#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h5d h TYR 3 N 0.00 0.65 -0.23 0.66 3.20 -1.93 -2.65 116.97 116.68 3h5d h TYR 3 Ca 0.00 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.74 3h5d h TYR 3 Cb 0.00 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 3h5d h TYR 3 CO 0.00 0.33 -0.48 1.96 -1.64 0.00 0.00 178.16 178.33 3h5d h GLN 4 N 0.63 0.60 -0.34 1.82 1.08 -1.99 0.12 115.11 117.03 3h5d h GLN 4 Ca 0.31 -0.34 0.02 0.00 -1.45 0.00 0.00 58.65 57.19 3h5d h GLN 4 Cb 0.39 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.82 3h5d h GLN 4 CO -0.10 0.94 0.19 -0.44 -0.95 0.00 0.00 178.83 178.47 3h5d h ASP 5 N 0.47 0.29 0.92 1.46 3.32 -1.86 -3.27 116.42 117.76 3h5d h ASP 5 Ca 0.03 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 3h5d h ASP 5 Cb 1.01 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 3h5d h ASP 5 CO 0.09 0.21 -1.11 -0.07 -1.72 0.00 0.00 179.24 176.65 3h5d h LEU 6 N 0.38 0.00 -1.69 1.55 -0.00 -1.40 -3.40 115.31 110.74 3h5d h LEU 6 Ca 0.14 0.00 0.42 0.00 -0.00 0.00 0.00 57.88 58.43 3h5d h LEU 6 Cb 0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 40.63 3h5d h LEU 6 CO -0.08 0.19 1.20 0.07 -0.00 0.00 0.00 178.44 179.82 3h5d h LYS 7 N 0.00 0.00 0.00 1.13 2.10 -0.81 0.11 116.57 119.11 3h5d h LYS 7 Ca -0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 3h5d h LYS 7 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 3h5d h LYS 7 CO 0.02 0.00 -0.87 0.39 -2.00 0.00 0.00 179.45 176.98 3h5d n GLU 8 N -3.73 1.76 -1.68 0.07 -0.58 -1.26 -5.00 120.64 110.22 3h5d n GLU 8 Ca 0.32 -0.02 -0.40 0.00 -0.42 0.00 0.00 57.16 56.64 3h5d n GLU 8 Cb 1.64 -1.24 0.03 0.00 -0.57 0.00 0.00 31.44 31.30 3h5d n GLU 8 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h5d n LYS 10 N -0.45 0.00 -3.95 0.00 4.76 -1.26 -4.41 118.16 112.85 3h5d n LYS 10 Ca 0.10 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.23 3h5d n LYS 10 Cb 0.42 -0.64 -0.14 0.00 -1.84 0.00 0.00 35.03 32.83 3h5d n LYS 10 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3h5d s ILE 11 N -1.85 2.30 -0.24 -0.18 1.01 -1.26 -1.27 121.20 119.72 3h5d s ILE 11 Ca 0.00 -2.78 -0.21 0.00 0.00 0.00 0.00 60.65 57.66 3h5d s ILE 11 Cb 0.00 -2.65 -0.02 0.00 0.01 0.00 0.00 42.46 39.80 3h5d s ILE 11 CO 0.00 -0.72 0.66 -0.63 0.00 0.00 0.00 174.94 174.25 3h5d s ILE 12 N 0.34 4.97 -0.07 2.92 1.09 -0.40 -2.03 121.20 128.02 3h5d s ILE 12 Ca 0.14 1.20 -0.19 0.00 -1.10 0.00 0.00 60.65 60.71 3h5d s ILE 12 Cb -0.23 -3.96 -0.05 0.00 -1.06 0.00 0.00 42.46 37.17 3h5d s ILE 12 CO -0.05 0.03 0.52 -0.89 -0.10 0.00 0.00 174.94 174.46 3h5d s THR 13 N 2.41 5.08 -0.97 2.92 2.01 -0.58 0.75 115.64 127.27 3h5d s THR 13 Ca 0.28 1.06 -0.22 0.00 0.31 0.00 0.00 61.69 63.13 3h5d s THR 13 Cb -0.16 -3.86 0.08 0.00 0.01 0.00 0.00 72.50 68.58 3h5d s THR 13 CO 0.09 0.37 1.32 0.00 -0.69 0.00 0.00 174.62 175.71 3h5d s ALA 14 N 0.23 2.94 0.39 7.40 0.00 0.27 -0.08 121.76 132.91 3h5d s ALA 14 Ca 0.28 -2.38 -0.25 0.00 0.00 0.00 0.00 51.96 49.61 3h5d s ALA 14 Cb -0.16 -4.34 -0.09 0.00 0.00 0.00 0.00 23.12 18.53 3h5d s ALA 14 CO 0.13 -3.37 1.08 0.12 0.00 0.00 0.00 175.76 173.73 3h5d s PHE 15 N 4.22 3.23 0.95 0.00 5.36 -0.86 -4.71 117.98 126.17 3h5d s PHE 15 Ca 0.40 1.63 -0.15 0.00 -0.96 0.00 0.00 56.93 57.85 3h5d s PHE 15 Cb -0.02 -3.21 0.19 0.00 -0.34 0.00 0.00 43.02 39.64 3h5d s PHE 15 CO -0.08 -0.80 1.31 0.96 -1.46 0.00 0.00 175.22 175.14 3h5d s ILE 16 N -1.56 2.00 -0.26 3.12 -4.36 -1.26 -3.29 121.20 115.60 3h5d s ILE 16 Ca 0.57 -0.01 0.02 0.00 -0.26 0.00 0.00 60.65 60.97 3h5d s ILE 16 Cb -0.25 -2.99 0.06 0.00 1.25 0.00 0.00 42.46 40.53 3h5d s ILE 16 CO 0.31 0.00 -0.07 -0.89 0.24 0.00 0.00 174.94 174.53 3h5d s THR 17 N -3.86 1.92 0.36 8.37 2.01 -1.26 -4.79 115.64 118.39 3h5d s THR 17 Ca 0.73 -1.54 -0.28 0.00 0.31 0.00 0.00 61.69 60.91 3h5d s THR 17 Cb -0.04 -2.12 -0.10 0.00 0.01 0.00 0.00 72.50 70.24 3h5d s THR 17 CO 0.53 -0.11 1.35 -2.84 -0.69 0.00 0.00 174.62 172.85 3h5d s PRO 18 N 1.20 4.23 0.12 4.92 0.02 -1.25 -4.93 135.00 139.31 3h5d s PRO 18 Ca -0.06 2.29 0.08 0.00 0.02 0.00 0.00 61.00 63.34 3h5d s PRO 18 Cb -0.19 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 3h5d s PRO 18 CO -0.06 -0.32 -0.20 -0.06 -0.33 0.00 0.00 177.00 176.02 3h5d s PHE 19 N -1.16 1.81 0.78 6.54 2.99 -0.51 -0.42 117.98 128.01 3h5d s PHE 19 Ca 0.51 -0.43 -0.12 0.00 0.00 0.00 0.00 56.93 56.90 3h5d s PHE 19 Cb -0.41 -0.97 0.06 0.00 0.00 0.00 0.00 43.02 41.70 3h5d s PHE 19 CO 0.55 0.24 1.12 -1.01 -0.00 0.00 0.00 175.22 176.12 3h5d s HIS 20 N -1.38 3.01 0.61 0.36 3.76 0.13 -4.04 115.29 117.75 3h5d s HIS 20 Ca 0.09 0.98 0.39 0.00 -0.15 0.00 0.00 55.06 56.37 3h5d s HIS 20 Cb -0.09 -3.22 2.16 0.00 1.11 0.00 0.00 32.58 32.54 3h5d s HIS 20 CO 0.05 -1.61 2.31 0.93 -0.85 0.00 0.00 174.74 175.57 3h5d h GLU 21 N -0.96 0.00 0.00 1.40 4.39 -1.99 -0.13 114.58 117.29 3h5d h GLU 21 Ca -0.46 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.24 3h5d h GLU 21 Cb 1.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 3h5d h GLU 21 CO 0.63 0.01 0.00 -0.40 -1.16 0.00 0.00 179.01 178.09 3h5d n ASP 22 N -3.36 0.19 0.00 1.42 3.85 -1.26 -4.89 116.55 112.50 3h5d n ASP 22 Ca -0.03 0.52 0.00 0.00 -0.71 0.00 0.00 54.79 54.57 3h5d n ASP 22 Cb 0.09 -0.57 0.00 0.00 -1.35 0.00 0.00 41.12 39.29 3h5d n ASP 22 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3h5d n GLY 23 N 1.29 2.55 3.77 6.12 0.00 -0.06 -5.06 105.19 113.80 3h5d n GLY 23 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 3h5d n GLY 23 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h5d s SER 24 N -0.54 6.73 0.29 1.61 0.01 -1.26 -4.57 113.70 115.97 3h5d s SER 24 Ca 0.00 2.36 -0.28 0.00 1.31 0.00 0.00 55.95 59.34 3h5d s SER 24 Cb 0.00 -2.62 -0.14 0.00 0.21 0.00 0.00 66.02 63.47 3h5d s SER 24 CO 0.00 -0.53 1.05 -0.38 0.41 0.00 0.00 173.24 173.79 3h5d n ILE 25 N 0.40 1.91 -3.43 1.44 5.41 -1.26 0.20 119.36 124.02 3h5d n ILE 25 Ca 0.03 -0.48 -0.44 0.00 1.00 0.00 0.00 62.75 62.86 3h5d n ILE 25 Cb 0.46 -1.05 -0.03 0.00 -0.71 0.00 0.00 39.64 38.30 3h5d n ILE 25 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 3h5d s ASN 26 N -0.48 6.51 0.00 4.38 3.84 0.44 -4.61 114.94 125.02 3h5d s ASN 26 Ca 0.59 -2.97 0.21 0.00 0.21 0.00 0.00 52.86 50.91 3h5d s ASN 26 Cb -0.70 -2.12 1.04 0.00 -0.55 0.00 0.00 41.25 38.93 3h5d s ASN 26 CO 0.59 -0.45 1.68 0.49 -2.79 0.00 0.00 177.10 176.63 3h5d n PHE 27 N 3.52 0.00 0.10 0.43 3.01 -1.26 -2.54 117.46 120.71 3h5d n PHE 27 Ca 0.15 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.46 3h5d n PHE 27 Cb 0.43 -0.33 -0.14 0.00 -0.01 0.00 0.00 39.48 39.43 3h5d n PHE 27 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 3h5d h ASP 28 N 0.00 0.40 0.73 4.37 3.32 -1.98 -3.31 116.42 119.95 3h5d h ASP 28 Ca 0.00 -0.44 -0.11 0.00 0.02 0.00 0.00 57.03 56.50 3h5d h ASP 28 Cb 0.24 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 3h5d h ASP 28 CO 0.00 1.35 -0.54 0.00 -1.72 0.00 0.00 179.24 178.33 3h5d h ALA 29 N 0.59 0.96 -0.59 3.45 0.00 -1.79 -3.38 119.26 118.51 3h5d h ALA 29 Ca -0.14 -0.49 0.11 0.00 0.00 0.00 0.00 54.91 54.39 3h5d h ALA 29 Cb 1.97 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 19.56 3h5d h ALA 29 CO 0.20 0.67 -0.24 0.82 0.00 0.00 0.00 179.25 180.70 3h5d h ILE 30 N 0.00 0.28 -0.36 0.00 2.04 -1.64 -2.27 117.51 115.55 3h5d h ILE 30 Ca -0.01 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.73 3h5d h ILE 30 Cb 1.05 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 3h5d h ILE 30 CO 0.07 0.00 -0.30 -0.65 0.00 0.00 0.00 178.15 177.27 3h5d h PRO 31 N -0.09 0.77 -0.80 2.37 0.11 -1.80 -2.32 132.00 130.25 3h5d h PRO 31 Ca 0.27 -0.35 0.12 0.00 0.11 0.00 0.00 66.00 66.15 3h5d h PRO 31 Cb 0.51 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 31.52 3h5d h PRO 31 CO -0.65 0.97 0.41 0.00 -0.21 0.00 0.00 178.00 178.51 3h5d h ALA 32 N 1.01 1.16 0.00 -0.75 0.00 -1.63 -1.16 119.26 117.89 3h5d h ALA 32 Ca 0.08 0.07 -0.26 0.00 0.00 0.00 0.00 54.91 54.80 3h5d h ALA 32 Cb 0.83 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 3h5d h ALA 32 CO 0.07 -0.06 -1.67 1.47 0.00 0.00 0.00 179.25 179.06 3h5d n LEU 33 N -4.86 0.80 -0.29 0.00 -0.00 -1.10 -3.04 117.00 108.51 3h5d n LEU 33 Ca 0.15 0.37 -0.05 0.00 -0.00 0.00 0.00 56.01 56.48 3h5d n LEU 33 Cb 0.36 0.16 0.07 0.00 -0.00 0.00 0.00 43.42 44.01 3h5d n LEU 33 CO 0.23 0.32 1.17 0.40 -0.00 0.00 0.00 177.39 179.51 3h5d h ILE 34 N 0.00 1.22 -0.40 1.47 2.04 -1.25 0.42 117.51 121.00 3h5d h ILE 34 Ca -0.26 -0.46 -0.00 0.00 1.00 0.00 0.00 64.86 65.13 3h5d h ILE 34 Cb 1.90 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 3h5d h ILE 34 CO 0.07 0.22 0.24 -0.08 0.00 0.00 0.00 178.15 178.60 3h5d h GLU 35 N 1.08 0.54 -0.22 2.37 4.57 -1.34 -0.85 114.58 120.73 3h5d h GLU 35 Ca 0.28 -0.04 -0.09 0.00 -1.18 0.00 0.00 59.36 58.33 3h5d h GLU 35 Cb -0.06 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 3h5d h GLU 35 CO -0.05 0.38 -0.26 1.25 -1.18 0.00 0.00 179.01 179.15 3h5d h HIS 36 N 0.55 0.46 0.41 0.92 2.76 -0.59 -2.02 115.15 117.63 3h5d h HIS 36 Ca 0.14 -0.09 -0.02 0.00 -2.20 0.00 0.00 60.37 58.20 3h5d h HIS 36 Cb -0.02 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 28.83 3h5d h HIS 36 CO 0.00 0.64 -0.20 -0.07 -1.30 0.00 0.00 177.93 177.01 3h5d h LEU 37 N 0.37 -0.46 -1.71 0.26 3.38 0.97 -2.75 115.31 115.37 3h5d h LEU 37 Ca 0.05 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3h5d h LEU 37 Cb 0.65 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 3h5d h LEU 37 CO 0.05 -0.04 0.05 -0.07 0.09 0.00 0.00 178.44 178.52 3h5d h LEU 38 N -1.02 0.21 -1.63 1.67 4.07 -1.31 0.86 115.31 118.16 3h5d h LEU 38 Ca -0.06 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 57.87 3h5d h LEU 38 Cb 0.53 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 3h5d h LEU 38 CO 0.09 0.21 -0.02 0.00 -1.08 0.00 0.00 178.44 177.65 3h5d h ALA 39 N 1.82 1.71 -2.06 1.53 0.00 -1.37 -3.20 119.26 117.68 3h5d h ALA 39 Ca 0.06 -0.11 -0.60 0.00 0.00 0.00 0.00 54.91 54.27 3h5d h ALA 39 Cb 0.08 -0.07 -0.42 0.00 0.00 0.00 0.00 17.79 17.38 3h5d h ALA 39 CO -0.00 0.22 -0.62 0.72 0.00 0.00 0.00 179.25 179.57 3h5d n HIS 40 N -4.39 3.86 -2.10 0.00 8.25 0.22 -4.95 115.22 116.12 3h5d n HIS 40 Ca -0.01 -3.73 -0.18 0.00 -0.26 0.00 0.00 57.72 53.54 3h5d n HIS 40 Cb 0.17 -0.40 -0.03 0.00 1.12 0.00 0.00 29.99 30.85 