.17 -0.07 0.00 -0.39 0.00 0.00 64.86 63.82 3h3o h ILE 166 Cb 1.28 0.23 -0.02 0.00 -3.07 0.00 0.00 36.82 35.23 3h3o h ILE 166 CO 0.47 0.09 0.09 -2.24 -0.69 0.00 0.00 178.15 175.87 3h3o h ASP 167 N 0.49 0.90 -0.09 1.72 2.03 -1.93 -1.32 116.42 118.22 3h3o h ASP 167 Ca 0.43 -0.20 -0.18 0.00 -0.73 0.00 0.00 57.03 56.35 3h3o h ASP 167 Cb 0.93 -0.24 -0.00 0.00 -0.83 0.00 0.00 39.33 39.20 3h3o h ASP 167 CO -0.17 0.91 -0.60 -1.28 -1.03 0.00 0.00 179.24 177.07 3h3o h SER 168 N 0.89 0.79 -0.25 4.15 0.87 -1.47 -2.64 113.55 115.89 3h3o h SER 168 Ca 0.18 -0.44 -0.00 0.00 -1.23 0.00 0.00 61.79 60.29 3h3o h SER 168 Cb 0.40 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 3h3o h SER 168 CO 0.01 1.21 0.14 -0.25 -0.53 0.00 0.00 176.83 177.40 3h3o h TRP 169 N 0.52 0.34 -0.38 2.24 -0.00 -1.08 -1.86 115.95 115.73 3h3o h TRP 169 Ca -0.00 -0.01 -0.02 0.00 -0.00 0.00 0.00 58.89 58.86 3h3o h TRP 169 Cb 1.19 -0.11 -0.02 0.00 -0.00 0.00 0.00 29.16 30.22 3h3o h TRP 169 CO 0.06 0.29 0.15 -0.07 -0.00 0.00 0.00 178.44 178.87 3h3o h LEU 170 N 0.29 0.53 -1.12 0.65 3.38 -1.27 -1.64 115.31 116.12 3h3o h LEU 170 Ca 0.09 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 3h3o h LEU 170 Cb 0.06 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3h3o h LEU 170 CO -0.01 0.56 -0.12 0.58 0.09 0.00 0.00 178.44 179.54 3h3o h VAL 171 N 0.46 1.22 -0.26 1.22 2.07 -1.45 0.27 116.25 119.79 3h3o h VAL 171 Ca 0.13 -0.99 -0.07 0.00 0.82 0.00 0.00 66.70 66.59 3h3o h VAL 171 Cb 0.20 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3h3o h VAL 171 CO -0.01 0.32 -0.14 -0.25 0.02 0.00 0.00 177.57 177.52 3h3o h TRP 172 N 0.44 0.46 -0.02 1.57 2.91 -1.03 -1.76 115.95 118.53 3h3o h TRP 172 Ca 0.08 -0.07 -0.03 0.00 1.13 0.00 0.00 58.89 60.01 3h3o h TRP 172 Cb 0.47 -0.12 0.00 0.00 -0.51 0.00 0.00 29.16 29.00 3h3o h TRP 172 CO 0.01 0.56 -0.10 0.87 -1.03 0.00 0.00 178.44 178.75 3h3o h LYS 173 N 0.40 0.10 -0.12 2.65 1.79 -0.19 0.33 116.57 121.52 3h3o h LYS 173 Ca 0.07 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3h3o h LYS 173 Cb 0.48 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.14 3h3o h LYS 173 CO 0.03 0.76 0.08 -0.07 -1.08 0.00 0.00 179.45 179.17 3h3o h LEU 174 N -0.54 0.13 -2.93 2.94 3.38 -0.45 -2.00 115.31 115.84 3h3o h LEU 174 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3h3o h LEU 174 Cb 0.78 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.50 3h3o h LEU 174 CO 0.02 0.09 0.00 0.35 0.09 0.00 0.00 178.44 178.99 3h3o n THR 175 N -4.52 1.33 -3.88 0.22 -2.24 -0.67 -1.33 114.28 103.18 3h3o n THR 175 Ca -0.01 -1.10 -0.34 0.00 -2.27 0.00 0.00 64.05 60.33 3h3o n THR 175 Cb 0.09 0.35 0.01 0.00 -2.10 0.00 0.00 70.33 68.68 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 1.18 -3.36 0.00 3.42 -0.08 -0.75 -1.80 116.55 115.16 3h3o n ASP 176 Ca 0.23 -1.10 0.00 0.00 -1.51 0.00 0.00 54.79 52.41 3h3o n ASP 176 Cb 0.69 -2.78 0.00 0.00 2.34 0.00 0.00 41.12 41.36 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 -1.91 0.47 0.09 0.27 0.00 0.11 -4.90 105.19 99.33 3h3o n GLY 177 Ca -0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.82 3h3o n GLY 177 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3h3o h GLN 178 N 1.25 0.00 -4.45 1.61 1.08 -1.58 -3.45 115.11 109.57 3h3o h GLN 178 Ca 0.00 0.00 -0.56 0.00 -1.45 0.00 0.00 58.65 56.64 3h3o h GLN 178 Cb 0.19 0.00 -0.36 0.00 -0.05 0.00 0.00 27.48 27.26 3h3o h GLN 178 CO 0.00 0.70 -0.82 0.08 -0.95 0.00 0.00 178.83 177.84 3h3o s VAL 179 N -2.81 1.27 -0.41 -0.54 1.01 -1.26 -5.08 120.40 112.58 3h3o s VAL 179 Ca 0.01 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.54 3h3o s VAL 179 Cb 0.09 -1.23 0.11 0.00 0.00 0.00 0.00 36.38 35.35 3h3o s VAL 179 CO 0.79 0.41 0.17 -2.28 0.00 0.00 0.00 175.10 174.19 3h3o s HIS 180 N 1.50 3.62 0.14 5.22 5.04 -1.26 -3.85 115.29 125.70 3h3o s HIS 180 Ca 0.03 -2.70 -0.05 0.00 -1.54 0.00 0.00 55.06 50.80 3h3o s HIS 180 Cb -0.13 -3.09 -0.03 0.00 0.04 0.00 0.00 32.58 29.37 3h3o s HIS 180 CO -0.08 -0.94 0.15 0.54 -2.34 0.00 0.00 174.74 172.07 3h3o s VAL 181 N 0.88 0.09 0.15 0.89 0.11 -1.26 -2.42 120.40 118.84 3h3o s VAL 181 Ca 0.10 -1.66 -0.10 0.00 -2.93 0.00 0.00 61.98 57.39 3h3o s VAL 181 Cb -0.21 -1.91 -0.00 0.00 -1.53 0.00 0.00 36.38 32.73 3h3o s VAL 181 CO -0.05 -0.43 0.30 0.28 -3.33 0.00 0.00 175.10 171.87 3h3o s THR 182 N -4.00 0.08 0.36 5.04 -1.32 -0.50 -4.09 115.64 111.21 3h3o s THR 182 Ca 0.20 -1.24 0.08 0.00 -1.21 0.00 0.00 61.69 59.51 3h3o s THR 182 Cb 0.06 -1.69 -0.02 0.00 -1.51 0.00 0.00 72.50 69.33 3h3o s THR 182 CO -0.00 -0.34 0.32 1.51 -2.21 0.00 0.00 174.62 173.90 3h3o s ASP 183 N -2.93 5.20 0.16 8.08 -4.77 -1.26 -0.94 116.67 120.22 3h3o s ASP 183 Ca 0.13 -0.59 -0.23 0.00 -3.30 0.00 0.00 52.55 48.57 3h3o s ASP 183 Cb 0.03 -0.83 0.06 0.00 -1.09 0.00 0.00 42.92 41.09 3h3o s ASP 183 CO -0.03 -0.46 1.61 1.88 0.70 0.00 0.00 175.17 178.87 3h3o h TYR 184 N 1.17 -0.83 -0.69 2.11 0.05 -1.63 -0.51 116.97 116.66 3h3o h TYR 184 Ca -0.43 0.05 0.10 0.00 0.05 0.00 0.00 58.73 58.50 3h3o h TYR 184 Cb 1.26 0.42 -0.08 0.00 1.01 0.00 0.00 36.73 39.34 3h3o h TYR 184 CO 0.53 -0.37 0.31 0.66 -1.05 0.00 0.00 178.16 178.24 3h3o h SER 185 N -0.25 0.35 -0.21 3.88 4.64 -1.83 -0.63 113.55 119.51 3h3o h SER 185 Ca 0.17 0.08 -0.19 0.00 -0.47 0.00 0.00 61.79 61.37 3h3o h SER 185 Cb 0.52 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3h3o h SER 185 CO -0.51 0.19 -0.61 0.78 -0.87 0.00 0.00 176.83 175.81 3h3o h ASN 186 N 0.51 0.92 -0.45 4.97 2.35 -1.81 -3.24 115.58 118.84 3h3o h ASN 186 Ca 0.35 -0.52 0.01 0.00 -0.55 0.00 0.00 56.30 55.58 3h3o h ASN 186 Cb 0.43 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 3h3o h ASN 186 CO -0.31 1.32 0.30 0.00 -1.65 0.00 0.00 177.43 177.08 3h3o h ALA 187 N 0.69 0.57 -0.02 -0.83 0.00 -0.44 -2.26 119.26 116.97 3h3o h ALA 187 Ca -0.00 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3h3o h ALA 187 Cb 1.22 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 3h3o h ALA 187 CO 0.13 0.01 0.09 0.66 0.00 0.00 0.00 179.25 180.15 3h3o h SER 188 N 0.60 0.00 -0.07 0.00 4.64 -1.16 -1.45 113.55 116.11 3h3o h SER 188 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 3h3o h SER 188 Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 3h3o h SER 188 CO -0.04 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.46 3h3o n ARG 189 N -3.19 1.89 0.13 4.77 5.12 -0.85 -4.10 116.66 120.43 3h3o n ARG 189 Ca -0.02 -1.30 0.07 0.00 -1.93 0.00 0.00 57.85 54.66 3h3o n ARG 189 Cb 0.16 -1.46 0.03 0.00 -1.16 0.00 0.00 32.46 30.03 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 3.03 0.35 -0.22 0.55 1.35 -1.30 -3.31 112.91 113.37 3h3o h THR 190 Ca 0.00 -1.56 -0.09 0.00 -0.55 0.00 0.00 66.41 64.21 3h3o h THR 190 Cb 0.65 2.01 -0.04 0.00 -1.73 0.00 0.00 68.15 69.04 3h3o h THR 190 CO 0.00 0.20 -0.09 0.80 -0.25 0.00 0.00 175.52 176.19 3h3o n MET 191 N -2.99 -0.45 0.00 4.72 1.56 -1.26 -0.06 117.12 118.65 3h3o n MET 191 Ca -0.00 0.58 0.00 0.00 -0.27 0.00 0.00 57.70 58.01 3h3o n MET 191 Cb 0.66 -4.26 0.00 0.00 2.15 0.00 0.00 33.22 31.77 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 -0.52 1.26 -4.42 -0.89 4.77 -1.26 -4.85 117.00 111.09 3h3o n LEU 192 Ca -0.05 -1.26 -0.33 0.00 -0.03 0.00 0.00 56.01 54.35 3h3o n LEU 192 Cb 0.18 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.13 3h3o n LEU 192 CO 0.07 0.32 -0.46 -0.47 -1.33 0.00 0.00 177.39 175.51 3h3o s TYR 193 N -0.34 2.71 -0.62 -1.77 5.04 -1.26 -1.48 117.35 119.63 3h3o s TYR 193 Ca 0.00 -0.39 -0.23 0.00 -2.44 0.00 0.00 57.07 54.01 3h3o s TYR 193 Cb 0.00 -1.70 0.06 0.00 0.35 0.00 0.00 41.96 40.67 3h3o s TYR 193 CO 0.00 0.00 0.94 1.21 -1.34 0.00 0.00 175.55 176.36 3h3o s ASN 194 N -0.29 6.22 0.00 4.32 3.84 0.18 -4.20 114.94 125.01 3h3o s ASN 194 Ca 0.02 -0.81 0.15 0.00 0.21 0.00 0.00 52.86 52.43 3h3o s ASN 194 Cb -0.13 -2.42 0.91 0.00 -0.55 0.00 0.00 41.25 39.06 3h3o s ASN 194 CO 0.03 -1.35 1.34 2.30 -2.79 0.00 0.00 177.10 176.62 3h3o n ILE 195 N 5.98 0.04 -0.10 -5.21 -5.35 -0.82 -0.78 119.36 113.12 3h3o n ILE 195 Ca -0.03 0.01 -0.14 0.00 -0.27 0.00 0.00 62.75 62.33 3h3o n ILE 195 Cb 0.46 -0.77 -0.09 0.00 -1.74 0.00 0.00 39.64 37.49 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 -1.02 0.00 1.12 4.28 8.25 -1.26 -4.47 115.22 122.11 3h3o n HIS 196 Ca 0.11 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.69 3h3o n HIS 196 Cb 0.06 -0.78 0.17 0.00 1.12 0.00 0.00 29.99 30.55 3h3o n HIS 196 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3h3o n LYS 197 N -3.08 1.34 -3.59 -0.41 5.02 -1.19 -4.99 118.16 111.26 3h3o n LYS 197 Ca -0.36 -1.01 -0.24 0.00 -2.02 0.00 0.00 58.31 54.68 3h3o n LYS 197 Cb 0.89 -1.48 0.05 0.00 -0.02 0.00 0.00 35.03 34.46 3h3o n LYS 197 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3h3o n LEU 198 N 0.05 -3.58 -3.49 -0.35 4.77 0.04 -5.01 117.00 109.43 3h3o n LEU 198 Ca 0.12 -0.88 -0.12 0.00 -0.03 0.00 0.00 56.01 55.10 3h3o n LEU 198 Cb 0.45 -2.68 -0.03 0.00 -2.33 0.00 0.00 43.42 38.83 3h3o n LEU 198 CO 0.24 0.36 0.33 -1.83 -1.33 0.00 0.00 177.39 175.17 3h3o s GLU 199 N -5.62 1.19 0.28 3.23 -1.05 -1.17 -4.99 118.70 110.57 3h3o s GLU 199 Ca 0.30 -0.45 -0.30 0.00 -0.15 0.00 0.00 54.97 54.37 3h3o s GLU 199 Cb -0.08 0.54 -0.11 0.00 -0.44 0.00 0.00 34.13 34.05 3h3o s GLU 199 CO 0.82 -0.49 1.49 -1.58 0.95 0.00 0.00 175.26 176.45 3h3o s TRP 200 N -3.44 2.89 -0.29 4.83 0.52 -1.26 -0.65 118.94 121.54 3h3o s TRP 200 Ca -0.00 0.97 -0.27 0.00 0.02 0.00 0.00 56.10 56.82 3h3o s TRP 200 Cb -0.00 -3.92 0.01 0.00 -1.15 0.00 0.00 33.47 28.41 3h3o s TRP 200 CO -0.10 -2.97 0.95 0.34 0.02 0.00 0.00 176.95 175.18 3h3o s ASP 201 N 0.33 6.86 0.37 2.95 2.15 -0.55 -4.80 116.67 123.98 3h3o s ASP 201 Ca 0.60 0.97 0.11 0.00 0.43 0.00 0.00 52.55 54.66 3h3o s ASP 201 Cb -0.44 -2.49 0.73 0.00 -0.30 0.00 0.00 42.92 40.43 3h3o s ASP 201 CO 0.47 -0.72 1.85 1.56 -0.17 0.00 0.00 175.17 178.16 3h3o h GLN 202 N 7.95 0.08 -0.08 4.34 1.08 -1.91 -2.48 115.11 124.08 3h3o h GLN 202 Ca -0.22 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 56.94 3h3o h GLN 202 Cb 1.08 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.50 3h3o h GLN 202 CO 0.96 0.38 0.00 0.93 -0.95 0.00 0.00 178.83 180.15 3h3o h GLU 203 N 0.07 0.15 -0.64 1.46 5.08 -1.98 -2.06 114.58 116.66 3h3o h GLU 203 Ca 0.01 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 3h3o h GLU 203 Cb 0.58 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 3h3o h GLU 203 CO 0.04 0.41 0.05 0.82 -1.00 0.00 0.00 179.01 179.33 3h3o h ILE 204 N -0.13 1.26 0.35 3.13 2.04 -1.93 -0.59 117.51 121.65 3h3o h ILE 204 Ca 0.02 -1.10 -0.02 0.00 1.00 0.00 0.00 64.86 64.76 3h3o h ILE 204 Cb 0.34 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 3h3o h ILE 204 CO 0.00 0.41 -0.17 -0.07 0.00 0.00 0.00 178.15 178.32 3h3o h LEU 205 N 1.01 -0.40 -1.79 1.44 3.38 -1.42 0.74 115.31 118.26 3h3o h LEU 205 Ca 0.19 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 3h3o h LEU 205 Cb 0.51 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 3h3o h LEU 205 CO 0.02 -0.28 -0.08 0.44 0.09 0.00 0.00 178.44 178.64 3h3o h ASP 206 N -0.48 0.03 0.67 -0.43 5.19 -1.33 0.39 116.42 120.46 3h3o h ASP 206 Ca -0.05 -0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.22 3h3o h ASP 206 Cb 0.37 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.85 3h3o h ASP 206 CO 0.08 0.12 -0.64 0.25 -3.12 0.00 0.00 179.24 175.93 3h3o h LEU 207 N 0.04 0.00 -2.05 1.55 5.85 -0.52 -3.01 115.31 117.16 3h3o h LEU 207 Ca 0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3h3o h LEU 207 Cb 0.