#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hr6 s THR 55 N 0.00 1.79 0.02 0.55 -4.23 0.03 -4.84 115.64 108.96 3hr6 s THR 55 Ca 0.00 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.42 3hr6 s THR 55 Cb 0.00 -2.85 0.00 0.00 1.34 0.00 0.00 72.50 70.99 3hr6 s THR 55 CO 0.00 0.00 0.19 -0.94 -0.54 0.00 0.00 174.62 173.33 3hr6 s SER 56 N -3.71 0.01 -0.19 3.99 1.04 -0.03 -0.51 113.70 114.29 3hr6 s SER 56 Ca 0.31 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.48 3hr6 s SER 56 Cb 0.09 0.26 0.02 0.00 0.10 0.00 0.00 66.02 66.49 3hr6 s SER 56 CO 0.16 -0.48 -0.18 -0.63 0.98 0.00 0.00 173.24 173.09 3hr6 s ILE 57 N -2.02 2.24 -0.37 -1.02 1.01 -0.50 -0.66 121.20 119.87 3hr6 s ILE 57 Ca -0.09 -0.91 -0.13 0.00 0.00 0.00 0.00 60.65 59.51 3hr6 s ILE 57 Cb -0.04 -1.97 0.01 0.00 0.01 0.00 0.00 42.46 40.47 3hr6 s ILE 57 CO -0.01 0.50 0.25 0.00 0.00 0.00 0.00 174.94 175.68 3hr6 s ALA 58 N 1.31 3.43 -0.26 9.38 0.00 0.94 -0.38 121.76 136.18 3hr6 s ALA 58 Ca 0.05 -1.57 -0.16 0.00 0.00 0.00 0.00 51.96 50.27 3hr6 s ALA 58 Cb -0.13 -2.72 -0.03 0.00 0.00 0.00 0.00 23.12 20.24 3hr6 s ALA 58 CO -0.11 -1.23 0.41 0.08 0.00 0.00 0.00 175.76 174.91 3hr6 s VAL 59 N 1.67 5.15 -0.26 0.00 1.01 0.56 -1.19 120.40 127.33 3hr6 s VAL 59 Ca 0.05 0.67 -0.07 0.00 0.00 0.00 0.00 61.98 62.63 3hr6 s VAL 59 Cb -0.18 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 3hr6 s VAL 59 CO 0.09 0.15 0.06 -1.00 0.00 0.00 0.00 175.10 174.41 3hr6 s HIS 60 N 2.02 3.09 -0.49 5.22 3.76 0.10 -0.36 115.29 128.62 3hr6 s HIS 60 Ca 0.17 -0.70 -0.22 0.00 -0.15 0.00 0.00 55.06 54.17 3hr6 s HIS 60 Cb -0.16 -2.23 0.04 0.00 1.11 0.00 0.00 32.58 31.34 3hr6 s HIS 60 CO 0.09 -0.47 0.74 0.00 -0.85 0.00 0.00 174.74 174.26 3hr6 s ALA 61 N 1.56 3.30 -0.11 -1.40 0.00 -1.26 -3.30 121.76 120.54 3hr6 s ALA 61 Ca 0.05 -1.33 -0.12 0.00 0.00 0.00 0.00 51.96 50.55 3hr6 s ALA 61 Cb -0.16 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.46 3hr6 s ALA 61 CO 0.02 -2.03 0.29 -0.51 0.00 0.00 0.00 175.76 173.53 3hr6 s LEU 62 N 3.14 4.33 -0.27 0.00 1.02 -0.25 -0.70 118.68 125.96 3hr6 s LEU 62 Ca 0.24 0.61 -0.17 0.00 0.02 0.00 0.00 54.13 54.83 3hr6 s LEU 62 Cb -0.15 -2.36 -0.03 0.00 0.02 0.00 0.00 46.19 43.67 3hr6 s LEU 62 CO 0.18 0.23 0.45 -0.32 0.02 0.00 0.00 176.35 176.91 3hr6 s MET 63 N -0.26 4.02 0.00 1.70 1.75 -0.32 -0.38 119.30 125.81 3hr6 s MET 63 Ca 0.18 0.17 0.00 0.00 -1.25 0.00 0.00 55.69 54.79 3hr6 s MET 63 Cb -0.14 -3.66 0.00 0.00 2.84 0.00 0.00 34.83 33.87 3hr6 s MET 63 CO 0.06 -0.34 0.00 0.41 -0.65 0.00 0.00 175.02 174.50 3hr6 n GLY 64 N 4.54 -2.11 3.72 2.11 0.00 -0.34 -4.19 105.19 108.93 3hr6 n GLY 64 Ca -0.06 -1.42 -0.35 0.00 0.00 0.00 0.00 46.02 44.19 3hr6 n GLY 64 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hr6 s LEU 65 N 0.00 4.13 0.65 0.99 1.43 -1.26 -4.20 118.68 120.42 3hr6 s LEU 65 Ca 0.00 0.22 -0.17 0.00 -1.03 0.00 0.00 54.13 53.15 3hr6 s LEU 65 Cb 0.00 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.16 3hr6 s LEU 65 CO 0.00 0.21 1.24 -2.84 0.23 0.00 0.00 176.35 175.19 3hr6 s PRO 66 N 0.19 2.59 -0.05 1.29 0.02 -1.26 -4.98 135.00 132.80 3hr6 s PRO 66 Ca 0.08 1.89 -0.14 0.00 0.02 0.00 0.00 61.00 62.85 3hr6 s PRO 66 Cb -0.11 -1.87 -0.30 0.00 0.02 0.00 0.00 34.50 32.23 3hr6 s PRO 66 CO -0.01 -1.52 0.70 1.15 -0.33 0.00 0.00 177.00 176.99 3hr6 h THR 67 N 0.43 1.05 0.00 0.99 2.02 -2.02 -3.45 112.91 111.94 3hr6 h THR 67 Ca -0.50 -2.50 0.00 0.00 0.77 0.00 0.00 66.41 64.18 3hr6 h THR 67 Cb 1.31 2.82 0.00 0.00 -1.74 0.00 0.00 68.15 70.55 3hr6 h THR 67 CO 0.53 0.80 0.00 0.61 0.37 0.00 0.00 175.52 177.83 3hr6 n GLY 68 N 1.79 1.34 0.05 2.16 0.00 -1.26 -5.11 105.19 104.16 3hr6 n GLY 68 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3hr6 n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hr6 n GLY 80 N -0.85 0.00 3.73 -0.02 0.00 -1.26 -5.30 105.19 101.50 3hr6 n GLY 80 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3hr6 n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hr6 s LEU 81 N 0.00 3.34 0.27 0.99 1.43 -1.26 -4.93 118.68 118.52 3hr6 s LEU 81 Ca 0.00 2.32 -0.30 0.00 -1.03 0.00 0.00 54.13 55.12 3hr6 s LEU 81 Cb 0.00 -4.58 -0.11 0.00 0.03 0.00 0.00 46.19 41.53 3hr6 s LEU 81 CO 0.00 -2.17 1.50 -2.16 0.23 0.00 0.00 176.35 173.75 3hr6 s PRO 82 N -3.91 4.21 0.39 1.29 0.04 -1.26 -4.81 135.00 130.94 3hr6 s PRO 82 Ca 0.74 2.42 -0.18 0.00 0.04 0.00 0.00 61.00 64.01 3hr6 s PRO 82 Cb -0.28 -3.07 -0.10 0.00 0.04 0.00 0.00 34.50 31.08 3hr6 s PRO 82 CO 0.44 -0.51 0.86 0.15 0.04 0.00 0.00 177.00 177.99 3hr6 s LYS 83 N -0.45 4.13 -0.04 4.56 1.02 -1.26 -1.17 119.74 126.52 3hr6 s LYS 83 Ca 0.61 0.93 0.05 0.00 0.02 0.00 0.00 55.97 57.57 3hr6 s LYS 83 Cb -0.44 -2.28 -0.01 0.00 -0.52 0.00 0.00 37.83 34.58 3hr6 s LYS 83 CO 0.45 0.04 -0.19 0.08 -0.92 0.00 0.00 175.35 174.82 3hr6 s VAL 84 N -2.11 1.56 0.42 3.17 1.01 0.13 -4.89 120.40 119.69 3hr6 s VAL 84 Ca 0.59 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.74 3hr6 s VAL 84 Cb -0.10 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 3hr6 s VAL 84 CO 0.15 0.44 0.68 -1.81 0.00 0.00 0.00 175.10 174.57 3hr6 s ASP 85 N -0.11 6.28 -0.03 3.32 1.01 -1.26 -4.37 116.67 121.52 3hr6 s ASP 85 Ca -0.01 0.73 0.00 0.00 0.71 0.00 0.00 52.55 53.98 3hr6 s ASP 85 Cb -0.11 -2.16 0.00 0.00 1.01 0.00 0.00 42.92 41.66 3hr6 s ASP 85 CO 0.02 -0.45 0.00 0.61 0.21 0.00 0.00 175.17 175.56 3hr6 n GLY 86 N -2.03 0.47 3.74 0.21 0.00 -0.02 -4.82 105.19 102.75 3hr6 n GLY 86 Ca -0.02 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 3hr6 n GLY 86 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3hr6 s MET 87 N -0.57 4.39 -0.20 1.61 -1.94 -1.26 0.31 119.30 121.65 3hr6 s MET 87 Ca 0.00 0.81 -0.08 0.00 -1.71 0.00 0.00 55.69 54.71 3hr6 s MET 87 Cb 0.00 -3.40 -0.04 0.00 2.01 0.00 0.00 34.83 33.40 3hr6 s MET 87 CO 0.00 0.22 0.08 0.45 -0.01 0.00 0.00 175.02 175.75 3hr6 s SER 88 N 0.30 5.65 0.00 3.03 0.15 -1.26 -0.49 113.70 121.08 3hr6 s SER 88 Ca 0.34 0.05 0.04 0.00 0.70 0.00 0.00 55.95 57.08 3hr6 s SER 88 Cb -0.18 -1.98 -0.01 0.00 -1.71 0.00 0.00 66.02 62.14 3hr6 s SER 88 CO 0.18 0.13 -0.13 -0.36 1.20 0.00 0.00 173.24 174.27 3hr6 s PHE 89 N 0.62 1.11 -0.14 3.44 0.08 -0.12 0.05 117.98 123.02 3hr6 s PHE 89 Ca 0.04 -0.24 -0.03 0.00 0.12 0.00 0.00 56.93 56.82 3hr6 s PHE 89 Cb -0.13 -0.70 -0.03 0.00 -0.57 0.00 0.00 43.02 41.59 3hr6 s PHE 89 CO 0.01 -0.01 -0.04 0.99 -0.10 0.00 0.00 175.22 176.08 3hr6 s THR 90 N -0.43 3.91 -0.19 0.64 2.01 0.35 -0.96 115.64 120.97 3hr6 s THR 90 Ca 0.04 -0.36 -0.15 0.00 0.31 0.00 0.00 61.69 61.52 3hr6 s THR 90 Cb -0.05 -2.69 -0.04 0.00 0.01 0.00 0.00 72.50 69.72 3hr6 s THR 90 CO -0.00 0.51 0.36 -0.22 -0.69 0.00 0.00 174.62 174.59 3hr6 s LEU 91 N 0.13 4.18 0.06 4.42 2.96 0.03 -0.39 118.68 130.07 3hr6 s LEU 91 Ca -0.01 0.51 0.08 0.00 -0.22 0.00 0.00 54.13 54.49 3hr6 s LEU 91 Cb -0.14 -2.47 -0.03 0.00 0.50 0.00 0.00 46.19 44.05 3hr6 s LEU 91 CO 0.03 -0.02 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.53 3hr6 s TYR 92 N 1.05 2.50 -0.02 5.38 2.02 0.35 -0.42 117.35 128.20 3hr6 s TYR 92 Ca 0.18 -0.29 -0.20 0.00 -0.37 0.00 0.00 57.07 56.40 3hr6 s TYR 92 Cb -0.14 -1.42 -0.05 0.00 -0.40 0.00 0.00 41.96 39.94 3hr6 s TYR 92 CO 0.07 0.26 0.56 0.50 -1.57 0.00 0.00 175.55 175.37 3hr6 s ARG 93 N -1.55 4.29 -0.32 -0.62 3.52 0.12 0.14 118.95 124.52 3hr6 s ARG 93 Ca 0.15 0.66 -0.29 0.00 -0.13 0.00 0.00 55.73 56.12 3hr6 s ARG 93 Cb -0.10 -3.35 0.01 0.00 -1.56 0.00 0.00 34.95 29.95 3hr6 s ARG 93 CO 0.06 0.36 1.11 0.08 -0.81 0.00 0.00 175.30 176.09 3hr6 s VAL 94 N -0.12 4.45 0.36 7.11 1.01 0.55 -0.94 120.40 132.81 3hr6 s VAL 94 Ca 0.30 1.67 -0.28 0.00 0.00 0.00 0.00 61.98 63.66 3hr6 s VAL 94 Cb -0.18 -4.38 -0.11 0.00 0.00 0.00 0.00 36.38 31.72 3hr6 s VAL 94 CO 0.16 -0.49 1.40 0.20 0.00 0.00 0.00 175.10 176.37 3hr6 s ASN 95 N 1.82 6.54 -1.33 3.32 0.02 -0.06 -3.72 114.94 121.53 3hr6 s ASN 95 Ca 0.47 2.87 -0.05 0.00 -1.02 0.00 0.00 52.86 55.13 3hr6 s ASN 95 Cb -0.13 -2.66 0.02 0.00 0.02 0.00 0.00 41.25 38.50 3hr6 s ASN 95 CO 0.17 -0.72 0.96 -0.62 0.02 0.00 0.00 177.10 176.92 3hr6 n GLU 96 N 0.60 -6.32 -3.90 -0.60 1.02 -1.26 -4.96 120.64 105.23 3hr6 n GLU 96 Ca 0.01 0.74 -0.28 0.00 -0.02 0.00 0.00 57.16 57.61 3hr6 n GLU 96 Cb 0.41 -5.62 -0.17 0.00 -0.02 0.00 0.00 31.44 26.04 3hr6 n GLU 96 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3hr6 s ILE 97 N -3.42 1.11 -0.37 -3.67 -1.09 -1.24 -4.98 121.20 107.53 3hr6 s ILE 97 Ca 0.27 -0.53 -0.04 