3h5d n HIS 40 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3h5d n HIS 41 N -0.31 -0.60 -2.77 4.41 8.25 -1.13 -4.51 115.22 118.56 3h5d n HIS 41 Ca 0.34 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.37 3h5d n HIS 41 Cb 0.46 -3.46 -0.04 0.00 1.12 0.00 0.00 29.99 28.07 3h5d n HIS 41 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3h5d s THR 42 N -2.84 4.21 -2.24 1.59 2.01 -0.76 -4.52 115.64 113.08 3h5d s THR 42 Ca 0.00 0.13 0.23 0.00 0.31 0.00 0.00 61.69 62.36 3h5d s THR 42 Cb 0.00 -4.68 0.53 0.00 0.01 0.00 0.00 72.50 68.36 3h5d s THR 42 CO 0.00 -1.40 1.47 -0.90 -0.69 0.00 0.00 174.62 173.10 3h5d n ASP 43 N 8.00 3.71 -3.53 3.53 5.68 -0.86 -4.34 116.55 128.74 3h5d n ASP 43 Ca 0.01 -2.00 -0.14 0.00 -0.50 0.00 0.00 54.79 52.16 3h5d n ASP 43 Cb 0.47 -0.36 -0.04 0.00 -1.14 0.00 0.00 41.12 40.04 3h5d n ASP 43 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3h5d s GLY 44 N -1.26 -0.50 -0.16 6.12 0.00 -1.13 -4.08 107.32 106.31 3h5d s GLY 44 Ca 0.44 0.64 -0.04 0.00 0.00 0.00 0.00 44.72 45.76 3h5d s GLY 44 CO 0.33 0.33 0.25 -0.42 0.00 0.00 0.00 173.10 173.58 3h5d s ILE 45 N -2.71 -0.38 -0.01 0.90 1.01 -0.86 -1.52 121.20 117.63 3h5d s ILE 45 Ca -0.04 0.11 -0.23 0.00 0.00 0.00 0.00 60.65 60.49 3h5d s ILE 45 Cb -0.00 -0.55 -0.05 0.00 0.01 0.00 0.00 42.46 41.87 3h5d s ILE 45 CO -0.04 -0.02 0.68 -0.22 0.00 0.00 0.00 174.94 175.34 3h5d s LEU 46 N 2.38 4.39 -0.09 2.97 2.96 0.88 -0.03 118.68 132.15 3h5d s LEU 46 Ca 0.05 1.26 0.01 0.00 -0.22 0.00 0.00 54.13 55.23 3h5d s LEU 46 Cb -0.14 -3.07 -0.02 0.00 0.50 0.00 0.00 46.19 43.46 3h5d s LEU 46 CO -0.10 0.00 -0.12 -0.76 -1.32 0.00 0.00 176.35 174.05 3h5d s LEU 47 N 0.18 2.85 -1.22 -0.68 1.43 0.15 -2.03 118.68 119.37 3h5d s LEU 47 Ca 0.36 -0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 53.24 3h5d s LEU 47 Cb -0.19 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.42 3h5d s LEU 47 CO 0.19 0.27 1.03 0.00 0.23 0.00 0.00 176.35 178.07 3h5d n ALA 48 N 2.80 -1.91 -1.49 4.21 0.00 -1.26 -1.38 120.51 121.48 3h5d n ALA 48 Ca -0.18 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.28 3h5d n ALA 48 Cb 0.52 -2.90 0.00 0.00 0.00 0.00 0.00 19.45 17.07 3h5d n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h5d n GLY 49 N -1.27 0.86 0.24 0.00 0.00 -1.26 -4.15 105.19 99.61 3h5d n GLY 49 Ca -0.24 -1.78 -0.02 0.00 0.00 0.00 0.00 46.02 43.98 3h5d n GLY 49 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3h5d h THR 50 N 0.00 1.25 0.00 2.61 2.02 -1.96 -2.93 112.91 113.90 3h5d h THR 50 Ca 0.00 -1.14 0.00 0.00 0.77 0.00 0.00 66.41 66.04 3h5d h THR 50 Cb 0.00 1.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 3h5d h THR 50 CO 0.00 0.36 -0.01 0.41 0.37 0.00 0.00 175.52 176.65 3h5d n THR 51 N -4.16 0.27 1.27 3.16 -1.04 -1.26 -1.77 114.28 110.74 3h5d n THR 51 Ca -0.00 -0.13 0.13 0.00 -2.04 0.00 0.00 64.05 62.01 3h5d n THR 51 Cb 0.36 -0.53 0.33 0.00 -1.82 0.00 0.00 70.33 68.67 3h5d n THR 51 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h5d n ALA 52 N -1.63 2.60 -3.30 2.41 0.00 -1.14 -4.14 120.51 115.30 3h5d n ALA 52 Ca 0.06 -0.55 -0.18 0.00 0.00 0.00 0.00 53.44 52.78 3h5d n ALA 52 Cb 0.38 -1.01 0.06 0.00 0.00 0.00 0.00 19.45 18.89 3h5d n ALA 52 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3h5d n GLU 53 N 0.59 -5.95 -0.19 0.00 1.02 -0.73 -4.10 120.64 111.27 3h5d n GLU 53 Ca 0.16 0.63 0.17 0.00 -0.02 0.00 0.00 57.16 58.11 3h5d n GLU 53 Cb 0.46 -5.08 0.51 0.00 -0.02 0.00 0.00 31.44 27.31 3h5d n GLU 53 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3h5d h SER 54 N -1.98 0.38 0.00 1.62 4.64 -1.72 -0.33 113.55 116.16 3h5d h SER 54 Ca -0.44 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 3h5d h SER 54 Cb 1.28 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3h5d h SER 54 CO 0.42 0.18 0.52 -0.65 -0.87 0.00 0.00 176.83 176.43 3h5d h PRO 55 N 0.40 0.00 0.00 4.77 0.11 -1.90 -1.94 132.00 133.44 3h5d h PRO 55 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 3h5d h PRO 55 Cb 0.98 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 3h5d h PRO 55 CO -0.13 0.00 -0.38 0.25 -0.21 0.00 0.00 178.00 177.53 3h5d n THR 56 N -2.65 0.00 -2.84 -1.15 -2.24 -0.14 -5.00 114.28 100.26 3h5d n THR 56 Ca -0.01 -0.35 -0.40 0.00 -2.27 0.00 0.00 64.05 61.02 3h5d n THR 56 Cb 0.55 0.88 -0.05 0.00 -2.10 0.00 0.00 70.33 69.61 3h5d n THR 56 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3h5d s LEU 57 N -2.40 4.49 0.88 3.22 1.43 -0.73 -5.06 118.68 120.52 3h5d s LEU 57 Ca 0.01 1.67 -0.13 0.00 -1.03 0.00 0.00 54.13 54.64 3h5d s LEU 57 Cb 0.03 -3.44 0.13 0.00 0.03 0.00 0.00 46.19 42.93 3h5d s LEU 57 CO 0.14 -0.01 1.21 0.42 0.23 0.00 0.00 176.35 178.34 3h5d s THR 58 N -0.13 1.99 0.11 5.49 -4.23 -1.26 -4.81 115.64 112.79 3h5d s THR 58 Ca 0.43 0.00 -0.19 0.00 -1.18 0.00 0.00 61.69 60.75 3h5d s THR 58 Cb -0.22 -2.95 -0.07 0.00 1.34 0.00 0.00 72.50 70.60 3h5d s THR 58 CO 0.27 0.00 1.71 -0.74 -0.54 0.00 0.00 174.62 175.33 3h5d h HIS 59 N -1.34 0.31 0.57 3.99 2.76 -1.98 0.20 115.15 119.66 3h5d h HIS 59 Ca -0.46 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 57.67 3h5d h HIS 59 Cb 1.30 -0.10 0.01 0.00 1.55 0.00 0.00 27.41 30.17 3h5d h HIS 59 CO -0.18 0.27 -0.27 -0.44 -1.30 0.00 0.00 177.93 176.01 3h5d h ASP 60 N 0.26 -0.65 -1.23 3.26 3.45 -1.98 -0.78 116.42 118.75 3h5d h ASP 60 Ca 0.08 -0.04 0.37 0.00 0.43 0.00 0.00 57.03 57.88 3h5d h ASP 60 Cb 0.06 0.17 -0.11 0.00 -0.56 0.00 0.00 39.33 38.89 3h5d h ASP 60 CO -0.01 -0.33 0.80 -0.33 -1.57 0.00 0.00 179.24 177.80 3h5d h GLU 61 N -0.96 0.18 0.33 3.56 5.08 -1.92 1.39 114.58 122.24 3h5d h GLU 61 Ca -0.08 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 3h5d h GLU 61 Cb 0.65 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3h5d h GLU 61 CO 0.13 0.12 -0.16 1.49 -1.00 0.00 0.00 179.01 179.59 3h5d h GLU 62 N 0.18 -0.43 -0.59 2.33 4.81 -0.34 -1.08 114.58 119.47 3h5d h GLU 62 Ca 0.73 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 60.10 3h5d h GLU 62 Cb 2.22 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 31.66 3h5d h GLU 62 CO -0.35 -0.14 0.40 -0.07 -0.73 0.00 0.00 179.01 178.12 3h5d h LEU 63 N -1.00 0.31 -1.24 1.64 3.38 0.54 0.29 115.31 119.22 3h5d h LEU 63 Ca -0.05 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 3h5d h LEU 63 Cb 0.49 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 3h5d h LEU 63 CO 0.08 0.18 -0.13 -0.33 0.09 0.00 0.00 178.44 178.32 3h5d h GLU 64 N 0.34 0.35 -0.01 1.13 5.08 0.18 -1.34 114.58 120.31 3h5d h GLU 64 Ca 0.27 -0.09 -0.25 0.00 -1.00 0.00 0.00 59.36 58.29 3h5d h GLU 64 Cb 0.62 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.84 3h5d h GLU 64 CO -0.07 0.49 -1.00 -0.07 -1.00 0.00 0.00 179.01 177.37 3h5d h LEU 65 N 0.33 0.80 -0.19 1.33 4.07 0.79 -2.02 115.31 120.41 3h5d h LEU 65 Ca 0.06 -0.63 -0.00 0.00 0.08 0.00 0.00 57.88 57.39 3h5d h LEU 65 Cb 0.44 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.93 3h5d h LEU 65 CO 0.03 1.43 0.11 -0.26 -1.08 0.00 0.00 178.44 178.67 3h5d h PHE 66 N 0.35 0.26 0.40 1.13 0.04 -0.50 -2.31 116.94 116.32 3h5d h PHE 66 Ca -0.11 -0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.64 3h5d h PHE 66 Cb 1.64 -0.08 -0.00 0.00 2.20 0.00 0.00 35.95 39.71 3h5d h PHE 66 CO 0.09 0.22 -0.24 0.00 -0.60 0.00 0.00 178.31 177.78 3h5d h ALA 67 N 1.02 -1.10 -1.16 2.45 0.00 -1.31 -0.62 119.26 118.55 3h5d h ALA 67 Ca 0.07 -0.13 0.34 0.00 0.00 0.00 0.00 54.91 55.20 3h5d h ALA 67 Cb 0.03 0.33 -0.11 0.00 0.00 0.00 0.00 17.79 18.04 3h5d h ALA 67 CO -0.01 -1.07 0.74 0.00 0.00 0.00 0.00 179.25 178.90 3h5d h ALA 68 N -1.58 2.43 0.18 0.00 0.00 -1.39 -0.50 119.26 118.40 3h5d h ALA 68 Ca -0.05 0.09 -0.27 0.00 0.00 0.00 0.00 54.91 54.68 3h5d h ALA 68 Cb 0.48 0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.40 3h5d h ALA 68 CO 0.06 -0.95 -1.20 0.28 0.00 0.00 0.00 179.25 177.44 3h5d h VAL 69 N 0.25 1.32 -0.63 0.00 2.07 -1.35 -3.20 116.25 114.70 3h5d h VAL 69 Ca 0.70 -2.58 0.06 0.00 0.82 0.00 0.00 66.70 65.70 3h5d h VAL 69 Cb 1.98 3.05 -0.04 0.00 -1.52 0.00 0.00 31.29 34.77 3h5d h VAL 69 CO -0.37 0.76 0.42 1.56 0.02 0.00 0.00 177.57 179.96 3h5d h GLN 70 N -0.14 0.62 0.76 1.57 4.20 0.46 -0.47 115.11 122.10 3h5d h GLN 70 Ca -0.22 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.41 3h5d h GLN 70 Cb 1.88 -0.14 0.01 0.00 0.30 0.00 0.00 27.48 29.53 3h5d h GLN 70 CO 0.19 0.41 -0.36 -0.22 -0.67 0.00 0.00 178.83 178.17 3h5d h LYS 71 N 0.64 -0.98 0.62 1.46 3.64 -1.38 -3.35 116.57 117.23 3h5d h LYS 71 Ca 0.27 0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.69 3h5d h LYS 71 Cb 0.25 0.22 0.01 0.00 -0.41 0.00 0.00 32.23 32.30 3h5d h LYS 71 CO -0.08 -0.66 -0.30 -0.24 -2.27 0.00 0.00 179.45 175.90 3h5d h VAL 72 N -1.12 0.38 -1.26 2.00 3.04 -1.50 -3.29 116.25 114.51 3h5d h VAL 72 Ca -0.10 -0.03 -0.51 0.00 -1.01 0.00 0.00 66.70 65.05 3h5d h VAL 72 Cb 0.78 0.39 -0.08 0.00 -2.01 0.00 0.00 31.29 30.38 3h5d h VAL 72 CO 0.17 0.01 1.23 0.54 -1.01 0.00 0.00 177.57 178.51 3h5d s VAL 73 N -5.97 3.73 -1.44 1.51 0.11 -0.21 -4.85 120.40 113.28 3h5d s VAL 73 Ca -0.17 -0.42 -0.12 0.00 -2.93 0.00 0.00 61.98 58.34 3h5d s VAL 73 Cb 0.03 -4.69 -0.05 0.00 -1.53 0.00 0.00 36.38 30.14 3h5d s VAL 73 CO 0.61 -1.60 2.57 -3.20 -3.33 0.00 0.00 175.10 170.15 3h5d n ASN 74 N 10.52 6.37 0.00 3.54 5.15 -1.24 -4.20 115.26 135.40 3h5d n ASN 74 Ca 0.30 -2.64 0.00 0.00 -0.60 0.00 0.00 54.58 51.64 3h5d n ASN 74 Cb 0.50 -1.51 0.00 0.00 -0.53 0.00 0.00 39.78 38.23 3h5d n ASN 74 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3h5d n GLY 75 N 3.83 0.24 0.46 8.20 0.00 -1.26 -4.91 105.19 111.74 3h5d n GLY 75 Ca 0.65 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.51 3h5d n GLY 75 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3h5d h ARG 76 N 0.48 -0.66 -6.70 1.61 -0.00 -1.93 -3.43 114.38 103.76 3h5d h ARG 76 Ca 0.00 0.04 -0.67 0.00 -0.50 0.00 0.00 59.98 58.86 3h5d h ARG 76 Cb 0.53 0.15 -0.19 0.00 0.00 0.00 0.00 29.97 30.46 3h5d h ARG 76 CO 0.00 -0.44 -0.82 0.14 0.00 0.00 0.00 179.97 178.85 3h5d s VAL 77 N -5.60 2.54 0.30 2.04 -7.23 -1.26 -5.09 120.40 106.10 3h5d s VAL 77 Ca -0.15 -1.80 -0.30 0.00 -1.81 0.00 0.00 61.98 57.93 3h5d s VAL 77 Cb 0.06 -2.19 -0.12 0.00 0.56 0.00 0.00 36.38 34.69 3h5d s VAL 77 CO 0.57 -0.01 1.51 -2.65 -0.31 0.00 0.00 175.10 174.21 3h5d n PRO 78 N 0.53 2.51 -4.34 