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.19 3h3o h LEU 207 CO 0.01 0.64 0.00 0.18 -0.34 0.00 0.00 178.44 178.93 3h3o n LEU 208 N -3.74 2.94 -3.61 2.25 4.77 0.20 -4.98 117.00 114.83 3h3o n LEU 208 Ca -0.01 -1.27 -0.22 0.00 -0.03 0.00 0.00 56.01 54.47 3h3o n LEU 208 Cb 0.64 -0.11 0.07 0.00 -2.33 0.00 0.00 43.42 41.68 3h3o n LEU 208 CO 0.42 0.58 0.13 -3.20 -1.33 0.00 0.00 177.39 173.99 3h3o n ASN 209 N 1.18 -3.87 -4.33 -1.43 5.15 0.12 -4.87 115.26 107.20 3h3o n ASN 209 Ca 0.14 -0.65 -0.38 0.00 -0.60 0.00 0.00 54.58 53.09 3h3o n ASN 209 Cb 0.52 -4.73 -0.12 0.00 -0.53 0.00 0.00 39.78 34.92 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 -3.39 4.06 0.20 -1.44 1.01 -0.18 -5.01 121.20 116.46 3h3o s ILE 210 Ca 0.31 -0.85 -0.32 0.00 0.00 0.00 0.00 60.65 59.79 3h3o s ILE 210 Cb -0.14 -3.20 -0.12 0.00 0.01 0.00 0.00 42.46 39.01 3h3o s ILE 210 CO 0.76 -0.07 1.69 -2.65 0.00 0.00 0.00 174.94 174.67 3h3o n PRO 211 N 4.88 2.67 0.29 2.79 -0.02 -1.26 -4.62 135.00 139.73 3h3o n PRO 211 Ca -0.13 0.96 0.13 0.00 -2.02 0.00 0.00 63.50 62.44 3h3o n PRO 211 Cb 0.47 -2.79 0.84 0.00 -0.02 0.00 0.00 33.50 31.99 3h3o n PRO 211 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3h3o h SER 212 N 6.53 0.00 0.00 2.55 4.64 -1.96 -2.66 113.55 122.65 3h3o h SER 212 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 3h3o h SER 212 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3h3o h SER 212 CO 0.94 0.01 0.09 0.77 -0.87 0.00 0.00 176.83 177.76 3h3o h SER 213 N 0.00 0.00 1.90 4.97 4.64 -1.91 0.26 113.55 123.42 3h3o h SER 213 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3h3o h SER 213 Cb 0.01 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3h3o h SER 213 CO 0.00 0.00 -0.04 0.24 -0.87 0.00 0.00 176.83 176.16 3h3o h MET 214 N 0.00 0.00 -6.74 4.77 2.86 -1.64 -3.47 114.93 110.70 3h3o h MET 214 Ca 0.00 0.00 -0.51 0.00 -2.06 0.00 0.00 59.70 57.13 3h3o h MET 214 Cb 0.18 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.84 3h3o h MET 214 CO 0.00 0.04 0.45 -0.51 1.06 0.00 0.00 176.91 177.96 3h3o s LEU 215 N -6.23 4.55 0.72 1.22 1.43 0.08 -1.09 118.68 119.35 3h3o s LEU 215 Ca 0.06 2.15 -0.10 0.00 -1.03 0.00 0.00 54.13 55.21 3h3o s LEU 215 Cb 0.05 -3.62 0.04 0.00 0.03 0.00 0.00 46.19 42.70 3h3o s LEU 215 CO 0.67 -0.12 1.07 -2.16 0.23 0.00 0.00 176.35 176.05 3h3o s PRO 216 N -1.02 2.51 0.20 1.29 0.04 -1.26 -5.00 135.00 131.76 3h3o s PRO 216 Ca 0.46 0.17 -0.29 0.00 0.04 0.00 0.00 61.00 61.37 3h3o s PRO 216 Cb -0.30 -2.07 -0.08 0.00 0.04 0.00 0.00 34.50 32.09 3h3o s PRO 216 CO 0.37 -1.17 0.92 -2.00 0.04 0.00 0.00 177.00 175.16 3h3o s GLU 217 N -5.34 4.78 -0.29 4.56 2.12 -1.02 -4.82 118.70 118.70 3h3o s GLU 217 Ca 0.59 1.43 -0.11 0.00 0.36 0.00 0.00 54.97 57.24 3h3o s GLU 217 Cb -0.11 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 3h3o s GLU 217 CO 0.49 0.45 0.18 0.08 -0.54 0.00 0.00 175.26 175.92 3h3o s VAL 218 N -0.90 5.11 0.47 3.70 1.01 -1.26 -1.42 120.40 127.12 3h3o s VAL 218 Ca 0.42 0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.43 3h3o s VAL 218 Cb -0.25 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 3h3o s VAL 218 CO 0.31 0.20 0.04 -0.54 0.00 0.00 0.00 175.10 175.10 3h3o s LYS 219 N 1.72 2.10 1.18 2.72 1.02 -0.11 -4.92 119.74 123.44 3h3o s LYS 219 Ca 0.07 -2.31 -0.17 0.00 0.02 0.00 0.00 55.97 53.57 3h3o s LYS 219 Cb -0.16 -1.30 0.27 0.00 -0.52 0.00 0.00 37.83 36.13 3h3o s LYS 219 CO 0.10 -0.36 1.06 -1.54 -0.92 0.00 0.00 175.35 173.69 3h3o s SER 220 N -3.79 1.06 0.03 2.83 1.04 -1.26 -1.84 113.70 111.77 3h3o s SER 220 Ca 0.13 0.95 0.27 0.00 0.48 0.00 0.00 55.95 57.78 3h3o s SER 220 Cb 0.03 -1.43 0.79 0.00 0.10 0.00 0.00 66.02 65.51 3h3o s SER 220 CO 0.07 -4.07 1.63 0.59 0.98 0.00 0.00 173.24 172.44 3h3o n ASN 221 N -4.77 0.35 -3.50 7.02 3.02 -0.81 -4.64 115.26 111.94 3h3o n ASN 221 Ca 0.09 0.14 -0.29 0.00 -0.03 0.00 0.00 54.58 54.49 3h3o n ASN 221 Cb 0.58 -0.12 -0.13 0.00 -0.61 0.00 0.00 39.78 39.50 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 -3.25 3.14 -0.22 6.41 0.15 -1.25 -2.20 113.70 116.48 3h3o s SER 222 Ca 0.12 -2.03 -0.34 0.00 0.70 0.00 0.00 55.95 54.39 3h3o s SER 222 Cb 0.17 -0.44 0.15 0.00 -1.71 0.00 0.00 66.02 64.20 3h3o s SER 222 CO 0.63 -0.33 1.24 -1.83 1.20 0.00 0.00 173.24 174.15 3h3o s GLU 223 N 1.23 0.25 -0.32 5.44 -1.05 -0.94 -4.75 118.70 118.56 3h3o s GLU 223 Ca 0.16 -0.06 -0.29 0.00 -0.15 0.00 0.00 54.97 54.64 3h3o s GLU 223 Cb -0.22 0.12 -0.01 0.00 -0.44 0.00 0.00 34.13 33.58 3h3o s GLU 223 CO -0.07 -0.10 1.66 0.08 0.95 0.00 0.00 175.26 177.78 3h3o s VAL 224 N -2.00 3.64 -0.19 1.83 1.01 -1.26 -4.27 120.40 119.16 3h3o s VAL 224 Ca 0.09 0.67 0.17 0.00 0.00 0.00 0.00 61.98 62.91 3h3o s VAL 224 Cb -0.01 -3.80 0.04 0.00 0.00 0.00 0.00 36.38 32.61 3h3o s VAL 224 CO -0.04 -0.46 1.26 1.88 0.00 0.00 0.00 175.10 177.73 3h3o h TYR 225 N 11.77 0.00 0.00 5.22 -1.99 -1.27 -3.49 116.97 127.21 3h3o h TYR 225 Ca -0.32 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.41 3h3o h TYR 225 Cb 1.15 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.88 3h3o h TYR 225 CO 0.95 0.41 0.00 0.41 -0.00 0.00 0.00 178.16 179.92 3h3o n GLY 226 N 1.25 -0.79 3.20 3.88 0.00 -1.23 -5.01 105.19 106.49 3h3o n GLY 226 Ca -0.01 -1.14 -0.22 0.00 0.00 0.00 0.00 46.02 44.65 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 1.50 0.81 1.61 3.76 -1.26 -0.88 115.29 117.83 3h3o s HIS 227 Ca 0.00 -0.39 -0.11 0.00 -0.15 0.00 0.00 55.06 54.42 3h3o s HIS 227 Cb 0.00 -0.87 0.08 0.00 1.11 0.00 0.00 32.58 32.90 3h3o s HIS 227 CO 0.00 0.09 1.09 0.95 -0.85 0.00 0.00 174.74 176.02 3h3o s THR 228 N -0.95 3.14 -0.00 1.30 -4.23 -0.16 -4.63 115.64 110.11 3h3o s THR 228 Ca 0.04 0.37 -0.19 0.00 -1.18 0.00 0.00 61.69 60.73 3h3o s THR 228 Cb -0.09 -2.85 -0.06 0.00 1.34 0.00 0.00 72.50 70.84 3h3o s THR 228 CO 0.02 -0.49 0.54 -0.13 -0.54 0.00 0.00 174.62 174.03 3h3o s ARG 229 N -4.91 4.23 0.27 3.99 1.81 -0.44 -4.30 118.95 119.60 3h3o s ARG 229 Ca 0.62 0.64 -0.02 0.00 -1.72 0.00 0.00 55.73 55.25 3h3o s ARG 229 Cb -0.17 -3.31 0.60 0.00 -0.45 0.00 0.00 34.95 31.61 3h3o s ARG 229 CO 0.56 0.45 1.65 0.66 -0.68 0.00 0.00 175.30 177.94 3h3o h SER 230 N 5.39 -0.11 0.03 0.23 4.64 -1.86 0.55 113.55 122.42 3h3o h SER 230 Ca -0.47 0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3h3o h SER 230 Cb 1.20 0.29 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 3h3o h SER 230 CO 0.68 -0.15 0.00 0.00 -0.87 0.00 0.00 176.83 176.49 3h3o n TYR 231 N -5.26 0.00 0.35 4.77 0.18 -1.26 -2.01 117.16 113.92 3h3o n TYR 231 Ca 0.18 0.00 0.07 0.00 1.88 0.00 0.00 57.90 60.03 3h3o n TYR 231 Cb 0.59 -0.02 -0.09 0.00 -0.38 0.00 0.00 39.34 39.44 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 -1.02 1.55 -3.32 -3.48 5.12 0.19 -4.77 116.66 110.93 3h3o n ARG 232 Ca 0.15 -0.06 -0.26 0.00 -1.93 0.00 0.00 57.85 55.75 3h3o n ARG 232 Cb 0.08 -1.23 -0.07 0.00 -1.16 0.00 0.00 32.46 30.07 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 -1.63 2.15 -3.98 -1.55 -0.00 -0.85 -4.92 117.46 106.68 3h3o n PHE 233 Ca 0.00 -3.93 -0.32 0.00 -0.00 0.00 0.00 57.45 53.20 3h3o n PHE 233 Cb 0.28 -0.48 -0.03 0.00 -0.00 0.00 0.00 39.48 39.25 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 1.01 -1.62 0.00 -5.13 4.19 -1.26 -2.33 117.16 112.03 3h3o n TYR 234 Ca 0.27 0.63 0.00 0.00 3.31 0.00 0.00 57.90 62.10 3h3o n TYR 234 Cb 0.46 -2.47 0.00 0.00 0.49 0.00 0.00 39.34 37.82 3h3o n TYR 234 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 3h3o n GLY 235 N -1.17 2.41 1.68 2.98 0.00 -0.93 -4.77 105.19 105.39 3h3o n GLY 235 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 3h3o n GLY 235 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h3o n SER 236 N 0.00 0.73 -4.36 1.61 3.41 -0.98 -4.74 113.62 109.29 3h3o n SER 236 Ca 0.00 -2.10 -0.40 0.00 -0.26 0.00 0.00 58.87 56.11 3h3o n SER 236 Cb 0.00 0.60 -0.11 0.00 -0.26 0.00 0.00 64.21 64.44 3h3o n SER 236 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3h3o s GLU 237 N -2.76 2.78 0.04 4.33 2.02 -1.26 -3.25 118.70 120.60 3h3o s GLU 237 Ca 0.13 -1.14 0.08 0.00 0.02 0.00 0.00 54.97 54.06 3h3o s GLU 237 Cb 0.01 -3.74 -0.03 0.00 0.10 0.00 0.00 34.13 30.47 3h3o s GLU 237 CO 0.09 -0.74 -0.23 0.08 0.02 0.00 0.00 175.26 174.48 3h3o s VAL 238 N 1.53 2.39 0.09 2.63 1.01 -1.26 -4.86 120.40 121.94 3h3o s VAL 238 Ca 0.02 -1.29 -0.31 0.00 0.00 0.00 0.00 61.98 60.40 3h3o s VAL 238 Cb -0.20 -1.96 -0.07 0.00 0.00 0.00 0.00 36.38 34.16 3h3o s VAL 238 CO 0.06 0.37 1.24 -2.16 0.00 0.00 0.00 175.10 174.61 3h3o s PRO 239 N -1.28 4.41 -0.46 2.72 0.04 -1.26 -0.99 135.00 138.19 3h3o s PRO 239 Ca 0.13 1.86 -0.19 0.00 0.04 0.00 0.00 61.00 62.83 3h3o s PRO 239 Cb -0.10 -3.31 0.04 0.00 0.04 0.00 0.00 34.50 31.17 3h3o s PRO 239 CO 0.03 -0.27 0.58 0.42 0.04 0.00 0.00 177.00 177.79 3h3o s ILE 240 N 0.89 4.92 -0.01 0.56 1.01 -0.05 -1.22 121.20 127.30 3h3o s ILE 240 Ca 0.59 -0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.99 3h3o s ILE 240 Cb -0.32 -4.19 0.02 0.00 0.01 0.00 0.00 42.46 37.98 3h3o s ILE 240 CO 0.31 -0.63 0.93 0.00 0.00 0.00 0.00 174.94 175.55 3h3o n ALA 241 N 6.03 1.86 -3.50 9.38 0.00 -0.61 -0.73 120.51 132.94 3h3o n ALA 241 Ca -0.05 -1.03 -0.13 0.00 0.00 0.00 0.00 53.44 52.23 3h3o n ALA 241 Cb 0.47 -0.03 -0.09 0.00 0.00 0.00 0.00 19.45 19.80 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 -0.97 -0.43 -0.10 0.00 0.00 -1.13 -2.22 107.32 102.47 3h3o s GLY 242 Ca 0.02 1.65 -0.13 0.00 0.00 0.00 0.00 44.72 46.26 3h3o s GLY 242 CO 0.00 1.49 0.35 1.06 0.00 0.00 0.00 173.10 176.01 3h3o s MET 243 N 0.54 0.49 -0.13 2.90 -1.94 -0.93 -0.40 119.30 119.83 3h3o s MET 243 Ca -0.02 0.33 -0.31 0.00 -1.71 0.00 0.00 55.69 53.98 3h3o s MET 243 Cb -0.04 0.23 0.13 0.00 2.01 0.00 0.00 34.83 37.16 3h3o s MET 243 CO -0.03 -0.09 1.04 0.00 -0.01 0.00 0.00 175.02 175.94 3h3o s ALA 244 N -0.20 -1.95 0.57 3.03 0.00 -0.87 -4.47 121.76 117.87 3h3o s ALA 244 Ca -0.04 1.45 -0.19 0.00 0.00 0.00 0.00 51.96 53.18 3h3o s ALA 244 Cb -0.03 -0.31 -0.05 0.00 0.00 0.00 0.00 23.12 22.73 3h3o s ALA 244 CO 0.02 -0.48 1.14 0.20 0.00 0.00 0.00 175.76 176.63 3h3o s GLY 245 N -1.76 2.59 0.32 0.00 0.00 -1.26 -3.28 107.32 103.92 3h3o s GLY 245 Ca 0.04 0.81 0.08 0.00 0.00 0.00 0.00 44.72 45.65 3h3o s GLY 245 CO -0.04 1.18 1.78 1.29 0.00 0.00 0.00 173.10 177.31 3h3o h ASP 246 N 1.00 0.73 0.56 1.64 2.03 -1.10 -1.42 116.42 119.86 3h3o h ASP 246 Ca -0.50 0.09 -0.16 0.00 -0.73 0.00 0.00 57.03 55.73 3h3o h ASP 246 Cb 1.26 -0.04 -0.01 0.00 -0.83 0.00 0.00 39.33 39.71 3h3o h ASP 246 CO 0.56 0.25 -0.73 1.56 -1.03 0.00 0.00 179.24 179.85 3h3o h GLN 247 N 0.71 0.14 0.01 4.15 1.08 -1.91 -2.42 115.11 116.87 3h3o h GLN 247 Ca 0.58 -0.12 -0.19 0.00 -1.45 0.00 0.00 58.65 57.46 3h3o h GLN 247 Cb 0.97 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.41 3h3o h GLN 247 CO -0.37 0.81 -0.88 1.96 -0.95 0.00 0.00 178.83 179.40 3h3o h GLN 248 N 0.09 0.08 0.00 1.46 7.50 -1.74 -2.65 115.11 119.85 3h3o h GLN 248 Ca -0.02 -0.09 -0.10 0.00 0.50 0.00 0.00 58.65 58.94 3h3o h GLN 248 Cb 1.29 0.03 -0.01 0.00 0.05 0.00 0.00 27.48 28.83 3h3o h GLN 248 CO 0.11 0.90 -0.46 0.00 -1.50 0.00 0.00 178.83 177.87 3h3o h ALA 249 N 1.07 1.04 -0.07 3.87 0.00 -1.22 -2.09 119.26 121.86 3h3o h ALA 249 Ca -0.03 -0.42 -0.17 0.00 0.00 0.00 0.00 54.91 54.29 3h3o h ALA 249 Cb 1.53 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 3h3o h ALA 249 CO 