0.00 -2.23 0.00 0.00 60.65 58.12 3hr6 s ILE 97 Cb -0.12 -1.22 0.08 0.00 -1.58 0.00 0.00 42.46 39.61 3hr6 s ILE 97 CO 0.77 0.22 0.14 -0.62 -1.23 0.00 0.00 174.94 174.22 3hr6 s ASP 98 N 1.65 5.22 0.00 3.58 2.15 -1.26 -4.40 116.67 123.61 3hr6 s ASP 98 Ca 0.02 -1.59 0.25 0.00 0.43 0.00 0.00 52.55 51.66 3hr6 s ASP 98 Cb -0.14 -1.83 1.48 0.00 -0.30 0.00 0.00 42.92 42.13 3hr6 s ASP 98 CO -0.08 -0.43 1.87 0.18 -0.17 0.00 0.00 175.17 176.55 3hr6 n LEU 99 N 4.68 0.00 -0.19 -1.34 4.77 -1.26 -2.60 117.00 121.06 3hr6 n LEU 99 Ca -0.08 0.05 0.14 0.00 -0.03 0.00 0.00 56.01 56.08 3hr6 n LEU 99 Cb 0.43 -0.05 0.49 0.00 -2.33 0.00 0.00 43.42 41.96 3hr6 n LEU 99 CO 0.32 -0.01 0.76 0.35 -1.33 0.00 0.00 177.39 177.48 3hr6 n THR 100 N -1.05 0.00 -4.45 -5.08 -2.24 -1.26 -4.64 114.28 95.57 3hr6 n THR 100 Ca 0.18 -0.10 -0.25 0.00 -2.27 0.00 0.00 64.05 61.62 3hr6 n THR 100 Cb 0.11 0.16 -0.10 0.00 -2.10 0.00 0.00 70.33 68.40 3hr6 n THR 100 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3hr6 s THR 101 N -2.49 2.53 0.09 4.28 -4.23 -1.07 -5.05 115.64 109.70 3hr6 s THR 101 Ca 0.26 -2.19 -0.11 0.00 -1.18 0.00 0.00 61.69 58.47 3hr6 s THR 101 Cb 0.20 -2.59 -0.21 0.00 1.34 0.00 0.00 72.50 71.24 3hr6 s THR 101 CO 0.50 -0.28 1.24 1.56 -0.54 0.00 0.00 174.62 177.09 3hr6 h GLN 102 N 2.04 0.65 -0.52 3.99 1.08 -1.90 -0.61 115.11 119.83 3hr6 h GLN 102 Ca -0.42 -0.67 0.10 0.00 -1.45 0.00 0.00 58.65 56.22 3hr6 h GLN 102 Cb 1.25 0.18 -0.11 0.00 -0.05 0.00 0.00 27.48 28.76 3hr6 h GLN 102 CO 0.65 1.26 -0.28 0.00 -0.95 0.00 0.00 178.83 179.52 3hr6 h ALA 103 N 0.51 0.04 -0.06 3.87 0.00 -1.97 -1.50 119.26 120.15 3hr6 h ALA 103 Ca -0.11 0.16 -0.24 0.00 0.00 0.00 0.00 54.91 54.73 3hr6 h ALA 103 Cb 1.63 0.66 0.01 0.00 0.00 0.00 0.00 17.79 20.09 3hr6 h ALA 103 CO 0.19 -0.62 -0.91 0.78 0.00 0.00 0.00 179.25 178.69 3hr6 h GLY 104 N -0.15 0.75 1.54 0.00 0.00 -1.60 -1.81 103.07 101.80 3hr6 h GLY 104 Ca 0.23 -1.20 -0.05 0.00 0.00 0.00 0.00 47.33 46.31 3hr6 h GLY 104 CO -0.61 1.06 0.01 -0.25 0.00 0.00 0.00 176.54 176.75 3hr6 h TRP 105 N 0.42 0.59 0.00 5.60 2.91 -0.99 -0.54 115.95 123.94 3hr6 h TRP 105 Ca -0.09 -0.06 -0.23 0.00 1.13 0.00 0.00 58.89 59.64 3hr6 h TRP 105 Cb 1.55 -0.17 -0.04 0.00 -0.51 0.00 0.00 29.16 29.99 3hr6 h TRP 105 CO 0.09 0.57 -1.21 -0.44 -1.03 0.00 0.00 178.44 176.42 3hr6 h ASP 106 N 0.55 0.00 -0.58 2.65 3.32 -1.30 -3.04 116.42 118.01 3hr6 h ASP 106 Ca 0.12 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 3hr6 h ASP 106 Cb 0.34 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 3hr6 h ASP 106 CO 0.01 0.97 0.05 0.00 -1.72 0.00 0.00 179.24 178.55 3hr6 h ALA 107 N 1.03 0.95 -0.36 3.45 0.00 -1.09 -2.81 119.26 120.43 3hr6 h ALA 107 Ca -0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3hr6 h ALA 107 Cb 1.83 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.37 3hr6 h ALA 107 CO 0.11 0.64 0.16 0.00 0.00 0.00 0.00 179.25 180.16 3hr6 h ALA 108 N 1.11 1.61 0.00 0.00 0.00 -1.12 -2.52 119.26 118.33 3hr6 h ALA 108 Ca 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3hr6 h ALA 108 Cb 0.47 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3hr6 h ALA 108 CO 0.02 0.31 -0.15 -1.13 0.00 0.00 0.00 179.25 178.30 3hr6 n SER 109 N -4.41 0.72 0.03 0.00 3.41 -1.14 -3.26 113.62 108.97 3hr6 n SER 109 Ca 0.02 0.45 0.12 0.00 -0.26 0.00 0.00 58.87 59.20 3hr6 n SER 109 Cb 0.13 -0.54 0.11 0.00 -0.26 0.00 0.00 64.21 63.65 3hr6 n SER 109 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3hr6 n LYS 110 N -2.15 0.24 -1.71 4.33 5.02 -0.97 -5.00 118.16 117.91 3hr6 n LYS 110 Ca 0.05 0.03 -0.43 0.00 -2.02 0.00 0.00 58.31 55.94 3hr6 n LYS 110 Cb 0.42 -1.61 -0.02 0.00 -0.02 0.00 0.00 35.03 33.80 3hr6 n LYS 110 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3hr6 n ILE 111 N -1.93 1.04 -3.81 -0.18 5.41 -1.07 -4.98 119.36 113.84 3hr6 n ILE 111 Ca 0.03 -0.26 -0.36 0.00 1.00 0.00 0.00 62.75 63.16 3hr6 n ILE 111 Cb 0.42 -1.70 -0.13 0.00 -0.71 0.00 0.00 39.64 37.52 3hr6 n ILE 111 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 3hr6 s LYS 112 N -0.53 3.40 0.51 0.38 1.02 -1.26 -4.99 119.74 118.26 3hr6 s LYS 112 Ca 0.66 -0.64 0.30 0.00 0.02 0.00 0.00 55.97 56.31 3hr6 s LYS 112 Cb -0.58 -3.23 1.41 0.00 -0.52 0.00 0.00 37.83 34.91 3hr6 s LYS 112 CO 0.50 -0.27 1.84 -0.07 -0.92 0.00 0.00 175.35 176.43 3hr6 h LEU 113 N 8.19 0.11 -2.26 3.17 3.38 -1.93 0.47 115.31 126.43 3hr6 h LEU 113 Ca -0.37 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 3hr6 h LEU 113 Cb 1.16 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 3hr6 h LEU 113 CO 0.59 0.03 -0.05 1.05 0.09 0.00 0.00 178.44 180.16 3hr6 h GLU 114 N 0.10 0.00 0.00 1.13 9.09 -1.95 -1.02 114.58 121.93 3hr6 h GLU 114 Ca 0.50 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.80 3hr6 h GLU 114 Cb 1.81 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.89 3hr6 h GLU 114 CO -0.07 0.05 -0.53 0.93 0.05 0.00 0.00 179.01 179.44 3hr6 h GLU 115 N 0.00 0.00 0.00 1.06 4.39 -0.48 -3.29 114.58 116.26 3hr6 h GLU 115 Ca -0.00 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.60 3hr6 h GLU 115 Cb 0.21 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 3hr6 h GLU 115 CO 0.01 0.53 -1.76 1.28 -1.16 0.00 0.00 179.01 177.91 3hr6 n LEU 116 N -3.57 0.35 -3.62 1.33 4.77 -0.50 -4.63 117.00 111.13 3hr6 n LEU 116 Ca -0.00 0.14 -0.04 0.00 -0.03 0.00 0.00 56.01 56.09 3hr6 n LEU 116 Cb 0.61 0.10 -0.06 0.00 -2.33 0.00 0.00 43.42 41.73 3hr6 n LEU 116 CO 0.40 0.09 0.47 -0.47 -1.33 0.00 0.00 177.39 176.55 3hr6 s TYR 117 N -3.17 -0.91 -0.08 -1.77 5.04 -0.54 -1.25 117.35 114.68 3hr6 s TYR 117 Ca -0.06 1.74 -0.28 0.00 -2.44 0.00 0.00 57.07 56.03 3hr6 s TYR 117 Cb 0.11 0.54 0.06 0.00 0.35 0.00 0.00 41.96 43.02 3hr6 s TYR 117 CO 0.85 -0.45 0.64 -0.08 -1.34 0.00 0.00 175.55 175.17 3hr6 s THR 118 N 1.82 0.01 -1.52 4.34 -1.32 -0.51 -3.94 115.64 114.52 3hr6 s THR 118 Ca -0.08 -0.05 -0.06 0.00 -1.21 0.00 0.00 61.69 60.29 3hr6 s THR 118 Cb -0.06 -0.95 0.01 0.00 -1.51 0.00 0.00 72.50 69.99 3hr6 s THR 118 CO -0.18 -0.03 0.74 -3.20 -2.21 0.00 0.00 174.62 169.75 3hr6 n ASN 119 N 1.23 -6.15 -0.46 8.08 5.15 -1.26 -2.72 115.26 119.14 3hr6 n ASN 119 Ca -0.18 -0.35 -0.06 0.00 -0.60 0.00 0.00 54.58 53.38 3hr6 n ASN 119 Cb 0.57 -4.94 -0.03 0.00 -0.53 0.00 0.00 39.78 34.86 3hr6 n ASN 119 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3hr6 n GLY 120 N -1.63 0.84 3.27 8.20 0.00 -1.26 -5.03 105.19 109.58 3hr6 n GLY 120 Ca -0.08 -0.68 -0.14 0.00 0.00 0.00 0.00 46.02 45.12 3hr6 n GLY 120 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3hr6 s HIS 121 N -2.19 -0.25 0.56 1.61 -3.43 -1.10 -5.14 115.29 105.34 3hr6 s HIS 121 Ca 0.00 0.43 -0.18 0.00 -0.80 0.00 0.00 55.06 54.51 3hr6 s HIS 121 Cb 0.00 0.13 -0.05 0.00 -1.43 0.00 0.00 32.58 31.23 3hr6 s HIS 121 CO 0.00 -0.39 1.08 -1.25 -2.00 0.00 0.00 174.74 172.18 3hr6 s PRO 122 N -1.16 3.37 0.60 -0.38 0.04 -1.26 -1.42 135.00 134.78 3hr6 s PRO 122 Ca -0.12 1.40 0.01 0.00 0.04 0.00 0.00 61.00 62.33 3hr6 s PRO 122 Cb -0.04 -2.03 0.12 0.00 0.04 0.00 0.00 34.50 32.59 3hr6 s PRO 122 CO 0.04 -0.80 0.83 0.25 0.04 0.00 0.00 177.00 177.37 3hr6 n THR 123 N -1.60 0.00 1.59 1.26 -2.24 -0.38 -4.85 114.28 108.05 3hr6 n THR 123 Ca 0.10 -1.41 0.12 0.00 -2.27 0.00 0.00 64.05 60.59 3hr6 n THR 123 Cb 0.52 -0.89 0.73 0.00 -2.10 0.00 0.00 70.33 68.59 3hr6 n THR 123 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3hr6 n ASP 124 N -2.83 0.00 0.00 3.42 5.68 -1.26 -3.10 116.55 118.46 3hr6 n ASP 124 Ca 0.14 -0.82 0.14 0.00 -0.50 0.00 0.00 54.79 53.76 3hr6 n ASP 124 Cb 0.51 0.00 0.68 0.00 -1.14 0.00 0.00 41.12 41.17 3hr6 n ASP 124 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3hr6 n LYS 125 N -0.98 0.23 -4.31 0.11 5.02 -1.26 -4.84 118.16 112.13 3hr6 n LYS 125 Ca 0.18 0.01 -0.17 0.00 -2.02 0.00 0.00 58.31 56.31 3hr6 n LYS 125 Cb 0.08 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.49 3hr6 n LYS 125 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3hr6 s VAL 126 N -2.76 1.53 -0.11 -0.18 -7.23 -1.18 -0.88 120.40 109.59 3hr6 s VAL 126 Ca 0.22 -2.10 0.02 0.00 -1.81 0.00 0.00 61.98 58.31 3hr6 s VAL 126 Cb 0.19 -1.92 0.01 0.00 0.56 0.00 0.00 36.38 35.23 3hr6 s VAL 126 CO 0.48 -0.61 -0.17 -0.89 -0.31 0.00 0.00 175.10 173.61 3hr6 s THR 127 N -2.94 1.60 0.32 5.32 2.01 -0.12 -4.89 115.64 116.95 3hr6 s THR 127 Ca 0.19 -0.71 -0.29 0.00 0.31 0.00 0.00 61.69 61.19 3hr6 s THR 127 Cb -0.01 -1.45 -0.11 0.00 0.01 0.00 0.00 72.50 70.94 3hr6 s THR 