4.82 -0.02 -1.26 -4.86 135.00 132.38 3h5d n PRO 78 Ca -0.14 0.89 -0.31 0.00 -2.02 0.00 0.00 63.50 61.91 3h5d n PRO 78 Cb 0.54 -2.61 -0.10 0.00 -0.02 0.00 0.00 33.50 31.31 3h5d n PRO 78 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3h5d s LEU 79 N -0.73 3.18 -0.03 2.45 1.43 -1.26 -2.04 118.68 121.69 3h5d s LEU 79 Ca 0.62 -0.22 0.07 0.00 -1.03 0.00 0.00 54.13 53.57 3h5d s LEU 79 Cb -0.53 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 43.78 3h5d s LEU 79 CO 0.53 0.23 -0.23 -0.63 0.23 0.00 0.00 176.35 176.48 3h5d s ILE 80 N -1.11 2.27 -0.07 -0.59 -1.09 0.96 -1.73 121.20 119.84 3h5d s ILE 80 Ca 0.20 -1.02 0.01 0.00 -2.23 0.00 0.00 60.65 57.60 3h5d s ILE 80 Cb -0.11 -1.81 -0.03 0.00 -1.58 0.00 0.00 42.46 38.93 3h5d s ILE 80 CO 0.11 0.58 -0.08 0.00 -1.23 0.00 0.00 174.94 174.32 3h5d s ALA 81 N -0.61 2.92 -0.18 9.38 0.00 -1.01 0.35 121.76 132.61 3h5d s ALA 81 Ca 0.09 -0.91 -0.27 0.00 0.00 0.00 0.00 51.96 50.88 3h5d s ALA 81 Cb -0.10 -1.19 -0.01 0.00 0.00 0.00 0.00 23.12 21.82 3h5d s ALA 81 CO -0.00 0.56 0.92 0.20 0.00 0.00 0.00 175.76 177.43 3h5d s GLY 82 N -0.75 2.04 0.00 0.00 0.00 -0.48 0.39 107.32 108.52 3h5d s GLY 82 Ca 0.11 0.13 0.00 0.00 0.00 0.00 0.00 44.72 44.97 3h5d s GLY 82 CO 0.01 1.86 0.00 3.33 0.00 0.00 0.00 173.10 178.30 3h5d n VAL 83 N 4.88 0.00 -2.36 1.40 0.24 -0.10 -4.86 118.33 117.53 3h5d n VAL 83 Ca 0.07 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 62.02 3h5d n VAL 83 Cb 0.48 -0.75 -0.02 0.00 -1.47 0.00 0.00 33.84 32.09 3h5d n VAL 83 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3h5d s GLY 84 N -2.78 2.67 0.32 7.63 0.00 -0.70 -4.64 107.32 109.82 3h5d s GLY 84 Ca 0.00 0.79 0.03 0.00 0.00 0.00 0.00 44.72 45.54 3h5d s GLY 84 CO 0.00 1.18 0.33 -1.08 0.00 0.00 0.00 173.10 173.53 3h5d s THR 85 N -1.73 0.00 -2.08 0.90 -1.32 -1.26 -4.50 115.64 105.65 3h5d s THR 85 Ca 0.66 -1.86 0.27 0.00 -1.21 0.00 0.00 61.69 59.56 3h5d s THR 85 Cb -0.23 -2.54 0.74 0.00 -1.51 0.00 0.00 72.50 68.96 3h5d s THR 85 CO 0.28 0.00 2.00 -0.46 -2.21 0.00 0.00 174.62 174.23 3h5d n ASN 86 N -1.33 0.30 -4.26 8.08 6.94 -1.26 -4.53 115.26 119.20 3h5d n ASN 86 Ca 0.05 -1.21 -0.35 0.00 -0.02 0.00 0.00 54.58 53.05 3h5d n ASN 86 Cb 0.62 -0.01 -0.14 0.00 -2.36 0.00 0.00 39.78 37.90 3h5d n ASN 86 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3h5d s ASP 87 N -1.87 4.26 0.24 0.53 -1.08 -1.26 -4.88 116.67 112.61 3h5d s ASP 87 Ca 0.41 -0.59 -0.05 0.00 -0.52 0.00 0.00 52.55 51.79 3h5d s ASP 87 Cb 0.19 -1.70 0.26 0.00 -1.46 0.00 0.00 42.92 40.21 3h5d s ASP 87 CO 0.32 -0.07 1.81 0.74 0.52 0.00 0.00 175.17 178.50 3h5d h THR 88 N 5.88 1.25 0.22 1.71 2.02 -1.94 -2.62 112.91 119.42 3h5d h THR 88 Ca -0.38 -0.78 -0.00 0.00 0.77 0.00 0.00 66.41 66.01 3h5d h THR 88 Cb 1.14 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 3h5d h THR 88 CO 0.60 0.32 -0.33 -0.09 0.37 0.00 0.00 175.52 176.39 3h5d h ARG 89 N 1.06 -0.55 -1.09 6.66 9.65 -1.96 -0.74 114.38 127.41 3h5d h ARG 89 Ca 0.25 0.04 0.30 0.00 -1.10 0.00 0.00 59.98 59.46 3h5d h ARG 89 Cb 0.20 0.13 -0.08 0.00 -1.39 0.00 0.00 29.97 28.83 3h5d h ARG 89 CO -0.02 -0.37 0.74 -0.44 2.80 0.00 0.00 179.97 182.68 3h5d h ASP 90 N -0.57 0.26 0.60 -3.80 5.19 -1.97 0.56 116.42 116.68 3h5d h ASP 90 Ca -0.03 0.05 -0.19 0.00 -0.62 0.00 0.00 57.03 56.25 3h5d h ASP 90 Cb 0.52 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 40.03 3h5d h ASP 90 CO -0.10 0.04 -0.84 0.28 -3.12 0.00 0.00 179.24 175.50 3h5d h SER 91 N 0.22 0.22 0.63 6.45 0.02 -1.04 -1.42 113.55 118.63 3h5d h SER 91 Ca 0.58 -0.17 -0.15 0.00 -0.84 0.00 0.00 61.79 61.21 3h5d h SER 91 Cb 1.82 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 64.28 3h5d h SER 91 CO -0.18 0.96 -0.71 0.40 -1.14 0.00 0.00 176.83 176.16 3h5d h ILE 92 N 0.10 1.49 0.10 3.27 2.04 0.57 -2.08 117.51 122.99 3h5d h ILE 92 Ca -0.04 -2.37 -0.19 0.00 1.00 0.00 0.00 64.86 63.26 3h5d h ILE 92 Cb 1.46 2.28 0.02 0.00 -0.74 0.00 0.00 36.82 39.84 3h5d h ILE 92 CO 0.13 0.68 -0.82 -0.33 0.00 0.00 0.00 178.15 177.81 3h5d h GLU 93 N 0.04 0.38 -0.05 2.37 4.39 -1.21 -3.15 114.58 117.35 3h5d h GLU 93 Ca -0.01 -0.54 -0.01 0.00 0.34 0.00 0.00 59.36 59.14 3h5d h GLU 93 Cb 1.26 0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 30.09 3h5d h GLU 93 CO 0.10 1.22 0.01 0.35 -1.16 0.00 0.00 179.01 179.53 3h5d h PHE 94 N -0.20 0.09 -0.05 4.33 3.57 -1.29 -2.04 116.94 121.35 3h5d h PHE 94 Ca -0.13 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.37 3h5d h PHE 94 Cb 1.59 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 40.30 3h5d h PHE 94 CO 0.17 0.33 0.06 -0.24 -2.23 0.00 0.00 178.31 176.40 3h5d h VAL 95 N -0.18 0.42 -0.10 1.41 3.04 -1.52 0.15 116.25 119.48 3h5d h VAL 95 Ca 0.01 0.00 -0.09 0.00 -1.01 0.00 0.00 66.70 65.62 3h5d h VAL 95 Cb 0.29 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 30.52 3h5d h VAL 95 CO 0.00 0.00 -0.28 0.11 -1.01 0.00 0.00 177.57 176.39 3h5d h LYS 96 N 0.00 0.36 0.18 4.17 1.57 -1.44 -1.95 116.57 119.46 3h5d h LYS 96 Ca 0.02 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 3h5d h LYS 96 Cb 0.14 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 3h5d h LYS 96 CO -0.00 0.87 -0.38 0.93 -0.57 0.00 0.00 179.45 180.31 3h5d h GLU 97 N -0.09 -0.58 -0.21 3.15 5.08 -0.34 -0.04 114.58 121.54 3h5d h GLU 97 Ca -0.01 0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 3h5d h GLU 97 Cb 0.89 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 3h5d h GLU 97 CO 0.06 -0.39 0.23 0.28 -1.00 0.00 0.00 179.01 178.19 3h5d h VAL 98 N -0.61 0.47 -0.07 3.13 2.07 -0.87 1.13 116.25 121.50 3h5d h VAL 98 Ca -0.02 0.00 -0.25 0.00 0.82 0.00 0.00 66.70 67.25 3h5d h VAL 98 Cb 0.58 0.81 0.02 0.00 -1.52 0.00 0.00 31.29 31.18 3h5d h VAL 98 CO -0.15 0.00 -0.93 0.00 0.02 0.00 0.00 177.57 176.51 3h5d h ALA 99 N 1.74 0.21 -0.26 1.67 0.00 -0.92 -0.70 119.26 121.00 3h5d h ALA 99 Ca 0.10 -0.66 -0.07 0.00 0.00 0.00 0.00 54.91 54.28 3h5d h ALA 99 Cb 0.57 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3h5d h ALA 99 CO -0.00 0.69 -0.12 0.93 0.00 0.00 0.00 179.25 180.75 3h5d h GLU 100 N 0.46 0.54 -0.87 0.00 5.08 0.14 -2.74 114.58 117.19 3h5d h GLU 100 Ca -0.10 -0.23 0.13 0.00 -1.00 0.00 0.00 59.36 58.16 3h5d h GLU 100 Cb 1.58 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 30.74 3h5d h GLU 100 CO 0.19 0.79 0.56 0.35 -1.00 0.00 0.00 179.01 179.90 3h5d h PHE 101 N 0.27 0.82 -3.08 4.33 3.04 0.11 -3.47 116.94 118.95 3h5d h PHE 101 Ca 0.06 0.02 0.37 0.00 3.98 0.00 0.00 57.97 62.41 3h5d h PHE 101 Cb 0.62 -0.26 -0.10 0.00 2.56 0.00 0.00 35.95 38.78 3h5d h PHE 101 CO 0.06 0.32 -0.52 0.41 -2.02 0.00 0.00 178.31 176.57 3h5d n GLY 102 N -1.43 -1.82 0.22 2.40 0.00 -0.27 -4.91 105.19 99.37 3h5d n GLY 102 Ca 0.16 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 45.11 3h5d n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h5d n GLY 103 N -4.08 3.40 3.71 -0.02 0.00 -1.26 -4.95 105.19 101.98 3h5d n GLY 103 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 3h5d n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h5d s PHE 104 N -2.87 3.34 0.22 1.61 0.08 -1.26 -4.62 117.98 114.47 3h5d s PHE 104 Ca 0.00 0.22 0.04 0.00 0.12 0.00 0.00 56.93 57.31 3h5d s PHE 104 Cb 0.00 -2.03 0.18 0.00 -0.57 0.00 0.00 43.02 40.60 3h5d s PHE 104 CO 0.00 0.33 1.51 0.00 -0.10 0.00 0.00 175.22 176.96 3h5d h ALA 105 N 6.17 0.76 -2.95 5.36 0.00 -1.71 -3.43 119.26 123.45 3h5d h ALA 105 Ca -0.43 -0.60 0.03 0.00 0.00 0.00 0.00 54.91 53.91 3h5d h ALA 105 Cb 1.18 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.82 3h5d h ALA 105 CO 0.67 0.78 0.13 0.00 0.00 0.00 0.00 179.25 180.83 3h5d s ALA 106 N -3.60 -0.99 0.11 0.00 0.00 -1.24 0.74 121.76 116.79 3h5d s ALA 106 Ca -0.04 -0.39 0.08 0.00 0.00 0.00 0.00 51.96 51.62 3h5d s ALA 106 Cb 0.11 0.90 -0.04 0.00 0.00 0.00 0.00 23.12 24.10 3h5d s ALA 106 CO 0.81 -0.96 -0.13 0.20 0.00 0.00 0.00 175.76 175.68 3h5d s GLY 107 N -2.93 1.75 -0.15 0.00 0.00 0.03 -2.40 107.32 103.63 3h5d s GLY 107 Ca 0.13 -1.30 -0.04 0.00 0.00 0.00 0.00 44.72 43.51 3h5d s GLY 107 CO 0.05 -1.28 -0.02 -2.27 0.00 0.00 0.00 173.10 169.58 3h5d s LEU 108 N -2.23 3.40 -0.12 0.66 2.96 0.16 -0.86 118.68 122.65 3h5d s LEU 108 Ca 0.20 -0.05 0.01 0.00 -0.22 0.00 0.00 54.13 54.08 3h5d s LEU 108 Cb -0.11 -1.82 0.02 0.00 0.50 0.00 0.00 46.19 44.78 3h5d s LEU 108 CO 0.12 0.21 -0.15 0.00 -1.32 0.00 0.00 176.35 175.22 3h5d s ALA 109 N 0.13 1.72 0.23 5.97 0.00 -0.38 -0.92 121.76 128.52 3h5d s ALA 109 Ca 0.00 -0.76 -0.25 0.00 0.00 0.00 0.00 51.96 50.94 3h5d s ALA 109 Cb -0.13 -0.88 -0.09 0.00 0.00 0.00 0.00 23.12 22.02 3h5d s ALA 109 CO 0.02 -0.15 0.84 -1.50 0.00 0.00 0.00 175.76 174.97 3h5d s ILE 110 N 1.11 4.31 0.28 0.00 2.07 -1.26 -0.15 121.20 127.55 3h5d s ILE 110 Ca -0.04 1.73 -0.30 0.00 -1.41 0.00 0.00 60.65 60.63 3h5d s ILE 110 Cb -0.14 -4.09 -0.11 0.00 0.13 0.00 0.00 42.46 38.24 3h5d s ILE 110 CO -0.04 0.36 1.63 0.68 -1.91 0.00 0.00 174.94 175.66 3h5d s VAL 111 N -1.35 2.04 0.04 4.00 -7.23 -0.86 -4.63 120.40 112.41 3h5d s VAL 111 Ca 0.42 0.03 -0.39 0.00 -1.81 0.00 0.00 61.98 60.24 3h5d s VAL 111 Cb -0.21 -3.02 -0.19 0.00 0.56 0.00 0.00 36.38 33.52 3h5d s VAL 111 CO 0.26 0.00 1.14 -2.65 -0.31 0.00 0.00 175.10 173.55 3h5d n PRO 112 N 2.55 0.39 -3.82 4.82 -0.02 -1.26 -4.94 135.00 132.72 3h5d n PRO 112 Ca 0.10 0.14 -0.22 0.00 -2.02 0.00 0.00 63.50 61.50 3h5d n PRO 112 Cb 0.37 -1.67 -0.02 0.00 -0.02 0.00 0.00 33.50 32.16 3h5d n PRO 112 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3h5d s TYR 113 N 0.12 3.46 0.00 6.00 1.13 -1.26 -4.38 117.35 122.42 3h5d s TYR 113 Ca 0.88 0.09 0.00 0.00 -1.41 0.00 0.00 57.07 56.62 3h5d s TYR 113 Cb -1.15 -1.66 0.00 0.00 -1.10 0.00 0.00 41.96 38.05 3h5d s TYR 113 CO 0.54 0.37 0.00 0.98 -2.51 0.00 0.00 175.55 174.92 3h5d n TYR 114 N -1.44 0.00 0.93 -3.49 9.36 -1.26 -4.52 117.16 116.74 3h5d n TYR 114 Ca -0.08 0.00 0.11 0.00 3.32 0.00 0.00 57.90 61.25 3h5d n TYR 114 Cb 0.57 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.25 3h5d n TYR 114 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 3h5d n ASN 115 N 0.64 0.82 -3.66 2.98 0.23 -1.26 -5.02 115.26 109.99 3h5d n ASN 115 Ca 0.00 -0.74 -0.29 0.00 -0.53 0.00 0.00 54.58 53.02 3h5d n ASN 115 Cb 0.00 0.86 0.04 0.00 -2.08 0.00 0.00 39.78 38.60 3h5d n ASN 115 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3h5d