0.12 0.58 -0.70 0.00 0.00 0.00 0.00 179.25 179.25 3h3o h ALA 250 N 1.54 0.67 -0.40 0.00 0.00 -1.32 -1.01 119.26 118.74 3h3o h ALA 250 Ca -0.00 -0.60 -0.05 0.00 0.00 0.00 0.00 54.91 54.26 3h3o h ALA 250 Cb 0.93 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3h3o h ALA 250 CO 0.06 0.77 0.06 1.25 0.00 0.00 0.00 179.25 181.39 3h3o h LEU 251 N 0.23 0.64 -0.73 0.00 5.85 -1.11 -2.22 115.31 117.96 3h3o h LEU 251 Ca -0.02 -0.26 -0.09 0.00 0.84 0.00 0.00 57.88 58.34 3h3o h LEU 251 Cb 1.25 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 3h3o h LEU 251 CO 0.11 0.74 -0.05 0.15 -0.34 0.00 0.00 178.44 179.05 3h3o h PHE 252 N 0.51 1.00 0.00 1.25 3.57 -1.27 -1.44 116.94 120.56 3h3o h PHE 252 Ca 0.12 -0.18 0.00 0.00 3.53 0.00 0.00 57.97 61.45 3h3o h PHE 252 Cb 0.37 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.85 3h3o h PHE 252 CO 0.03 0.93 0.00 0.78 -2.23 0.00 0.00 178.31 177.81 3h3o h GLY 253 N 0.98 0.00 -0.68 2.40 0.00 -1.01 -1.12 103.07 103.64 3h3o h GLY 253 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 3h3o h GLY 253 CO 0.03 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.51 3h3o n GLN 254 N -2.81 1.73 -3.52 4.80 1.13 -0.85 -4.82 117.38 113.03 3h3o n GLN 254 Ca 0.02 -1.07 -0.25 0.00 -1.94 0.00 0.00 57.00 53.76 3h3o n GLN 254 Cb 0.35 -1.45 0.05 0.00 0.11 0.00 0.00 30.24 29.30 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 0.30 -6.28 -1.69 -1.09 2.81 -0.42 -4.86 117.12 105.88 3h3o n MET 255 Ca 0.18 0.77 -0.40 0.00 -1.81 0.00 0.00 57.70 56.43 3h3o n MET 255 Cb 0.36 -5.71 -0.01 0.00 -0.71 0.00 0.00 33.22 27.14 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 -4.46 6.95 0.49 3.04 0.00 -0.56 -4.63 120.51 121.33 3h3o n ALA 256 Ca -0.01 -3.84 0.13 0.00 0.00 0.00 0.00 53.44 49.72 3h3o n ALA 256 Cb 0.56 -3.12 0.42 0.00 0.00 0.00 0.00 19.45 17.31 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 4.98 0.00 -2.79 0.00 0.04 -1.89 -3.44 116.94 113.84 3h3o h PHE 257 Ca 0.75 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 60.92 3h3o h PHE 257 Cb 0.34 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 38.38 3h3o h PHE 257 CO 1.70 0.00 -0.66 -1.21 -0.60 0.00 0.00 178.31 177.53 3h3o s GLU 258 N -3.21 2.35 0.29 1.51 2.02 -1.26 -4.97 118.70 115.42 3h3o s GLU 258 Ca 0.08 -1.17 -0.29 0.00 0.02 0.00 0.00 54.97 53.61 3h3o s GLU 258 Cb 0.10 -2.31 -0.13 0.00 0.10 0.00 0.00 34.13 31.89 3h3o s GLU 258 CO 0.55 0.44 1.27 1.17 0.02 0.00 0.00 175.26 178.71 3h3o n LYS 259 N -0.22 1.89 0.00 1.61 4.81 -1.26 -1.73 118.16 123.26 3h3o n LYS 259 Ca -0.09 0.67 0.00 0.00 -0.87 0.00 0.00 58.31 58.01 3h3o n LYS 259 Cb 0.56 -2.23 0.00 0.00 0.02 0.00 0.00 35.03 33.38 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 1.39 3.09 3.72 3.14 0.00 0.59 -4.97 105.19 112.15 3h3o n GLY 260 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.50 4.46 0.10 1.61 -1.94 -0.70 -4.83 119.30 117.49 3h3o s MET 261 Ca 0.00 1.81 0.04 0.00 -1.71 0.00 0.00 55.69 55.84 3h3o s MET 261 Cb 0.00 -3.30 -0.03 0.00 2.01 0.00 0.00 34.83 33.50 3h3o s MET 261 CO 0.00 -0.19 -0.11 -1.50 -0.01 0.00 0.00 175.02 173.21 3h3o s ILE 262 N 0.63 1.04 0.13 2.53 2.07 -1.26 -1.34 121.20 124.99 3h3o s ILE 262 Ca 0.57 -1.59 -0.07 0.00 -1.41 0.00 0.00 60.65 58.14 3h3o s ILE 262 Cb -0.31 -1.33 -0.01 0.00 0.13 0.00 0.00 42.46 40.93 3h3o s ILE 262 CO 0.32 -0.48 0.19 -1.59 -1.91 0.00 0.00 174.94 171.47 3h3o s LYS 263 N -2.58 0.97 -0.04 3.50 0.00 -0.08 -2.88 119.74 118.62 3h3o s LYS 263 Ca 0.05 -1.15 0.02 0.00 0.00 0.00 0.00 55.97 54.88 3h3o s LYS 263 Cb -0.05 0.33 0.01 0.00 0.00 0.00 0.00 37.83 38.13 3h3o s LYS 263 CO 0.01 -0.32 -0.08 1.21 0.00 0.00 0.00 175.35 176.17 3h3o s ASN 264 N -2.94 1.23 -0.16 0.03 3.84 0.20 -1.12 114.94 116.01 3h3o s ASN 264 Ca 0.14 -0.19 0.01 0.00 0.21 0.00 0.00 52.86 53.03 3h3o s ASN 264 Cb 0.05 -0.49 0.01 0.00 -0.55 0.00 0.00 41.25 40.26 3h3o s ASN 264 CO -0.04 0.01 -0.19 -0.89 -2.79 0.00 0.00 177.10 173.20 3h3o s THR 265 N 0.57 2.27 -0.45 -5.21 2.01 -0.95 -1.80 115.64 112.08 3h3o s THR 265 Ca -0.09 -0.90 -0.15 0.00 0.31 0.00 0.00 61.69 60.86 3h3o s THR 265 Cb -0.13 -1.94 0.06 0.00 0.01 0.00 0.00 72.50 70.50 3h3o s THR 265 CO 0.01 0.53 0.36 -0.31 -0.69 0.00 0.00 174.62 174.52 3h3o s TYR 266 N 0.99 3.25 0.00 4.92 2.02 -0.20 -2.27 117.35 126.06 3h3o s TYR 266 Ca -0.03 -0.84 0.00 0.00 -0.37 0.00 0.00 57.07 55.83 3h3o s TYR 266 Cb -0.15 -2.97 0.00 0.00 -0.40 0.00 0.00 41.96 38.44 3h3o s TYR 266 CO -0.05 -0.73 0.00 0.41 -1.57 0.00 0.00 175.55 173.61 3h3o n GLY 267 N 5.18 5.41 0.29 0.71 0.00 -1.26 -2.11 105.19 113.41 3h3o n GLY 267 Ca -0.12 -0.78 0.09 0.00 0.00 0.00 0.00 46.02 45.21 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 0.48 -4.58 2.61 2.02 -1.93 -0.97 112.91 110.54 3h3o h THR 268 Ca 0.00 -0.11 -0.41 0.00 0.77 0.00 0.00 66.41 66.66 3h3o h THR 268 Cb 0.00 0.13 -0.08 0.00 -1.74 0.00 0.00 68.15 66.46 3h3o h THR 268 CO 0.00 0.06 -0.31 0.61 0.37 0.00 0.00 175.52 176.25 3h3o n GLY 269 N -1.35 3.74 3.02 2.16 0.00 -1.25 -1.33 105.19 110.17 3h3o n GLY 269 Ca 0.18 -2.25 -0.27 0.00 0.00 0.00 0.00 46.02 43.68 3h3o n GLY 269 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3o s ALA 270 N -2.60 1.45 -0.13 4.61 0.00 0.37 -4.45 121.76 121.01 3h3o s ALA 270 Ca 0.03 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.43 3h3o s ALA 270 Cb 0.00 -0.73 0.02 0.00 0.00 0.00 0.00 23.12 22.41 3h3o s ALA 270 CO 0.02 -0.04 -0.13 -0.06 0.00 0.00 0.00 175.76 175.55 3h3o s PHE 271 N 0.95 1.97 -0.28 0.00 0.08 -0.96 -0.79 117.98 118.96 3h3o s PHE 271 Ca -0.08 -1.05 -0.13 0.00 0.12 0.00 0.00 56.93 55.78 3h3o s PHE 271 Cb -0.15 -1.48 -0.04 0.00 -0.57 0.00 0.00 43.02 40.78 3h3o s PHE 271 CO -0.00 -0.60 0.28 0.42 -0.10 0.00 0.00 175.22 175.22 3h3o s ILE 272 N 1.44 5.24 -0.07 0.64 1.01 -0.60 -2.25 121.20 126.62 3h3o s ILE 272 Ca 0.03 0.34 0.04 0.00 0.00 0.00 0.00 60.65 61.06 3h3o s ILE 272 Cb -0.13 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.72 3h3o s ILE 272 CO -0.08 0.19 -0.19 -0.69 0.00 0.00 0.00 174.94 174.17 3h3o s VAL 273 N 1.91 1.63 -0.10 2.92 1.01 -0.28 -0.89 120.40 126.61 3h3o s VAL 273 Ca 0.11 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.32 3h3o s VAL 273 Cb -0.16 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.81 3h3o s VAL 273 CO 0.11 0.46 -0.18 -0.32 0.00 0.00 0.00 175.10 175.17 3h3o s MET 274 N 0.32 2.41 0.19 2.72 0.00 0.05 -0.90 119.30 124.08 3h3o s MET 274 Ca -0.13 -0.64 -0.30 0.00 0.00 0.00 0.00 55.69 54.62 3h3o s MET 274 Cb -0.15 -1.94 -0.09 0.00 0.00 0.00 0.00 34.83 32.64 3h3o s MET 274 CO 0.05 0.03 1.39 1.21 0.00 0.00 0.00 175.02 177.71 3h3o s ASN 275 N 0.71 6.78 0.00 1.11 3.84 -0.45 -0.71 114.94 126.22 3h3o s ASN 275 Ca -0.12 2.48 0.04 0.00 0.21 0.00 0.00 52.86 55.47 3h3o s ASN 275 Cb -0.16 -2.61 0.04 0.00 -0.55 0.00 0.00 41.25 37.98 3h3o s ASN 275 CO 0.03 -0.64 0.69 0.35 -2.79 0.00 0.00 177.10 174.73 3h3o n THR 276 N 3.00 0.13 -1.21 -5.21 -2.24 0.44 -0.30 114.28 108.89 3h3o n THR 276 Ca 0.08 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 3h3o n THR 276 Cb 0.41 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 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 -1.80 0.00 3.38 0.00 -1.24 -4.36 105.19 101.35 3h3o n GLY 277 Ca 0.03 -1.84 0.11 0.00 0.00 0.00 0.00 46.02 44.31 3h3o n GLY 277 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h3o n GLU 278 N 0.00 0.36 -3.82 1.61 1.02 -1.26 -0.21 120.64 118.33 3h3o n GLU 278 Ca 0.00 0.07 -0.13 0.00 -0.02 0.00 0.00 57.16 57.08 3h3o n GLU 278 Cb 0.00 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 29.78 3h3o n GLU 278 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 3h3o s GLU 279 N -2.50 0.03 0.06 3.49 4.04 -1.26 -4.84 118.70 117.71 3h3o s GLU 279 Ca 0.22 0.13 -0.37 0.00 0.04 0.00 0.00 54.97 54.99 3h3o s GLU 279 Cb 0.15 -0.07 -0.21 0.00 0.02 0.00 0.00 34.13 34.03 3h3o s GLU 279 CO 0.32 -0.06 1.58 -1.00 -1.84 0.00 0.00 175.26 174.26 3h3o h PRO 280 N 6.51 -1.24 -6.29 -4.83 0.13 -1.85 -3.47 132.00 120.96 3h3o h PRO 280 Ca -0.32 0.08 -0.45 0.00 -0.87 0.00 0.00 66.00 64.45 3h3o h PRO 280 Cb 1.18 0.28 0.06 0.00 0.13 0.00 0.00 31.00 32.65 3h3o h PRO 280 CO 0.48 -0.83 -0.93 0.94 -0.23 0.00 0.00 178.00 177.42 3h3o n GLN 281 N -5.65 -1.63 0.00 0.86 -0.06 -1.26 -4.96 117.38 104.68 3h3o n GLN 281 Ca -0.16 0.44 0.00 0.00 -2.00 0.00 0.00 57.00 55.27 3h3o n GLN 281 Cb 0.51 -4.15 0.00 0.00 -4.06 0.00 0.00 30.24 22.54 3h3o n GLN 281 CO 0.00 0.00 0.00 1.47 -0.20 0.00 0.00 177.06 178.33 3h3o n LEU 282 N -4.26 0.00 -4.83 1.69 -0.00 -1.26 -5.11 117.00 103.23 3h3o n LEU 282 Ca -0.13 0.00 -0.34 0.00 -0.00 0.00 0.00 56.01 55.53 3h3o n LEU 282 Cb 0.61 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.97 3h3o n LEU 282 CO 0.69 0.00 0.43 -0.94 -0.00 0.00 0.00 177.39 177.56 3h3o s SER 283 N 0.00 6.94 -0.25 1.45 1.04 -1.26 -4.99 113.70 116.63 3h3o s SER 283 Ca 0.00 1.37 0.12 0.00 0.48 0.00 0.00 55.95 57.92 3h3o s SER 283 Cb 0.00 -2.40 0.46 0.00 0.10 0.00 0.00 66.02 64.17 3h3o s SER 283 CO 0.00 -0.08 1.18 -0.90 0.98 0.00 0.00 173.24 174.43 3h3o n ASP 284 N 0.23 3.35 -4.66 7.02 3.85 -1.26 -4.68 116.55 120.40 3h3o n ASP 284 Ca 0.00 -3.41 -0.53 0.00 -0.71 0.00 0.00 54.79 50.14 3h3o n ASP 284 Cb 0.52 -0.41 -0.06 0.00 -1.35 0.00 0.00 41.12 39.82 3h3o n ASP 284 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 3h3o n ASN 285 N -0.71 2.40 0.00 -1.12 5.15 -1.26 -0.66 115.26 119.06 3h3o n ASN 285 Ca 0.30 1.07 0.00 0.00 -0.60 0.00 0.00 54.58 55.35 3h3o n ASN 285 Cb 0.89 -1.23 0.00 0.00 -0.53 0.00 0.00 39.78 38.91 3h3o n ASN 285 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3h3o n ASP 286 N 4.39 -2.48 -4.22 1.20 8.00 -1.26 -4.97 116.55 117.20 3h3o n ASP 286 Ca 0.22 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.49 3h3o n ASP 286 Cb 0.20 -1.46 -0.09 0.00 -0.02 0.00 0.00 41.12 39.74 3h3o n ASP 286 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3h3o s LEU 287 N 0.00 1.98 0.07 0.64 1.43 0.17 -4.38 118.68 118.59 3h3o s LEU 287 Ca 0.00 -1.55 0.04 0.00 -1.03 0.00 0.00 54.13 51.59 3h3o s LEU 287 Cb 0.00 -0.15 -0.04 0.00 0.03 0.00 0.00 46.19 46.03 3h3o s LEU 287 CO 0.00 -0.82 -0.02 -0.76 0.23 0.00 0.00 176.35 174.99 3h3o s LEU 288 N -3.52 3.41 -0.15 1.79 1.43 -0.31 -4.90 118.68 116.42 3h3o s LEU 288 Ca 0.30 -0.16 -0.00 0.00 -1.03 0.00 0.00 54.13 53.23 3h3o s LEU 288 Cb 0.05 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 3h3o s LEU 288 CO 0.15 0.20 -0.14 -0.89 0.23 0.00 0.00 176.35 175.90 3h3o s THR 289 N -1.23 2.83 0.34 5.49 2.01 -0.69 -0.75 115.64 123.63 3h3o s THR 289 Ca 0.23 -0.72 0.06 0.00 0.31 0.00 0.00 61.69 61.57 3h3o s THR 289 Cb -0.12 -2.19 -0.02 0.00 0.01 0.00 0.00 72.50 70.18 3h3o s THR 289 CO 0.16 0.51 0.32 0.42 -0.69 0.00 0.00 174.62 175.34 3h3o s THR 290 N 0.66 0.00 -0.07 -0.82 -4.23 -0.77 -4.32 115.64 106.09 3h3o s THR 290 Ca -0.07 -1.93 -0.17 0.00 -1.18 0.00 0.00 61.69 58.33 3h3o s THR 290 Cb -0.16 -2.53 -0.05 0.00 1.34 0.00 0.00 72.50 71.11 3h3o s THR 290 CO 0.02 0.00 0.47 -0.63 -0.54 0.00 0.00 174.62 173.94 3h3o s ILE 291 N -3.35 5.10 -0.14 2.99 1.01 -1.26 -0.59 121.20 124.97 3h3o s ILE 291 Ca 0.39 0.95 -0.18 0.00 0.00 0.00 0.00 60.65 61.81 3h3o s ILE 291 Cb 0.02 -3.80 -0.16 0.00 0.01 0.00 0.00 42.46 38.52 3h3o s ILE 291 CO 0.27 0.41 0.42 1.23 0.00 0.00 0.00 174.94 177.27 3h3o h GLY 292 N 6.03 0.00 -4.09 6.18 0.00 -0.56 -3.41 103.07 107.21 3h3o h GLY 292 Ca -0.44 0.00 0.28 0.00 0.00 0.00 0.00 47.33 47.17 3h3o h GLY 292 CO 0.71 0.00 0.91 -2.52 