127 CO 0.05 0.46 1.50 -0.75 -0.69 0.00 0.00 174.62 175.18 3hr6 s LYS 128 N 0.92 4.17 -0.17 4.92 2.20 -1.26 0.12 119.74 130.65 3hr6 s LYS 128 Ca -0.07 2.48 -0.11 0.00 -0.36 0.00 0.00 55.97 57.90 3hr6 s LYS 128 Cb -0.15 -3.03 -0.07 0.00 -1.51 0.00 0.00 37.83 33.07 3hr6 s LYS 128 CO -0.01 -0.51 -0.26 0.28 -0.36 0.00 0.00 175.35 174.49 3hr6 n VAL 129 N 1.49 1.24 -3.68 4.02 0.31 0.44 -4.83 118.33 117.32 3hr6 n VAL 129 Ca 0.05 -0.10 -0.04 0.00 -0.01 0.00 0.00 64.34 64.24 3hr6 n VAL 129 Cb 0.39 -1.92 -0.01 0.00 -0.91 0.00 0.00 33.84 31.38 3hr6 n VAL 129 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hr6 s ALA 130 N -2.49 -1.76 -0.01 3.52 0.00 -1.15 -5.02 121.76 114.85 3hr6 s ALA 130 Ca -0.26 0.41 0.03 0.00 0.00 0.00 0.00 51.96 52.14 3hr6 s ALA 130 Cb 0.08 0.55 -0.00 0.00 0.00 0.00 0.00 23.12 23.74 3hr6 s ALA 130 CO 0.34 -0.96 -0.10 0.99 0.00 0.00 0.00 175.76 176.04 3hr6 s THR 131 N -3.15 0.80 0.27 0.00 2.01 -1.26 -0.79 115.64 113.52 3hr6 s THR 131 Ca 0.11 -0.41 -0.20 0.00 0.31 0.00 0.00 61.69 61.50 3hr6 s THR 131 Cb -0.01 -0.68 0.02 0.00 0.01 0.00 0.00 72.50 71.84 3hr6 s THR 131 CO -0.01 0.23 0.67 -1.59 -0.69 0.00 0.00 174.62 173.23 3hr6 s LYS 132 N -0.11 1.72 0.03 4.92 -2.85 -0.13 -4.99 119.74 118.33 3hr6 s LYS 132 Ca 0.02 -1.01 0.00 0.00 -1.00 0.00 0.00 55.97 53.99 3hr6 s LYS 132 Cb -0.05 0.58 -0.04 0.00 -2.06 0.00 0.00 37.83 36.26 3hr6 s LYS 132 CO -0.00 -0.77 0.13 0.15 0.10 0.00 0.00 175.35 174.95 3hr6 s LYS 133 N -3.93 3.16 0.38 1.78 1.02 -1.26 -0.94 119.74 119.95 3hr6 s LYS 133 Ca 0.12 -0.51 -0.27 0.00 0.02 0.00 0.00 55.97 55.34 3hr6 s LYS 133 Cb -0.05 -2.90 -0.09 0.00 -0.52 0.00 0.00 37.83 34.27 3hr6 s LYS 133 CO 0.06 0.62 1.26 0.95 -0.92 0.00 0.00 175.35 177.32 3hr6 s THR 134 N -1.34 2.81 -0.05 2.17 -4.23 0.36 -4.57 115.64 110.78 3hr6 s THR 134 Ca 0.28 0.74 -0.04 0.00 -1.18 0.00 0.00 61.69 61.50 3hr6 s THR 134 Cb -0.12 -3.45 0.02 0.00 1.34 0.00 0.00 72.50 70.29 3hr6 s THR 134 CO 0.20 0.12 0.13 -0.70 -0.54 0.00 0.00 174.62 173.83 3hr6 s GLU 135 N -2.09 0.13 -1.65 3.99 2.56 -0.30 -0.84 118.70 120.51 3hr6 s GLU 135 Ca 0.54 0.22 -0.00 0.00 0.00 0.00 0.00 54.97 55.72 3hr6 s GLU 135 Cb -0.37 0.01 0.00 0.00 2.00 0.00 0.00 34.13 35.77 3hr6 s GLU 135 CO 0.47 -0.05 0.05 0.41 -0.56 0.00 0.00 175.26 175.58 3hr6 n GLY 136 N 3.31 -0.50 2.06 -1.50 0.00 -1.26 -2.19 105.19 105.12 3hr6 n GLY 136 Ca -0.16 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3hr6 n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hr6 n GLY 137 N -1.02 0.77 3.09 -0.02 0.00 -1.26 -5.03 105.19 101.72 3hr6 n GLY 137 Ca -0.22 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 3hr6 n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hr6 s VAL 138 N -2.90 0.02 -0.35 1.61 0.11 -0.93 -4.06 120.40 113.90 3hr6 s VAL 138 Ca 0.00 -0.19 -0.03 0.00 -2.93 0.00 0.00 61.98 58.83 3hr6 s VAL 138 Cb 0.00 -0.33 0.07 0.00 -1.53 0.00 0.00 36.38 34.59 3hr6 s VAL 138 CO 0.00 -0.10 0.11 0.00 -3.33 0.00 0.00 175.10 171.77 3hr6 s ALA 139 N -0.32 3.00 -0.30 1.54 0.00 0.51 -1.15 121.76 125.05 3hr6 s ALA 139 Ca -0.04 -2.08 -0.14 0.00 0.00 0.00 0.00 51.96 49.69 3hr6 s ALA 139 Cb -0.03 -2.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.86 3hr6 s ALA 139 CO 0.01 -1.51 0.34 0.21 0.00 0.00 0.00 175.76 174.81 3hr6 s LYS 140 N 1.24 3.81 -0.48 0.00 2.20 -1.26 -0.32 119.74 124.93 3hr6 s LYS 140 Ca 0.01 -0.20 -0.16 0.00 -0.36 0.00 0.00 55.97 55.25 3hr6 s LYS 140 Cb -0.21 -3.72 0.06 0.00 -1.51 0.00 0.00 37.83 32.45 3hr6 s LYS 140 CO -0.02 -0.37 0.45 -0.06 -0.36 0.00 0.00 175.35 174.99 3hr6 s PHE 141 N 2.01 3.19 0.30 4.03 0.08 0.49 -4.98 117.98 123.11 3hr6 s PHE 141 Ca 0.13 -0.79 0.07 0.00 0.12 0.00 0.00 56.93 56.45 3hr6 s PHE 141 Cb -0.16 -3.21 -0.03 0.00 -0.57 0.00 0.00 43.02 39.05 3hr6 s PHE 141 CO 0.11 -0.84 0.26 0.34 -0.10 0.00 0.00 175.22 174.99 3hr6 s ASP 142 N 2.54 5.41 -1.15 1.36 -1.08 -1.26 -1.41 116.67 121.08 3hr6 s ASP 142 Ca 0.07 -0.39 -0.02 0.00 -0.52 0.00 0.00 52.55 51.69 3hr6 s ASP 142 Cb -0.22 -1.15 0.00 0.00 -1.46 0.00 0.00 42.92 40.09 3hr6 s ASP 142 CO 0.08 -0.23 0.98 -3.20 0.52 0.00 0.00 175.17 173.31 3hr6 n ASN 143 N -1.31 -3.15 -4.89 -0.34 5.15 -1.12 -4.96 115.26 104.64 3hr6 n ASN 143 Ca -0.04 -0.55 -0.34 0.00 -0.60 0.00 0.00 54.58 53.04 3hr6 n ASN 143 Cb 0.59 -4.77 -0.05 0.00 -0.53 0.00 0.00 39.78 35.02 3hr6 n ASN 143 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3hr6 s LEU 144 N -6.27 4.37 0.32 1.20 1.43 0.33 -4.86 118.68 115.20 3hr6 s LEU 144 Ca 0.15 0.49 -0.27 0.00 -1.03 0.00 0.00 54.13 53.46 3hr6 s LEU 144 Cb -0.07 -2.65 -0.09 0.00 0.03 0.00 0.00 46.19 43.41 3hr6 s LEU 144 CO 0.68 0.26 1.02 0.42 0.23 0.00 0.00 176.35 178.96 3hr6 s THR 145 N -1.31 3.81 0.06 5.49 -4.23 -1.26 -0.79 115.64 117.41 3hr6 s THR 145 Ca 0.27 1.62 -0.33 0.00 -1.18 0.00 0.00 61.69 62.07 3hr6 s THR 145 Cb -0.13 -3.96 -0.12 0.00 1.34 0.00 0.00 72.50 69.63 3hr6 s THR 145 CO 0.17 0.24 1.75 -2.65 -0.54 0.00 0.00 174.62 173.58 3hr6 n PRO 146 N 0.76 2.29 -3.80 3.99 -0.02 -1.26 -4.86 135.00 132.08 3hr6 n PRO 146 Ca 0.01 0.83 -0.03 0.00 -2.02 0.00 0.00 63.50 62.29 3hr6 n PRO 146 Cb 0.48 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 3hr6 n PRO 146 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hr6 s ALA 147 N 2.49 -1.62 -0.10 3.55 0.00 -0.32 -4.98 121.76 120.78 3hr6 s ALA 147 Ca 0.85 -0.07 -0.22 0.00 0.00 0.00 0.00 51.96 52.52 3hr6 s ALA 147 Cb -0.65 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 3hr6 s ALA 147 CO 0.43 -1.05 0.64 -1.17 0.00 0.00 0.00 175.76 174.60 3hr6 s LEU 148 N -3.14 4.28 0.25 0.00 2.96 -1.26 -1.85 118.68 119.92 3hr6 s LEU 148 Ca 0.16 1.05 0.10 0.00 -0.22 0.00 0.00 54.13 55.23 3hr6 s LEU 148 Cb -0.02 -2.96 -0.04 0.00 0.50 0.00 0.00 46.19 43.67 3hr6 s LEU 148 CO 0.04 -0.11 -0.09 -0.31 -1.32 0.00 0.00 176.35 174.56 3hr6 s TYR 149 N 0.90 2.54 -0.12 5.38 2.02 0.80 -0.33 117.35 128.54 3hr6 s TYR 149 Ca 0.33 -0.26 0.01 0.00 -0.37 0.00 0.00 57.07 56.79 3hr6 s TYR 149 Cb -0.17 -1.15 0.02 0.00 -0.40 0.00 0.00 41.96 40.26 3hr6 s TYR 149 CO 0.15 0.62 -0.15 -1.17 -1.57 0.00 0.00 175.55 173.43 3hr6 s LEU 150 N -3.38 1.71 -0.24 -1.29 2.96 0.12 -0.62 118.68 117.95 3hr6 s LEU 150 Ca 0.29 -0.44 -0.09 0.00 -0.22 0.00 0.00 54.13 53.67 3hr6 s LEU 150 Cb -0.07 -1.11 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 3hr6 s LEU 150 CO 0.17 0.00 0.11 -0.69 -1.32 0.00 0.00 176.35 174.62 3hr6 s VAL 151 N 1.10 4.80 -0.25 1.68 1.01 -0.18 -0.50 120.40 128.06 3hr6 s VAL 151 Ca -0.04 -0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.94 3hr6 s VAL 151 Cb -0.14 -3.23 0.05 0.00 0.00 0.00 0.00 36.38 33.05 3hr6 s VAL 151 CO -0.04 0.35 -0.11 -0.69 0.00 0.00 0.00 175.10 174.62 3hr6 s VAL 152 N 1.26 2.31 0.29 2.92 1.01 0.48 -2.22 120.40 126.45 3hr6 s VAL 152 Ca 0.06 -1.43 -0.29 0.00 0.00 0.00 0.00 61.98 60.32 3hr6 s VAL 152 Cb -0.14 -2.27 -0.10 0.00 0.00 0.00 0.00 36.38 33.86 3hr6 s VAL 152 CO 0.05 0.08 1.24 -1.58 0.00 0.00 0.00 175.10 174.89 3hr6 s GLN 153 N 1.17 4.45 0.40 2.72 0.74 -1.26 -0.49 119.66 127.39 3hr6 s GLN 153 Ca -0.05 2.06 0.08 0.00 0.05 0.00 0.00 55.36 57.49 3hr6 s GLN 153 Cb -0.18 -3.13 -0.03 0.00 1.10 0.00 0.00 33.01 30.77 3hr6 s GLN 153 CO -0.06 -0.07 0.33 -1.21 -0.55 0.00 0.00 175.29 173.73 3hr6 s GLU 154 N -1.39 2.51 0.00 1.67 0.41 0.11 -4.85 118.70 117.16 3hr6 s GLU 154 Ca 0.49 -1.55 0.21 0.00 -0.41 0.00 0.00 54.97 53.71 3hr6 s GLU 154 Cb -0.37 -2.33 0.59 0.00 -1.78 0.00 0.00 34.13 30.24 3hr6 s GLU 154 CO 0.47 -0.14 1.47 1.28 -0.49 0.00 0.00 175.26 177.84 3hr6 n LEU 155 N -1.47 2.37 -1.59 1.80 4.77 -1.26 -4.22 117.00 117.40 3hr6 n LEU 155 Ca 0.02 -1.03 -0.12 0.00 -0.03 0.00 0.00 56.01 54.85 3hr6 n LEU 155 Cb 0.62 -0.18 0.20 0.00 -2.33 0.00 0.00 43.42 41.72 3hr6 n LEU 155 CO 0.43 0.52 0.92 -0.46 -1.33 0.00 0.00 177.39 177.47 3hr6 n ASN 156 N 0.79 3.01 -4.41 -1.43 6.94 -1.26 -1.67 115.26 117.22 3hr6 n ASN 156 Ca 0.17 -3.70 -0.29 0.00 -0.02 0.00 0.00 54.58 50.74 3hr6 n ASN 156 Cb 0.43 -0.72 0.22 0.00 -2.36 0.00 0.00 39.78 37.36 3hr6 n ASN 156 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 3hr6 s GLY 157 N -2.04 1.54 0.30 4.83 0.00 -1.26 -4.80 107.32 105.90 3hr6 s GLY 157 Ca 0.50 -0.43 -0.01 0.00 0.00 0.00 0.00 44.72 44.78 3hr6 s GLY 157 CO 0.04 0.30 1.93 0.00 0.00 0.00 0.00 173.10 175.37 3hr6 h ALA 158 N -2.37 1.37 -4.01 3.20 0.00 -0.46 -3.42 119.26 113.57 3hr6 h ALA 158 Ca -0.55 -0.11 -0.64 0.00 0.00 0.00 0.00 54.91 53.61 3hr6 h ALA 158 Cb 1.33 -0.28 -0.24 0.00 0.00 0.00 0.00 17.79 18.60 3hr6 h ALA 158 CO 0.50 0.52 -0.86 -1.21 0.00 0.00 0.00 179.25 178.21 3hr6 s GLU 159 N -5.63 1.45 0.08 0.00 2.02 -1.26 -5.05 118.70 110.30 3hr6 s GLU 159 Ca -0.11 -1.14 -0.30 0.00 0.02 0.00 0.00 54.97 53.44 3hr6 s GLU 159 Cb 0.17 -1.71 -0.06 0.00 0.10 0.00 0.00 34.13 32.63 3hr6 s GLU 159 CO 0.79 0.42 1.17 0.00 0.02 0.00 0.00 175.26 177.67 3hr6 s ALA 160 N -0.94 3.38 0.22 5.21 0.00 -1.26 -4.98 121.76 123.38 3hr6 s ALA 160 Ca 0.10 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.90 3hr6 s ALA 160 Cb -0.10 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.55 3hr6 s ALA 160 CO 0.03 -0.39 0.09 0.14 0.00 0.00 0.00 175.76 175.63 3hr6 s VAL 161 N 0.83 0.34 -0.59 0.00 -7.23 -1.26 -4.06 120.40 108.43 3hr6 s VAL 161 Ca 0.57 -1.99 -0.25 0.00 -1.81 0.00 0.00 61.98 58.50 3hr6 s VAL 161 Cb -0.29 -2.47 0.04 0.00 0.56 0.00 0.00 36.38 34.22 3hr6 s VAL 161 CO 0.30 -0.10 1.04 -0.69 -0.31 0.00 0.00 175.10 175.34 3hr6 s VAL 162 N -3.91 4.22 0.66 1.32 1.01 0.62 -4.82 120.40 119.51 3hr6 s VAL 162 Ca 0.35 0.39 -0.12 0.00 0.00 0.00 0.00 61.98 62.60 3hr6 s VAL 162 Cb 0.07 -4.64 -0.01 0.00 0.00 0.00 0.00 36.38 31.81 3hr6 s VAL 162 CO 0.11 -1.28 1.06 0.00 0.00 0.00 0.00 175.10 174.99 3hr6 s ARG 163 N 4.39 3.05 0.48 2.72 1.70 -1.26 -1.49 118.95 128.54 3hr6 s ARG 163 Ca 0.33 1.03 -0.23 0.00 -0.47 0.00 0.00 55.73 56.39 3hr6 s ARG 163 Cb -0.11 -2.00 -0.07 0.00 -0.57 0.00 0.00 34.95 32.20 3hr6 s ARG 163 CO 0.19 -1.01 1.26 -1.12 -1.08 0.00 0.00 175.30 173.54 3hr6 s SER 164 N -3.49 5.90 0.73 -2.89 0.01 -1.25 -4.90 113.70 107.81 3hr6 s SER 164 Ca 0.60 2.53 -0.13 0.00 1.31 0.00 0.00 55.95 60.26 3hr6 s SER 164 Cb -0.15 -2.62 0.03 0.00 0.21 0.00 0.00 66.02 63.50 3hr6 s SER 164 CO 0.49 -1.12 1.11 -1.10 0.41 0.00 0.00 173.24 173.03 3hr6 s GLN 165 N -2.67 2.45 0.55 12.44 -1.52 -1.26 -4.29 119.66 125.36 3hr6 s GLN 165 Ca 0.65 1.30 -0.21 0.00 -1.95 0.00 0.00 55.36 55.15 3hr6 s GLN 165 Cb -0.35 -1.91 -0.05 0.00 -0.22 0.00 0.00 33.01 30.48 3hr6 s GLN 165 CO 0.42 -1.51 1.26 -2.30 -0.25 0.00 0.00 175.29 172.91 3hr6 n PRO 166 N -3.03 1.51 -3.74 2.91 -0.02 -1.26 -4.71 135.00 126.67 3hr6 n PRO 166 Ca 0.10 0.56 -0.12 0.00 -2.02 0.00 0.00 63.50 62.02 3hr6 n PRO 166 Cb 0.52 -2.46 -0.07 0.00 -0.02 0.00 0.00 33.50 31.47 3hr6 n PRO 166 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3hr6 s PHE 167 N -1.32 -0.15 0.15 6.00 -0.12 -0.94 -4.99 117.98 116.60 3hr6 s PHE 167 Ca 0.72 0.08 -0.15 0.00 -0.05 0.00 0.00 56.93 57.53 3hr6 s PHE 167 Cb -0.43 0.12 -0.07 0.00 -0.63 0.00 0.00 43.02 42.01 3hr6 s PHE 167 CO 0.49 -0.49 0.56 -0.51 -0.05 0.00 0.00 175.22 175.22 3hr6 s LEU 168 N -1.90 4.35 -0.05 -1.99 1.43 -1.26 -1.01 118.68 118.24 3hr6 s LEU 168 Ca -0.07 1.11 -0.02 0.00 -1.03 0.00 0.00 54.13 54.12 3hr6 s LEU 168 Cb -0.02 -3.27 0.03 0.00 0.03 0.00 0.00 46.19 42.96 3hr6 s LEU 168 CO -0.02 0.10 0.08 -0.69 0.23 0.00 0.00 176.35 176.06 3hr6 s VAL 169 N -1.45 -0.14 0.28 -1.59 1.01 0.21 -4.95 120.40 113.77 3hr6 s VAL 169 Ca 0.38 0.38 -0.25 0.00 0.00 0.00 0.00 61.98 62.49 3hr6 s VAL 169 Cb -0.15 -0.18 -0.09 0.00 0.00 0.00 0.00 36.38 35.96 3hr6 s VAL 169 CO 0.19 0.16 0.88 0.00 0.00 0.00 0.00 175.10 176.33 3hr6 s ALA 170 N 2.04 3.29 -0.08 5.51 0.00 -1.26 -0.14 121.76 131.11 3hr6 s ALA 170 Ca 0.03 0.44 -0.04 0.00 0.00 0.00 0.00 51.96 52.39 3hr6 s ALA 170 Cb -0.12 -3.09 0.04 0.00 0.00 0.00 0.00 23.12 19.96 3hr6 s ALA 170 CO -0.04 0.22 0.19 0.00 0.00 0.00 0.00 175.76 176.13 3hr6 s ALA 171 N -1.52 -0.37 1.04 0.00 0.00 -0.77 -4.38 121.76 115.76 3hr6 s ALA 171 Ca 0.47 0.80 -0.17 0.00 0.00 0.00 0.00 51.96 53.06 3hr6 s ALA 171 Cb -0.19 -0.57 0.22 0.00 0.00 0.00 0.00 23.12 22.58 3hr6 s ALA 171 CO 0.24 -0.23 1.22 -1.25 0.00 0.00 0.00 175.76 175.74 3hr6 s PRO 172 N 1.35 0.05 0.39 0.00 0.04 -1.26 -1.17 135.00 134.39 3hr6 s PRO 172 Ca -0.08 -0.19 0.05 0.00 0.04 0.00 0.00 61.00 60.82 3hr6 s PRO 172 Cb -0.11 -1.76 -0.06 0.00 0.04 0.00 0.00 34.50 32.61 3hr6 s PRO 172 CO -0.07 -2.85 0.04 -0.65 0.04 0.00 0.00 177.00 173.51 3hr6 s GLN 173 N -5.63 1.87 0.14 4.56 -0.21 -0.35 -4.97 119.66 115.06 3hr6 s GLN 173 Ca 0.71 -2.08 -0.27 0.00 0.02 0.00 0.00 55.36 53.75 3hr6 s GLN 173 Cb -0.07 -1.26 -0.07 0.00 1.00 0.00 0.00 33.01 32.60 3hr6 s GLN 173 CO 0.54 -0.17 0.84 0.99 -2.12 0.00 0.00 175.29 175.38 3hr6 s THR 174 N -2.98 4.43 0.28 -0.19 2.01 -1.26 0.63 115.64 118.55 3hr6 s THR 174 Ca 0.31 1.84 -0.30 0.00 0.31 0.00 0.00 61.69 63.85 3hr6 s THR 174 Cb 0.08 -4.21 -0.12 0.00 0.01 0.00 0.00 72.50 68.26 3hr6 s THR 174 CO 0.15 0.44 1.56 -3.20 -0.69 0.00 0.00 174.62 172.88 3hr6 n ASN 175 N 2.11 3.63 0.09 3.53 2.85 0.44 -4.65 115.26 123.25 3hr6 n ASN 175 Ca -0.03 1.15 0.18 0.00 -0.11 0.00 0.00 54.58 55.77 3hr6 n ASN 175 Cb 0.49 -1.56 0.73 0.00 1.24 0.00 0.00 39.78 40.68 3hr6 n ASN 175 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3hr6 h PRO 176 N 4.66 0.00 0.00 1.20 0.11 -1.95 0.46 132.00 136.48 3hr6 h PRO 176 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3hr6 h PRO 176 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3hr6 h PRO 176 CO 0.78 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 180.36 3hr6 h THR 177 N 0.00 0.00 0.00 -1.15 1.35 -1.95 -3.46 112.91 107.70 3hr6 h THR 177 Ca 0.18 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 3hr6 h THR 177 Cb 0.79 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 3hr6 h THR 177 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3hr6 n GLY 178 N -0.03 1.45 3.15 5.82 0.00 0.16 -4.96 105.19 110.78 3hr6 n GLY 178 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 3hr6 n GLY 178 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hr6 n ASP 179 N 0.00 5.03 0.00 1.61 2.03 -1.26 -4.86 116.55 119.10 3hr6 n ASP 179 Ca 0.00 -3.02 0.00 0.00 0.52 0.00 0.00 54.79 52.29 3hr6 n ASP 179 Cb 0.00 -1.55 0.00 0.00 -0.72 0.00 0.00 41.12 38.85 3hr6 n ASP 179 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hr6 n GLY 180 N 3.64 -2.60 3.85 0.27 0.00 -1.26 -4.76 105.19 104.33 3hr6 n GLY 180 Ca 0.40 -1.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.32 3hr6 n GLY 180 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3hr6 s TRP 181 N -0.52 3.56 -0.40 1.61 0.52 -1.26 -0.42 118.94 122.02 3hr6 s TRP 181 Ca 0.00 1.07 -0.11 0.00 0.02 0.00 0.00 56.10 57.08 3hr6 s TRP 181 Cb 0.00 -2.39 0.05 0.00 -1.15 0.00 0.00 33.47 29.98 3hr6 s TRP 181 CO 0.00 0.36 0.25 -1.17 0.02 0.00 0.00 176.95 176.41 3hr6 s LEU 182 N -2.20 4.99 0.02 2.99 2.96 0.20 -4.62 118.68 123.02 3hr6 s LEU 182 Ca 0.41 -1.20 0.05 0.00 -0.22 0.00 0.00 54.13 53.17 3hr6 s LEU 182 Cb -0.14 -2.04 -0.24 0.00 0.50 0.00 0.00 46.19 44.27 3hr6 s LEU 182 CO 0.20 -0.47 0.89 1.56 -1.32 0.00 0.00 176.35 177.20 3hr6 h GLN 183 N 8.48 0.10 -4.15 1.98 1.08 -1.92 -0.92 115.11 119.76 3hr6 h GLN 183 Ca -0.25 -0.18 -0.75 0.00 -1.45 0.00 0.00 58.65 56.03 3hr6 h GLN 183 Cb 1.10 0.07 -0.26 0.00 -0.05 0.00 0.00 27.48 28.33 3hr6 h GLN 183 CO 0.73 0.89 -0.27 -0.51 -0.95 0.00 0.00 178.83 178.71 3hr6 s ASP 184 N -6.62 6.03 0.15 1.46 1.01 -1.26 -0.85 116.67 116.58 3hr6 s ASP 184 Ca -0.05 -1.87 -0.11 0.00 0.71 0.00 0.00 52.55 51.22 3hr6 s ASP 184 Cb 0.08 -2.14 -0.07 0.00 1.01 0.00 0.00 42.92 41.81 3hr6 s ASP 184 CO 0.83 -0.79 0.50 -0.69 0.21 0.00 0.00 175.17 175.23 3hr6 s VAL 185 N 1.46 4.95 -0.05 -1.27 1.01 0.16 -4.97 120.40 121.70 3hr6 s VAL 185 Ca 0.05 0.59 0.05 0.00 0.00 0.00 0.00 61.98 62.67 3hr6 s VAL 185 Cb -0.28 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 3hr6 s VAL 185 CO 0.01 0.16 -0.19 -1.00 0.00 0.00 0.00 175.10 174.08 3hr6 s HIS 186 N -1.55 1.91 0.08 5.22 3.76 -1.26 -0.04 115.29 123.41 3hr6 s HIS 186 Ca 0.39 -0.54 0.03 0.00 -0.15 0.00 0.00 55.06 54.79 3hr6 s HIS 186 Cb -0.14 -1.27 -0.03 0.00 1.11 0.00 0.00 32.58 32.25 3hr6 s HIS 186 CO 0.20 -0.17 -0.09 0.14 -0.85 0.00 0.00 174.74 173.96 3hr6 s VAL 187 N -0.05 0.80 -0.38 -0.90 -7.23 -0.33 -4.96 120.40 107.35 3hr6 s VAL 187 Ca -0.03 -1.54 0.13 0.00 -1.81 0.00 0.00 61.98 58.72 3hr6 s VAL 187 Cb -0.12 -1.22 0.38 0.00 0.56 0.00 0.00 36.38 35.98 3hr6 s VAL 187 CO 0.02 -0.56 0.80 -1.22 -0.31 0.00 0.00 175.10 173.84 3hr6 n TYR 188 N 0.70 0.76 -1.80 2.82 4.01 -1.26 -0.73 117.16 121.67 3hr6 n TYR 188 Ca -0.17 -3.58 -0.41 0.00 -0.16 0.00 0.00 57.90 53.57 3hr6 n TYR 188 Cb 0.57 -0.41 -0.00 0.00 -0.31 0.00 0.00 39.34 39.19 3hr6 n TYR 188 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 3hr6 s PRO 189 N -2.69 4.10 -0.07 -0.72 0.04 -1.21 -4.70 135.00 129.76 3hr6 s PRO 189 Ca 0.38 2.58 -0.08 0.00 0.04 0.00 0.00 61.00 63.92 3hr6 s PRO 189 Cb 0.37 -2.97 -0.04 0.00 0.04 0.00 0.00 34.50 31.90 3hr6 s PRO 189 CO -0.06 -0.54 0.21 0.15 0.04 0.00 0.00 177.00 176.80 3hr6 s LYS 190 N -2.09 3.55 0.26 4.56 3.01 -1.26 -1.09 119.74 126.68 3hr6 s LYS 190 Ca 0.53 -0.03 0.03 0.00 -1.01 0.00 0.00 55.97 55.48 3hr6 s LYS 190 Cb -0.47 -3.18 -0.05 0.00 -1.01 0.00 0.00 37.83 33.12 3hr6 s LYS 190 CO 0.63 0.74 0.04 -3.38 0.51 0.00 0.00 175.35 173.90 3hr6 s HIS 191 N -1.09 1.64 -0.03 3.18 -3.43 0.49 -3.79 115.29 112.26 3hr6 s HIS 191 Ca 0.19 -1.01 0.07 0.00 -0.80 0.00 0.00 55.06 53.51 3hr6 s HIS 191 Cb -0.13 -0.99 -0.02 0.00 -1.43 0.00 0.00 32.58 30.01 3hr6 s HIS 191 CO 0.08 -0.12 -0.24 -0.65 -2.00 0.00 0.00 174.74 171.81 3hr6 s GLN 192 N -3.92 2.06 0.56 -0.38 1.11 -0.56 -1.20 119.66 117.33 3hr6 s GLN 192 Ca 0.33 -0.86 -0.17 0.00 0.01 0.00 0.00 55.36 54.67 3hr6 s GLN 192 Cb 0.07 -1.93 -0.05 0.00 -1.01 0.00 0.00 33.01 30.09 3hr6 s GLN 192 CO 0.12 0.48 1.05 0.00 0.01 0.00 0.00 175.29 176.95 3hr6 s ALA 193 N -0.46 2.78 -0.17 6.09 0.00 -1.26 -0.28 121.76 128.46 3hr6 s ALA 193 Ca 0.06 0.46 -0.07 0.00 0.00 0.00 0.00 51.96 52.41 3hr6 s ALA 193 Cb -0.10 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.74 3hr6 s ALA 193 CO 0.00 -0.67 0.06 -0.51 0.00 0.00 0.00 175.76 174.64 3hr6 s LEU 194 N -4.21 3.81 0.47 0.00 1.43 -1.26 -4.78 118.68 114.15 3hr6 s LEU 194 Ca 0.65 0.11 -0.20 0.00 -1.03 0.00 0.00 54.13 53.65 3hr6 s LEU 194 Cb -0.16 -1.95 -0.09 0.00 0.03 0.00 0.00 46.19 44.02 3hr6 s LEU 194 CO 0.32 0.21 1.00 -0.44 0.23 0.00 0.00 176.35 177.66 3hr6 s SER 195 N 0.17 6.58 -0.08 2.29 0.01 -1.26 -4.98 113.70 116.43 3hr6 s SER 195 Ca 0.04 1.77 -0.30 0.00 1.31 0.00 0.00 55.95 58.78 3hr6 s SER 195 Cb -0.12 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.52 3hr6 s SER 195 CO 0.01 -0.61 1.55 -0.70 0.41 0.00 0.00 173.24 173.89 3hr6 s GLU 196 N -3.39 4.20 0.72 12.44 2.12 -1.26 -4.74 118.70 128.78 3hr6 s GLU 196 Ca 0.64 2.05 -0.16 0.00 0.36 0.00 0.00 54.97 57.86 3hr6 s GLU 196 Cb -0.12 -3.91 0.03 0.00 0.26 0.00 0.00 34.13 30.38 3hr6 s GLU 196 CO 0.20 -0.80 1.25 -2.14 -0.54 0.00 0.00 175.26 173.23 3hr6 s PRO 197 N 3.83 2.14 -0.33 4.30 0.02 -1.26 -4.72 135.00 138.99 3hr6 s PRO 197 Ca 0.68 1.91 -0.09 0.00 0.02 0.00 0.00 61.00 63.52 3hr6 s PRO 197 Cb -0.30 -1.82 0.02 0.00 0.02 0.00 0.00 34.50 32.42 3hr6 s PRO 197 CO 0.26 -1.87 0.14 0.08 -0.33 0.00 0.00 177.00 175.28 3hr6 s VAL 198 N -1.76 4.26 -0.19 3.83 1.01 -0.13 -0.17 120.40 127.25 3hr6 s VAL 198 Ca 0.78 -0.79 -0.10 0.00 0.00 0.00 0.00 61.98 61.87 3hr6 s VAL 198 Cb -0.33 -3.30 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 3hr6 s VAL 198 CO 0.44 -0.09 0.13 -0.75 0.00 0.00 0.00 175.10 174.84 3hr6 s LYS 199 N 1.52 4.14 0.24 2.72 2.20 -1.26 -0.90 119.74 128.40 3hr6 s LYS 199 Ca 0.02 -0.21 0.04 0.00 -0.36 0.00 0.00 55.97 55.46 3hr6 s LYS 199 Cb -0.18 -3.41 -0.05 0.00 -1.51 0.00 0.00 37.83 32.68 3hr6 s LYS 199 CO 0.05 0.33 -0.02 0.95 -0.36 0.00 0.00 175.35 176.29 3hr6 s THR 200 N 0.28 1.19 0.02 3.43 -4.23 0.23 -4.48 115.64 112.08 3hr6 s THR 200 Ca 0.09 -2.06 0.07 0.00 -1.18 0.00 0.00 61.69 58.61 3hr6 s THR 200 Cb -0.11 -2.33 -0.03 0.00 1.34 0.00 0.00 72.50 71.36 3hr6 s THR 200 CO -0.01 -0.35 -0.19 0.00 -0.54 0.00 0.00 174.62 173.53 3hr6 s ALA 201 N -3.31 2.55 0.00 3.99 0.00 -1.26 -1.02 121.76 122.71 3hr6 s ALA 201 Ca 0.28 -1.16 0.03 0.00 0.00 0.00 0.00 51.96 51.11 3hr6 s ALA 201 Cb 0.05 -0.74 -0.01 0.00 0.00 0.00 0.00 23.12 22.42 3hr6 s ALA 201 CO 0.09 0.56 -0.10 0.08 0.00 0.00 0.00 175.76 176.39 3hr6 s VAL 202 N -0.86 0.78 -0.38 0.00 1.01 0.37 -4.98 120.40 116.34 3hr6 s VAL 202 Ca 0.14 -0.55 -0.27 0.00 0.00 0.00 0.00 61.98 61.30 3hr6 s VAL 202 Cb -0.10 -0.68 0.02 0.00 0.00 0.00 0.00 36.38 35.61 3hr6 s VAL 202 CO 0.04 0.13 0.99 -0.62 0.00 0.00 0.00 175.10 175.64 3hr6 s ASP 203 N -0.48 6.71 0.00 3.32 2.15 -1.26 -1.95 116.67 125.16 3hr6 s ASP 203 Ca 0.02 0.64 0.29 0.00 0.43 0.00 0.00 52.55 53.92 3hr6 s ASP 203 Cb -0.05 -2.49 1.23 0.00 -0.30 0.00 0.00 42.92 41.31 3hr6 s ASP 203 CO -0.00 -0.93 1.92 -0.81 -0.17 0.00 0.00 175.17 175.18 3hr6 n PRO 204 N 6.98 0.01 -3.65 4.34 -0.04 -1.26 -4.64 135.00 136.74 3hr6 n PRO 204 Ca 0.09 0.01 -0.19 0.00 -0.04 0.00 0.00 63.50 63.36 3hr6 n PRO 204 Cb 0.48 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.28 3hr6 n PRO 204 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3hr6 s ASP 205 N -2.99 1.14 0.00 3.54 -1.08 -1.26 -5.03 116.67 110.98 3hr6 s ASP 205 Ca 0.14 0.08 0.30 0.00 -0.52 0.00 0.00 52.55 52.55 3hr6 s ASP 205 Cb 0.19 0.08 1.51 0.00 -1.46 0.00 0.00 42.92 43.25 3hr6 s ASP 205 CO 0.52 -0.27 2.01 0.00 0.52 0.00 0.00 175.17 177.96 3hr6 n ALA 206 N 5.31 2.66 -0.33 3.66 0.00 -1.26 -4.12 120.51 126.43 3hr6 n ALA 206 Ca -0.04 -0.29 0.03 0.00 0.00 0.00 0.00 53.44 53.14 3hr6 n ALA 206 Cb 0.50 -1.38 0.18 0.00 0.00 0.00 0.00 19.45 18.75 3hr6 n ALA 206 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3hr6 h THR 207 N 0.84 0.98 -3.78 0.00 2.02 -1.96 -3.38 112.91 107.63 3hr6 h THR 207 Ca 0.00 -0.33 -0.56 0.00 0.77 0.00 0.00 66.41 66.29 3hr6 h THR 207 Cb 0.22 -0.07 -0.32 0.00 -1.74 0.00 0.00 68.15 66.24 3hr6 h THR 207 CO 0.00 0.18 -0.83 -1.58 0.37 0.00 0.00 175.52 173.65 3hr6 s GLN 208 N -6.02 1.83 0.44 6.66 0.74 -1.26 -5.08 119.66 116.97 3hr6 s GLN 208 Ca -0.12 -0.58 -0.25 0.00 0.05 0.00 0.00 55.36 54.45 3hr6 s GLN 208 Cb 0.20 -1.55 -0.09 0.00 1.10 0.00 0.00 33.01 32.66 3hr6 s GLN 208 CO 0.80 0.20 1.31 -2.30 -0.55 0.00 0.00 175.29 174.74 3hr6 n PRO 209 N 3.29 1.96 0.00 1.67 -0.02 -1.26 -4.75 135.00 135.89 3hr6 n PRO 209 Ca -0.19 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3hr6 n PRO 209 Cb 0.53 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 3hr6 n PRO 209 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hr6 n GLY 210 N 0.77 -1.24 2.27 -1.23 0.00 -1.26 -4.59 105.19 99.91 3hr6 n GLY 210 Ca 0.07 -1.24 -0.22 0.00 0.00 0.00 0.00 46.02 44.63 3hr6 n GLY 210 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3hr6 n PHE 211 N -0.23 0.58 -0.79 1.61 1.16 -1.26 -4.89 117.46 113.64 3hr6 n PHE 211 Ca 0.00 -3.75 -0.30 0.00 -1.87 0.00 0.00 57.45 51.52 3hr6 n PHE 211 Cb 0.00 -0.41 0.17 0.00 -1.61 0.00 0.00 39.48 37.63 3hr6 n PHE 211 CO 0.00 0.00 0.00 -1.12 -1.87 0.00 0.00 176.76 173.77 3hr6 s SER 212 N -1.99 2.82 0.03 5.98 0.01 -1.26 -4.67 113.70 114.62 3hr6 s SER 212 Ca 0.39 1.96 -0.37 0.00 1.31 0.00 0.00 55.95 59.24 3hr6 s SER 212 Cb 0.25 -2.48 -0.16 0.00 0.21 0.00 0.00 66.02 63.84 3hr6 s SER 212 CO -0.09 -3.12 1.50 0.52 0.41 0.00 0.00 173.24 172.45 3hr6 n VAL 213 N -4.23 0.09 0.00 3.43 0.31 -0.18 -1.25 118.33 116.51 3hr6 n VAL 213 Ca 0.09 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 3hr6 n VAL 213 Cb 0.53 -1.11 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 3hr6 n VAL 213 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hr6 n GLY 214 N 3.12 0.71 3.78 2.92 0.00 -0.42 -0.47 105.19 114.83 3hr6 n GLY 214 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 3hr6 n GLY 214 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hr6 s GLU 215 N -0.53 2.20 -0.01 1.61 2.02 -0.38 -4.78 118.70 118.83 3hr6 s GLU 215 Ca 0.00 -2.09 -0.06 0.00 0.02 0.00 0.00 54.97 52.84 3hr6 s GLU 215 Cb 0.00 -1.84 -0.04 0.00 0.10 0.00 0.00 34.13 32.35 3hr6 s GLU 215 CO 0.00 -0.32 0.24 -0.80 0.02 0.00 0.00 175.26 174.40 3hr6 s ASN 216 N -3.98 6.45 0.16 -0.19 0.01 -1.26 -0.46 114.94 115.67 3hr6 s ASN 216 Ca 0.27 0.50 0.02 0.00 -0.71 0.00 0.00 52.86 52.94 3hr6 s ASN 216 Cb 0.02 -2.06 -0.04 0.00 0.41 0.00 0.00 41.25 39.58 3hr6 s ASN 216 CO 0.16 0.27 0.30 0.54 -1.51 0.00 0.00 177.10 176.85 3hr6 s VAL 217 N -1.29 5.31 -0.04 1.60 0.11 -0.25 -4.38 120.40 121.47 3hr6 s VAL 217 Ca 0.27 -0.66 0.05 0.00 -2.93 0.00 0.00 61.98 58.70 3hr6 s VAL 217 Cb -0.13 -3.75 -0.01 0.00 -1.53 0.00 0.00 36.38 30.97 3hr6 s VAL 217 CO 0.16 -0.12 -0.18 -0.75 -3.33 0.00 0.00 175.10 170.88 3hr6 s LYS 218 N -3.29 1.79 0.12 1.54 2.20 -0.82 -1.07 119.74 120.20 3hr6 s LYS 218 Ca 0.35 -0.65 0.10 0.00 -0.36 0.00 0.00 55.97 55.41 3hr6 s LYS 218 Cb -0.11 -1.58 -0.04 0.00 -1.51 0.00 0.00 37.83 34.59 3hr6 s LYS 218 CO 0.29 0.29 -0.21 0.71 -0.36 0.00 0.00 175.35 176.06 3hr6 s TYR 219 N -0.08 2.45 -0.07 4.03 2.02 0.32 -0.48 117.35 125.54 3hr6 s TYR 219 Ca -0.01 -0.31 0.00 0.00 -0.37 0.00 0.00 57.07 56.38 3hr6 s TYR 219 Cb -0.11 -1.32 0.02 0.00 -0.40 0.00 0.00 41.96 