n LYS 116 N -1.56 -1.63 -1.19 -3.83 5.02 -1.26 -4.93 118.16 108.78 3h5d n LYS 116 Ca 0.04 0.50 -0.35 0.00 -2.02 0.00 0.00 58.31 56.48 3h5d n LYS 116 Cb 0.35 -4.36 0.10 0.00 -0.02 0.00 0.00 35.03 31.09 3h5d n LYS 116 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 3h5d n PRO 117 N -4.11 0.26 -1.56 1.97 -0.02 -1.26 -5.06 135.00 125.22 3h5d n PRO 117 Ca -0.11 0.15 -0.28 0.00 -2.02 0.00 0.00 63.50 61.23 3h5d n PRO 117 Cb 0.60 -2.13 0.21 0.00 -0.02 0.00 0.00 33.50 32.16 3h5d n PRO 117 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3h5d n SER 118 N -1.71 -0.52 0.04 2.55 3.41 -1.26 -4.83 113.62 111.30 3h5d n SER 118 Ca 0.12 -1.36 -0.04 0.00 -0.26 0.00 0.00 58.87 57.33 3h5d n SER 118 Cb 0.50 -0.96 0.19 0.00 -0.26 0.00 0.00 64.21 63.69 3h5d n SER 118 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3h5d h GLN 119 N 0.00 0.41 -0.12 4.33 1.08 -1.97 -1.47 115.11 117.37 3h5d h GLN 119 Ca -0.40 -0.18 -0.21 0.00 -1.45 0.00 0.00 58.65 56.41 3h5d h GLN 119 Cb 1.14 -0.01 0.01 0.00 -0.05 0.00 0.00 27.48 28.56 3h5d h GLN 119 CO 0.28 0.70 -0.78 1.49 -0.95 0.00 0.00 178.83 179.56 3h5d h GLU 120 N 0.35 0.67 -0.26 1.46 4.57 -1.99 -2.58 114.58 116.80 3h5d h GLU 120 Ca 0.04 -0.56 0.03 0.00 -1.18 0.00 0.00 59.36 57.70 3h5d h GLU 120 Cb 0.76 0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 29.44 3h5d h GLU 120 CO 0.06 1.17 0.06 0.78 -1.18 0.00 0.00 179.01 179.91 3h5d h GLY 121 N 0.78 0.30 0.38 1.92 0.00 -1.86 -0.60 103.07 104.00 3h5d h GLY 121 Ca -0.05 -0.03 0.13 0.00 0.00 0.00 0.00 47.33 47.38 3h5d h GLY 121 CO 0.15 0.00 0.52 -0.33 0.00 0.00 0.00 176.54 176.89 3h5d h MET 122 N 0.17 0.77 -0.04 4.80 2.86 -1.28 -2.40 114.93 119.81 3h5d h MET 122 Ca 0.12 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 3h5d h MET 122 Cb 0.11 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.59 3h5d h MET 122 CO -0.14 0.51 -0.06 -0.92 1.06 0.00 0.00 176.91 177.36 3h5d h TYR 123 N 0.80 0.14 0.00 -0.22 3.20 -0.73 -1.68 116.97 118.47 3h5d h TYR 123 Ca 0.46 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 62.26 3h5d h TYR 123 Cb 0.53 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.77 3h5d h TYR 123 CO -0.05 0.61 -0.12 1.96 -1.64 0.00 0.00 178.16 178.93 3h5d h GLN 124 N -0.37 0.00 0.38 1.82 4.20 -1.25 0.40 115.11 120.29 3h5d h GLN 124 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 3h5d h GLN 124 Cb 0.60 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 3h5d h GLN 124 CO 0.01 0.12 -0.18 1.25 -0.67 0.00 0.00 178.83 179.36 3h5d h HIS 125 N 0.00 -0.48 -0.02 2.96 2.76 -1.24 -2.60 115.15 116.54 3h5d h HIS 125 Ca -0.00 -0.01 -0.15 0.00 -2.20 0.00 0.00 60.37 58.00 3h5d h HIS 125 Cb 0.34 0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.44 3h5d h HIS 125 CO 0.00 -0.19 -0.69 0.74 -1.30 0.00 0.00 177.93 176.49 3h5d h PHE 126 N -1.04 0.16 -0.47 5.26 0.04 -1.19 -2.17 116.94 117.52 3h5d h PHE 126 Ca -0.05 -0.07 -0.02 0.00 2.80 0.00 0.00 57.97 60.63 3h5d h PHE 126 Cb 0.50 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.60 3h5d h PHE 126 CO 0.02 0.77 0.22 -0.22 -0.60 0.00 0.00 178.31 178.50 3h5d h LYS 127 N 0.08 0.69 0.87 1.51 3.64 -0.31 0.21 116.57 123.26 3h5d h LYS 127 Ca -0.01 -0.11 -0.04 0.00 -1.27 0.00 0.00 60.65 59.22 3h5d h LYS 127 Cb 1.23 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 32.94 3h5d h LYS 127 CO 0.10 0.59 -0.42 0.00 -2.27 0.00 0.00 179.45 177.45 3h5d h ALA 128 N 1.06 -1.29 -1.15 5.00 0.00 -1.33 0.25 119.26 121.80 3h5d h ALA 128 Ca 0.16 -0.26 0.32 0.00 0.00 0.00 0.00 54.91 55.14 3h5d h ALA 128 Cb 0.14 0.45 -0.08 0.00 0.00 0.00 0.00 17.79 18.30 3h5d h ALA 128 CO -0.02 -1.21 0.77 0.82 0.00 0.00 0.00 179.25 179.62 3h5d h ILE 129 N -1.20 0.41 0.00 0.00 2.04 -1.37 0.19 117.51 117.59 3h5d h ILE 129 Ca -0.12 -0.07 -0.11 0.00 1.00 0.00 0.00 64.86 65.56 3h5d h ILE 129 Cb 0.90 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 3h5d h ILE 129 CO 0.20 0.04 -0.52 0.00 0.00 0.00 0.00 178.15 177.86 3h5d h ALA 130 N 1.53 0.74 0.00 1.87 0.00 -0.51 -3.24 119.26 119.65 3h5d h ALA 130 Ca 0.62 -0.48 -0.19 0.00 0.00 0.00 0.00 54.91 54.87 3h5d h ALA 130 Cb 1.97 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.65 3h5d h ALA 130 CO -0.21 0.65 -1.04 -0.44 0.00 0.00 0.00 179.25 178.21 3h5d h ASP 131 N 0.00 0.00 -0.57 0.00 3.32 0.15 -3.40 116.42 115.92 3h5d h ASP 131 Ca -0.01 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.81 3h5d h ASP 131 Cb 1.27 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.68 3h5d h ASP 131 CO 0.07 0.80 0.30 0.00 -1.72 0.00 0.00 179.24 178.68 3h5d n ALA 132 N -2.36 4.20 -3.57 3.45 0.00 -0.72 -4.95 120.51 116.55 3h5d n ALA 132 Ca -0.04 -1.71 -0.07 0.00 0.00 0.00 0.00 53.44 51.62 3h5d n ALA 132 Cb 0.89 -1.23 -0.04 0.00 0.00 0.00 0.00 19.45 19.07 3h5d n ALA 132 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3h5d s SER 133 N -0.51 -0.27 0.51 0.00 0.15 -1.26 -4.55 113.70 107.77 3h5d s SER 133 Ca 0.37 0.17 0.29 0.00 0.70 0.00 0.00 55.95 57.47 3h5d s SER 133 Cb 0.30 0.25 1.34 0.00 -1.71 0.00 0.00 66.02 66.20 3h5d s SER 133 CO 0.08 -0.34 2.00 0.44 1.20 0.00 0.00 173.24 176.62 3h5d h ASP 134 N 2.23 0.00 -3.12 5.45 3.32 -1.92 -3.44 116.42 118.94 3h5d h ASP 134 Ca -0.16 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.32 3h5d h ASP 134 Cb 1.18 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.68 3h5d h ASP 134 CO 0.28 0.13 0.93 -0.22 -1.72 0.00 0.00 179.24 178.64 3h5d s LEU 135 N -6.87 3.96 0.38 1.55 2.96 -1.26 -5.02 118.68 114.38 3h5d s LEU 135 Ca -0.01 1.29 -0.26 0.00 -0.22 0.00 0.00 54.13 54.92 3h5d s LEU 135 Cb 0.12 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 43.18 3h5d s LEU 135 CO 0.58 -0.97 1.21 -2.84 -1.32 0.00 0.00 176.35 173.01 3h5d s PRO 136 N 3.91 4.15 0.03 0.98 0.02 -1.26 -4.74 135.00 138.09 3h5d s PRO 136 Ca 0.54 1.96 0.01 0.00 0.02 0.00 0.00 61.00 63.52 3h5d s PRO 136 Cb -0.17 -2.81 -0.04 0.00 0.02 0.00 0.00 34.50 31.50 3h5d s PRO 136 CO 0.19 -0.27 0.08 0.42 -0.33 0.00 0.00 177.00 177.09 3h5d s ILE 137 N -1.31 4.62 -0.11 2.83 -1.09 0.32 -0.79 121.20 125.67 3h5d s ILE 137 Ca 0.54 -0.56 0.02 0.00 -2.23 0.00 0.00 60.65 58.42 3h5d s ILE 137 Cb -0.34 -3.15 0.01 0.00 -1.58 0.00 0.00 42.46 37.41 3h5d s ILE 137 CO 0.43 0.26 -0.15 -0.63 -1.23 0.00 0.00 174.94 173.63 3h5d s ILE 138 N -1.26 1.48 -0.07 2.92 1.01 -0.04 0.26 121.20 125.50 3h5d s ILE 138 Ca 0.25 -0.63 -0.18 0.00 0.00 0.00 0.00 60.65 60.09 3h5d s ILE 138 Cb -0.12 -1.36 -0.05 0.00 0.01 0.00 0.00 42.46 40.94 3h5d s ILE 138 CO 0.17 0.44 0.51 -0.63 0.00 0.00 0.00 174.94 175.42 3h5d s ILE 139 N 1.00 5.09 -0.51 2.92 1.01 -0.34 -1.24 121.20 129.12 3h5d s ILE 139 Ca -0.06 1.03 -0.13 0.00 0.00 0.00 0.00 60.65 61.48 3h5d s ILE 139 Cb -0.15 -3.84 0.12 0.00 0.01 0.00 0.00 42.46 38.60 3h5d s ILE 139 CO -0.02 0.38 0.43 -0.47 0.00 0.00 0.00 174.94 175.27 3h5d s TYR 140 N 0.17 3.32 -0.56 3.97 5.04 0.79 -0.16 117.35 129.92 3h5d s TYR 140 Ca 0.27 -1.51 -0.19 0.00 -2.44 0.00 0.00 57.07 53.20 3h5d s TYR 140 Cb -0.16 -3.64 0.08 0.00 0.35 0.00 0.00 41.96 38.59 3h5d s TYR 140 CO 0.13 -1.00 0.70 1.21 -1.34 0.00 0.00 175.55 175.25 3h5d s ASN 141 N 3.16 6.21 -0.41 4.32 2.47 -0.44 -2.02 114.94 128.21 3h5d s ASN 141 Ca 0.04 -1.13 0.04 0.00 0.42 0.00 0.00 52.86 52.23 3h5d s ASN 141 Cb -0.28 -2.31 0.17 0.00 -1.45 0.00 0.00 41.25 37.37 3h5d s ASN 141 CO 0.02 -1.05 0.37 -0.51 -3.72 0.00 0.00 177.10 172.21 3h5d s ILE 142 N 2.82 0.07 0.50 -5.21 2.07 -1.26 -0.57 121.20 119.62 3h5d s ILE 142 Ca 0.15 -2.13 0.26 0.00 -1.41 0.00 0.00 60.65 57.52 3h5d s ILE 142 Cb -0.21 -1.01 0.43 0.00 0.13 0.00 0.00 42.46 41.80 3h5d s ILE 142 CO 0.10 -0.98 1.91 -0.65 -1.91 0.00 0.00 174.94 173.41 3h5d h PRO 143 N 5.92 0.11 0.00 3.50 0.11 -1.73 -1.01 132.00 138.90 3h5d h PRO 143 Ca 0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.29 3h5d h PRO 143 Cb 0.96 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.04 3h5d h PRO 143 CO 0.29 0.07 0.00 0.78 -0.21 0.00 0.00 178.00 178.93 3h5d h GLY 144 N 0.11 0.00 0.00 -0.55 0.00 -1.85 0.50 103.07 101.28 3h5d h GLY 144 Ca 0.38 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.67 3h5d h GLY 144 CO -0.05 0.00 -1.30 0.54 0.00 0.00 0.00 176.54 175.73 3h5d n ARG 145 N -2.44 1.39 0.00 4.80 1.74 -0.48 -4.78 116.66 116.89 3h5d n ARG 145 Ca 0.02 -0.03 0.01 0.00 -0.77 0.00 0.00 57.85 57.07 3h5d n ARG 145 Cb 0.26 -1.14 0.00 0.00 -1.02 0.00 0.00 32.46 30.56 3h5d n ARG 145 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3h5d n VAL 146 N -1.90 0.00 0.00 1.55 0.31 -0.61 -4.91 118.33 112.77 3h5d n VAL 146 Ca -0.04 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.79 3h5d n VAL 146 Cb 0.36 1.03 0.00 0.00 -0.91 0.00 0.00 33.84 34.32 3h5d n VAL 146 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3h5d n VAL 147 N -0.03 0.00 -1.77 2.52 0.31 0.16 -4.46 118.33 115.07 3h5d n VAL 147 Ca 0.01 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.03 3h5d n VAL 147 Cb 0.04 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 32.99 3h5d n VAL 147 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 3h5d s VAL 148 N 0.00 4.42 -0.01 2.52 -7.23 -1.26 -4.63 120.40 114.21 3h5d s VAL 148 Ca 0.00 0.79 0.04 0.00 -1.81 0.00 0.00 61.98 61.00 3h5d s VAL 148 Cb 0.00 -3.70 -0.01 0.00 0.56 0.00 0.00 36.38 33.24 3h5d s VAL 148 CO 0.00 -1.03 -0.13 -1.61 -0.31 0.00 0.00 175.10 172.02 3h5d s GLU 149 N -5.14 1.09 -0.12 4.82 2.02 -1.26 -3.86 118.70 116.26 3h5d s GLU 149 Ca 0.56 -0.46 -0.30 0.00 0.02 0.00 0.00 54.97 54.80 3h5d s GLU 149 Cb -0.12 -1.04 -0.02 0.00 0.10 0.00 0.00 34.13 33.04 3h5d s GLU 149 CO 0.54 0.26 1.24 -1.17 0.02 0.00 0.00 175.26 176.16 3h5d s LEU 150 N -0.24 4.23 0.86 1.80 2.96 -1.26 -4.94 118.68 122.08 3h5d s LEU 150 Ca 0.04 1.76 -0.11 0.00 -0.22 0.00 0.00 54.13 55.60 3h5d s LEU 150 Cb -0.06 -3.55 0.11 0.00 0.50 0.00 0.00 46.19 43.19 3h5d s LEU 150 CO -0.00 -0.69 1.10 0.42 -1.32 0.00 0.00 176.35 175.86 3h5d s THR 151 N 2.95 2.80 0.48 3.68 -4.23 -1.26 -4.81 115.64 115.25 3h5d s THR 151 Ca 0.56 0.26 0.25 0.00 -1.18 0.00 0.00 61.69 61.57 3h5d s THR 151 Cb -0.23 -2.61 0.29 0.00 1.34 0.00 0.00 72.50 71.28 3h5d s THR 151 CO 0.18 -0.34 2.12 -0.65 -0.54 0.00 0.00 174.62 175.39 3h5d h PRO 152 N -1.49 0.00 -0.04 3.99 0.11 -1.96 -0.40 132.00 132.22 3h5d h PRO 152 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 3h5d h PRO 152 Cb 1.26 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 3h5d h PRO 152 CO 0.50 0.09 -0.03 1.49 -0.21 0.00 0.00 178.00 179.83 3h5d h GLU 153 N 0.00 0.08 -0.59 1.05 4.81 -1.99 -1.71 114.58 116.23 3h5d h GLU 153 Ca -0.00 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.10 3h5d h GLU 153 Cb 0.