0.00 0.00 0.00 176.54 175.64 3h3o s TYR 293 N -2.05 -0.07 -0.15 5.60 -0.85 -1.07 -4.66 117.35 114.11 3h3o s TYR 293 Ca -0.14 0.06 0.02 0.00 -0.52 0.00 0.00 57.07 56.48 3h3o s TYR 293 Cb -0.01 0.50 0.01 0.00 0.38 0.00 0.00 41.96 42.85 3h3o s TYR 293 CO 0.45 -0.09 -0.21 0.20 -1.52 0.00 0.00 175.55 174.38 3h3o s GLY 294 N -1.86 1.34 0.03 5.49 0.00 -1.26 -1.49 107.32 109.56 3h3o s GLY 294 Ca 0.10 -1.09 -0.22 0.00 0.00 0.00 0.00 44.72 43.51 3h3o s GLY 294 CO -0.04 0.09 0.49 -0.26 0.00 0.00 0.00 173.10 173.38 3h3o s ILE 295 N 0.97 0.03 -1.70 0.90 -4.36 -0.99 -1.93 121.20 114.12 3h3o s ILE 295 Ca -0.04 -0.29 -0.02 0.00 -0.26 0.00 0.00 60.65 60.05 3h3o s ILE 295 Cb -0.15 -0.94 0.00 0.00 1.25 0.00 0.00 42.46 42.63 3h3o s ILE 295 CO -0.05 -0.16 0.21 0.59 0.24 0.00 0.00 174.94 175.78 3h3o n ASN 296 N 0.58 -5.98 0.00 4.36 3.02 -1.26 -1.69 115.26 114.29 3h3o n ASN 296 Ca -0.19 -0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.25 3h3o n ASN 296 Cb 0.59 -4.93 0.00 0.00 -0.61 0.00 0.00 39.78 34.83 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 -1.19 0.59 3.79 7.41 0.00 -1.26 -5.00 105.19 109.53 3h3o n GLY 297 Ca -0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.35 2.23 -0.06 1.61 -0.14 -0.68 -5.14 119.74 117.22 3h3o s LYS 298 Ca 0.00 -1.97 -0.01 0.00 -1.36 0.00 0.00 55.97 52.63 3h3o s LYS 298 Cb 0.00 -1.95 0.03 0.00 -1.68 0.00 0.00 37.83 34.23 3h3o s LYS 298 CO 0.00 -0.28 0.02 0.08 -0.76 0.00 0.00 175.35 174.41 3h3o s VAL 299 N -2.68 0.19 -0.16 3.17 1.01 -1.26 -2.35 120.40 118.32 3h3o s VAL 299 Ca 0.34 0.22 -0.05 0.00 0.00 0.00 0.00 61.98 62.49 3h3o s VAL 299 Cb 0.02 -0.37 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 3h3o s VAL 299 CO 0.19 0.22 0.02 -0.31 0.00 0.00 0.00 175.10 175.22 3h3o s TYR 300 N 1.92 3.16 0.42 5.22 2.02 -0.56 -4.22 117.35 125.31 3h3o s TYR 300 Ca 0.03 -0.04 0.03 0.00 -0.37 0.00 0.00 57.07 56.73 3h3o s TYR 300 Cb -0.12 -1.99 0.00 0.00 -0.40 0.00 0.00 41.96 39.44 3h3o s TYR 300 CO -0.04 0.14 0.60 0.71 -1.57 0.00 0.00 175.55 175.39 3h3o s TYR 301 N 0.17 3.10 0.08 2.71 2.02 0.70 0.11 117.35 126.24 3h3o s TYR 301 Ca 0.02 -0.03 -0.03 0.00 -0.37 0.00 0.00 57.07 56.66 3h3o s TYR 301 Cb -0.13 -2.25 -0.03 0.00 -0.40 0.00 0.00 41.96 39.15 3h3o s TYR 301 CO 0.01 -0.30 0.05 0.00 -1.57 0.00 0.00 175.55 173.75 3h3o s ALA 302 N -2.42 0.38 -0.15 3.71 0.00 0.24 -0.42 121.76 123.10 3h3o s ALA 302 Ca 0.49 -1.11 -0.01 0.00 0.00 0.00 0.00 51.96 51.33 3h3o s ALA 302 Cb -0.10 0.44 -0.01 0.00 0.00 0.00 0.00 23.12 23.44 3h3o s ALA 302 CO 0.35 -0.43 -0.11 -1.17 0.00 0.00 0.00 175.76 174.40 3h3o s LEU 303 N -2.93 2.76 -0.01 0.00 0.20 0.12 -1.84 118.68 116.97 3h3o s LEU 303 Ca 0.10 -0.34 0.04 0.00 0.69 0.00 0.00 54.13 54.62 3h3o s LEU 303 Cb 0.07 -1.64 -0.01 0.00 -0.43 0.00 0.00 46.19 44.18 3h3o s LEU 303 CO -0.08 0.12 -0.14 -0.70 -0.29 0.00 0.00 176.35 175.27 3h3o s GLU 304 N 0.59 1.14 -0.17 1.98 2.12 0.07 -0.77 118.70 123.66 3h3o s GLU 304 Ca -0.07 -0.49 -0.00 0.00 0.36 0.00 0.00 54.97 54.77 3h3o s GLU 304 Cb -0.15 -1.09 0.00 0.00 0.26 0.00 0.00 34.13 33.15 3h3o s GLU 304 CO 0.03 0.29 -0.15 0.20 -0.54 0.00 0.00 175.26 175.09 3h3o s GLY 305 N -0.30 1.46 -0.19 -1.50 0.00 -0.06 -1.17 107.32 105.57 3h3o s GLY 305 Ca 0.05 -1.13 -0.07 0.00 0.00 0.00 0.00 44.72 43.57 3h3o s GLY 305 CO -0.00 0.18 0.04 -0.56 0.00 0.00 0.00 173.10 172.76 3h3o s SER 306 N 1.09 5.37 -0.40 1.64 0.01 -1.26 -1.55 113.70 118.60 3h3o s SER 306 Ca -0.00 -0.02 0.02 0.00 1.31 0.00 0.00 55.95 57.26 3h3o s SER 306 Cb -0.14 -1.92 0.11 0.00 0.21 0.00 0.00 66.02 64.28 3h3o s SER 306 CO -0.05 0.13 0.14 -0.63 0.41 0.00 0.00 173.24 173.25 3h3o s ILE 307 N 0.61 2.67 0.28 1.44 1.01 0.03 -0.70 121.20 126.54 3h3o s ILE 307 Ca 0.02 -2.46 -0.00 0.00 0.00 0.00 0.00 60.65 58.21 3h3o s ILE 307 Cb -0.13 -2.89 0.28 0.00 0.01 0.00 0.00 42.46 39.72 3h3o s ILE 307 CO 0.02 -0.67 1.87 -0.26 0.00 0.00 0.00 174.94 175.90 3h3o h PHE 308 N 7.52 1.16 -3.44 3.97 0.04 -1.92 0.11 116.94 124.38 3h3o h PHE 308 Ca -0.07 0.03 -0.66 0.00 2.80 0.00 0.00 57.97 60.07 3h3o h PHE 308 Cb 1.00 -0.38 -0.28 0.00 2.20 0.00 0.00 35.95 38.50 3h3o h PHE 308 CO 0.51 0.55 -0.71 0.08 -0.60 0.00 0.00 178.31 178.13 3h3o s VAL 309 N -5.98 3.41 0.00 -0.55 1.01 -1.26 -3.90 120.40 113.12 3h3o s VAL 309 Ca -0.12 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.31 3h3o s VAL 309 Cb 0.21 -2.59 0.00 0.00 0.00 0.00 0.00 36.38 34.00 3h3o s VAL 309 CO 0.81 0.37 0.00 0.00 0.00 0.00 0.00 175.10 176.28 3h3o n ALA 310 N 4.80 1.08 0.25 5.51 0.00 -0.44 -4.78 120.51 126.93 3h3o n ALA 310 Ca -0.18 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.37 3h3o n ALA 310 Cb 0.50 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.61 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 -0.68 -2.00 103.07 102.39 3h3o h GLY 311 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3h3o h GLY 311 CO 0.00 0.00 -0.03 1.48 0.00 0.00 0.00 176.54 177.99 3h3o h SER 312 N 0.00 0.00 -0.32 0.19 4.64 -1.73 -1.34 113.55 115.00 3h3o h SER 312 Ca -0.00 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.14 3h3o h SER 312 Cb 0.38 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3h3o h SER 312 CO 0.02 0.03 -0.49 0.00 -0.87 0.00 0.00 176.83 175.53 3h3o h ALA 313 N 1.97 0.51 -0.29 5.18 0.00 -1.65 -0.79 119.26 124.19 3h3o h ALA 313 Ca -0.00 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.32 3h3o h ALA 313 Cb 0.37 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3h3o h ALA 313 CO 0.00 0.68 -0.22 0.82 0.00 0.00 0.00 179.25 180.53 3h3o h ILE 314 N 0.71 1.26 -0.07 0.00 1.08 -1.39 -2.06 117.51 117.04 3h3o h ILE 314 Ca 0.03 -1.24 -0.10 0.00 -0.39 0.00 0.00 64.86 63.16 3h3o h ILE 314 Cb 1.09 1.28 -0.01 0.00 -3.07 0.00 0.00 36.82 36.11 3h3o h ILE 314 CO 0.11 0.40 -0.41 -0.61 -0.69 0.00 0.00 178.15 176.95 3h3o h GLN 315 N 0.48 0.15 -0.26 2.37 4.15 -1.03 -2.65 115.11 118.32 3h3o h GLN 315 Ca 0.07 -0.07 -0.15 0.00 0.77 0.00 0.00 58.65 59.27 3h3o h GLN 315 Cb 0.65 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.33 3h3o h GLN 315 CO 0.05 0.55 -0.44 2.35 -1.93 0.00 0.00 178.83 179.40 3h3o h TRP 316 N 0.13 0.80 0.00 3.99 7.01 -0.53 0.71 115.95 128.06 3h3o h TRP 316 Ca 0.01 -0.25 -0.07 0.00 2.11 0.00 0.00 58.89 60.69 3h3o h TRP 316 Cb 0.79 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.68 3h3o h TRP 316 CO 0.01 0.99 -0.34 -0.07 -2.79 0.00 0.00 178.44 176.23 3h3o h LEU 317 N 0.53 0.00 0.17 0.65 3.38 -1.14 1.04 115.31 119.94 3h3o h LEU 317 Ca 0.04 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.66 3h3o h LEU 317 Cb 0.98 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.74 3h3o h LEU 317 CO 0.09 0.34 -1.75 -0.09 0.09 0.00 0.00 178.44 177.13 3h3o h ARG 318 N 0.00 0.37 0.00 1.13 2.43 -1.24 0.18 114.38 117.24 3h3o h ARG 318 Ca -0.00 -0.63 -0.35 0.00 -0.81 0.00 0.00 59.98 58.19 3h3o h ARG 318 Cb 0.63 0.23 -0.07 0.00 -0.42 0.00 0.00 29.97 30.35 3h3o h ARG 318 CO 0.04 1.30 -2.33 -0.25 -1.51 0.00 0.00 179.97 177.22 3h3o n ASP 319 N -3.62 0.30 0.00 -3.80 8.00 0.22 -4.16 116.55 113.49 3h3o n ASP 319 Ca -0.26 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.24 3h3o n ASP 319 Cb 1.05 0.92 0.00 0.00 -0.02 0.00 0.00 41.12 43.07 3h3o n ASP 319 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h3o n GLY 320 N 1.83 0.68 0.15 0.44 0.00 0.35 -4.60 105.19 104.05 3h3o n GLY 320 Ca -0.32 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.64 3h3o n GLY 320 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3h3o h LEU 321 N 0.00 0.23 0.04 0.99 3.38 -1.55 -3.48 115.31 114.91 3h3o h LEU 321 Ca 0.00 -0.15 -0.14 0.00 0.09 0.00 0.00 57.88 57.68 3h3o h LEU 321 Cb 0.00 -0.07 0.02 0.00 0.09 0.00 0.00 40.66 40.70 3h3o h LEU 321 CO 0.00 0.84 -0.21 0.54 0.09 0.00 0.00 178.44 179.69 3h3o n ARG 322 N -3.81 -1.71 0.22 1.13 1.74 -0.09 -4.96 116.66 109.18 3h3o n ARG 322 Ca -0.02 0.32 0.11 0.00 -0.77 0.00 0.00 57.85 57.49 3h3o n ARG 322 Cb 0.67 -3.97 0.25 0.00 -1.02 0.00 0.00 32.46 28.38 3h3o n ARG 322 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 3h3o h MET 323 N -0.48 0.00 -6.15 5.56 2.86 -1.03 -3.45 114.93 112.23 3h3o h MET 323 Ca -0.19 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 56.88 3h3o h MET 323 Cb 1.13 0.00 -0.23 0.00 0.06 0.00 0.00 31.60 32.56 3h3o h MET 323 CO 0.20 0.08 -0.83 0.96 1.06 0.00 0.00 176.91 178.38 3h3o s ILE 324 N -3.27 1.71 -0.03 -1.22 -4.36 -1.19 -5.05 121.20 107.79 3h3o s ILE 324 Ca 0.05 -1.42 -0.20 0.00 -0.26 0.00 0.00 60.65 58.83 3h3o s ILE 324 Cb 0.06 -1.53 -0.33 0.00 1.25 0.00 0.00 42.46 41.92 3h3o s ILE 324 CO 0.66 0.04 0.91 -0.33 0.24 0.00 0.00 174.94 176.46 3h3o h GLU 325 N 4.37 0.37 -3.76 0.37 5.08 -1.90 -3.39 114.58 115.72 3h3o h GLU 325 Ca -0.45 -0.64 -0.24 0.00 -1.00 0.00 0.00 59.36 57.03 3h3o h GLU 325 Cb 1.17 0.24 -0.28 0.00 0.50 0.00 0.00 28.75 30.38 3h3o h GLU 325 CO 0.41 1.31 -0.72 0.95 -1.00 0.00 0.00 179.01 179.96 3h3o s THR 326 N -2.48 0.02 0.45 1.13 -4.23 -1.26 -5.01 115.64 104.25 3h3o s THR 326 Ca -0.13 -0.01 0.32 0.00 -1.18 0.00 0.00 61.69 60.70 3h3o s THR 326 Cb 0.02 -0.03 0.51 0.00 1.34 0.00 0.00 72.50 74.33 3h3o s THR 326 CO 0.86 0.01 1.61 0.28 -0.54 0.00 0.00 174.62 176.85 3h3o h SER 327 N 6.18 0.22 0.81 3.99 0.02 -1.90 0.78 113.55 123.66 3h3o h SER 327 Ca -0.25 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 3h3o h SER 327 Cb 1.21 0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.87 3h3o h SER 327 CO 0.51 -0.18 -0.07 -0.65 -1.14 0.00 0.00 176.83 175.30 3h3o h PRO 328 N 0.07 0.00 0.00 3.45 0.11 -1.98 -2.68 132.00 130.96 3h3o h PRO 328 Ca 0.84 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.91 3h3o h PRO 328 Cb 2.69 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 33.79 3h3o h PRO 328 CO -0.40 0.07 -0.15 0.37 -0.21 0.00 0.00 178.00 177.68 3h3o h GLN 329 N 0.00 0.00 -1.00 1.05 4.15 0.18 -2.84 115.11 116.65 3h3o h GLN 329 Ca -0.00 0.00 0.13 0.00 0.77 0.00 0.00 58.65 59.55 3h3o h GLN 329 Cb 0.49 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.10 3h3o h GLN 329 CO 0.01 0.15 0.63 0.66 -1.93 0.00 0.00 178.83 178.35 3h3o h SER 330 N 0.00 0.91 -0.22 -0.69 4.64 -1.58 -1.40 113.55 115.22 3h3o h SER 330 Ca -0.00 0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.35 3h3o h SER 330 Cb 0.28 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 3h3o h SER 330 CO 0.02 0.47 0.06 -0.08 -0.87 0.00 0.00 176.83 176.43 3h3o h GLU 331 N 0.97 0.35 -0.45 4.77 4.81 -1.70 -1.11 114.58 122.23 3h3o h GLU 331 Ca 0.50 -0.08 0.04 0.00 -0.13 0.00 0.00 59.36 59.69 3h3o h GLU 331 Cb 0.53 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.82 3h3o h GLU 331 CO -0.28 0.45 0.22 1.49 -0.73 0.00 0.00 179.01 180.17 3h3o h GLU 332 N 0.18 0.43 0.55 1.92 4.81 -1.45 -2.30 114.58 118.72 3h3o h GLU 332 Ca 0.07 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 3h3o h GLU 332 Cb 0.26 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.55 3h3o h GLU 332 CO -0.00 0.29 -0.26 -0.07 -0.73 0.00 0.00 179.01 178.23 3h3o h LEU 333 N 0.44 -0.62 -1.06 1.64 -0.00 -1.16 -3.02 115.31 111.52 3h3o h LEU 333 Ca 0.20 -0.00 0.22 0.00 -0.00 0.00 0.00 57.88 58.29 3h3o h LEU 333 Cb 0.11 0.16 -0.11 0.00 -0.00 0.00 0.00 40.66 40.82 3h3o h LEU 333 CO -0.14 -0.40 0.61 0.00 -0.00 0.00 0.00 178.44 178.51 3h3o h ALA 334 N -0.37 1.80 -0.42 1.53 0.00 -1.08 0.61 119.26 121.32 3h3o h ALA 334 Ca -0.08 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3h3o h ALA 334 Cb 0.59 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3h3o