40.16 3hr6 s TYR 219 CO 0.02 0.36 -0.06 0.50 -1.57 0.00 0.00 175.55 174.80 3hr6 s ARG 220 N -2.07 1.15 -0.24 -0.62 3.52 -0.19 -1.65 118.95 118.86 3hr6 s ARG 220 Ca 0.16 -0.16 0.02 0.00 -0.13 0.00 0.00 55.73 55.62 3hr6 s ARG 220 Cb -0.10 -1.19 0.05 0.00 -1.56 0.00 0.00 34.95 32.15 3hr6 s ARG 220 CO 0.08 -0.16 -0.12 0.08 -0.81 0.00 0.00 175.30 174.37 3hr6 s VAL 221 N 1.32 2.04 -0.30 7.11 1.01 0.31 -0.60 120.40 131.28 3hr6 s VAL 221 Ca -0.04 -1.41 -0.08 0.00 0.00 0.00 0.00 61.98 60.45 3hr6 s VAL 221 Cb -0.14 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.14 3hr6 s VAL 221 CO -0.03 0.08 0.12 0.00 0.00 0.00 0.00 175.10 175.27 3hr6 s ALA 222 N 1.19 3.17 -0.13 5.51 0.00 -0.08 -1.33 121.76 130.09 3hr6 s ALA 222 Ca -0.05 -1.42 0.01 0.00 0.00 0.00 0.00 51.96 50.49 3hr6 s ALA 222 Cb -0.18 -2.27 -0.01 0.00 0.00 0.00 0.00 23.12 20.66 3hr6 s ALA 222 CO -0.07 -0.92 -0.15 0.99 0.00 0.00 0.00 175.76 175.61 3hr6 s THR 223 N 1.56 2.79 0.14 0.00 2.01 -0.23 -0.95 115.64 120.95 3hr6 s THR 223 Ca 0.04 -0.75 -0.29 0.00 0.31 0.00 0.00 61.69 60.99 3hr6 s THR 223 Cb -0.17 -2.16 -0.07 0.00 0.01 0.00 0.00 72.50 70.12 3hr6 s THR 223 CO 0.04 0.53 0.92 -0.54 -0.69 0.00 0.00 174.62 174.88 3hr6 s LYS 224 N 0.45 4.70 -0.29 4.92 1.02 -1.26 -0.41 119.74 128.87 3hr6 s LYS 224 Ca -0.11 1.40 -0.26 0.00 0.02 0.00 0.00 55.97 57.01 3hr6 s LYS 224 Cb -0.16 -3.35 0.01 0.00 -0.52 0.00 0.00 37.83 33.81 3hr6 s LYS 224 CO 0.05 0.32 0.92 0.42 -0.92 0.00 0.00 175.35 176.14 3hr6 s ILE 225 N -0.36 4.69 0.63 2.17 -1.09 -0.03 -4.71 121.20 122.50 3hr6 s ILE 225 Ca 0.44 1.52 -0.16 0.00 -2.23 0.00 0.00 60.65 60.23 3hr6 s ILE 225 Cb -0.24 -4.26 -0.02 0.00 -1.58 0.00 0.00 42.46 36.37 3hr6 s ILE 225 CO 0.29 -0.30 1.10 -2.16 -1.23 0.00 0.00 174.94 172.64 3hr6 s PRO 226 N 3.21 3.01 0.01 2.79 0.04 -1.26 0.20 135.00 142.99 3hr6 s PRO 226 Ca 0.39 1.36 -0.30 0.00 0.04 0.00 0.00 61.00 62.48 3hr6 s PRO 226 Cb -0.14 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 3hr6 s PRO 226 CO 0.12 -1.08 1.18 -2.00 0.04 0.00 0.00 177.00 175.26 3hr6 s GLU 227 N -4.01 4.41 0.32 4.56 2.12 -1.26 -4.66 118.70 120.19 3hr6 s GLU 227 Ca 0.67 1.70 0.08 0.00 0.36 0.00 0.00 54.97 57.78 3hr6 s GLU 227 Cb -0.19 -3.44 -0.04 0.00 0.26 0.00 0.00 34.13 30.71 3hr6 s GLU 227 CO 0.39 -0.32 0.13 0.96 -0.54 0.00 0.00 175.26 175.88 3hr6 s ILE 228 N 1.53 3.18 0.13 -3.70 -4.36 -1.26 -4.91 121.20 111.80 3hr6 s ILE 228 Ca 0.57 -1.71 -0.34 0.00 -0.26 0.00 0.00 60.65 58.91 3hr6 s ILE 228 Cb -0.27 -2.98 -0.17 0.00 1.25 0.00 0.00 42.46 40.29 3hr6 s ILE 228 CO 0.26 -0.22 1.15 0.00 0.24 0.00 0.00 174.94 176.37 3hr6 n ALA 229 N -1.12 -1.33 -1.64 2.27 0.00 -1.26 -4.83 120.51 112.61 3hr6 n ALA 229 Ca -0.04 0.49 -0.43 0.00 0.00 0.00 0.00 53.44 53.47 3hr6 n ALA 229 Cb 0.61 -1.98 -0.00 0.00 0.00 0.00 0.00 19.45 18.08 3hr6 n ALA 229 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hr6 n SER 230 N 2.05 1.82 -0.18 0.00 7.64 -1.26 -1.79 113.62 121.90 3hr6 n SER 230 Ca 0.17 1.14 -0.02 0.00 1.01 0.00 0.00 58.87 61.16 3hr6 n SER 230 Cb 0.21 -1.38 -0.01 0.00 -1.01 0.00 0.00 64.21 62.02 3hr6 n SER 230 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3hr6 n ASN 231 N 0.79 -5.86 -4.97 6.43 5.03 -1.26 -4.99 115.26 110.43 3hr6 n ASN 231 Ca 0.08 0.06 -0.21 0.00 0.87 0.00 0.00 54.58 55.37 3hr6 n ASN 231 Cb 0.36 -3.61 -0.00 0.00 -1.02 0.00 0.00 39.78 35.50 3hr6 n ASN 231 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 3hr6 s THR 232 N -1.19 4.42 0.17 3.41 -4.23 -0.74 -5.14 115.64 112.34 3hr6 s THR 232 Ca 0.00 -0.78 0.09 0.00 -1.18 0.00 0.00 61.69 59.83 3hr6 s THR 232 Cb 0.00 -3.58 -0.04 0.00 1.34 0.00 0.00 72.50 70.22 3hr6 s THR 232 CO 0.00 -0.30 -0.20 -0.54 -0.54 0.00 0.00 174.62 173.04 3hr6 s LYS 233 N -4.27 1.34 0.38 3.99 -0.14 -1.26 -4.90 119.74 114.88 3hr6 s LYS 233 Ca 0.43 -1.42 -0.28 0.00 -1.36 0.00 0.00 55.97 53.34 3hr6 s LYS 233 Cb -0.10 -1.51 -0.10 0.00 -1.68 0.00 0.00 37.83 34.45 3hr6 s LYS 233 CO 0.33 0.32 1.41 -0.06 -0.76 0.00 0.00 175.35 176.60 3hr6 s PHE 234 N -1.84 2.71 0.14 3.18 0.08 -1.26 -4.90 117.98 116.08 3hr6 s PHE 234 Ca 0.16 1.27 0.16 0.00 0.12 0.00 0.00 56.93 58.64 3hr6 s PHE 234 Cb -0.07 -3.89 0.45 0.00 -0.57 0.00 0.00 43.02 38.95 3hr6 s PHE 234 CO 0.07 -2.61 1.63 0.93 -0.10 0.00 0.00 175.22 175.15 3hr6 h GLU 235 N 2.98 0.00 0.00 0.44 5.08 -1.95 -3.47 114.58 117.65 3hr6 h GLU 235 Ca -0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 3hr6 h GLU 235 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 3hr6 h GLU 235 CO 0.64 0.49 0.00 0.41 -1.00 0.00 0.00 179.01 179.55 3hr6 n GLY 236 N 0.47 -0.73 3.15 -3.84 0.00 -1.24 -4.43 105.19 98.58 3hr6 n GLY 236 Ca -0.00 -1.14 0.04 0.00 0.00 0.00 0.00 46.02 44.92 3hr6 n GLY 236 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3hr6 s PHE 237 N -2.00 -1.68 -0.08 1.61 5.36 -1.25 -2.80 117.98 117.15 3hr6 s PHE 237 Ca 0.00 1.32 0.05 0.00 -0.96 0.00 0.00 56.93 57.34 3hr6 s PHE 237 Cb 0.00 0.42 -0.01 0.00 -0.34 0.00 0.00 43.02 43.09 3hr6 s PHE 237 CO 0.00 -0.96 -0.23 0.99 -1.46 0.00 0.00 175.22 173.57 3hr6 s THR 238 N 2.85 2.25 -0.20 0.12 2.01 0.29 -1.02 115.64 121.94 3hr6 s THR 238 Ca 0.15 -0.98 -0.02 0.00 0.31 0.00 0.00 61.69 61.15 3hr6 s THR 238 Cb -0.12 -1.85 0.01 0.00 0.01 0.00 0.00 72.50 70.55 3hr6 s THR 238 CO -0.23 0.56 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.46 3hr6 s VAL 239 N -0.03 2.76 0.09 3.82 1.01 0.33 -0.81 120.40 127.57 3hr6 s VAL 239 Ca -0.07 -0.72 0.08 0.00 0.00 0.00 0.00 61.98 61.27 3hr6 s VAL 239 Cb -0.15 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 3hr6 s VAL 239 CO 0.05 0.46 -0.21 0.00 0.00 0.00 0.00 175.10 175.40 3hr6 s ALA 240 N 1.39 1.80 -0.11 5.51 0.00 -0.12 -0.70 121.76 129.53 3hr6 s ALA 240 Ca 0.05 -1.19 -0.03 0.00 0.00 0.00 0.00 51.96 50.78 3hr6 s ALA 240 Cb -0.14 -0.28 0.05 0.00 0.00 0.00 0.00 23.12 22.76 3hr6 s ALA 240 CO -0.08 0.37 0.12 0.34 0.00 0.00 0.00 175.76 176.52 3hr6 s ASP 241 N -1.69 1.33 -0.62 0.00 -1.08 0.30 -0.31 116.67 114.59 3hr6 s ASP 241 Ca 0.07 -0.04 -0.20 0.00 -0.52 0.00 0.00 52.55 51.86 3hr6 s ASP 241 Cb -0.10 0.05 0.09 0.00 -1.46 0.00 0.00 42.92 41.51 3hr6 s ASP 241 CO 0.04 -0.28 0.79 -0.75 0.52 0.00 0.00 175.17 175.49 3hr6 s LYS 242 N 2.23 3.07 0.58 4.34 2.20 -1.26 -0.68 119.74 130.20 3hr6 s LYS 242 Ca 0.04 -1.16 -0.20 0.00 -0.36 0.00 0.00 55.97 54.29 3hr6 s LYS 242 Cb -0.13 -4.26 -0.04 0.00 -1.51 0.00 0.00 37.83 31.89 3hr6 s LYS 242 CO -0.07 -1.64 1.27 1.28 -0.36 0.00 0.00 175.35 175.84 3hr6 n LEU 243 N 6.80 5.29 -4.71 5.43 4.32 0.71 -4.72 117.00 130.12 3hr6 n LEU 243 Ca -0.08 0.92 -0.34 0.00 -0.02 0.00 0.00 56.01 56.49 3hr6 n LEU 243 Cb 0.43 -1.54 0.11 0.00 -1.62 0.00 0.00 43.42 40.81 3hr6 n LEU 243 CO 0.60 -0.91 0.81 -2.16 -1.22 0.00 0.00 177.39 174.52 3hr6 s PRO 244 N -2.96 1.87 0.62 3.23 0.04 -1.26 -4.35 135.00 132.19 3hr6 s PRO 244 Ca 0.75 1.85 0.39 0.00 0.04 0.00 0.00 61.00 64.03 3hr6 s PRO 244 Cb -0.41 -1.79 2.01 0.00 0.04 0.00 0.00 34.50 34.35 3hr6 s PRO 244 CO 0.47 -2.06 2.23 0.00 0.04 0.00 0.00 177.00 177.68 3hr6 h ALA 245 N -0.51 1.06 0.00 8.56 0.00 -1.93 -2.06 119.26 124.38 3hr6 h ALA 245 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3hr6 h ALA 245 Cb 1.31 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3hr6 h ALA 245 CO 0.48 0.02 0.00 0.39 0.00 0.00 0.00 179.25 180.14 3hr6 n GLU 246 N -3.18 0.21 -3.88 0.00 4.71 -1.26 -4.76 120.64 112.48 3hr6 n GLU 246 Ca -0.02 0.08 -0.36 0.00 -0.01 0.00 0.00 57.16 56.86 3hr6 n GLU 246 Cb 0.15 -1.50 -0.06 0.00 -1.01 0.00 0.00 31.44 29.03 3hr6 n GLU 246 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3hr6 s LEU 247 N -2.72 4.38 0.00 -4.62 1.43 -0.78 -0.48 118.68 115.90 3hr6 s LEU 247 Ca 0.18 0.44 -0.06 0.00 -1.03 0.00 0.00 54.13 53.66 3hr6 s LEU 247 Cb 0.15 -2.29 0.08 0.00 0.03 0.00 0.00 46.19 44.16 3hr6 s LEU 247 CO 0.37 0.35 0.45 0.61 0.23 0.00 0.00 176.35 178.37 3hr6 n GLY 248 N 1.58 -1.40 3.78 -3.19 0.00 -0.23 -4.82 105.19 100.90 3hr6 n GLY 248 Ca -0.16 -1.66 -0.36 0.00 0.00 0.00 0.00 46.02 43.83 3hr6 n GLY 248 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hr6 s LYS 249 N -4.00 3.97 0.39 1.61 1.02 -1.26 -4.46 119.74 117.01 3hr6 s LYS 249 Ca 0.26 1.61 -0.27 0.00 0.02 0.00 0.00 55.97 57.59 3hr6 s LYS 249 Cb -0.01 -2.45 -0.10 0.00 -0.52 0.00 0.00 37.83 34.76 3hr6 s LYS 249 CO 0.18 -0.33 1.38 -2.14 -0.92 0.00 0.00 175.35 173.52 3hr6 s PRO 250 N -2.64 4.03 -0.19 -1.68 0.02 -1.26 -4.40 135.00 128.87 3hr6 s PRO 250 Ca 0.61 2.34 -0.29 