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 3h5d h GLU 153 CO 0.01 0.53 0.03 1.15 -0.73 0.00 0.00 179.01 180.00 3h5d h THR 154 N -0.36 1.26 -0.78 0.32 2.02 -1.89 -2.49 112.91 110.98 3h5d h THR 154 Ca 0.01 -1.09 0.01 0.00 0.77 0.00 0.00 66.41 66.11 3h5d h THR 154 Cb 0.52 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 3h5d h THR 154 CO 0.01 0.40 0.52 -0.03 0.37 0.00 0.00 175.52 176.78 3h5d h MET 155 N 0.93 1.03 0.00 6.66 1.85 -1.02 -2.45 114.93 121.94 3h5d h MET 155 Ca 0.17 -0.06 -0.05 0.00 -0.61 0.00 0.00 59.70 59.15 3h5d h MET 155 Cb 0.50 -0.23 -0.01 0.00 0.43 0.00 0.00 31.60 32.29 3h5d h MET 155 CO 0.02 0.68 -0.25 -0.07 -0.40 0.00 0.00 176.91 176.90 3h5d h LEU 156 N 1.06 0.00 -0.63 3.39 3.38 -1.20 -0.88 115.31 120.43 3h5d h LEU 156 Ca 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 3h5d h LEU 156 Cb -0.12 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3h5d h LEU 156 CO -0.06 0.25 0.37 0.03 0.09 0.00 0.00 178.44 179.12 3h5d h ARG 157 N 0.00 0.87 0.00 1.13 3.08 -1.24 -3.11 114.38 115.11 3h5d h ARG 157 Ca -0.00 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 3h5d h ARG 157 Cb 1.01 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 3h5d h ARG 157 CO 0.03 0.63 -0.31 -0.07 -1.07 0.00 0.00 179.97 179.19 3h5d h LEU 158 N 0.86 0.00 -0.29 3.04 3.38 -0.75 -3.26 115.31 118.29 3h5d h LEU 158 Ca 0.23 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.99 3h5d h LEU 158 Cb -0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3h5d h LEU 158 CO -0.04 0.31 -0.78 0.00 0.09 0.00 0.00 178.44 178.02 3h5d h ALA 159 N 1.69 0.47 0.00 1.53 0.00 -1.15 -2.25 119.26 119.55 3h5d h ALA 159 Ca -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 3h5d h ALA 159 Cb 0.97 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3h5d h ALA 159 CO 0.04 0.74 0.00 -0.25 0.00 0.00 0.00 179.25 179.78 3h5d n ASP 160 N -3.86 0.00 -4.72 0.00 8.00 -1.18 -4.59 116.55 110.21 3h5d n ASP 160 Ca -0.06 0.39 -0.42 0.00 0.71 0.00 0.00 54.79 55.42 3h5d n ASP 160 Cb 0.74 -0.41 -0.03 0.00 -0.02 0.00 0.00 41.12 41.40 3h5d n ASP 160 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 3h5d s HIS 161 N -2.81 3.36 0.32 1.24 2.46 -0.85 -4.91 115.29 114.10 3h5d s HIS 161 Ca 0.01 1.19 0.08 0.00 0.47 0.00 0.00 55.06 56.82 3h5d s HIS 161 Cb 0.01 -3.52 0.84 0.00 -0.13 0.00 0.00 32.58 29.78 3h5d s HIS 161 CO 0.03 -1.68 1.75 -1.35 -2.47 0.00 0.00 174.74 171.03 3h5d h PRO 162 N 6.61 0.63 -0.03 2.88 0.11 -1.88 -2.69 132.00 137.63 3h5d h PRO 162 Ca -0.42 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3h5d h PRO 162 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3h5d h PRO 162 CO 0.82 0.42 -0.10 -1.71 -0.21 0.00 0.00 178.00 177.22 3h5d n ASN 163 N -4.82 2.73 -4.56 -2.05 5.15 -1.26 -4.79 115.26 105.66 3h5d n ASN 163 Ca 0.25 -1.86 -0.40 0.00 -0.60 0.00 0.00 54.58 51.97 3h5d n ASN 163 Cb 0.68 0.10 -0.10 0.00 -0.53 0.00 0.00 39.78 39.93 3h5d n ASN 163 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3h5d s ILE 164 N -2.02 5.22 -0.06 -1.44 1.01 -1.02 0.12 121.20 123.00 3h5d s ILE 164 Ca 0.25 0.11 0.01 0.00 0.00 0.00 0.00 60.65 61.01 3h5d s ILE 164 Cb 0.19 -3.73 0.01 0.00 0.01 0.00 0.00 42.46 38.94 3h5d s ILE 164 CO 0.34 0.02 0.69 2.30 0.00 0.00 0.00 174.94 178.29 3h5d n ILE 165 N 5.16 0.34 0.00 2.92 -5.35 0.14 -4.63 119.36 117.94 3h5d n ILE 165 Ca -0.10 -0.67 0.00 0.00 -0.27 0.00 0.00 62.75 61.70 3h5d n ILE 165 Cb 0.50 0.84 0.00 0.00 -1.74 0.00 0.00 39.64 39.24 3h5d n ILE 165 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h5d n GLY 166 N -0.13 -0.34 3.00 3.28 0.00 -1.18 0.80 105.19 110.61 3h5d n GLY 166 Ca 0.00 -0.92 -0.18 0.00 0.00 0.00 0.00 46.02 44.92 3h5d n GLY 166 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h5d s VAL 167 N -2.00 0.65 -0.68 1.61 0.11 0.42 -1.20 120.40 119.31 3h5d s VAL 167 Ca 0.00 -0.33 -0.16 0.00 -2.93 0.00 0.00 61.98 58.56 3h5d s VAL 167 Cb 0.00 -0.56 0.16 0.00 -1.53 0.00 0.00 36.38 34.45 3h5d s VAL 167 CO 0.00 0.19 0.67 -0.75 -3.33 0.00 0.00 175.10 171.89 3h5d s LYS 168 N -0.04 3.28 -0.27 1.54 2.20 0.77 -1.10 119.74 126.12 3h5d s LYS 168 Ca 0.01 -1.96 -0.12 0.00 -0.36 0.00 0.00 55.97 53.54 3h5d s LYS 168 Cb -0.05 -4.38 -0.05 0.00 -1.51 0.00 0.00 37.83 31.84 3h5d s LYS 168 CO -0.00 -1.37 0.24 -2.00 -0.36 0.00 0.00 175.35 171.85 3h5d s GLU 169 N 1.25 3.99 -0.52 4.03 2.56 -0.60 -1.33 118.70 128.08 3h5d s GLU 169 Ca 0.12 -0.21 0.07 0.00 0.00 0.00 0.00 54.97 54.96 3h5d s GLU 169 Cb -0.20 -3.64 0.30 0.00 2.00 0.00 0.00 34.13 32.59 3h5d s GLU 169 CO -0.02 -0.16 0.76 0.00 -0.56 0.00 0.00 175.26 175.28 3h5d n THR 171 N 0.49 0.00 -4.30 0.00 -2.24 -1.26 -4.21 114.28 102.76 3h5d n THR 171 Ca 0.28 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.81 3h5d n THR 171 Cb 0.48 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.62 3h5d n THR 171 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3h5d s SER 172 N 0.82 4.25 0.46 3.42 1.04 -1.26 -5.03 113.70 117.39 3h5d s SER 172 Ca 0.00 -1.00 0.26 0.00 0.48 0.00 0.00 55.95 55.68 3h5d s SER 172 Cb 0.00 -0.54 0.95 0.00 0.10 0.00 0.00 66.02 66.53 3h5d s SER 172 CO 0.00 -0.30 1.83 -0.07 0.98 0.00 0.00 173.24 175.68 3h5d h LEU 173 N 1.72 0.00 -0.84 2.42 3.38 -2.00 -2.88 115.31 117.11 3h5d h LEU 173 Ca -0.43 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 3h5d h LEU 173 Cb 1.25 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.96 3h5d h LEU 173 CO 0.68 0.17 0.40 0.00 0.09 0.00 0.00 178.44 179.78 3h5d h ALA 174 N 1.83 1.09 -0.08 1.53 0.00 -1.99 -1.87 119.26 119.76 3h5d h ALA 174 Ca -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 3h5d h ALA 174 Cb 0.74 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3h5d h ALA 174 CO 0.02 0.66 -0.08 -0.91 0.00 0.00 0.00 179.25 178.94 3h5d h ASN 175 N 1.20 0.21 -0.63 0.00 2.35 -1.93 -2.85 115.58 113.94 3h5d h ASN 175 Ca 0.29 -0.49 0.01 0.00 -0.55 0.00 0.00 56.30 55.56 3h5d h ASN 175 Cb 0.13 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.41 3h5d h ASN 175 CO -0.03 0.66 0.42 -0.03 -1.65 0.00 0.00 177.43 176.79 3h5d h MET 176 N -0.23 0.81 -0.72 0.81 4.05 -1.51 -0.27 114.93 117.86 3h5d h MET 176 Ca 0.01 -0.05 0.05 0.00 -0.28 0.00 0.00 59.70 59.43 3h5d h MET 176 Cb 0.60 -0.18 -0.05 0.00 -0.80 0.00 0.00 31.60 31.17 3h5d h MET 176 CO 0.02 0.53 0.43 0.00 0.23 0.00 0.00 176.91 178.12 3h5d h ALA 177 N 1.61 0.97 -0.11 0.39 0.00 -1.31 -0.23 119.26 120.58 3h5d h ALA 177 Ca 0.24 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3h5d h ALA 177 Cb -0.06 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3h5d h ALA 177 CO -0.06 0.16 -0.06 -0.92 0.00 0.00 0.00 179.25 178.37 3h5d h TYR 178 N 0.81 0.28 -0.22 0.00 3.20 -0.99 -1.17 116.97 118.88 3h5d h TYR 178 Ca 0.31 -0.07 0.05 0.00 3.14 0.00 0.00 58.73 62.16 3h5d h TYR 178 Cb 0.13 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.28 3h5d h TYR 178 CO -0.06 0.60 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.87 3h5d h LEU 179 N -0.12 -0.41 -1.99 2.82 4.07 -0.95 0.00 115.31 118.73 3h5d h LEU 179 Ca 0.02 0.09 -0.02 0.00 0.08 0.00 0.00 57.88 58.06 3h5d h LEU 179 Cb 0.53 0.22 -0.00 0.00 1.08 0.00 0.00 40.66 42.49 3h5d h LEU 179 CO 0.02 -0.16 -0.10 0.40 -1.08 0.00 0.00 178.44 177.52 3h5d h ILE 180 N -0.11 0.73 0.18 1.22 2.04 -0.95 0.77 117.51 121.40 3h5d h ILE 180 Ca 0.12 -0.39 -0.33 0.00 1.00 0.00 0.00 64.86 65.26 3h5d h ILE 180 Cb 0.29 1.23 0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3h5d h ILE 180 CO -0.29 0.10 -1.61 -0.33 0.00 0.00 0.00 178.15 176.01 3h5d h GLU 181 N 0.00 0.38 -0.35 2.37 4.39 -0.41 -3.36 114.58 117.60 3h5d h GLU 181 Ca -0.00 -0.65 -0.20 0.00 0.34 0.00 0.00 59.36 58.84 3h5d h GLU 181 Cb 0.23 0.24 -0.13 0.00 -0.10 0.00 0.00 28.75 28.99 3h5d h GLU 181 CO 0.01 1.29 -0.18 0.72 -1.16 0.00 0.00 179.01 179.69 3h5d n HIS 182 N -3.58 1.13 -2.38 4.33 8.25 -0.09 -5.01 115.22 117.87 3h5d n HIS 182 Ca -0.20 -1.70 -0.37 0.00 -0.26 0.00 0.00 57.72 55.19 3h5d n HIS 182 Cb 1.07 -0.48 -0.02 0.00 1.12 0.00 0.00 29.99 31.68 3h5d n HIS 182 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 3h5d s LYS 183 N -3.31 4.00 0.79 -0.41 -2.85 0.24 -4.97 119.74 113.24 3h5d s LYS 183 Ca 0.45 1.68 -0.10 0.00 -1.00 0.00 0.00 55.97 57.00 3h5d s LYS 183 Cb 0.41 -2.53 0.17 0.00 -2.06 0.00 0.00 37.83 33.82 3h5d s LYS 183 CO -0.01 -0.32 1.07 -2.30 0.10 0.00 0.00 175.35 173.89 3h5d n PRO 184 N -0.17 -0.78 0.25 1.78 -0.02 -1.26 -5.06 135.00 129.74 3h5d n PRO 184 Ca 0.06 -1.99 -0.10 0.00 -2.02 0.00 0.00 63.50 59.44 3h5d n PRO 184 Cb 0.48 -1.00 -0.05 0.00 -0.02 0.00 0.00 33.50 32.91 3h5d n PRO 184 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3h5d h GLU 185 N 0.00 -0.65 -2.93 -0.52 3.07 -1.98 -3.30 114.58 108.27 3h5d h GLU 185 Ca -0.35 0.04 -0.76 0.00 -0.50 0.00 0.00 59.36 57.79 3h5d h GLU 185 Cb 1.05 0.15 -0.17 0.00 -0.84 0.00 0.00 28.75 28.93 3h5d h GLU 185 CO 0.28 -0.44 1.90 0.39 -1.40 0.00 0.00 179.01 179.74 3h5d n GLU 186 N -5.01 4.33 -3.52 2.33 -0.58 -1.26 -4.88 120.64 112.05 3h5d n GLU 186 Ca -0.08 -3.77 -0.15 0.00 -0.42 0.00 0.00 57.16 52.73 3h5d n GLU 186 Cb 0.27 -2.70 -0.12 0.00 -0.57 0.00 0.00 31.44 28.32 3h5d n GLU 186 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 3h5d s PHE 187 N -1.20 -0.43 0.10 -0.32 5.36 -1.24 -4.24 117.98 116.01 3h5d s PHE 187 Ca 0.44 0.60 -0.22 0.00 -0.96 0.00 0.00 56.93 56.79 3h5d s PHE 187 Cb 0.14 -0.18 -0.07 0.00 -0.34 0.00 0.00 43.02 42.57 3h5d s PHE 187 CO -0.03 -0.54 0.65 -0.51 -1.46 0.00 0.00 175.22 173.33 3h5d s LEU 188 N 2.40 4.55 -0.23 6.12 1.02 0.24 -4.86 118.68 127.92 3h5d s LEU 188 Ca 0.06 1.41 -0.03 0.00 0.02 0.00 0.00 54.13 55.59 3h5d s LEU 188 Cb -0.14 -3.06 0.01 0.00 0.02 0.00 0.00 46.19 43.02 3h5d s LEU 188 CO -0.12 0.24 -0.07 -0.63 0.02 0.00 0.00 176.35 175.79 3h5d s ILE 189 N -1.05 3.05 0.19 -0.59 1.09 -1.26 -0.44 121.20 122.20 3h5d s ILE 189 Ca 0.32 -0.74 0.11 0.00 -1.10 0.00 0.00 60.65 59.24 3h5d s ILE 189 Cb -0.21 -2.44 -0.04 0.00 -1.06 0.00 0.00 42.46 38.71 3h5d s ILE 189 CO 0.22 0.35 -0.22 -0.31 -0.10 