h ALA 334 CO 0.12 -0.21 0.10 0.00 0.00 0.00 0.00 179.25 179.26 3h3o h ALA 335 N 1.68 1.38 -0.00 0.00 0.00 -1.30 -2.57 119.26 118.45 3h3o h ALA 335 Ca 0.60 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.34 3h3o h ALA 335 Cb 1.10 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.71 3h3o h ALA 335 CO -0.40 0.44 -0.00 1.63 0.00 0.00 0.00 179.25 180.92 3h3o n LYS 336 N -4.31 0.60 -1.65 0.00 5.02 0.19 -4.89 118.16 113.12 3h3o n LYS 336 Ca 0.03 -0.01 -0.48 0.00 -2.02 0.00 0.00 58.31 55.83 3h3o n LYS 336 Cb 0.20 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.66 3h3o n LYS 336 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h3o n ALA 337 N -1.19 0.71 0.70 7.82 0.00 -0.97 -4.88 120.51 122.70 3h3o n ALA 337 Ca 0.17 0.46 0.08 0.00 0.00 0.00 0.00 53.44 54.15 3h3o n ALA 337 Cb 0.21 -2.28 0.01 0.00 0.00 0.00 0.00 19.45 17.39 3h3o n ALA 337 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3h3o n LYS 338 N 3.31 1.61 -0.50 0.00 5.02 -1.26 -5.00 118.16 121.34 3h3o n LYS 338 Ca 0.18 -0.96 -0.19 0.00 -2.02 0.00 0.00 58.31 55.32 3h3o n LYS 338 Cb 0.26 -1.28 0.16 0.00 -0.02 0.00 0.00 35.03 34.16 3h3o n LYS 338 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h3o n GLY 339 N 1.09 -3.00 1.09 0.72 0.00 -1.26 -4.98 105.19 98.85 3h3o n GLY 339 Ca 0.07 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3h3o n GLY 339 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3h3o n ASP 340 N -4.33 3.11 -3.40 1.61 3.85 -1.26 -4.98 116.55 111.14 3h3o n ASP 340 Ca 0.09 -3.45 -0.17 0.00 -0.71 0.00 0.00 54.79 50.56 3h3o n ASP 340 Cb 0.37 -0.61 0.09 0.00 -1.35 0.00 0.00 41.12 39.62 3h3o n ASP 340 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 3h3o n ASN 341 N -0.88 -2.97 -0.25 -1.12 3.02 -1.26 -4.94 115.26 106.86 3h3o n ASN 341 Ca 0.29 -0.64 0.04 0.00 -0.03 0.00 0.00 54.58 54.25 3h3o n ASN 341 Cb 1.01 -5.14 0.01 0.00 -0.61 0.00 0.00 39.78 35.05 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 -3.95 1.41 -3.55 3.52 0.28 -1.26 -4.93 120.64 112.16 3h3o n GLU 342 Ca -0.25 -0.73 -0.36 0.00 -0.16 0.00 0.00 57.16 55.65 3h3o n GLU 342 Cb 0.66 -1.08 -0.07 0.00 1.43 0.00 0.00 31.44 32.38 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 -1.02 5.30 -0.05 3.84 1.01 -1.26 -4.49 120.40 123.73 3h3o s VAL 343 Ca 0.08 0.55 0.05 0.00 0.00 0.00 0.00 61.98 62.66 3h3o s VAL 343 Cb 0.07 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 3h3o s VAL 343 CO 0.17 0.41 -0.20 -0.31 0.00 0.00 0.00 175.10 175.17 3h3o s TYR 344 N 0.28 1.99 -0.10 5.22 2.02 -0.54 -4.77 117.35 121.46 3h3o s TYR 344 Ca 0.17 -0.57 0.03 0.00 -0.37 0.00 0.00 57.07 56.33 3h3o s TYR 344 Cb -0.13 -1.32 -0.01 0.00 -0.40 0.00 0.00 41.96 40.10 3h3o s TYR 344 CO 0.04 -0.18 -0.20 0.08 -1.57 0.00 0.00 175.55 173.73 3h3o s VAL 345 N -0.07 2.46 -0.45 0.71 1.01 -1.26 0.03 120.40 122.82 3h3o s VAL 345 Ca -0.03 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.09 3h3o s VAL 345 Cb -0.12 -1.96 0.13 0.00 0.00 0.00 0.00 36.38 34.42 3h3o s VAL 345 CO 0.03 0.55 0.21 -0.69 0.00 0.00 0.00 175.10 175.20 3h3o s VAL 346 N 0.14 1.99 -0.50 2.92 1.01 0.90 -4.68 120.40 122.19 3h3o s VAL 346 Ca -0.11 -2.77 -0.06 0.00 0.00 0.00 0.00 61.98 59.04 3h3o s VAL 346 Cb -0.16 -2.41 -0.17 0.00 0.00 0.00 0.00 36.38 33.65 3h3o s VAL 346 CO 0.06 -0.80 2.90 -0.81 0.00 0.00 0.00 175.10 176.46 3h3o n PRO 347 N 3.55 2.17 -1.39 2.72 -0.04 -1.26 -0.54 135.00 140.21 3h3o n PRO 347 Ca 0.06 -1.23 -0.39 0.00 -0.04 0.00 0.00 63.50 61.90 3h3o n PRO 347 Cb 0.35 -2.19 -0.03 0.00 -0.04 0.00 0.00 33.50 31.59 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 3.06 7.48 -0.35 0.55 0.00 -1.26 -4.73 120.51 125.25 3h3o n ALA 348 Ca 0.46 -3.60 0.11 0.00 0.00 0.00 0.00 53.44 50.41 3h3o n ALA 348 Cb 0.54 -3.31 0.29 0.00 0.00 0.00 0.00 19.45 16.97 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 4.96 1.09 -0.03 0.00 0.04 -1.87 -2.08 116.94 119.05 3h3o h PHE 349 Ca 0.86 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 61.66 3h3o h PHE 349 Cb 0.29 -0.34 -0.00 0.00 2.20 0.00 0.00 35.95 38.10 3h3o h PHE 349 CO 1.85 0.33 -0.04 0.25 -0.60 0.00 0.00 178.31 180.10 3h3o n THR 350 N -4.69 1.96 0.00 -1.55 -2.24 -1.26 -4.66 114.28 101.84 3h3o n THR 350 Ca 0.21 -2.33 0.00 0.00 -2.27 0.00 0.00 64.05 59.66 3h3o n THR 350 Cb 0.48 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 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 -1.33 2.80 3.72 3.38 0.00 -0.83 -4.82 105.19 108.10 3h3o n GLY 351 Ca 0.17 -2.00 -0.41 0.00 0.00 0.00 0.00 46.02 43.78 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 0.00 4.42 0.00 0.99 1.43 -0.65 -4.67 118.68 120.20 3h3o s LEU 352 Ca 0.00 1.62 0.00 0.00 -1.03 0.00 0.00 54.13 54.72 3h3o s LEU 352 Cb 0.00 -3.47 0.00 0.00 0.03 0.00 0.00 46.19 42.75 3h3o s LEU 352 CO 0.00 -0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.06 3h3o n GLY 353 N 2.61 1.18 3.77 -3.19 0.00 -1.26 -1.96 105.19 106.33 3h3o n GLY 353 Ca 0.03 -1.58 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 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 -3.73 3.37 -0.29 4.61 0.00 0.13 -0.19 121.76 125.65 3h3o s ALA 354 Ca 0.00 1.26 0.12 0.00 0.00 0.00 0.00 51.96 53.34 3h3o s ALA 354 Cb 0.00 -3.49 0.77 0.00 0.00 0.00 0.00 23.12 20.40 3h3o s ALA 354 CO 0.00 -0.76 1.71 -0.35 0.00 0.00 0.00 175.76 176.36 3h3o n PRO 355 N 0.40 4.51 0.03 0.00 -0.04 -1.26 -4.67 135.00 133.97 3h3o n PRO 355 Ca 0.02 -2.99 -0.22 0.00 -0.04 0.00 0.00 63.50 60.27 3h3o n PRO 355 Cb 0.43 -2.23 -0.14 0.00 -0.04 0.00 0.00 33.50 31.52 3h3o n PRO 355 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3h3o h TYR 356 N 3.56 0.52 -6.62 0.54 0.05 -1.01 -3.45 116.97 110.56 3h3o h TYR 356 Ca 0.05 -0.38 -0.49 0.00 0.05 0.00 0.00 58.73 57.96 3h3o h TYR 356 Cb 1.99 -0.02 0.02 0.00 1.01 0.00 0.00 36.73 39.73 3h3o h TYR 356 CO 1.09 1.59 -0.96 0.91 -1.05 0.00 0.00 178.16 179.74 3h3o n TRP 357 N -3.83 -1.78 -3.91 4.88 7.02 0.73 -4.95 117.44 115.60 3h3o n TRP 357 Ca -0.25 0.43 -0.30 0.00 -1.02 0.00 0.00 57.50 56.35 3h3o n TRP 357 Cb 0.95 -3.02 -0.15 0.00 -2.42 0.00 0.00 31.31 26.68 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 -3.34 4.44 0.02 -0.99 2.15 -0.83 -4.98 116.67 113.15 3h3o s ASP 358 Ca 0.33 -2.17 0.15 0.00 0.43 0.00 0.00 52.55 51.30 3h3o s ASP 358 Cb -0.16 -1.39 0.66 0.00 -0.30 0.00 0.00 42.92 41.73 3h3o s ASP 358 CO 0.91 -0.36 1.49 -1.54 -0.17 0.00 0.00 175.17 175.50 3h3o n SER 359 N 4.21 0.05 -0.47 -0.34 3.41 -1.26 -1.63 113.62 117.58 3h3o n SER 359 Ca 0.03 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.28 3h3o n SER 359 Cb 0.40 -0.52 0.41 0.00 -0.26 0.00 0.00 64.21 64.24 3h3o n SER 359 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3h3o n GLU 360 N -1.55 1.49 -2.95 4.33 1.02 -1.26 -4.60 120.64 117.11 3h3o n GLU 360 Ca 0.04 -0.95 -0.31 0.00 -0.02 0.00 0.00 57.16 55.92 3h3o n GLU 360 Cb 0.18 -1.48 -0.04 0.00 -0.02 0.00 0.00 31.44 30.08 3h3o n GLU 360 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h3o s ALA 361 N -2.16 3.35 0.18 0.62 0.00 -1.07 -1.76 121.76 120.92 3h3o s ALA 361 Ca 0.32 -0.14 0.01 0.00 0.00 0.00 0.00 51.96 52.15 3h3o s ALA 361 Cb 0.20 -2.71 -0.05 0.00 0.00 0.00 0.00 23.12 20.56 3h3o s ALA 361 CO 0.39 0.10 0.04 1.03 0.00 0.00 0.00 175.76 177.33 3h3o s ARG 362 N -3.58 1.14 0.27 0.00 1.81 -1.24 -3.09 118.95 114.26 3h3o s ARG 362 Ca 0.52 -1.57 -0.30 0.00 -1.72 0.00 0.00 55.73 52.66 3h3o s ARG 362 Cb -0.10 -0.12 -0.13 0.00 -0.45 0.00 0.00 34.95 34.15 3h3o s ARG 362 CO 0.27 -0.21 1.37 0.41 -0.68 0.00 0.00 175.30 176.46 3h3o n GLY 363 N -0.26 0.70 3.11 -3.53 0.00 -0.90 -4.42 105.19 99.88 3h3o n GLY 363 Ca -0.04 0.45 -0.08 0.00 0.00 0.00 0.00 46.02 46.35 3h3o n GLY 363 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3o s ALA 364 N -0.34 0.30 -0.02 4.61 0.00 0.30 -4.90 121.76 121.72 3h3o s ALA 364 Ca 0.65 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 51.61 3h3o s ALA 364 Cb -0.63 0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.80 3h3o s ALA 364 CO 0.53 -0.38 -0.05 0.08 0.00 0.00 0.00 175.76 175.94 3h3o s VAL 365 N -3.66 0.45 0.12 0.00 1.01 -1.26 -0.07 120.40 116.99 3h3o s VAL 365 Ca 0.04 -0.18 0.05 0.00 0.00 0.00 0.00 61.98 61.89 3h3o s VAL 365 Cb 0.06 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 3h3o s VAL 365 CO -0.09 0.16 -0.12 -0.36 0.00 0.00 0.00 175.10 174.68 3h3o s PHE 366 N 0.25 1.27 -0.21 5.22 0.08 0.10 -4.88 117.98 119.82 3h3o s PHE 366 Ca -0.03 -0.62 0.00 0.00 0.12 0.00 0.00 56.93 56.41 3h3o s PHE 366 Cb -0.07 -0.67 0.00 0.00 -0.57 0.00 0.00 43.02 41.72 3h3o s PHE 366 CO -0.00 0.09 0.00 0.41 -0.10 0.00 0.00 175.22 175.62 3h3o n GLY 367 N 0.43 0.52 3.77 4.36 0.00 -1.26 -1.47 105.19 111.54 3h3o n GLY 367 Ca -0.15 -0.98 -0.38 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.47 4.17 0.19 0.99 1.43 -1.26 -4.57 118.68 119.16 3h3o s LEU 368 Ca 0.00 2.37 -0.01 0.00 -1.03 0.00 0.00 54.13 55.46 3h3o s LEU 368 Cb 0.00 -4.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.14 3h3o s LEU 368 CO 0.00 -0.72 0.12 0.42 0.23 0.00 0.00 176.35 176.40 3h3o s THR 369 N -1.41 0.02 -1.33 5.49 -4.23 -1.26 -5.02 115.64 107.89 3h3o s THR 369 Ca 0.58 -1.99 0.15 0.00 -1.18 0.00 0.00 61.69 59.25 3h3o s THR 369 Cb -0.31 -2.43 0.23 0.00 1.34 0.00 0.00 72.50 71.32 3h3o s THR 369 CO 0.39 -0.07 1.42 -2.11 -0.54 0.00 0.00 174.62 173.71 3h3o n ARG 370 N -0.25 0.16 0.01 3.99 -4.01 -1.26 -1.90 116.66 113.41 3h3o n ARG 370 Ca 0.01 0.17 0.11 0.00 -1.04 0.00 0.00 57.85 57.10 3h3o n ARG 370 Cb 0.66 -1.50 0.07 0.00 -3.04 0.00 0.00 32.46 28.64 3h3o n ARG 370 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 3h3o n GLY 371 N -0.02 -1.16 3.69 2.89 0.00 -1.26 -4.91 105.19 104.41 3h3o n GLY 371 Ca 0.06 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 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 -3.07 2.64 0.49 2.61 2.01 -0.80 -4.99 115.64 114.53 3h3o s THR 372 Ca 0.08 0.07 0.07 0.00 0.31 0.00 0.00 61.69 62.21 3h3o s THR 372 Cb 0.16 -3.04 0.01 0.00 0.01 0.00 0.00 72.50 69.64 3h3o s THR 372 CO 0.78 -0.00 0.38 0.42 -0.69 0.00 0.00 174.62 175.51 3h3o s THR 373 N 3.03 2.06 0.17 -0.82 -4.23 -1.26 -4.95 115.64 109.65 3h3o s THR 373 Ca 0.82 -1.46 -0.15 0.00 -1.18 0.00 0.00 61.69 59.72 3h3o s THR 373 Cb -0.45 -2.53 0.05 0.00 1.34 0.00 0.00 72.50 70.92 3h3o s THR 373 CO 0.37 0.00 1.83 0.50 -0.54 0.00 0.00 174.62 176.78 3h3o h LYS 374 N 0.91 0.66 -0.86 3.99 3.64 -1.99 -1.35 116.57 121.57 3h3o h LYS 374 Ca -0.39 -0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.04 3h3o h LYS 374 Cb 1.28 -0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 32.89 3h3o h LYS 374 CO 0.59 0.44 0.56 0.93 -2.27 0.00 0.00 179.45 179.70 3h3o h GLU 375 N 0.68 0.83 -0.34 1.90 3.07 -1.94 0.11 114.58 118.89 3h3o h GLU 375 Ca 0.18 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.36 58.94 3h3o h GLU 375 Cb -0.08 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 27.63 3h3o h GLU 375 CO -0.04 0.55 -0.00 -0.44 -1.40 0.00 0.00 179.01 177.68 3h3o h ASP 376 N 0.86 0.60 -0.16 1.42 3.32 -1.61 -1.98 116.42 118.86 3h3o h ASP 376 Ca 0.40 -0.31 -0.04 0.00 0.02 0.00 0.00 57.03 57.10 3h3o h ASP 376 Cb 0.39 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 3h3o h ASP 376 CO -0.16 0.76 -0.05 0.15 -1.72 0.00 0.00 179.24 178.22 3h3o h PHE 377 N 0.42 0.36 -0.63 4.55 3.57 -0.53 -1.82 116.94 122.85 3h3o h PHE 377 Ca 0.10 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.53 3h3o h PHE 377 Cb 0.46 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 3h3o h PHE 377 CO 0.04 0.60 0.41 0.28 -2.23 0.00 0.00 178.31 177.41 3h3o h VAL 378 N 0.01 1.14 -0.64 1.41 2.07 -0.85 -2.30 116.25 117.09 3h3o h VAL 378 Ca 0.04 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.28 3h3o h VAL 378 Cb 0.49 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 3h3o h VAL 378 CO 0.02 0.15 0.42 -0.09 0.02 0.00 0.00 177.57 178.09 3h3o h ARG 379 N 0.83 0.83 -0.73 1.57 2.43 -1.25 -2.63 114.38 115.44 3h3o h ARG 379 Ca 0.24 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.35 3h3o h ARG 379 Cb -0.06 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.26 3h3o h ARG 379 CO -0.07 0.55 0.41 0.00 -1.51 0.00 0.00 179.97 179.35 3h3o h ALA 380 N 1.24 1.35 -0.47 2.80 0.00 -0.90 -2.10 119.26 121.19 3h3o h ALA 380 Ca 0.24 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3h3o h ALA 380 Cb -0.08 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 3h3o h ALA 380 CO -0.06 0.54 0.20 1.15 0.00 0.00 0.00 179.25 181.08 3h3o h THR 381 N 1.01 1.20 -0.69 0.00 2.02 -1.08 -2.68 112.91 112.69 3h3o h THR 381 Ca 0.26 -0.62 -0.07 0.00 0.77 0.00 0.00 66.41 66.75 3h3o h THR 381 Cb 0.01 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 3h3o h THR 381 CO -0.04 0.23 0.16 -0.07 0.37 0.00 0.00 175.52 176.17 3h3o h LEU 382 N 0.62 1.05 -1.03 2.58 3.38 -1.11 -2.94 115.31 117.86 3h3o h LEU 382 Ca 0.16 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3h3o h LEU 382 Cb 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3h3o h LEU 382 CO -0.01 1.01 -0.24 1.56 0.09 0.00 0.00 178.44 180.85 3h3o h GLN 383 N 1.05 0.00 -0.84 1.13 4.20 -1.30 -3.28 115.11 116.07 3h3o h GLN 383 Ca 0.22 0.00 0.20 0.00 0.06 0.00 0.00 58.65 59.13 3h3o h GLN 383 Cb 0.38 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 28.03 3h3o h GLN 383 CO 0.00 0.24 0.25 0.00 -0.67 0.00 0.00 178.83 178.66 3h3o h ALA 384 N 1.76 1.20 -0.77 3.87 0.00 -1.29 0.12 119.26 124.14 3h3o h ALA 384 Ca -0.00 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3h3o h ALA 384 Cb 0.79 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 3h3o h ALA 384 CO 0.03 -0.39 0.37 -0.24 0.00 0.00 0.00 179.25 179.03 3h3o h VAL 385 N 0.28 1.25 -0.80 0.00 3.04 -1.74 -1.58 116.25 116.69 3h3o h VAL 385 Ca 0.51 -0.69 -0.03 0.00 -1.01 0.00 0.00 66.70 65.48 3h3o h VAL 385 Cb 0.96 0.27 -0.04 0.00 -2.01 0.00 0.00 31.29 30.47 3h3o h VAL 385 CO -0.58 0.29 0.40 0.00 -1.01 0.00 0.00 177.57 176.67 3h3o h ALA 386 N 1.19 1.03 0.21 3.17 0.00 -1.01 -0.58 119.26 123.28 3h3o h ALA 386 Ca 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3h3o h ALA 386 Cb 0.12 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3h3o h ALA 386 CO -0.03 0.59 -0.10 1.88 0.00 0.00 0.00 179.25 181.58 3h3o h TYR 387 N 1.13 -0.26 0.00 0.00 0.05 -0.84 -2.35 116.97 114.69 3h3o h TYR 387 Ca 0.28 -0.01 -0.03 0.00 0.05 0.00 0.00 58.73 59.02 3h3o h TYR 387 Cb 0.10 0.09 -0.00 0.00 1.01 0.00 0.00 36.73 37.92 3h3o h TYR 387 CO 0.01 0.06 -0.14 0.37 -1.05 0.00 0.00 178.16 177.40 3h3o h GLN 388 N -0.60 0.00 -0.69 4.88 4.15 -1.27 -0.82 115.11 120.75 3h3o h GLN 388 Ca -0.03 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.33 3h3o h GLN 388 Cb 0.44 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.10 3h3o h GLN 388 CO 0.05 0.14 0.20 0.77 -1.93 0.00 0.00 178.83 178.07 3h3o h SER 389 N 0.00 1.02 -0.18 -0.69 0.02 -0.95 -1.55 113.55 111.22 3h3o h SER 389 Ca -0.00 -0.21 -0.07 0.00 -0.84 0.00 0.00 61.79 60.67 3h3o h SER 389 Cb 0.29 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 3h3o h SER 389 CO 0.02 0.97 -0.09 0.50 -1.14 0.00 0.00 176.83 177.08 3h3o h LYS 390 N 1.02 0.54 -0.40 3.45 3.64 -0.64 -0.36 116.57 123.83 3h3o h LYS 390 Ca 0.22 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3h3o h LYS 390 Cb 0.32 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 3h3o h LYS 390 CO -0.00 0.63 0.25 -0.44 -2.27 0.00 0.00 179.45 177.62 3h3o h ASP 391 N 0.50 0.47 -0.03 4.20 3.32 -0.56 -1.73 116.42 122.59 3h3o h ASP 391 Ca 0.10 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 3h3o h ASP 391 Cb 0.47 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 3h3o h ASP 391 CO 0.03 0.36 0.00 0.58 -1.72 0.00 0.00 179.24 178.49 3h3o h VAL 392 N 0.53 1.23 -0.46 -1.35 2.07 -0.80 -2.02 116.25 115.45 3h3o h VAL 392 Ca 0.14 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 67.02 3h3o h VAL 392 Cb -0.03 1.64 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 3h3o h VAL 392 CO -0.03 0.18 0.20 0.40 0.02 0.00 0.00 177.57 178.35 3h3o h ILE 393 N -0.23 0.92 -0.12 4.57 1.08 -1.02 0.11 117.51 122.81 3h3o h ILE 393 Ca 0.01 -0.14 -0.01 0.00 -0.39 0.00 0.00 64.86 64.33 3h3o h ILE 393 Cb 0.30 0.48 -0.01 0.00 -3.07 0.00 0.00 36.82 34.52 3h3o h ILE 393 CO 0.00 0.07 0.01 0.44 -0.69 0.00 0.00 178.15 177.99 3h3o h ASP 394 N 0.41 0.15 -0.16 1.72 3.32 -1.29 -0.52 116.42 120.06 3h3o h ASP 394 Ca 0.21 -0.01 -0.19 0.00 0.02 0.00 0.00 57.03 57.05 3h3o h ASP 394 Cb 0.15 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.67 3h3o h ASP 394 CO -0.17 0.18 -0.66 0.74 -1.72 0.00 0.00 179.24 177.61 3h3o h THR 395 N 0.17 1.30 -0.32 0.35 2.02 -0.32 -1.92 112.91 114.20 3h3o h THR 395 Ca 0.04 -1.89 -0.03 0.00 0.77 0.00 0.00 66.41 65.30 3h3o h THR 395 Cb 0.10 2.00 -0.02 0.00 -1.74 0.00 0.00 68.15 68.50 3h3o h THR 395 CO -0.00 0.59 0.05 0.24 0.37 0.00 0.00 175.52 176.77 3h3o h MET 396 N 0.42 0.47 0.14 6.66 2.86 -0.12 -0.62 114.93 124.75 3h3o h MET 396 Ca -0.04 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 3h3o h MET 396 Cb 1.29 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.87 3h3o h MET 396 CO 0.14 0.46 -0.07 -0.22 1.06 0.00 0.00 176.91 178.28 3h3o h LYS 397 N 0.46 -0.19 -0.95 1.72 1.63 -1.06 0.12 116.57 118.30 3h3o h LYS 397 Ca 0.11 0.01 0.10 0.00 -0.85 0.00 0.00 60.65 60.02 3h3o h LYS 397 Cb 0.22 0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 31.82 3h3o h LYS 397 CO 0.00 0.18 0.61 -0.22 -3.45 0.00 0.00 179.45 176.57 3h3o h LYS 398 N -0.59 0.96 0.02 1.90 3.64 -1.07 0.20 116.57 121.62 3h3o h LYS 398 Ca -0.02 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.20 3h3o h LYS 398 Cb 0.45 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3h3o h LYS 398 CO 0.03 0.63 -0.41 -0.44 -2.27 0.00 0.00 179.45 176.99 3h3o h ASP 399 N 0.99 0.34 0.44 4.20 5.19 -1.05 -3.39 116.42 123.14 3h3o h ASP 399 Ca 0.44 -0.81 -0.30 0.00 -0.62 0.00 0.00 57.03 55.74 3h3o h ASP 399 Cb 0.38 -0.10 -0.04 0.00 0.18 0.00 0.00 39.33 39.75 3h3o h ASP 399 CO -0.20 1.10 -1.71 0.77 -3.12 0.00 0.00 179.24 176.08 3h3o h SER 400 N -0.39 0.14 0.00 6.45 4.64 -0.64 -3.39 113.55 120.35 3h3o h SER 400 Ca -0.06 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3h3o h SER 400 Cb 1.18 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3h3o h SER 400 CO 0.08 1.24 0.00 0.61 -0.87 0.00 0.00 176.83 177.89 3h3o n GLY 401 N 1.65 2.68 3.77 -0.77 0.00 0.70 -5.00 105.19 108.22 3h3o n GLY 401 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.09 2.96 0.45 -0.61 1.09 -1.26 -5.03 121.20 116.71 3h3o s ILE 402 Ca 0.00 0.75 -0.03 0.00 -1.10 0.00 0.00 60.65 60.26 3h3o s ILE 402 Cb 0.00 -3.39 -0.03 0.00 -1.06 0.00 0.00 42.46 37.98 3h3o s ILE 402 CO 0.00 0.02 0.72 -1.81 -0.10 0.00 0.00 174.94 173.77 3h3o s ASP 403 N -1.22 6.21 -0.39 3.58 -0.00 -1.26 -4.66 116.67 118.92 3h3o s ASP 403 Ca 0.63 0.75 0.01 0.00 -0.00 0.00 0.00 52.55 53.94 3h3o s ASP 403 Cb -0.31 -2.12 0.15 0.00 -0.00 0.00 0.00 42.92 40.64 3h3o s ASP 403 CO 0.38 -0.53 0.25 -0.63 -0.00 0.00 0.00 175.17 174.64 3h3o s ILE 404 N -2.63 0.54 -0.06 0.77 1.01 -1.26 -4.96 121.20 114.61 3h3o s ILE 404 Ca 0.46 -2.17 0.13 0.00 0.00 0.00 0.00 60.65 59.07 3h3o s ILE 404 Cb -0.10 -1.39 -0.08 0.00 0.01 0.00 0.00 42.46 40.90 3h3o s ILE 404 CO 0.42 -1.02 1.20 1.55 0.00 0.00 0.00 174.94 177.08 3h3o h PRO 405 N 6.62 0.00 -4.55 2.79 0.13 -1.97 -3.46 132.00 131.55 3h3o h PRO 405 Ca 0.09 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.76 3h3o h PRO 405 Cb 0.94 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 31.75 3h3o h PRO 405 CO 0.35 0.60 -0.80 -1.17 -0.23 0.00 0.00 178.00 176.75 3h3o s LEU 406 N -6.36 1.68 -0.16 1.56 2.96 -1.26 -2.60 118.68 114.51 3h3o s LEU 406 Ca 0.01 -0.22 0.02 0.00 -0.22 0.00 0.00 54.13 53.71 3h3o s LEU 406 Cb 0.09 -0.65 0.01 0.00 0.50 0.00 0.00 46.19 46.14 3h3o s LEU 406 CO 0.79 0.05 -0.21 -0.22 -1.32 0.00 0.00 176.35 175.44 3h3o s LEU 407 N 0.43 2.14 0.07 -0.68 2.96 -0.93 -4.69 118.68 117.98 3h3o s LEU 407 Ca -0.08 -0.62 -0.19 0.00 -0.22 0.00 0.00 54.13 53.02 3h3o s LEU 407 Cb -0.12 -1.47 -0.07 0.00 0.50 0.00 0.00 46.19 45.04 3h3o s LEU 407 CO 0.02 0.04 0.57 -0.54 -1.32 0.00 0.00 176.35 175.12 3h3o s LYS 408 N 1.05 4.21 0.08 1.98 -0.14 -1.14 -1.98 119.74 123.80 3h3o s LYS 408 Ca -0.01 0.74 0.04 0.00 -1.36 0.00 0.00 55.97 55.39 3h3o s LYS 408 Cb -0.14 -3.24 -0.03 0.00 -1.68 0.00 0.00 37.83 32.73 3h3o s LYS 408 CO -0.07 0.63 -0.12 0.14 -0.76 0.00 0.00 175.35 175.18 3h3o s VAL 409 N -1.09 1.00 0.40 3.17 -7.23 -0.90 -0.63 120.40 115.11 3h3o s VAL 409 Ca 0.29 -1.47 -0.14 0.00 -1.81 0.00 0.00 61.98 58.86 3h3o s VAL 409 Cb -0.20 -1.19 0.05 0.00 0.56 0.00 0.00 36.38 35.61 3h3o s VAL 409 CO 0.19 -0.40 0.77 1.51 -0.31 0.00 0.00 175.10 176.86 3h3o s ASP 410 N -2.10 0.13 0.00 4.85 1.47 -0.74 -2.40 116.67 117.88 3h3o s ASP 410 Ca 0.01 -1.25 0.00 0.00 1.18 0.00 0.00 52.55 52.50 3h3o s ASP 410 Cb -0.06 0.85 0.00 0.00 -0.34 0.00 0.00 42.92 43.37 3h3o s ASP 410 CO 0.01 -1.70 0.00 0.61 0.68 0.00 0.00 175.17 174.77 3h3o n GLY 411 N -0.55 2.45 0.25 2.12 0.00 -0.31 -1.03 105.19 108.13 3h3o n GLY 411 Ca -0.08 -1.89 -0.04 0.00 0.00 0.00 0.00 46.02 44.01 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 0.16 1.32 -0.02 0.00 -1.67 -0.33 103.07 102.54 3h3o h GLY 412 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.58 3h3o h GLY 412 CO 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 176.54 176.33 3h3o n ALA 413 N -2.93 1.63 1.72 3.60 0.00 -1.03 -1.52 120.51 121.98 3h3o n ALA 413 Ca 0.04 -0.04 0.10 0.00 0.00 0.00 0.00 53.44 53.53 3h3o n ALA 413 Cb 0.30 -1.12 0.48 0.00 0.00 0.00 0.00 19.45 19.10 3h3o n ALA 413 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h3o n ALA 414 N -1.16 2.57 -0.09 0.00 0.00 -0.13 -3.51 120.51 118.19 3h3o n ALA 414 Ca 0.04 -0.26 -0.13 0.00 0.00 0.00 0.00 53.44 53.09 3h3o n ALA 414 Cb 0.04 -1.22 -0.05 0.00 0.00 0.00 0.00 19.45 18.23 3h3o n ALA 414 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3h3o h LYS 415 N 0.81 0.66 -5.65 0.00 3.11 -1.44 -3.43 116.57 110.64 3h3o h LYS 415 Ca 0.00 -0.36 -0.47 0.00 -2.81 0.00 0.00 60.65 57.01 3h3o h LYS 415 Cb 0.18 0.02 0.01 0.00 -1.00 0.00 0.00 32.23 31.43 3h3o h LYS 415 CO 0.00 0.97 1.62 1.21 -2.81 0.00 0.00 179.45 180.44 3h3o s ASN 416 N -6.52 4.52 0.15 4.20 3.84 -1.23 -4.86 114.94 115.03 3h3o s ASN 416 Ca -0.12 1.16 -0.16 0.00 0.21 0.00 0.00 52.86 53.95 3h3o s ASN 416 Cb 0.08 -2.50 0.01 0.00 -0.55 0.00 0.00 41.25 38.29 3h3o s ASN 416 CO 0.82 -2.80 1.75 0.44 -2.79 0.00 0.00 177.10 174.52 3h3o h ASP 417 N 19.21 0.52 -0.76 -4.21 3.32 -1.92 -2.15 116.42 130.43 3h3o h ASP 417 Ca -0.26 -0.09 0.12 0.00 0.02 0.00 0.00 57.03 56.82 3h3o h ASP 417 Cb 1.27 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 40.63 3h3o h ASP 417 CO 1.14 0.46 0.50 -0.07 -1.72 0.00 0.00 179.24 179.55 3h3o h LEU 418 N 0.54 0.54 0.03 1.55 3.38 -1.99 -0.44 115.31 118.93 3h3o h LEU 418 Ca 0.15 0.02 -0.22 0.00 0.09 0.00 0.00 57.88 57.92 3h3o h LEU 418 Cb 0.06 -0.09 0.02 0.00 