0.00 0.00 174.94 174.89 3h5d s TYR 190 N 1.40 2.36 0.47 3.97 2.02 -0.26 -0.05 117.35 127.27 3h5d s TYR 190 Ca 0.04 -0.33 -0.12 0.00 -0.37 0.00 0.00 57.07 56.28 3h5d s TYR 190 Cb -0.15 -1.16 -0.06 0.00 -0.40 0.00 0.00 41.96 40.18 3h5d s TYR 190 CO -0.05 0.50 0.87 0.99 -1.57 0.00 0.00 175.55 176.30 3h5d s THR 191 N -1.68 4.71 -1.39 -0.71 2.01 -0.62 -1.56 115.64 116.39 3h5d s THR 191 Ca 0.22 0.79 0.12 0.00 0.31 0.00 0.00 61.69 63.12 3h5d s THR 191 Cb -0.08 -3.76 0.12 0.00 0.01 0.00 0.00 72.50 68.79 3h5d s THR 191 CO 0.11 -0.69 0.92 0.61 -0.69 0.00 0.00 174.62 174.88 3h5d n GLY 192 N -1.67 0.12 3.44 4.40 0.00 -1.09 -1.73 105.19 108.67 3h5d n GLY 192 Ca 0.04 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 3h5d n GLY 192 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h5d s GLU 193 N -0.98 3.62 0.23 1.61 0.41 -1.26 -4.91 118.70 117.43 3h5d s GLU 193 Ca 0.15 -0.50 0.02 0.00 -0.41 0.00 0.00 54.97 54.23 3h5d s GLU 193 Cb 0.10 -3.34 0.24 0.00 -1.78 0.00 0.00 34.13 29.35 3h5d s GLU 193 CO 0.15 -0.21 1.57 -0.44 -0.49 0.00 0.00 175.26 175.84 3h5d h ASP 194 N 8.24 0.38 0.34 -0.19 3.32 -1.93 -2.12 116.42 124.47 3h5d h ASP 194 Ca -0.38 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.47 3h5d h ASP 194 Cb 1.17 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.61 3h5d h ASP 194 CO 0.58 0.86 0.00 1.23 -1.72 0.00 0.00 179.24 180.19 3h5d h GLY 195 N 1.29 0.00 0.00 2.75 0.00 -1.94 -3.01 103.07 102.16 3h5d h GLY 195 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h5d h GLY 195 CO 0.09 0.00 -0.87 1.22 0.00 0.00 0.00 176.54 176.98 3h5d n ASP 196 N -2.95 0.87 -0.33 0.19 9.92 -1.05 -4.68 116.55 118.52 3h5d n ASP 196 Ca -0.02 -0.66 0.14 0.00 -0.53 0.00 0.00 54.79 53.72 3h5d n ASP 196 Cb 0.14 1.14 0.33 0.00 -0.64 0.00 0.00 41.12 42.09 3h5d n ASP 196 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3h5d h ALA 197 N 1.86 1.60 -0.68 2.24 0.00 -1.25 0.51 119.26 123.54 3h5d h ALA 197 Ca 0.00 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3h5d h ALA 197 Cb 0.40 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 3h5d h ALA 197 CO 0.00 -0.21 0.32 0.35 0.00 0.00 0.00 179.25 179.71 3h5d h PHE 198 N 0.59 0.97 0.15 0.00 3.57 -1.83 0.31 116.94 120.70 3h5d h PHE 198 Ca 0.58 -0.04 -0.30 0.00 3.53 0.00 0.00 57.97 61.74 3h5d h PHE 198 Cb 1.02 -0.30 0.01 0.00 2.79 0.00 0.00 35.95 39.46 3h5d h PHE 198 CO -0.05 0.72 -1.43 0.45 -2.23 0.00 0.00 178.31 175.77 3h5d h HIS 199 N 0.97 0.56 -0.58 0.41 3.86 -1.23 -3.22 115.15 115.93 3h5d h HIS 199 Ca 0.24 -0.41 -0.05 0.00 -1.16 0.00 0.00 60.37 58.98 3h5d h HIS 199 Cb 0.12 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.54 3h5d h HIS 199 CO 0.01 1.39 0.16 0.00 0.86 0.00 0.00 177.93 180.35 3h5d h ALA 200 N 0.46 0.76 0.41 2.45 0.00 0.22 -2.18 119.26 121.37 3h5d h ALA 200 Ca -0.21 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 3h5d h ALA 200 Cb 2.03 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.60 3h5d h ALA 200 CO 0.20 0.44 -0.19 0.52 0.00 0.00 0.00 179.25 180.21 3h5d h MET 201 N 0.82 -0.52 0.00 0.00 2.07 -0.48 -0.85 114.93 115.97 3h5d h MET 201 Ca 0.18 0.04 0.00 0.00 -2.07 0.00 0.00 59.70 57.85 3h5d h MET 201 Cb 0.31 0.12 0.00 0.00 -1.87 0.00 0.00 31.60 30.16 3h5d h MET 201 CO -0.00 -0.21 0.00 0.27 1.07 0.00 0.00 176.91 178.03 3h5d n ASN 202 N -5.20 0.00 0.19 1.22 6.94 -1.21 -0.21 115.26 116.98 3h5d n ASN 202 Ca -0.10 -0.59 0.09 0.00 -0.02 0.00 0.00 54.58 53.96 3h5d n ASN 202 Cb 0.29 -0.04 0.11 0.00 -2.36 0.00 0.00 39.78 37.77 3h5d n ASN 202 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 3h5d h LEU 203 N 0.00 0.00 0.00 -4.53 5.85 -1.01 -3.48 115.31 112.14 3h5d h LEU 203 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3h5d h LEU 203 Cb 0.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.06 3h5d h LEU 203 CO 0.00 0.18 0.00 0.61 -0.34 0.00 0.00 178.44 178.89 3h5d n GLY 204 N 1.15 1.61 3.77 3.75 0.00 0.71 -4.96 105.19 111.23 3h5d n GLY 204 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 3h5d n GLY 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h5d s ALA 205 N -2.00 2.90 0.14 4.61 0.00 -0.36 -4.94 121.76 122.12 3h5d s ALA 205 Ca 0.00 0.90 -0.05 0.00 0.00 0.00 0.00 51.96 52.81 3h5d s ALA 205 Cb 0.00 -3.37 -0.05 0.00 0.00 0.00 0.00 23.12 19.70 3h5d s ALA 205 CO 0.00 -0.67 1.35 -0.44 0.00 0.00 0.00 175.76 175.99 3h5d h ASP 206 N 1.84 0.58 0.00 0.00 3.32 -0.80 -3.43 116.42 117.92 3h5d h ASP 206 Ca -0.49 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.13 3h5d h ASP 206 Cb 1.25 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.63 3h5d h ASP 206 CO 0.59 1.20 0.00 0.61 -1.72 0.00 0.00 179.24 179.92 3h5d n GLY 207 N 0.78 0.40 3.87 2.75 0.00 -1.23 -4.49 105.19 107.27 3h5d n GLY 207 Ca -0.06 -0.82 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 3h5d n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h5d s VAL 208 N -2.00 5.49 -0.38 1.61 0.11 -0.39 -1.60 120.40 123.24 3h5d s VAL 208 Ca 0.00 0.23 -0.18 0.00 -2.93 0.00 0.00 61.98 59.11 3h5d s VAL 208 Cb 0.00 -3.41 0.00 0.00 -1.53 0.00 0.00 36.38 31.44 3h5d s VAL 208 CO 0.00 0.61 0.48 -0.63 -3.33 0.00 0.00 175.10 172.23 3h5d s ILE 209 N -1.00 5.04 0.03 7.04 1.01 -0.70 -1.27 121.20 131.36 3h5d s ILE 209 Ca 0.15 0.08 0.08 0.00 0.00 0.00 0.00 60.65 60.97 3h5d s ILE 209 Cb -0.12 -3.98 -0.03 0.00 0.01 0.00 0.00 42.46 38.34 3h5d s ILE 209 CO 0.04 -0.28 -0.23 -0.55 0.00 0.00 0.00 174.94 173.92 3h5d s SER 210 N 1.79 3.40 -0.23 3.58 0.15 0.23 -4.59 113.70 118.03 3h5d s SER 210 Ca 0.16 -0.51 0.09 0.00 0.70 0.00 0.00 55.95 56.39 3h5d s SER 210 Cb -0.16 -0.42 -0.21 0.00 -1.71 0.00 0.00 66.02 63.53 3h5d s SER 210 CO 0.14 0.27 -0.09 0.52 1.20 0.00 0.00 173.24 175.28 3h5d n VAL 211 N 1.78 1.45 0.90 4.45 0.31 -1.26 -0.57 118.33 125.39 3h5d n VAL 211 Ca -0.17 -0.70 0.14 0.00 -0.01 0.00 0.00 64.34 63.60 3h5d n VAL 211 Cb 0.52 -1.00 0.56 0.00 -0.91 0.00 0.00 33.84 33.02 3h5d n VAL 211 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h5d n ALA 212 N -3.03 2.29 0.31 3.52 0.00 -1.26 -1.72 120.51 120.62 3h5d n ALA 212 Ca -0.40 -0.08 0.20 0.00 0.00 0.00 0.00 53.44 53.16 3h5d n ALA 212 Cb 1.07 -1.46 0.98 0.00 0.00 0.00 0.00 19.45 20.04 3h5d n ALA 212 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3h5d h SER 213 N 0.00 0.00 -0.25 0.00 4.64 -1.84 0.07 113.55 116.17 3h5d h SER 213 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h5d h SER 213 Cb 0.54 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 3h5d h SER 213 CO 0.00 0.00 0.14 0.45 -0.87 0.00 0.00 176.83 176.56 3h5d h HIS 214 N 0.00 0.35 -0.01 4.77 3.86 -1.61 -3.25 115.15 119.26 3h5d h HIS 214 Ca -0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 3h5d h HIS 214 Cb 0.23 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.58 3h5d h HIS 214 CO 0.00 0.29 0.00 0.25 0.86 0.00 0.00 177.93 179.33 3h5d n THR 215 N -4.85 0.19 -2.49 2.45 -2.24 -1.11 -4.73 114.28 101.50 3h5d n THR 215 Ca -0.02 -0.60 -0.01 0.00 -2.27 0.00 0.00 64.05 61.15 3h5d n THR 215 Cb 0.07 0.93 0.02 0.00 -2.10 0.00 0.00 70.33 69.26 3h5d n THR 215 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3h5d n ASN 216 N 0.01 0.20 0.20 3.42 3.02 -0.00 -4.90 115.26 117.20 3h5d n ASN 216 Ca 0.01 -2.04 0.04 0.00 -0.03 0.00 0.00 54.58 52.56 3h5d n ASN 216 Cb 0.09 -0.02 0.45 0.00 -0.61 0.00 0.00 39.78 39.69 3h5d n ASN 216 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3h5d h GLY 217 N 1.14 0.05 0.39 7.41 0.00 -1.69 -2.58 103.07 107.78 3h5d h GLY 217 Ca -0.33 -0.03 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 3h5d h GLY 217 CO -0.03 0.03 -0.02 -0.55 0.00 0.00 0.00 176.54 175.97 3h5d h ASP 218 N 0.04 -0.04 -0.21 0.19 5.19 -1.91 -0.62 116.42 119.06 3h5d h ASP 218 Ca 0.01 -0.55 -0.12 0.00 -0.62 0.00 0.00 57.03 55.75 3h5d h ASP 218 Cb 0.40 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 39.92 3h5d h ASP 218 CO 0.03 0.55 -0.32 1.05 -3.12 0.00 0.00 179.24 177.44 3h5d h GLU 219 N -0.67 0.59 -0.06 3.56 4.11 -1.97 0.49 114.58 120.62 3h5d h GLU 219 Ca -0.01 -0.35 0.03 0.00 0.07 0.00 0.00 59.36 59.10 3h5d h GLU 219 Cb 0.59 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.82 3h5d h GLU 219 CO 0.01 0.96 -0.51 0.52 0.07 0.00 0.00 179.01 180.06 3h5d h MET 220 N 0.27 -0.59 -0.58 1.06 2.86 -1.56 0.43 114.93 116.82 3h5d h MET 220 Ca 0.02 0.04 0.10 0.00 -2.06 0.00 0.00 59.70 57.80 3h5d h MET 220 Cb 0.90 0.13 -0.08 0.00 0.06 0.00 0.00 31.60 32.62 3h5d h MET 220 CO 0.07 -0.39 0.15 1.25 1.06 0.00 0.00 176.91 179.05 3h5d h HIS 221 N -0.61 0.24 -0.83 -0.22 -0.00 -1.03 -0.56 115.15 112.14 3h5d h HIS 221 Ca 0.03 0.03 0.04 0.00 -0.00 0.00 0.00 60.37 60.48 3h5d h HIS 221 Cb 0.69 -0.02 -0.05 0.00 -0.00 0.00 0.00 27.41 28.03 3h5d h HIS 221 CO -0.53 0.01 0.54 1.49 -0.00 0.00 0.00 177.93 179.44 3h5d h GLU 222 N 0.29 0.97 -0.22 5.26 4.81 0.64 -0.39 114.58 125.93 3h5d h GLU 222 Ca 0.30 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.30 3h5d h GLU 222 Cb 0.41 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 3h5d h GLU 222 CO -0.36 0.64 -0.54 1.98 -0.73 0.00 0.00 179.01 180.00 3h5d h MET 223 N 1.00 0.66 -0.05 1.92 4.05 0.86 -1.43 114.93 121.94 3h5d h MET 223 Ca 0.34 -0.41 -0.10 0.00 -0.28 0.00 0.00 59.70 59.24 3h5d h MET 223 Cb 0.08 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 3h5d h MET 223 CO -0.10 1.03 -0.44 0.74 0.23 0.00 0.00 176.91 178.37 3h5d h PHE 224 N 0.51 0.13 -0.13 1.39 -1.00 -0.60 -2.08 116.94 115.15 3h5d h PHE 224 Ca 0.01 -0.04 -0.09 0.00 2.81 0.00 0.00 57.97 60.66 3h5d h PHE 224 Cb 1.11 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.64 3h5d h PHE 224 CO 0.05 0.53 -0.29 1.15 -1.61 0.00 0.00 178.31 178.15 3h5d h THR 225 N 0.09 1.37 0.00 -1.55 2.02 -0.95 -1.29 112.91 112.60 3h5d h THR 225 Ca 0.00 -1.56 0.01 0.00 0.77 0.00 0.00 66.41 65.63 3h5d h THR 225 Cb 0.82 2.04 -0.02 0.00 -1.74 0.00 0.00 68.15 69.25 3h5d h THR 225 CO 0.06 0.46 -0.16 0.00 0.37 0.00 0.00 175.52 176.25 3h5d h ALA 226 N 0.54 -0.64 -0.98 6.16 0.00 -1.19 0.12 119.26 123.26 3h5d h ALA 226 Ca 0.00 -0.03 0.28 0.00 0.00 0.00 0.00 54.91 55.17 3h5d h ALA 226 Cb 0.88 0.63 -0.18 0.00 0.00 0.00 0.00 17.79 19.13 3h5d h ALA 226 CO 0.06 -0.69 0.07 -0.89 0.00 0.00 0.00 179.25 177.81 3h5d n ILE 227 N -3.39 -0.41 0.04 0.00 5.41 -0.79 -1.07 119.36 119.14 3h5d n ILE 227 Ca -0.02 2.14 -0.05 0.00 1.00 0.00 0.00 