0.09 0.00 0.00 40.66 40.73 3h3o h LEU 418 CO -0.02 0.31 -0.87 0.25 0.09 0.00 0.00 178.44 178.20 3h3o h LEU 419 N 0.59 0.71 -1.13 1.67 5.85 -1.87 -1.89 115.31 119.24 3h3o h LEU 419 Ca 0.36 -0.78 -0.03 0.00 0.84 0.00 0.00 57.88 58.28 3h3o h LEU 419 Cb 0.60 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 3h3o h LEU 419 CO -0.13 1.40 0.29 0.24 -0.34 0.00 0.00 178.44 179.90 3h3o h MET 420 N 0.10 0.90 -0.49 1.25 2.86 -0.86 0.40 114.93 119.08 3h3o h MET 420 Ca -0.12 -0.12 -0.07 0.00 -2.06 0.00 0.00 59.70 57.33 3h3o h MET 420 Cb 1.56 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 33.04 3h3o h MET 420 CO 0.17 0.71 0.05 0.37 1.06 0.00 0.00 176.91 179.27 3h3o h GLN 421 N 0.90 0.84 -0.74 1.72 5.75 -1.10 0.07 115.11 122.53 3h3o h GLN 421 Ca 0.22 -0.24 -0.05 0.00 -0.15 0.00 0.00 58.65 58.43 3h3o h GLN 421 Cb 0.12 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.54 3h3o h GLN 421 CO -0.03 0.85 0.27 0.35 -2.65 0.00 0.00 178.83 177.62 3h3o h PHE 422 N 0.70 1.15 -0.32 3.99 3.57 -0.48 0.19 116.94 125.74 3h3o h PHE 422 Ca 0.15 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.56 3h3o h PHE 422 Cb 0.44 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 3h3o h PHE 422 CO 0.03 0.89 0.21 0.37 -2.23 0.00 0.00 178.31 177.57 3h3o h GLN 423 N 1.09 0.41 -0.28 1.11 5.75 0.27 -1.40 115.11 122.05 3h3o h GLN 423 Ca 0.24 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.71 3h3o h GLN 423 Cb 0.25 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 3h3o h GLN 423 CO -0.02 0.27 0.15 0.00 -2.65 0.00 0.00 178.83 176.59 3h3o h ALA 424 N 1.12 0.36 -0.59 3.38 0.00 -0.40 -1.64 119.26 121.48 3h3o h ALA 424 Ca 0.12 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3h3o h ALA 424 Cb -0.04 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.59 3h3o h ALA 424 CO -0.03 -0.11 0.31 -0.44 0.00 0.00 0.00 179.25 178.98 3h3o h ASP 425 N 0.33 0.45 -0.15 0.00 3.32 -0.39 0.16 116.42 120.14 3h3o h ASP 425 Ca 0.10 0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.08 3h3o h ASP 425 Cb 0.07 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3h3o h ASP 425 CO -0.02 0.30 -0.30 0.40 -1.72 0.00 0.00 179.24 177.90 3h3o h ILE 426 N 0.59 1.36 0.00 0.35 1.08 -1.18 -3.21 117.51 116.50 3h3o h ILE 426 Ca 0.27 -1.55 -0.07 0.00 -0.39 0.00 0.00 64.86 63.12 3h3o h ILE 426 Cb 0.17 1.98 -0.01 0.00 -3.07 0.00 0.00 36.82 35.90 3h3o h ILE 426 CO -0.18 0.47 -0.32 -0.07 -0.69 0.00 0.00 178.15 177.35 3h3o h LEU 427 N 0.09 0.00 0.36 1.44 3.38 -1.21 -3.47 115.31 115.91 3h3o h LEU 427 Ca 0.01 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.62 3h3o h LEU 427 Cb 0.89 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.71 3h3o h LEU 427 CO 0.07 0.32 -0.56 -0.67 0.09 0.00 0.00 178.44 177.69 3h3o n ASP 428 N -3.41 -5.71 -4.15 -0.43 2.03 0.57 -4.99 116.55 100.46 3h3o n ASP 428 Ca 0.00 -0.32 -0.11 0.00 0.52 0.00 0.00 54.79 54.89 3h3o n ASP 428 Cb 0.51 -4.48 -0.10 0.00 -0.72 0.00 0.00 41.12 36.33 3h3o n ASP 428 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3h3o s ILE 429 N -3.16 0.64 0.51 5.18 1.01 -1.19 -4.95 121.20 119.25 3h3o s ILE 429 Ca 0.34 -1.78 -0.20 0.00 0.00 0.00 0.00 60.65 59.01 3h3o s ILE 429 Cb -0.15 -1.48 -0.07 0.00 0.01 0.00 0.00 42.46 40.76 3h3o s ILE 429 CO 0.42 -0.80 1.08 -1.81 0.00 0.00 0.00 174.94 173.84 3h3o s ASP 430 N -2.78 6.07 -0.22 3.58 1.01 -1.07 -4.41 116.67 118.84 3h3o s ASP 430 Ca 0.08 2.06 -0.03 0.00 0.71 0.00 0.00 52.55 55.37 3h3o s ASP 430 Cb 0.03 -2.57 0.07 0.00 1.01 0.00 0.00 42.92 41.46 3h3o s ASP 430 CO -0.04 -0.98 0.06 -0.69 0.21 0.00 0.00 175.17 173.73 3h3o s VAL 431 N -1.86 0.44 -0.36 -1.27 1.01 -0.07 -2.18 120.40 116.11 3h3o s VAL 431 Ca 0.69 -0.65 -0.14 0.00 0.00 0.00 0.00 61.98 61.88 3h3o s VAL 431 Cb -0.20 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.11 3h3o s VAL 431 CO 0.24 -0.34 0.28 -1.58 0.00 0.00 0.00 175.10 173.70 3h3o s GLN 432 N 1.88 3.37 0.28 2.72 0.74 -0.84 -0.52 119.66 127.30 3h3o s GLN 432 Ca 0.02 -0.70 -0.20 0.00 0.05 0.00 0.00 55.36 54.53 3h3o s GLN 432 Cb -0.17 -3.85 -0.09 0.00 1.10 0.00 0.00 33.01 30.00 3h3o s GLN 432 CO -0.13 -0.54 0.79 0.50 -0.55 0.00 0.00 175.29 175.36 3h3o s ARG 433 N 1.77 4.27 0.26 1.67 3.52 0.24 -2.12 118.95 128.55 3h3o s ARG 433 Ca 0.07 0.95 -0.29 0.00 -0.13 0.00 0.00 55.73 56.32 3h3o s ARG 433 Cb -0.18 -2.71 -0.09 0.00 -1.56 0.00 0.00 34.95 30.41 3h3o s ARG 433 CO 0.11 0.29 0.97 0.00 -0.81 0.00 0.00 175.30 175.85 3h3o s ALA 434 N -1.69 3.33 0.20 6.12 0.00 -1.01 -2.58 121.76 126.13 3h3o s ALA 434 Ca 0.48 0.65 -0.14 0.00 0.00 0.00 0.00 51.96 52.96 3h3o s ALA 434 Cb -0.15 -3.23 0.22 0.00 0.00 0.00 0.00 23.12 19.96 3h3o s ALA 434 CO 0.20 0.14 1.65 0.00 0.00 0.00 0.00 175.76 177.75 3h3o h ALA 435 N 3.94 0.43 -2.90 0.00 0.00 -1.90 -3.28 119.26 115.55 3h3o h ALA 435 Ca -0.46 0.21 -0.71 0.00 0.00 0.00 0.00 54.91 53.96 3h3o h ALA 435 Cb 1.20 0.39 -0.26 0.00 0.00 0.00 0.00 17.79 19.13 3h3o h ALA 435 CO 0.67 -0.42 -0.54 1.21 0.00 0.00 0.00 179.25 180.17 3h3o s ASN 436 N -5.23 5.62 0.40 0.00 2.47 -1.26 -4.95 114.94 111.99 3h3o s ASN 436 Ca -0.14 -1.04 0.27 0.00 0.42 0.00 0.00 52.86 52.37 3h3o s ASN 436 Cb 0.18 -1.98 1.42 0.00 -1.45 0.00 0.00 41.25 39.42 3h3o s ASN 436 CO 0.73 -0.37 1.83 -0.07 -3.72 0.00 0.00 177.10 175.50 3h3o h LEU 437 N 8.38 0.00 -5.81 3.21 3.38 -1.92 -3.20 115.31 119.35 3h3o h LEU 437 Ca -0.25 0.00 -0.75 0.00 0.09 0.00 0.00 57.88 56.97 3h3o h LEU 437 Cb 1.10 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.70 3h3o h LEU 437 CO 0.65 0.00 2.22 1.21 0.09 0.00 0.00 178.44 182.61 3h3o n GLU 438 N -2.46 4.57 0.09 1.13 4.07 -1.26 -1.16 120.64 125.62 3h3o n GLU 438 Ca -0.01 -3.60 0.12 0.00 -0.06 0.00 0.00 57.16 53.61 3h3o n GLU 438 Cb 0.08 -2.65 0.45 0.00 -0.06 0.00 0.00 31.44 29.26 3h3o n GLU 438 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 3h3o n THR 439 N 1.72 0.64 -0.05 6.31 -2.24 -1.21 -3.23 114.28 116.21 3h3o n THR 439 Ca 0.58 -0.02 -0.13 0.00 -2.27 0.00 0.00 64.05 62.21 3h3o n THR 439 Cb 0.26 -0.81 -0.07 0.00 -2.10 0.00 0.00 70.33 67.60 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 1.36 -0.04 4.28 2.02 -1.83 -1.49 112.91 117.20 3h3o h THR 440 Ca 0.00 -1.36 -0.10 0.00 0.77 0.00 0.00 66.41 65.72 3h3o h THR 440 Cb 0.53 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.87 3h3o h THR 440 CO 0.00 0.40 -0.43 0.00 0.37 0.00 0.00 175.52 175.85 3h3o h ALA 441 N 0.58 1.20 -0.44 6.16 0.00 -1.89 -2.67 119.26 122.20 3h3o h ALA 441 Ca 0.02 -0.41 -0.13 0.00 0.00 0.00 0.00 54.91 54.39 3h3o h ALA 441 Cb 0.71 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3h3o h ALA 441 CO 0.04 0.57 -0.25 1.25 0.00 0.00 0.00 179.25 180.86 3h3o h LEU 442 N 0.08 0.95 -0.35 0.00 5.85 -1.51 -1.50 115.31 118.83 3h3o h LEU 442 Ca 0.00 -0.37 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 3h3o h LEU 442 Cb 0.80 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 3h3o h LEU 442 CO 0.06 1.14 0.06 1.23 -0.34 0.00 0.00 178.44 180.60 3h3o h GLY 443 N 0.89 0.62 0.85 3.75 0.00 -1.09 -1.42 103.07 106.66 3h3o h GLY 443 Ca 0.10 -0.41 0.04 0.00 0.00 0.00 0.00 47.33 47.06 3h3o h GLY 443 CO 0.07 0.38 0.66 0.00 0.00 0.00 0.00 176.54 177.64 3h3o h ALA 444 N 0.91 1.35 -0.27 3.60 0.00 -1.31 -1.07 119.26 122.46 3h3o h ALA 444 Ca 0.11 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 3h3o h ALA 444 Cb 0.34 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3h3o h ALA 444 CO 0.01 0.54 -0.25 0.00 0.00 0.00 0.00 179.25 179.54 3h3o h ALA 445 N 1.42 1.06 0.37 0.00 0.00 -1.01 -2.55 119.26 118.56 3h3o h ALA 445 Ca 0.41 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3h3o h ALA 445 Cb 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3h3o h ALA 445 CO -0.14 0.57 -0.18 1.88 0.00 0.00 0.00 179.25 181.39 3h3o h TYR 446 N 0.46 -0.46 -1.00 0.00 0.05 -0.14 0.20 116.97 116.08 3h3o h TYR 446 Ca 0.07 -0.01 0.18 0.00 0.05 0.00 0.00 58.73 59.02 3h3o h TYR 446 Cb 0.68 0.15 -0.10 0.00 1.01 0.00 0.00 36.73 38.47 3h3o h TYR 446 CO 0.02 -0.17 0.62 -0.07 -1.05 0.00 0.00 178.16 177.51 3h3o h LEU 447 N -0.72 0.79 -0.07 3.88 3.38 -1.21 0.51 115.31 121.87 3h3o h LEU 447 Ca -0.05 0.09 -0.25 0.00 0.09 0.00 0.00 57.88 57.76 3h3o h LEU 447 Cb 0.50 -0.06 0.02 0.00 0.09 0.00 0.00 40.66 41.21 3h3o h LEU 447 CO 0.08 0.31 -0.96 0.00 0.09 0.00 0.00 178.44 177.96 3h3o h ALA 448 N 1.63 0.22 -0.09 1.53 0.00 -1.28 -2.73 119.26 118.54 3h3o h ALA 448 Ca 0.56 -0.67 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3h3o h ALA 448 Cb 0.85 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 3h3o h ALA 448 CO -0.35 0.71 0.05 0.78 0.00 0.00 0.00 179.25 180.44 3h3o h GLY 449 N 0.58 0.13 0.87 0.00 0.00 0.67 -2.64 103.07 102.66 3h3o h GLY 449 Ca -0.10 -0.05 0.03 0.00 0.00 0.00 0.00 47.33 47.21 3h3o h GLY 449 CO 0.19 0.05 0.49 1.41 0.00 0.00 0.00 176.54 178.68 3h3o h LEU 450 N 0.08 0.81 -2.06 3.11 3.38 -1.02 0.29 115.31 119.90 3h3o h LEU 450 Ca 0.03 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3h3o h LEU 450 Cb 0.03 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 3h3o h LEU 450 CO -0.01 0.56 -0.07 0.00 0.09 0.00 0.00 178.44 179.01 3h3o h ALA 451 N 1.33 1.56 -0.16 1.53 0.00 -1.19 -2.74 119.26 119.59 3h3o h ALA 451 Ca 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3h3o h ALA 451 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3h3o h ALA 451 CO -0.11 0.09 0.00 1.33 0.00 0.00 0.00 179.25 180.56 3h3o n VAL 452 N -3.99 0.43 -0.69 0.00 0.24 -0.89 -4.71 118.33 108.72 3h3o n VAL 452 Ca -0.03 -0.71 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 3h3o n VAL 452 Cb 0.16 0.92 0.00 0.00 -1.47 0.00 0.00 33.84 33.45 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 0.59 0.68 0.25 7.63 0.00 -0.26 -4.91 105.19 109.18 3h3o n GLY 453 Ca 0.09 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.19 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 0.00 -3.90 1.61 3.57 -0.77 -3.40 116.94 114.05 3h3o h PHE 454 Ca 0.00 0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.18 3h3o h PHE 454 Cb 0.00 0.00 -0.28 0.00 2.79 0.00 0.00 35.95 38.46 3h3o h PHE 454 CO 0.00 0.06 -0.75 -1.58 -2.23 0.00 0.00 178.31 173.80 3h3o s TRP 455 N -4.86 0.46 -0.04 0.41 0.51 -1.21 -4.97 118.94 109.24 3h3o s TRP 455 Ca -0.05 -0.10 -0.24 0.00 -2.12 0.00 0.00 56.10 53.59 3h3o s TRP 455 Cb 0.16 -0.30 -0.23 0.00 -0.81 0.00 0.00 33.47 32.30 3h3o s TRP 455 CO 0.66 -0.01 1.07 -0.22 -0.51 0.00 0.00 176.95 177.94 3h3o h LYS 456 N 5.97 0.18 -3.33 4.98 3.64 -1.91 -3.37 116.57 122.74 3h3o h LYS 456 Ca -0.28 -0.18 -0.10 0.00 -1.27 0.00 0.00 60.65 58.82 3h3o h LYS 456 Cb 1.19 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.04 3h3o h LYS 456 CO 0.50 0.89 0.15 0.16 -2.27 0.00 0.00 179.45 178.87 3h3o s ASP 457 N -6.27 0.32 0.52 4.20 3.84 -1.26 -5.02 116.67 113.00 3h3o s ASP 457 Ca -0.16 -1.30 0.16 0.00 -0.00 0.00 0.00 52.55 51.26 3h3o s ASP 457 Cb 0.01 0.82 1.29 0.00 -1.38 0.00 0.00 42.92 43.65 3h3o s ASP 457 CO 0.74 -1.62 2.15 -0.07 -0.00 0.00 0.00 175.17 176.37 3h3o h LEU 458 N 2.02 0.00 -0.84 2.11 3.38 -2.00 -2.46 115.31 117.52 3h3o h LEU 458 Ca -0.32 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.56 3h3o h LEU 458 Cb 1.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 3h3o h LEU 458 CO 0.41 0.00 -0.06 0.44 0.09 0.00 0.00 178.44 179.33 3h3o h ASP 459 N 0.00 0.79 0.36 -0.43 3.32 -1.99 -1.21 116.42 117.25 3h3o h ASP 459 Ca -0.00 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 56.76 3h3o h ASP 459 Cb 0.00 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 3h3o h ASP 459 CO 0.00 0.89 -0.35 -0.08 -1.72 0.00 0.00 179.24 177.98 3h3o h GLU 460 N 0.74 0.00 -0.06 3.56 4.81 -1.85 -2.75 114.58 119.03 3h3o h GLU 460 Ca 0.13 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 3h3o h GLU 460 Cb 0.54 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3h3o h GLU 460 CO 0.03 0.35 -0.25 -0.07 -0.73 0.00 0.00 179.01 178.34 3h3o h LEU 461 N 0.00 0.33 -2.68 1.64 3.38 -1.38 -3.02 115.31 113.58 3h3o h LEU 461 Ca -0.00 -0.64 0.00 0.00 0.09 0.00 0.00 57.88 57.33 3h3o h LEU 461 Cb 0.63 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3h3o h LEU 461 CO 0.05 0.91 0.00 0.11 0.09 0.00 0.00 178.44 179.60 3h3o h LYS 462 N -0.24 0.00 0.70 1.13 1.57 -1.10 -2.29 116.57 116.34 3h3o h LYS 462 Ca -0.01 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 3h3o h LYS 462 Cb 0.90 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.21 3h3o h LYS 462 CO 0.05 0.00 -0.33 0.77 -0.57 0.00 0.00 179.45 179.37 3h3o h SER 463 N 0.00 -0.79 0.00 0.86 0.02 -1.36 -3.13 113.55 109.16 3h3o h SER 463 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3h3o h SER 463 Cb 0.01 0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.75 3h3o h SER 463 CO 0.00 -0.41 0.00 1.15 -1.14 0.00 0.00 176.83 176.43 3h3o n MET 464 N -5.37 0.52 -2.67 3.45 0.00 -0.86 -4.81 117.12 107.38 3h3o n MET 464 Ca -0.12 0.00 -0.42 0.00 0.00 0.00 0.00 57.70 57.17 3h3o n MET 464 Cb 0.37 -1.24 -0.03 0.00 0.00 0.00 0.00 33.22 32.31 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 0.43 3.21 -0.23 3.17 0.00 -1.18 -4.97 121.76 122.19 3h3o s ALA 465 Ca 0.00 0.60 -0.18 0.00 0.00 0.00 0.00 51.96 52.38 3h3o s ALA 465 Cb 0.00 -3.34 -0.15 0.00 0.00 0.00 0.00 23.12 19.63 3h3o s ALA 465 CO 0.00 -0.22 -0.06 0.39 0.00 0.00 0.00 175.76 175.87 3h3o n GLU 466 N 3.66 0.56 -0.62 0.00 1.02 -1.26 -5.12 120.64 118.89 3h3o n GLU 466 Ca 0.06 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.63 3h3o n GLU 466 Cb 0.50 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 3h3o n GLU 466 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 3h3o n GLU 467 N -4.38 0.00 -0.18 3.49 2.13 -1.26 -5.05 120.64 115.39 3h3o n GLU 467 Ca -0.38 0.35 0.00 0.00 0.66 0.00 0.00 57.16 57.79 3h3o n GLU 467 Cb 0.72 -0.27 0.00 0.00 0.27 0.00 0.00 31.44 32.16 3h3o n GLU 467 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3h3o n GLY 468 N 0.91 0.09 3.76 8.31 0.00 -1.06 -4.69 105.19 112.52 3h3o n GLY 468 Ca 0.00 -1.81 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 3h3o n GLY 468 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3h3o s GLN 469 N -0.79 4.37 0.15 1.61 0.74 -1.12 -4.69 119.66 119.93 3h3o s GLN 469 Ca 0.00 2.19 -0.04 0.00 0.05 0.00 0.00 55.36 57.56 3h3o s GLN 469 Cb 0.00 -3.09 -0.05 0.00 1.10 0.00 0.00 33.01 30.97 3h3o s GLN 469 CO 0.00 -0.19 0.37 1.41 -0.55 0.00 0.00 175.29 176.33 3h3o s MET 470 N -1.53 3.58 -0.09 1.67 -2.45 -1.26 -0.60 119.30 118.62 3h3o s MET 470 Ca 0.50 -0.17 -0.01 0.00 -1.25 0.00 0.00 55.69 54.77 3h3o s MET 470 Cb -0.39 -2.86 0.03 0.00 1.25 0.00 0.00 34.83 32.86 3h3o s MET 470 CO 0.50 0.46 -0.04 -0.06 1.05 0.00 0.00 175.02 176.93 3h3o s PHE 471 N -1.70 1.07 0.06 4.11 0.08 0.32 -4.96 117.98 116.96 3h3o s PHE 471 Ca 0.40 -0.45 0.05 0.00 0.12 0.00 0.00 56.93 57.06 3h3o s PHE 471 Cb -0.12 -1.00 -0.04 0.00 -0.57 0.00 0.00 43.02 41.29 3h3o s PHE 471 CO 0.26 -0.40 -0.08 0.99 -0.10 0.00 0.00 175.22 175.89 3h3o s THR 472 N 1.74 3.53 0.30 0.64 2.01 -1.26 -0.89 115.64 121.71 3h3o s THR 472 Ca 0.03 -1.03 -0.30 0.00 0.31 0.00 0.00 61.69 60.71 3h3o s THR 472 Cb -0.13 -2.60 -0.11 0.00 0.01 0.00 0.00 72.50 69.67 3h3o s THR 472 CO -0.06 0.24 1.54 -2.84 -0.69 0.00 0.00 174.62 172.81 3h3o s PRO 473 N -1.86 4.15 -0.33 4.92 0.02 -1.26 -4.75 135.00 135.89 3h3o s PRO 473 Ca 0.20 2.52 0.16 0.00 0.02 0.00 0.00 61.00 63.89 3h3o s PRO 473 Cb -0.11 -3.03 0.44 0.00 0.02 0.00 0.00 34.50 31.82 3h3o s PRO 473 CO 0.11 -0.56 1.30 -0.85 -0.33 0.00 0.00 177.00 176.67 3h3o n GLU 474 N 1.87 1.39 -4.83 5.54 0.28 -1.26 -5.00 120.64 118.62 3h3o n GLU 474 Ca 0.06 -2.26 -0.27 0.00 -0.16 0.00 0.00 57.16 54.54 3h3o n GLU 474 Cb 0.38 -0.46 -0.16 0.00 1.43 0.00 0.00 31.44 32.63 3h3o n GLU 474 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 177.13 178.38 3h3o s MET 475 N -1.39 1.99 0.61 3.44 1.75 -1.26 -5.08 119.30 119.37 3h3o s MET 475 Ca 0.19 -0.60 -0.18 0.00 -1.25 0.00 0.00 55.69 53.86 3h3o s MET 475 Cb 0.41 -1.65 -0.07 0.00 2.84 0.00 0.00 34.83 36.36 3h3o s MET 475 CO -0.07 0.17 0.62 -2.30 -0.65 0.00 0.00 175.02 172.78 3h3o n PRO 476 N 3.41 0.54 -0.22 4.11 -0.02 -1.26 -4.83 135.00 136.72 3h3o n PRO 476 Ca -0.20 0.22 -0.05 0.00 -2.02 0.00 0.00 63.50 61.45 3h3o n PRO 476 Cb 0.53 -1.83 0.12 0.00 -0.02 0.00 0.00 33.50 32.29 3h3o n PRO 476 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h3o h ALA 477 N 0.14 1.11 -0.64 3.55 0.00 -1.99 -2.94 119.26 118.49 3h3o h ALA 477 Ca -0.46 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.17 3h3o h ALA 477 Cb 1.38 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 3h3o h ALA 477 CO 0.47 0.62 0.11 1.49 0.00 0.00 0.00 179.25 181.94 3h3o h GLU 478 N 1.01 1.05 -0.08 0.00 4.81 -1.99 -1.94 114.58 117.44 3h3o h GLU 478 Ca 0.23 -0.28 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 3h3o h GLU 478 Cb 0.26 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.51 3h3o h GLU 478 CO -0.01 0.97 0.02 1.49 -0.73 0.00 0.00 179.01 180.75 3h3o h GLU 479 N 0.97 0.13 -0.26 1.92 4.81 -1.91 -2.11 114.58 118.12 3h3o h GLU 479 Ca 0.20 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.44 3h3o h GLU 479 Cb 0.42 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 3h3o h GLU 479 CO 0.01 0.31 -0.02 -0.09 -0.73 0.00 0.00 179.01 178.49 3h3o h ARG 480 N -0.08 0.05 0.00 1.92 2.43 -1.46 -0.73 114.38 116.51 3h3o h ARG 480 Ca 0.02 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.16 3h3o h ARG 480 Cb 0.24 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.78 3h3o h ARG 480 CO 0.00 0.03 -0.14 -0.44 -1.51 0.00 0.00 179.97 177.92 3h3o h ASP 481 N 0.05 0.00 0.23 -3.80 3.32 -1.29 -1.80 116.42 113.13 3h3o h ASP 481 Ca 0.13 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 3h3o h ASP 481 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3h3o h ASP 481 CO -0.23 0.14 -0.11 0.78 -1.72 0.00 0.00 179.24 178.09 3h3o h ASN 482 N 0.00 -0.26 -0.64 6.45 2.35 -0.61 -2.46 115.58 120.41 3h3o h ASN 482 Ca -0.00 -0.18 0.13 0.00 -0.55 0.00 0.00 56.30 55.70 3h3o h ASN 482 Cb 0.26 0.07 -0.12 0.00 0.05 0.00 0.00 38.32 38.58 3h3o h ASN 482 CO 0.02 0.25 -0.15 -0.07 -1.65 0.00 0.00 177.43 175.83 3h3o h LEU 483 N -1.00 -0.57 -1.06 1.61 3.38 -1.06 0.48 115.31 117.10 3h3o h LEU 483 Ca -0.03 0.19 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 3h3o h LEU 483 Cb 0.43 0.39 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 3h3o h LEU 483 CO 0.05 -0.21 -0.38 0.22 0.09 0.00 0.00 178.44 178.21 3h3o h TYR 484 N 0.01 0.18 -0.34 1.13 3.20 -1.44 -2.64 116.97 117.07 3h3o h TYR 484 Ca 0.31 -0.05 -0.13 0.00 3.14 0.00 0.00 58.73 62.00 3h3o h TYR 484 Cb 0.48 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 3h3o h TYR 484 CO -0.51 0.53 -0.33 1.49 -1.64 0.00 0.00 178.16 177.70 3h3o h GLU 485 N 0.14 0.74 -0.69 1.82 4.57 -0.47 -2.47 114.58 118.21 3h3o h GLU 485 Ca 0.01 -0.35 -0.04 0.00 -1.18 0.00 0.00 59.36 57.81 3h3o h GLU 485 Cb 0.74 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.29 3h3o h GLU 485 CO 0.06 0.96 0.28 0.78 -1.18 0.00 0.00 179.01 179.91 3h3o h GLY 486 N 0.95 1.10 0.86 1.92 0.00 -0.84 -2.58 103.07 104.48 3h3o h GLY 486 Ca 0.07 -0.60 0.01 0.00 0.00 0.00 0.00 47.33 46.81 3h3o h GLY 486 CO 0.07 0.56 -0.03 -0.25 0.00 0.00 0.00 176.54 176.89 3h3o h TRP 487 N 0.98 -0.08 -0.96 5.60 2.91 -1.26 0.15 115.95 123.29 3h3o h TRP 487 Ca 0.23 0.01 0.10 0.00 1.13 0.00 0.00 58.89 60.36 3h3o h TRP 487 Cb 0.20 0.04 -0.07 0.00 -0.51 0.00 0.00 29.16 28.82 3h3o h TRP 487 CO 0.01 -0.05 0.61 0.87 -1.03 0.00 0.00 178.44 178.86 3h3o h LYS 488 N -0.04 0.95 0.00 2.65 1.57 -1.31 0.19 116.57 120.59 3h3o h LYS 488 Ca 0.03 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.62 3h3o h LYS 488 Cb 0.08 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 3h3o h LYS 488 CO -0.06 0.63 -0.61 1.96 -0.57 0.00 0.00 179.45 180.80 3h3o h GLN 489 N 0.98 0.00 -0.27 3.15 4.20 -0.98 0.30 115.11 122.50 3h3o h GLN 489 Ca 0.45 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.99 3h3o h GLN 489 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 3h3o h GLN 489 CO -0.21 0.61 -0.50 0.00 -0.67 0.00 0.00 178.83 178.06 3h3o h ALA 490 N 1.39 0.42 -0.31 3.87 0.00 0.15 -1.59 119.26 123.20 3h3o h ALA 490 Ca -0.01 -0.49 -0.12 0.00 0.00 0.00 0.00 54.91 54.29 3h3o h ALA 490 Cb 1.13 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3h3o h ALA 490 CO 0.08 0.60 -0.30 0.28 0.00 0.00 0.00 179.25 179.92 3h3o h VAL 491 N 0.58 1.28 -0.68 0.00 2.07 -0.61 -0.90 116.25 117.99 3h3o h VAL 491 Ca 0.01 -1.41 -0.08 0.00 0.82 0.00 0.00 66.70 66.05 3h3o h VAL 491 Cb 1.10 1.36 -0.03 0.00 -1.52 0.00 0.00 31.29 32.21 3h3o h VAL 491 CO 0.11 0.46 0.12 0.00 0.02 0.00 0.00 177.57 178.28 3h3o h ALA 492 N 1.12 0.93 -0.05 1.67 0.00 -0.81 -1.59 119.26 120.54 3h3o h ALA 492 Ca 0.07 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 3h3o h ALA 492 Cb 0.79 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3h3o h ALA 492 CO 0.06 0.67 -0.60 0.00 0.00 0.00 0.00 179.25 179.38 3h3o h ALA 493 N 1.08 0.89 -0.35 0.00 0.00 -1.05 -3.10 119.26 116.73 3h3o h ALA 493 Ca 0.21 -0.54 -0.14 0.00 0.00 0.00 0.00 54.91 54.44 3h3o h ALA 493 Cb 0.42 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3h3o h ALA 493 CO 0.01 0.73 -0.33 1.15 0.00 0.00 0.00 179.25 180.81 3h3o h THR 494 N 0.14 1.28 0.00 0.00 2.02 -0.76 -2.98 112.91 112.60 3h3o h THR 494 Ca -0.01 -1.49 0.00 0.00 0.77 0.00 0.00 66.41 65.69 3h3o h THR 494 Cb 1.10 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 3h3o h THR 494 CO 0.09 0.49 0.00 1.56 0.37 0.00 0.00 175.52 178.03 3h3o h GLN 495 N 0.65 0.00 0.00 6.66 4.20 -1.23 -2.95 115.11 122.44 3h3o h GLN 495 Ca 0.07 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.69 3h3o h GLN 495 Cb 0.87 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 3h3o h GLN 495 CO 0.08 0.00 -0.43 1.79 -0.67 0.00 0.00 178.83 179.60 3h3o h THR 496 N 0.00 0.83 -2.72 -0.54 1.35 -1.45 -3.40 112.91 106.98 3h3o h THR 496 Ca 0.00 -1.87 -0.67 0.00 -0.55 0.00 0.00 66.41 63.32 3h3o h THR 496 Cb 0.45 2.19 -0.17 0.00 -1.73 0.00 0.00 68.15 68.89 3h3o h THR 496 CO 0.00 0.42 0.45 0.12 -0.25 0.00 0.00 175.52 176.26 3h3o s PHE 497 N -3.24 2.91 -0.22 4.73 2.19 -1.11 -5.03 117.98 118.20 3h3o s PHE 497 Ca 0.02 -0.91 -0.13 0.00 0.33 0.00 0.00 56.93 56.24 3h3o s PHE 497 Cb 0.09 -4.19 -0.04 0.00 -1.31 0.00 0.00 43.02 37.57 3h3o s PHE 497 CO 0.71 -1.48 0.29 0.15 1.83 0.00 0.00 175.22 176.72 3h3o s LYS 498 N 3.20 4.11 -0.28 10.12 1.02 -1.26 -4.67 119.74 131.99 3h3o s LYS 498 Ca 0.21 -0.02 -0.14 0.00 0.02 0.00 0.00 55.97 56.04 3h3o s LYS 498 Cb -0.17 -3.55 -0.04 0.00 -0.52 0.00 0.00 37.83 33.56 3h3o s LYS 498 CO 0.04 -0.01 0.31 -0.06 -0.92 0.00 0.00 175.35 174.71 3h3o s PHE 499 N 1.26 3.23 0.00 3.18 0.08 -0.72 -5.07 117.98 119.94 3h3o s PHE 499 Ca 0.14 0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.46 3h3o s PHE 499 Cb -0.14 -2.51 0.00 0.00 -0.57 0.00 0.00 43.02 39.80 3h3o s PHE 499 CO 0.07 -0.22 0.00 0.36 -0.10 0.00 0.00 175.22 175.33