62.75 65.81 3h5d n ILE 227 Cb 0.12 -3.15 0.15 0.00 -0.71 0.00 0.00 39.64 36.05 3h5d n ILE 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3h5d h ALA 228 N 1.96 0.95 -0.49 -1.39 0.00 -0.69 -2.91 119.26 116.68 3h5d h ALA 228 Ca 0.62 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3h5d h ALA 228 Cb 1.32 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3h5d h ALA 228 CO -0.90 0.63 0.00 0.39 0.00 0.00 0.00 179.25 179.37 3h5d n GLU 229 N -4.02 3.40 -3.85 0.00 1.02 -0.02 -4.94 120.64 112.22 3h5d n GLU 229 Ca -0.02 -2.29 -0.26 0.00 -0.02 0.00 0.00 57.16 54.57 3h5d n GLU 229 Cb 0.51 -1.86 0.01 0.00 -0.02 0.00 0.00 31.44 30.09 3h5d n GLU 229 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3h5d n SER 230 N 0.74 -2.18 -2.81 1.62 7.64 -0.76 -4.92 113.62 112.95 3h5d n SER 230 Ca 0.21 -0.86 -0.33 0.00 1.01 0.00 0.00 58.87 58.89 3h5d n SER 230 Cb 0.80 -3.70 0.01 0.00 -1.01 0.00 0.00 64.21 60.31 3h5d n SER 230 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3h5d n ASP 231 N -2.95 5.94 -0.49 6.43 -0.08 -0.95 -4.87 116.55 119.57 3h5d n ASP 231 Ca -0.18 -3.76 0.42 0.00 -1.51 0.00 0.00 54.79 49.77 3h5d n ASP 231 Cb 0.62 -0.76 0.76 0.00 2.34 0.00 0.00 41.12 44.09 3h5d n ASP 231 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 3h5d h MET 232 N 2.94 0.03 -0.41 -0.67 2.86 -1.90 0.44 114.93 118.21 3h5d h MET 232 Ca 0.40 -0.00 0.08 0.00 -2.06 0.00 0.00 59.70 58.12 3h5d h MET 232 Cb 0.49 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.08 3h5d h MET 232 CO 1.09 0.02 -0.06 0.87 1.06 0.00 0.00 176.91 179.88 3h5d h LYS 233 N 0.03 0.04 -0.06 1.72 1.57 -1.96 -0.52 116.57 117.38 3h5d h LYS 233 Ca 0.74 -0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 59.36 3h5d h LYS 233 Cb 2.88 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 35.19 3h5d h LYS 233 CO -0.06 0.03 -0.59 -0.22 -0.57 0.00 0.00 179.45 178.04 3h5d h LYS 234 N 0.04 0.51 -0.27 3.15 3.64 -1.33 -2.90 116.57 119.42 3h5d h LYS 234 Ca 0.20 -0.46 0.06 0.00 -1.27 0.00 0.00 60.65 59.18 3h5d h LYS 234 Cb 0.30 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.17 3h5d h LYS 234 CO -0.39 1.10 -0.13 0.00 -2.27 0.00 0.00 179.45 177.76 3h5d h ALA 235 N 0.42 0.09 -0.42 5.00 0.00 -1.29 -0.99 119.26 122.07 3h5d h ALA 235 Ca -0.06 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3h5d h ALA 235 Cb 1.25 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 19.34 3h5d h ALA 235 CO 0.12 -0.53 0.18 0.00 0.00 0.00 0.00 179.25 179.01 3h5d h ALA 236 N 1.12 0.54 -0.70 0.00 0.00 -1.21 -0.13 119.26 118.88 3h5d h ALA 236 Ca 0.14 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.02 3h5d h ALA 236 Cb 0.30 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 3h5d h ALA 236 CO -0.33 0.13 0.32 0.00 0.00 0.00 0.00 179.25 179.38 3h5d h ALA 237 N 1.02 0.96 -0.22 0.00 0.00 -1.23 0.72 119.26 120.51 3h5d h ALA 237 Ca 0.14 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 3h5d h ALA 237 Cb 0.17 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3h5d h ALA 237 CO -0.01 -0.11 -0.06 0.82 0.00 0.00 0.00 179.25 179.89 3h5d h ILE 238 N 0.53 1.29 -0.69 0.00 2.04 -0.91 -2.76 117.51 117.01 3h5d h ILE 238 Ca 0.35 -1.07 0.08 0.00 1.00 0.00 0.00 64.86 65.22 3h5d h ILE 238 Cb 0.42 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 37.98 3h5d h ILE 238 CO -0.30 0.33 0.36 -0.61 0.00 0.00 0.00 178.15 177.93 3h5d h GLN 239 N 0.15 0.62 -0.69 2.37 5.75 0.23 0.26 115.11 123.80 3h5d h GLN 239 Ca 0.05 -0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 58.47 3h5d h GLN 239 Cb 0.53 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.91 3h5d h GLN 239 CO 0.02 0.41 0.25 0.00 -2.65 0.00 0.00 178.83 176.86 3h5d h ARG 240 N 0.64 1.03 0.00 1.69 3.08 0.49 -1.55 114.38 119.76 3h5d h ARG 240 Ca 0.32 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.18 3h5d h ARG 240 Cb 0.28 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.16 3h5d h ARG 240 CO -0.23 0.86 -0.31 1.63 -1.07 0.00 0.00 179.97 180.85 3h5d n LYS 241 N -4.28 0.09 0.04 0.04 5.02 -0.87 -4.03 118.16 114.17 3h5d n LYS 241 Ca 0.06 0.04 -0.22 0.00 -2.02 0.00 0.00 58.31 56.17 3h5d n LYS 241 Cb 0.20 -1.58 -0.14 0.00 -0.02 0.00 0.00 35.03 33.49 3h5d n LYS 241 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 3h5d h PHE 242 N 0.00 0.58 -0.88 2.13 3.57 0.30 -3.36 116.94 119.29 3h5d h PHE 242 Ca 0.00 -0.43 0.17 0.00 3.53 0.00 0.00 57.97 61.24 3h5d h PHE 242 Cb 0.58 -0.02 -0.16 0.00 2.79 0.00 0.00 35.95 39.13 3h5d h PHE 242 CO 0.00 1.56 -0.26 0.82 -2.23 0.00 0.00 178.31 178.20 3h5d h ILE 243 N -0.15 0.10 0.00 1.41 2.04 -1.45 0.54 117.51 119.99 3h5d h ILE 243 Ca -0.29 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.57 3h5d h ILE 243 Cb 1.88 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 38.06 3h5d h ILE 243 CO 0.12 0.00 0.00 -0.65 0.00 0.00 0.00 178.15 177.62 3h5d h PRO 244 N -0.02 0.00 0.06 2.37 0.11 -1.79 0.19 132.00 132.92 3h5d h PRO 244 Ca 0.39 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 66.19 3h5d h PRO 244 Cb 0.63 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.71 3h5d h PRO 244 CO -0.90 0.00 -1.70 0.87 -0.21 0.00 0.00 178.00 176.05 3h5d h LYS 245 N 0.00 0.12 0.18 1.05 1.57 -0.16 -2.32 116.57 117.01 3h5d h LYS 245 Ca 0.00 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.56 3h5d h LYS 245 Cb 0.09 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3h5d h LYS 245 CO 0.00 0.84 -0.09 0.28 -0.57 0.00 0.00 179.45 179.92 3h5d h VAL 246 N 0.03 0.89 -0.42 0.50 2.07 0.20 0.07 116.25 119.59 3h5d h VAL 246 Ca -0.30 -0.29 0.09 0.00 0.82 0.00 0.00 66.70 67.02 3h5d h VAL 246 Cb 2.01 1.07 -0.09 0.00 -1.52 0.00 0.00 31.29 32.75 3h5d h VAL 246 CO 0.10 0.07 -0.18 0.78 0.02 0.00 0.00 177.57 178.36 3h5d h ASN 247 N -0.38 -0.63 -0.12 0.57 -0.26 -0.84 -2.18 115.58 111.74 3h5d h ASN 247 Ca -0.02 0.15 0.02 0.00 -0.56 0.00 0.00 56.30 55.89 3h5d h ASN 247 Cb 0.30 0.35 -0.04 0.00 -1.06 0.00 0.00 38.32 37.87 3h5d h ASN 247 CO 0.04 -0.21 -0.33 0.00 -1.06 0.00 0.00 177.43 175.86 3h5d h ALA 248 N 1.22 -0.69 -0.91 -0.83 0.00 -1.27 -0.91 119.26 115.87 3h5d h ALA 248 Ca 0.20 -0.03 0.26 0.00 0.00 0.00 0.00 54.91 55.35 3h5d h ALA 248 Cb 0.41 0.87 -0.04 0.00 0.00 0.00 0.00 17.79 19.03 3h5d h ALA 248 CO -0.48 -0.81 1.08 -0.07 0.00 0.00 0.00 179.25 178.96 3h5d h LEU 249 N -0.33 0.00 -3.06 0.00 -0.00 -0.37 0.53 115.31 112.09 3h5d h LEU 249 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.90 3h5d h LEU 249 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.06 3h5d h LEU 249 CO -0.29 0.00 0.00 0.49 -0.00 0.00 0.00 178.44 178.64 3h5d n PHE 250 N -3.32 0.33 -0.29 1.13 3.72 -0.47 -4.27 117.46 114.30 3h5d n PHE 250 Ca 0.20 -0.80 0.10 0.00 -0.05 0.00 0.00 57.45 56.91 3h5d n PHE 250 Cb 1.36 -0.16 0.34 0.00 -0.94 0.00 0.00 39.48 40.08 3h5d n PHE 250 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3h5d h SER 251 N 0.79 0.74 -3.12 4.37 0.02 0.13 -3.42 113.55 113.06 3h5d h SER 251 Ca 0.00 0.04 -0.48 0.00 -0.84 0.00 0.00 61.79 60.52 3h5d h SER 251 Cb 0.99 -0.10 -0.15 0.00 0.14 0.00 0.00 62.40 63.28 3h5d h SER 251 CO 0.06 0.38 -0.74 -0.47 -1.14 0.00 0.00 176.83 174.92 3h5d s TYR 252 N -5.76 1.79 0.02 3.45 5.04 -1.26 -5.07 117.35 115.56 3h5d s TYR 252 Ca -0.10 -0.53 -0.30 0.00 -2.44 0.00 0.00 57.07 53.70 3h5d s TYR 252 Cb 0.22 -0.83 -0.09 0.00 0.35 0.00 0.00 41.96 41.61 3h5d s TYR 252 CO 0.79 0.40 1.99 -2.14 -1.34 0.00 0.00 175.55 175.25 3h5d s PRO 253 N -3.52 4.08 0.38 4.97 0.02 -1.26 -4.53 135.00 135.13 3h5d s PRO 253 Ca 0.23 2.58 -0.24 0.00 0.02 0.00 0.00 61.00 63.58 3h5d s PRO 253 Cb -0.02 -4.18 -0.12 0.00 0.02 0.00 0.00 34.50 30.20 3h5d s PRO 253 CO 0.08 -1.03 0.77 0.45 -0.33 0.00 0.00 177.00 176.94 3h5d n SER 254 N 7.81 0.15 -1.90 2.53 2.88 -1.26 -1.69 113.62 122.14 3h5d n SER 254 Ca 0.21 1.01 -0.18 0.00 -1.33 0.00 0.00 58.87 58.57 3h5d n SER 254 Cb 0.41 -1.21 0.12 0.00 -0.75 0.00 0.00 64.21 62.78 3h5d n SER 254 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3h5d n PRO 255 N 0.49 1.93 -0.19 -1.46 -0.05 -1.26 -5.00 135.00 129.46 3h5d n PRO 255 Ca 0.11 -2.17 -0.07 0.00 -0.05 0.00 0.00 63.50 61.32 3h5d n PRO 255 Cb 0.37 -1.85 0.02 0.00 -0.05 0.00 0.00 33.50 31.99 3h5d n PRO 255 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 3h5d h ALA 256 N 1.34 0.69 -0.00 0.55 0.00 -1.60 -2.79 119.26 117.45 3h5d h ALA 256 Ca 0.45 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 55.10 3h5d h ALA 256 Cb 2.15 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.70 3h5d h ALA 256 CO 0.84 0.24 -0.71 -1.35 0.00 0.00 0.00 179.25 178.26 3h5d h PRO 257 N 0.71 0.00 -0.13 0.00 0.11 -1.80 -2.89 132.00 128.01 3h5d h PRO 257 Ca 0.18 -0.00 -0.21 0.00 0.11 0.00 0.00 66.00 66.08 3h5d h PRO 257 Cb 0.10 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.21 3h5d h PRO 257 CO -0.03 0.71 -0.76 -0.24 -0.21 0.00 0.00 178.00 177.47 3h5d h VAL 258 N 0.00 1.31 -0.45 3.15 3.04 -1.76 -2.95 116.25 118.59 3h5d h VAL 258 Ca -0.01 -2.02 -0.04 0.00 -1.01 0.00 0.00 66.70 63.62 3h5d h VAL 258 Cb 1.25 2.02 -0.02 0.00 -2.01 0.00 0.00 31.29 32.53 3h5d h VAL 258 CO 0.09 0.63 0.12 0.11 -1.01 0.00 0.00 177.57 177.51 3h5d h LYS 259 N 0.46 0.71 -0.78 4.17 1.57 -1.52 0.20 116.57 121.38 3h5d h LYS 259 Ca -0.05 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.56 3h5d h LYS 259 Cb 1.38 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 33.55 3h5d h LYS 259 CO 0.15 0.70 0.47 0.00 -0.57 0.00 0.00 179.45 180.20 3h5d h ALA 260 N 0.98 1.36 0.19 3.86 0.00 -1.55 0.75 119.26 124.85 3h5d h ALA 260 Ca 0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3h5d h ALA 260 Cb 0.31 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3h5d h ALA 260 CO -0.00 0.55 -0.09 0.82 0.00 0.00 0.00 179.25 180.53 3h5d h ILE 261 N 1.07 0.90 -0.77 0.00 2.04 -1.33 -2.66 117.51 116.77 3h5d h ILE 261 Ca 0.28 -0.85 0.14 0.00 1.00 0.00 0.00 64.86 65.43 3h5d h ILE 261 Cb -0.04 1.37 -0.05 0.00 -0.74 0.00 0.00 36.82 37.36 3h5d h ILE 261 CO -0.05 0.18 0.51 -0.07 0.00 0.00 0.00 178.15 178.72 3h5d h LEU 262 N -0.70 0.44 -0.31 1.44 3.38 -0.29 -0.45 115.31 118.81 3h5d h LEU 262 Ca -0.03 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3h5d h LEU 262 Cb 0.49 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 3h5d h LEU 262 CO 0.04 0.23 0.00 0.78 0.09 0.00 0.00 178.44 179.59 3h5d h ASN 263 N 0.47 0.54 0.36 -0.43 2.35 0.48 -2.10 115.58 117.25 3h5d h ASN 263 Ca 0.38 -0.30 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 3h5d h ASN 263 Cb 0.79 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 39.02 3h5d h ASN 263 CO -0.13 0.71 -0.11 0.22 -1.65 0.00 0.00 177.43 176.48 3h5d h TYR 264 N 0.35 0.00 -0.00 1.19 3.20 -0.95 -0.79 116.97 119.97 3h5d h TYR 264 Ca 0.09 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.96 3h5d h TYR 264 Cb 0.43 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.70 3h5d h TYR 264 CO 0.04 0.11 -0.29 -1.33 -1.64 0.00 0.00 178.16 175.04 3h5d n MET 265 N -3.62 0.03 0.00 1.82 2.81 -0.26 -4.96 117.12 112.94 3h5d n MET 265 Ca -0.02 -0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 3h5d n MET 265 Cb 0.23 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.24 3h5d n MET 265 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h5d n GLY 266 N 1.49 1.39 0.00 3.03 0.00 -0.30 -4.97 105.19 105.84 3h5d n GLY 266 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 3h5d n GLY 266 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h5d n PHE 267 N -0.91 0.00 -3.68 1.61 3.72 -0.83 -4.90 117.46 112.47 3h5d n PHE 267 Ca 0.00 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.17 3h5d n PHE 267 Cb 0.00 -0.29 0.03 0.00 -0.94 0.00 0.00 39.48 38.29 3h5d n PHE 267 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3h5d n GLU 268 N -1.29 -3.61 0.23 -1.08 4.07 -1.26 -4.77 120.64 112.93 3h5d n GLU 268 Ca 0.10 0.58 0.07 0.00 -0.06 0.00 0.00 57.16 57.85 3h5d n GLU 268 Cb 0.17 -4.93 0.54 0.00 -0.06 0.00 0.00 31.44 27.16 3h5d n GLU 268 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3h5d h ALA 269 N 0.76 1.55 0.00 4.31 0.00 -1.83 -3.42 119.26 120.62 3h5d h ALA 269 Ca -0.63 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.11 3h5d h ALA 269 Cb 1.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3h5d h ALA 269 CO 0.54 0.24 0.00 0.41 0.00 0.00 0.00 179.25 180.44 3h5d n GLY 270 N -0.86 -1.78 0.92 0.00 0.00 -1.26 -1.43 105.19 100.79 3h5d n GLY 270 Ca -0.02 -1.78 -0.06 0.00 0.00 0.00 0.00 46.02 44.16 3h5d n GLY 270 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3h5d n PRO 271 N 0.00 0.05 -4.26 1.61 -0.05 -1.26 -4.76 135.00 126.33 3h5d n PRO 271 Ca 0.00 -0.57 -0.26 0.00 -0.05 0.00 0.00 63.50 62.62 3h5d n PRO 271 Cb 0.00 -0.25 -0.09 0.00 -0.05 0.00 0.00 33.50 33.12 3h5d n PRO 271 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 175.50 176.40 3h5d s THR 272 N -1.15 3.39 0.12 0.52 -4.23 -1.26 -4.53 115.64 108.50 3h5d s THR 272 Ca 0.17 -1.61 -0.21 0.00 -1.18 0.00 0.00 61.69 58.86 3h5d s THR 272 Cb -0.01 -2.70 -0.07 0.00 1.34 0.00 0.00 72.50 71.06 3h5d s THR 272 CO 0.12 -0.14 0.65 -0.13 -0.54 0.00 0.00 174.62 174.58 3h5d s ARG 273 N -2.96 4.31 0.43 3.99 0.52 -1.25 -4.70 118.95 119.29 3h5d s ARG 273 Ca 0.26 0.87 -0.25 0.00 -0.52 0.00 0.00 55.73 56.09 3h5d s ARG 273 Cb -0.09 -3.19 -0.09 0.00 0.52 0.00 0.00 34.95 32.11 3h5d s ARG 273 CO 0.17 0.58 1.35 1.28 0.02 0.00 0.00 175.30 178.70 3h5d n LEU 274 N 1.51 4.55 0.09 2.53 4.77 -1.26 -1.22 117.00 127.97 3h5d n LEU 274 Ca -0.08 1.12 0.08 0.00 -0.03 0.00 0.00 56.01 57.10 3h5d n LEU 274 Cb 0.50 -1.55 0.37 0.00 -2.33 0.00 0.00 43.42 40.41 3h5d n LEU 274 CO 0.43 -0.40 0.73 -2.65 -1.33 0.00 0.00 177.39 174.17 3h5d n PRO 275 N -0.06 0.09 -3.21 3.23 -0.02 -1.26 -4.98 135.00 128.81 3h5d n PRO 275 Ca 0.06 0.50 -0.39 0.00 -2.02 0.00 0.00 63.50 61.64 3h5d n PRO 275 Cb 0.40 -1.75 -0.06 0.00 -0.02 0.00 0.00 33.50 32.07 3h5d n PRO 275 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3h5d s LEU 276 N -3.88 4.16 0.11 2.45 1.43 -0.36 -5.07 118.68 117.52 3h5d s LEU 276 Ca 0.01 0.75 -0.06 0.00 -1.03 0.00 0.00 54.13 53.80 3h5d s LEU 276 Cb 0.06 -2.77 -0.06 0.00 0.03 0.00 0.00 46.19 43.45 3h5d s LEU 276 CO 0.20 -0.19 0.37 0.68 0.23 0.00 0.00 176.35 177.63 3h5d s VAL 277 N 1.62 5.16 1.22 -1.59 -7.23 -1.26 -3.90 120.40 114.41 3h5d s VAL 277 Ca 0.26 0.17 -0.15 0.00 -1.81 0.00 0.00 61.98 60.45 3h5d s VAL 277 Cb -0.16 -3.62 0.30 0.00 0.56 0.00 0.00 36.38 33.46 3h5d s VAL 277 CO 0.10 0.15 1.01 -2.84 -0.31 0.00 0.00 175.10 173.21 3h5d s PRO 278 N -2.34 -1.33 0.09 4.82 0.02 -1.26 -4.87 135.00 130.13 3h5d s PRO 278 Ca 0.37 0.59 -0.30 0.00 0.02 0.00 0.00 61.00 61.68 3h5d s PRO 278 Cb -0.13 -1.53 -0.06 0.00 0.02 0.00 0.00 34.50 32.81 3h5d s PRO 278 CO 0.22 -3.93 1.18 0.00 -0.33 0.00 0.00 177.00 174.14 3h5d s ALA 279 N -2.49 3.39 0.82 -1.55 0.00 -1.26 -4.99 121.76 115.68 3h5d s ALA 279 Ca 0.68 0.85 -0.13 0.00 0.00 0.00 0.00 51.96 53.36 3h5d s ALA 279 Cb -0.21 -3.43 0.07 0.00 0.00 0.00 0.00 23.12 19.55 3h5d s ALA 279 CO 0.62 -0.40 1.04 -2.30 0.00 0.00 0.00 175.76 174.73 3h5d n PRO 280 N 3.57 0.09 -0.03 0.00 -0.02 -1.26 -4.65 135.00 132.70 3h5d n PRO 280 Ca 0.08 0.10 -0.10 0.00 -2.02 0.00 0.00 63.50 61.56 3h5d n PRO 280 Cb 0.46 -2.30 -0.04 0.00 -0.02 0.00 0.00 33.50 31.60 3h5d n PRO 280 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3h5d h GLU 281 N -1.00 0.13 -0.77 -0.52 4.57 -1.99 -1.32 114.58 113.68 3h5d h GLU 281 Ca -0.46 -0.01 0.09 0.00 -1.18 0.00 0.00 59.36 57.81 3h5d h GLU 281 Cb 1.30 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.81 3h5d h GLU 281 CO 0.44 0.08 0.50 1.49 -1.18 0.00 0.00 179.01 180.35 3h5d h GLU 282 N 0.13 0.68 -0.21 1.92 4.81 -2.02 0.14 114.58 120.03 3h5d h GLU 282 Ca 0.07 -0.04 -0.16 0.00 -0.13 0.00 0.00 59.36 59.10 3h5d h GLU 282 Cb 0.04 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 3h5d h GLU 282 CO -0.07 0.45 -0.52 -0.44 -0.73 0.00 0.00 179.01 177.69 3h5d h ASP 283 N 0.70 0.67 -0.48 1.04 5.19 -1.73 -3.31 116.42 118.49 3h5d h ASP 283 Ca 0.35 -0.35 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 3h5d h ASP 283 Cb 0.43 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 39.73 3h5d h ASP 283 CO -0.13 1.07 0.26 0.58 -3.12 0.00 0.00 179.24 177.90 3h5d h VAL 284 N 0.47 1.17 0.00 -1.35 2.07 0.15 0.27 116.25 119.02 3h5d h VAL 284 Ca 0.01 -0.44 -0.09 0.00 0.82 0.00 0.00 66.70 67.01 3h5d h VAL 284 Cb 1.07 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 3h5d h VAL 284 CO 0.10 0.19 -0.41 0.50 0.02 0.00 0.00 177.57 177.97 3h5d h LYS 285 N 0.71 0.00 0.09 1.57 1.63 -1.61 -2.28 116.57 116.69 3h5d h LYS 285 Ca 0.18 0.00 -0.20 0.00 -0.85 0.00 0.00 60.65 59.78 3h5d h LYS 285 Cb 0.05 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.68 3h5d h LYS 285 CO -0.03 0.41 -0.97 -0.09 -3.45 0.00 0.00 179.45 175.33 3h5d h ARG 286 N 0.00 0.20 0.32 1.90 2.43 -1.37 -3.07 114.38 114.79 3h5d h ARG 286 Ca -0.00 -0.34 -0.02 0.00 -0.81 0.00 0.00 59.98 58.81 3h5d h ARG 286 Cb 0.86 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 3h5d h ARG 286 CO 0.05 1.16 -0.15 0.82 -1.51 0.00 0.00 179.97 180.34 3h5d h ILE 287 N -0.51 0.69 -0.84 1.20 2.04 -1.02 -0.06 117.51 119.00 3h5d h ILE 287 Ca -0.21 -0.04 0.14 0.00 1.00 0.00 0.00 64.86 65.75 3h5d h ILE 287 Cb 1.55 0.72 -0.09 0.00 -0.74 0.00 0.00 36.82 38.26 3h5d h ILE 287 CO 0.05 0.01 0.44 0.40 0.00 0.00 0.00 178.15 179.05 3h5d h ILE 288 N -0.45 0.75 -0.59 -0.67 2.04 -1.58 -0.05 117.51 116.96 3h5d h ILE 288 Ca -0.04 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 3h5d h ILE 288 Cb 0.34 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 3h5d h ILE 288 CO 0.07 0.12 0.33 0.50 0.00 0.00 0.00 178.15 179.17 3h5d h LYS 289 N 0.64 0.82 0.19 2.37 1.63 -1.31 -2.06 116.57 118.85 3h5d h LYS 289 Ca 0.45 -0.09 -0.26 0.00 -0.85 0.00 0.00 60.65 59.90 3h5d h LYS 289 Cb 0.61 -0.16 0.03 0.00 -0.60 0.00 0.00 32.23 32.11 3h5d h LYS 289 CO -0.35 0.62 -1.14 0.28 -3.45 0.00 0.00 179.45 175.41 3h5d h VAL 290 N 0.80 1.39 0.07 2.00 2.07 -0.16 -3.39 116.25 119.03 3h5d h VAL 290 Ca 0.21 -2.59 -0.10 0.00 0.82 0.00 0.00 66.70 65.03 3h5d h VAL 290 Cb 0.03 3.08 0.01 0.00 -1.52 0.00 0.00 31.29 32.89 3h5d h VAL 290 CO -0.03 0.76 -0.47 0.58 0.02 0.00 0.00 177.57 178.43 3h5d h VAL 291 N -0.08 1.62 -2.31 2.57 2.07 -1.13 -3.42 116.25 115.56 3h5d h VAL 291 Ca -0.20 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 64.88 3h5d h VAL 291 Cb 1.90 3.26 0.00 0.00 -1.52 0.00 0.00 31.29 34.93 3h5d h VAL 291 CO 0.22 0.66 0.00 1.33 0.02 0.00 0.00 177.57 179.79 3h5d n VAL 292 N -4.35 0.00 -3.28 2.57 0.24 -0.78 -4.97 118.33 107.76 3h5d n VAL 292 Ca -0.13 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.10 3h5d n VAL 292 Cb 0.66 -0.20 -0.04 0.00 -1.47 0.00 0.00 33.84 32.79 3h5d n VAL 292 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3h5d s ASP 293 N 0.39 -0.18 0.00 -1.34 3.68 -1.25 -4.49 116.67 113.48 3h5d s ASP 293 Ca 0.00 -0.90 0.00 0.00 2.13 0.00 0.00 52.55 53.78 3h5d s ASP 293 Cb 0.00 1.29 0.00 0.00 -1.45 0.00 0.00 42.92 42.76 3h5d s ASP 293 CO 0.00 -0.25 0.00 0.61 0.13 0.00 0.00 175.17 175.66 3h5d n GLY 294 N 4.64 -0.58 3.39 2.66 0.00 -1.26 -5.10 105.19 108.94 3h5d n GLY 294 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 3h5d n GLY 294 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h5d s ASP 295 N 0.00 6.25 -0.43 1.61 1.01 -1.26 -2.90 116.67 120.95 3h5d s ASP 295 Ca 0.00 -1.49 -0.15 0.00 0.71 0.00 0.00 52.55 51.62 3h5d s ASP 295 Cb 0.00 -2.32 0.04 0.00 1.01 0.00 0.00 42.92 41.64 3h5d s ASP 295 CO 0.00 -1.14 0.34 -0.47 0.21 0.00 0.00 175.17 174.12 3h5d s TYR 296 N 2.78 3.23 -1.12 4.23 5.04 -1.26 -5.04 117.35 125.21 3h5d s TYR 296 Ca 0.15 -0.68 -0.13 0.00 -2.44 0.00 0.00 57.07 53.98 3h5d s TYR 296 Cb -0.21 -2.80 0.20 0.00 0.35 0.00 0.00 41.96 39.50 3h5d s TYR 296 CO 0.05 -0.67 1.26 -1.21 -1.34 0.00 0.00 175.55 173.64 3h5d s GLU 297 N 1.72 4.02 -0.34 4.97 8.01 -1.26 -4.83 118.70 131.00 3h5d s GLU 297 Ca 0.05 -2.63 -0.04 0.00 0.01 0.00 0.00 54.97 52.36 3h5d s GLU 297 Cb -0.20 -4.87 -0.11 0.00 -4.31 0.00 0.00 34.13 24.63 3h5d s GLU 297 CO 0.09 -1.60 2.20 0.00 0.01 0.00 0.00 175.26 175.96 3h5d n ALA 298 N 4.88 4.27 -1.02 5.21 0.00 -1.26 -4.75 120.51 127.83 3h5d n ALA 298 Ca 0.30 -1.38 -0.24 0.00 0.00 0.00 0.00 53.44 52.12 3h5d n ALA 298 Cb 0.43 -2.55 -0.10 0.00 0.00 0.00 0.00 19.45 17.23 3h5d n ALA 298 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 3h5d n THR 299 N 3.27 0.00 -0.38 0.00 5.66 -1.26 -5.19 114.28 116.38 3h5d n THR 299 Ca 0.32 -0.09 0.00 0.00 -3.05 0.00 0.00 64.05 61.23 3h5d n THR 299 Cb 0.37 -1.64 0.00 0.00 -1.55 0.00 0.00 70.33 67.51 3h5d n THR 299 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19