0.00 0.02 0.00 0.00 61.00 63.67 3hr6 s PRO 250 Cb -0.24 -2.86 -0.03 0.00 0.02 0.00 0.00 34.50 31.39 3hr6 s PRO 250 CO 0.30 -0.51 1.61 0.34 -0.33 0.00 0.00 177.00 178.41 3hr6 s ASP 251 N -0.48 6.44 0.42 2.53 -1.08 -0.96 -4.88 116.67 118.66 3hr6 s ASP 251 Ca 0.55 1.71 0.17 0.00 -0.52 0.00 0.00 52.55 54.46 3hr6 s ASP 251 Cb -0.42 -2.53 1.08 0.00 -1.46 0.00 0.00 42.92 39.58 3hr6 s ASP 251 CO 0.55 -1.20 1.86 0.74 0.52 0.00 0.00 175.17 177.64 3hr6 h THR 252 N 6.04 0.68 -0.00 1.71 2.02 -1.92 -0.40 112.91 121.05 3hr6 h THR 252 Ca -0.34 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 66.70 3hr6 h THR 252 Cb 1.15 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 3hr6 h THR 252 CO 0.99 0.08 -0.03 0.59 0.37 0.00 0.00 175.52 177.51 3hr6 n ASN 253 N -4.51 0.19 -0.44 4.18 5.03 -1.26 -3.33 115.26 115.11 3hr6 n ASN 253 Ca 0.19 -0.49 0.04 0.00 0.87 0.00 0.00 54.58 55.19 3hr6 n ASN 253 Cb 0.69 -0.15 0.11 0.00 -1.02 0.00 0.00 39.78 39.41 3hr6 n ASN 253 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3hr6 n LYS 254 N -1.09 2.87 -3.19 3.52 5.02 -0.16 -4.95 118.16 120.18 3hr6 n LYS 254 Ca 0.16 -1.95 -0.40 0.00 -2.02 0.00 0.00 58.31 54.11 3hr6 n LYS 254 Cb 0.23 -1.23 -0.07 0.00 -0.02 0.00 0.00 35.03 33.94 3hr6 n LYS 254 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hr6 s ILE 255 N -1.18 5.05 0.09 -0.18 1.01 -1.20 -4.06 121.20 120.74 3hr6 s ILE 255 Ca 0.18 1.02 0.07 0.00 0.00 0.00 0.00 60.65 61.92 3hr6 s ILE 255 Cb 0.10 -3.88 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 3hr6 s ILE 255 CO 0.10 0.11 -0.18 0.42 0.00 0.00 0.00 174.94 175.39 3hr6 s THR 256 N 2.04 1.46 -0.04 2.92 -4.23 -0.05 -4.98 115.64 112.76 3hr6 s THR 256 Ca 0.25 -1.45 -0.01 0.00 -1.18 0.00 0.00 61.69 59.31 3hr6 s THR 256 Cb -0.16 -1.35 0.03 0.00 1.34 0.00 0.00 72.50 72.36 3hr6 s THR 256 CO 0.09 -0.13 0.02 -0.69 -0.54 0.00 0.00 174.62 173.37 3hr6 s VAL 257 N -1.22 0.09 0.05 2.29 1.01 -1.26 -1.05 120.40 120.32 3hr6 s VAL 257 Ca 0.03 0.20 0.05 0.00 0.00 0.00 0.00 61.98 62.26 3hr6 s VAL 257 Cb -0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 36.38 36.01 3hr6 s VAL 257 CO 0.03 0.16 -0.13 0.42 0.00 0.00 0.00 175.10 175.59 3hr6 s THR 258 N 1.47 1.01 -0.18 3.92 -4.23 -0.37 -3.87 115.64 113.40 3hr6 s THR 258 Ca -0.04 -1.11 0.01 0.00 -1.18 0.00 0.00 61.69 59.37 3hr6 s THR 258 Cb -0.13 -0.96 0.03 0.00 1.34 0.00 0.00 72.50 72.78 3hr6 s THR 258 CO -0.03 -0.14 -0.14 -0.22 -0.54 0.00 0.00 174.62 173.55 3hr6 s LEU 259 N -1.41 2.06 -1.33 4.79 2.96 0.38 -0.53 118.68 125.60 3hr6 s LEU 259 Ca -0.01 -0.69 -0.01 0.00 -0.22 0.00 0.00 54.13 53.19 3hr6 s LEU 259 Cb -0.09 -1.28 0.00 0.00 0.50 0.00 0.00 46.19 45.32 3hr6 s LEU 259 CO 0.02 -0.08 0.14 0.61 -1.32 0.00 0.00 176.35 175.72 3hr6 n GLY 260 N 4.69 -0.28 2.63 7.98 0.00 -0.26 -1.28 105.19 118.67 3hr6 n GLY 260 Ca -0.17 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.68 3hr6 n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hr6 n GLY 261 N -1.11 0.23 3.73 -0.02 0.00 -1.26 -5.02 105.19 101.74 3hr6 n GLY 261 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 3hr6 n GLY 261 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hr6 s LYS 262 N -1.09 2.90 0.65 1.61 1.02 -0.40 -5.03 119.74 119.40 3hr6 s LYS 262 Ca 0.00 -0.57 -0.16 0.00 0.02 0.00 0.00 55.97 55.26 3hr6 s LYS 262 Cb 0.00 -2.75 -0.00 0.00 -0.52 0.00 0.00 37.83 34.56 3hr6 s LYS 262 CO 0.00 0.63 1.16 -1.25 -0.92 0.00 0.00 175.35 174.96 3hr6 s PRO 263 N -1.71 2.72 0.08 -1.68 0.04 -1.26 -0.47 135.00 132.72 3hr6 s PRO 263 Ca 0.22 1.60 0.02 0.00 0.04 0.00 0.00 61.00 62.88 3hr6 s PRO 263 Cb -0.12 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 3hr6 s PRO 263 CO 0.13 -1.35 0.11 0.42 0.04 0.00 0.00 177.00 176.34 3hr6 s ILE 264 N -2.03 4.72 -0.34 0.56 1.01 -1.25 -4.78 121.20 119.08 3hr6 s ILE 264 Ca 0.72 -0.69 -0.36 0.00 0.00 0.00 0.00 60.65 60.32 3hr6 s ILE 264 Cb -0.25 -3.28 -0.12 0.00 0.01 0.00 0.00 42.46 38.82 3hr6 s ILE 264 CO 0.39 0.12 2.16 0.59 0.00 0.00 0.00 174.94 178.20 3hr6 n ASN 265 N 0.40 2.13 0.28 3.58 3.02 -1.26 -4.78 115.26 118.63 3hr6 n ASN 265 Ca -0.08 0.47 0.13 0.00 -0.03 0.00 0.00 54.58 55.07 3hr6 n ASN 265 Cb 0.52 -1.25 0.80 0.00 -0.61 0.00 0.00 39.78 39.23 3hr6 n ASN 265 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3hr6 h SER 266 N 11.91 0.00 0.19 6.41 4.64 -1.96 0.40 113.55 135.14 3hr6 h SER 266 Ca -0.28 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.03 3hr6 h SER 266 Cb 1.32 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3hr6 h SER 266 CO 1.02 0.07 -0.06 0.71 -0.87 0.00 0.00 176.83 177.69 3hr6 h THR 267 N 0.00 0.54 0.00 2.95 1.35 -2.00 -2.28 112.91 113.46 3hr6 h THR 267 Ca -0.00 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 3hr6 h THR 267 Cb 0.17 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 3hr6 h THR 267 CO 0.01 0.06 -0.89 0.47 -0.25 0.00 0.00 175.52 174.92 3hr6 n ASP 268 N -3.73 0.64 -4.35 5.36 8.00 0.11 -4.81 116.55 117.78 3hr6 n ASP 268 Ca -0.02 -0.09 -0.35 0.00 0.71 0.00 0.00 54.79 55.04 3hr6 n ASP 268 Cb 0.16 0.57 -0.14 0.00 -0.02 0.00 0.00 41.12 41.70 3hr6 n ASP 268 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hr6 s VAL 269 N -3.19 3.63 -0.35 2.53 1.01 -0.86 -0.27 120.40 122.90 3hr6 s VAL 269 Ca 0.04 -0.41 -0.11 0.00 0.00 0.00 0.00 61.98 61.51 3hr6 s VAL 269 Cb 0.14 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.87 3hr6 s VAL 269 CO 0.77 0.40 0.19 -0.55 0.00 0.00 0.00 175.10 175.91 3hr6 s SER 270 N 1.52 5.68 -0.26 3.32 0.15 -0.27 -4.86 113.70 118.98 3hr6 s SER 270 Ca 0.06 -0.82 -0.09 0.00 0.70 0.00 0.00 55.95 55.80 3hr6 s SER 270 Cb -0.14 -2.02 -0.04 0.00 -1.71 0.00 0.00 66.02 62.11 3hr6 s SER 270 CO -0.01 -0.32 0.11 -0.69 1.20 0.00 0.00 173.24 173.53 3hr6 s VAL 271 N 1.58 4.67 0.05 4.45 1.01 -1.26 -1.54 120.40 129.35 3hr6 s VAL 271 Ca 0.03 -0.05 0.03 0.00 0.00 0.00 0.00 61.98 61.99 3hr6 s VAL 271 Cb -0.18 -3.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 3hr6 s VAL 271 CO 0.07 0.31 -0.10 -1.58 0.00 0.00 0.00 175.10 173.80 3hr6 s GLN 272 N 1.62 0.62 0.08 2.72 0.74 0.18 -4.99 119.66 120.64 3hr6 s GLN 272 Ca 0.06 -0.80 0.09 0.00 0.05 0.00 0.00 55.36 54.76 3hr6 s GLN 272 Cb -0.15 -0.47 -0.03 0.00 1.10 0.00 0.00 33.01 33.45 3hr6 s GLN 272 CO 0.06 0.10 -0.23 0.95 -0.55 0.00 0.00 175.29 175.62 3hr6 s THR 273 N -1.30 1.86 0.01 -0.34 -4.23 -1.26 -0.37 115.64 110.01 3hr6 s THR 273 Ca -0.07 -1.45 -0.14 0.00 -1.18 0.00 0.00 61.69 58.85 3hr6 s THR 273 Cb -0.10 -1.64 0.02 0.00 1.34 0.00 0.00 72.50 72.12 3hr6 s THR 273 CO 0.01 0.11 0.30 -0.72 -0.54 0.00 0.00 174.62 173.78 3hr6 s TYR 274 N -0.98 -0.14 -0.05 3.99 -0.85 -0.38 -4.99 117.35 113.96 3hr6 s TYR 274 Ca 0.09 0.13 -0.21 0.00 -0.52 0.00 0.00 57.07 56.56 3hr6 s TYR 274 Cb -0.10 0.08 -0.05 0.00 0.38 0.00 0.00 41.96 42.28 3hr6 s TYR 274 CO 0.03 -0.42 0.59 -0.65 -1.52 0.00 0.00 175.55 173.58 3hr6 s GLN 275 N -1.77 4.35 -0.26 -3.49 -1.52 -1.26 -0.50 119.66 115.21 3hr6 s GLN 275 Ca -0.11 0.70 0.02 0.00 -1.95 0.00 0.00 55.36 54.02 3hr6 s GLN 275 Cb -0.04 -3.39 0.07 0.00 -0.22 0.00 0.00 33.01 29.43 3hr6 s GLN 275 CO 0.01 0.24 -0.05 0.08 -0.25 0.00 0.00 175.29 175.33 3hr6 s VAL 276 N 0.26 1.74 0.00 1.09 1.01 0.32 -4.95 120.40 119.86 3hr6 s VAL 276 Ca 0.31 -1.47 0.00 0.00 0.00 0.00 0.00 61.98 60.82 3hr6 s VAL 276 Cb -0.17 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.19 3hr6 s VAL 276 CO 0.16 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.69 3hr6 n GLY 277 N 4.57 3.35 1.48 4.51 0.00 -1.26 -1.89 105.19 115.95 3hr6 n GLY 277 Ca -0.10 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.99 3hr6 n GLY 277 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hr6 n ASP 278 N 4.35 4.37 -4.25 1.61 5.75 -1.26 -4.88 116.55 122.24 3hr6 n ASP 278 Ca 0.00 -2.54 -0.27 0.00 -0.01 0.00 0.00 54.79 51.97 3hr6 n ASP 278 Cb 0.00 -0.58 -0.15 0.00 -1.03 0.00 0.00 41.12 39.36 3hr6 n ASP 278 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3hr6 s ARG 279 N -2.08 1.58 -0.10 0.11 0.52 -0.79 -4.62 118.95 113.56 3hr6 s ARG 279 Ca 0.43 -0.87 -0.21 0.00 -0.52 0.00 0.00 55.73 54.55 3hr6 s ARG 279 Cb 0.30 -1.62 -0.04 0.00 0.52 0.00 0.00 34.95 34.11 3hr6 s ARG 279 CO 0.17 0.43 0.63 0.99 0.02 0.00 0.00 175.30 177.53 3hr6 s THR 280 N -0.66 5.08 -0.19 0.02 2.01 -1.26 -0.52 115.64 120.12 3hr6 s THR 280 Ca 0.08 1.26 -0.12 0.00 0.31 0.00 0.00 61.69 63.22 3hr6 s THR 280 Cb -0.09 -3.96 -0.05 0.00 0.01 0.00 0.00 72.50 68.42 3hr6 s THR 280 CO 0.01 0.25 0.22 -0.69 -0.69 0.00 0.00 174.62 173.71 3hr6 s VAL 281 N 0.95 5.34 -0.16 3.82 1.01 0.34 -0.21 120.40 131.50 3hr6 s VAL 281 Ca 0.33 0.37 -0.08 0.00 0.00 0.00 0.00 61.98 62.60 3hr6 s VAL 281 Cb -0.17 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 3hr6 s VAL 281 CO 0.14 0.39 0.10 -0.22 0.00 0.00 0.00 175.10 175.51 3hr6 s LEU 282 N 0.59 4.08 -0.03 3.92 2.96 0.14 -1.24 118.68 129.09 3hr6 s LEU 282 Ca 0.12 0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.29 3hr6 s LEU 282 Cb -0.12 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.56 3hr6 s LEU 282 CO 0.02 0.26 -0.05 -0.55 -1.32 0.00 0.00 176.35 174.71 3hr6 s SER 283 N -0.13 0.88 -0.12 3.68 0.15 0.50 -0.54 113.70 118.10 3hr6 s SER 283 Ca 0.09 -0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.63 3hr6 s SER 283 Cb -0.12 -0.34 0.01 0.00 -1.71 0.00 0.00 66.02 63.86 3hr6 s SER 283 CO 0.01 -0.01 -0.18 -0.69 1.20 0.00 0.00 173.24 173.56 3hr6 s VAL 284 N 0.59 1.75 -0.04 4.45 1.01 0.13 -0.64 120.40 127.65 3hr6 s VAL 284 Ca -0.08 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.13 3hr6 s VAL 284 Cb -0.11 -1.57 0.01 0.00 0.00 0.00 0.00 36.38 34.70 3hr6 s VAL 284 CO 0.00 0.49 -0.10 -1.58 0.00 0.00 0.00 175.10 173.91 3hr6 s GLN 285 N 0.90 1.27 -0.13 2.72 0.74 -0.59 -0.51 119.66 124.06 3hr6 s GLN 285 Ca -0.07 -0.34 -0.10 0.00 0.05 0.00 0.00 55.36 54.91 3hr6 s GLN 285 Cb -0.15 -1.12 -0.05 0.00 1.10 0.00 0.00 33.01 32.79 3hr6 s GLN 285 CO -0.02 0.07 0.19 -0.51 -0.55 0.00 0.00 175.29 174.47 3hr6 s LEU 286 N 0.45 4.34 0.00 3.68 1.43 -0.18 -1.11 118.68 127.28 3hr6 s LEU 286 Ca -0.09 0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.50 3hr6 s LEU 286 Cb -0.12 -2.18 -0.00 0.00 0.03 0.00 0.00 46.19 43.92 3hr6 s LEU 286 CO 0.02 0.30 0.12 0.00 0.23 0.00 0.00 176.35 177.02 3hr6 n ALA 287 N 2.55 0.01 -0.94 4.21 0.00 0.63 -3.98 120.51 123.00 3hr6 n ALA 287 Ca -0.17 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.75 3hr6 n ALA 287 Cb 0.54 0.42 0.00 0.00 0.00 0.00 0.00 19.45 20.41 3hr6 n ALA 287 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hr6 n GLY 288 N -0.18 1.85 0.23 0.00 0.00 -1.26 -2.19 105.19 103.65 3hr6 n GLY 288 Ca 0.01 -0.52 -0.04 0.00 0.00 0.00 0.00 46.02 45.47 3hr6 n GLY 288 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hr6 h ALA 289 N -0.94 0.76 -0.58 4.61 0.00 -1.97 -1.59 119.26 119.55 3hr6 h ALA 289 Ca 0.00 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.95 3hr6 h ALA 289 Cb 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 3hr6 h ALA 289 CO 0.00 0.07 0.31 1.15 0.00 0.00 0.00 179.25 180.78 3hr6 h THR 290 N 0.69 0.96 -0.40 0.00 2.02 -1.91 0.22 112.91 114.49 3hr6 h THR 290 Ca 0.24 -0.20 -0.10 0.00 0.77 0.00 0.00 66.41 67.12 3hr6 h THR 290 Cb 0.05 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.77 3hr6 h THR 290 CO -0.11 0.11 -0.13 0.25 0.37 0.00 0.00 175.52 176.00 3hr6 h LEU 291 N 0.59 0.80 -1.56 2.58 5.85 -0.93 -2.08 115.31 120.56 3hr6 h LEU 291 Ca 0.26 -0.38 -0.05 0.00 0.84 0.00 0.00 57.88 58.55 3hr6 h LEU 291 Cb 0.15 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 3hr6 h LEU 291 CO -0.17 1.00 -0.23 1.56 -0.34 0.00 0.00 178.44 180.26 3hr6 h GLN 292 N 0.60 0.00 -0.48 1.25 1.08 -0.74 -2.41 115.11 114.40 3hr6 h GLN 292 Ca 0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 3hr6 h GLN 292 Cb 0.67 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.10 3hr6 h GLN 292 CO 0.05 0.23 0.00 -1.13 -0.95 0.00 0.00 178.83 177.03 3hr6 n SER 293 N -4.15 3.60 0.21 1.46 3.41 0.01 -4.50 113.62 113.68 3hr6 n SER 293 Ca -0.02 -2.00 0.05 0.00 -0.26 0.00 0.00 58.87 56.64 3hr6 n SER 293 Cb 0.29 -0.32 0.48 0.00 -0.26 0.00 0.00 64.21 64.40 3hr6 n SER 293 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3hr6 h LEU 294 N 4.45 0.00 -0.51 1.04 5.85 -0.84 -0.17 115.31 125.13 3hr6 h LEU 294 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3hr6 h LEU 294 Cb 0.99 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.02 3hr6 h LEU 294 CO 0.00 0.24 0.00 -0.90 -0.34 0.00 0.00 178.44 177.44 3hr6 n ASP 295 N -4.16 0.22 -0.67 1.25 5.75 -1.26 -1.31 116.55 116.37 3hr6 n ASP 295 Ca -0.02 0.60 0.12 0.00 -0.01 0.00 0.00 54.79 55.48 3hr6 n ASP 295 Cb 0.30 -0.63 0.37 0.00 -1.03 0.00 0.00 41.12 40.13 3hr6 n ASP 295 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hr6 n GLN 296 N -1.79 1.90 -1.18 0.11 6.02 -0.08 -4.20 117.38 118.16 3hr6 n GLN 296 Ca -0.00 -1.33 -0.11 0.00 -0.01 0.00 0.00 57.00 55.54 3hr6 n GLN 296 Cb 0.04 -1.45 0.14 0.00 1.02 0.00 0.00 30.24 29.98 3hr6 n GLN 296 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3hr6 n HIS 297 N 0.58 1.58 -1.71 1.08 8.25 -0.43 -5.04 115.22 119.53 3hr6 n HIS 297 Ca 0.17 -1.91 -0.43 0.00 -0.26 0.00 0.00 57.72 55.29 3hr6 n HIS 297 Cb 0.42 -0.50 -0.01 0.00 1.12 0.00 0.00 29.99 31.02 3hr6 n HIS 297 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 3hr6 n LYS 298 N -0.98 2.24 -0.76 -0.41 2.85 -1.26 -1.63 118.16 118.21 3hr6 n LYS 298 Ca 0.37 0.79 0.00 0.00 -1.05 0.00 0.00 58.31 58.42 3hr6 n LYS 298 Cb 0.92 -2.42 0.00 0.00 -0.65 0.00 0.00 35.03 32.87 3hr6 n LYS 298 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3hr6 n ASP 299 N 1.12 -0.44 -4.86 -5.58 8.00 0.13 -4.97 116.55 109.95 3hr6 n ASP 299 Ca 0.06 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.26 3hr6 n ASP 299 Cb 0.36 -1.41 0.06 0.00 -0.02 0.00 0.00 41.12 40.11 3hr6 n ASP 299 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3hr6 s GLN 300 N -0.58 2.56 -0.13 -1.24 -0.21 -0.65 -4.74 119.66 114.68 3hr6 s GLN 300 Ca 0.00 0.49 -0.03 0.00 0.02 0.00 0.00 55.36 55.84 3hr6 s GLN 300 Cb 0.00 -1.99 -0.03 0.00 1.00 0.00 0.00 33.01 31.99 3hr6 s GLN 300 CO 0.00 -1.25 -0.00 -1.21 -2.12 0.00 0.00 175.29 170.71 3hr6 s GLU 301 N -5.31 3.38 -0.28 2.91 2.02 -1.26 -0.85 118.70 119.32 3hr6 s GLU 301 Ca 0.59 -0.43 -0.19 0.00 0.02 0.00 0.00 54.97 54.96 3hr6 s GLU 301 Cb -0.12 -2.91 -0.02 0.00 0.10 0.00 0.00 34.13 31.19 3hr6 s GLU 301 CO 0.52 0.48 0.57 -1.17 0.02 0.00 0.00 175.26 175.69 3hr6 s LEU 302 N -0.26 4.10 -0.18 1.80 2.96 0.45 -1.10 118.68 126.44 3hr6 s LEU 302 Ca 0.06 0.50 -0.00 0.00 -0.22 0.00 0.00 54.13 54.47 3hr6 s LEU 302 Cb -0.12 -2.75 0.01 0.00 0.50 0.00 0.00 46.19 43.83 3hr6 s LEU 302 CO 0.02 -0.37 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.84 3hr6 s VAL 303 N 2.45 2.53 -0.19 1.68 1.01 0.31 -1.07 120.40 127.11 3hr6 s VAL 303 Ca 0.23 -0.79 -0.06 0.00 0.00 0.00 0.00 61.98 61.37 3hr6 s VAL 303 Cb -0.15 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 3hr6 s VAL 303 CO 0.10 0.50 0.02 -0.69 0.00 0.00 0.00 175.10 175.03 3hr6 s VAL 304 N 1.23 4.22 0.05 2.92 1.01 -0.44 -1.23 120.40 128.15 3hr6 s VAL 304 Ca 0.03 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 61.86 3hr6 s VAL 304 Cb -0.14 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 3hr6 s VAL 304 CO -0.07 0.44 -0.22 -1.61 0.00 0.00 0.00 175.10 173.63 3hr6 s GLU 305 N 0.79 1.50 0.13 2.72 2.02 -0.22 -0.53 118.70 125.11 3hr6 s GLU 305 Ca 0.01 -1.00 -0.18 0.00 0.02 0.00 0.00 54.97 53.82 3hr6 s GLU 305 Cb -0.14 -1.64 0.04 0.00 0.10 0.00 0.00 34.13 32.49 3hr6 s GLU 305 CO 0.02 0.42 0.45 -0.59 0.02 0.00 0.00 175.26 175.58 3hr6 s PHE 306 N -0.82 -0.28 0.10 1.61 -0.12 -0.66 -0.87 117.98 116.94 3hr6 s PHE 306 Ca 0.09 0.01 0.07 0.00 -0.05 0.00 0.00 56.93 57.05 3hr6 s PHE 306 Cb -0.09 0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.58 3hr6 s PHE 306 CO 0.02 -0.72 -0.11 -1.21 -0.05 0.00 0.00 175.22 173.14 3hr6 s GLU 307 N -3.68 2.11 0.02 1.99 2.02 -1.26 -0.52 118.70 119.37 3hr6 s GLU 307 Ca 0.02 -1.02 -0.11 0.00 0.02 0.00 0.00 54.97 53.87 3hr6 s GLU 307 Cb 0.01 -2.29 0.01 0.00 0.10 0.00 0.00 34.13 31.97 3hr6 s GLU 307 CO -0.11 0.51 0.23 0.00 0.02 0.00 0.00 175.26 175.91 3hr6 s ALA 308 N -1.18 -0.52 0.15 5.21 0.00 -0.23 -2.27 121.76 122.93 3hr6 s ALA 308 Ca 0.20 -0.04 -0.30 0.00 0.00 0.00 0.00 51.96 51.82 3hr6 s ALA 308 Cb -0.11 0.19 -0.07 0.00 0.00 0.00 0.00 23.12 23.13 3hr6 s ALA 308 CO 0.12 -0.31 1.12 -1.25 0.00 0.00 0.00 175.76 175.45 3hr6 s PRO 309 N -1.96 4.56 -0.44 0.00 0.04 -1.26 -1.09 135.00 134.84 3hr6 s PRO 309 Ca -0.10 1.73 -0.26 0.00 0.04 0.00 0.00 61.00 62.41 3hr6 s PRO 309 Cb -0.04 -3.29 0.02 0.00 0.04 0.00 0.00 34.50 31.23 3hr6 s PRO 309 CO -0.00 0.00 0.98 0.08 0.04 0.00 0.00 177.00 178.10 3hr6 s VAL 310 N 0.05 4.44 -0.21 -0.36 1.01 0.39 -1.07 120.40 124.65 3hr6 s VAL 310 Ca 0.51 0.99 0.18 0.00 0.00 0.00 0.00 61.98 63.66 3hr6 s VAL 310 Cb -0.29 -4.45 -0.26 0.00 0.00 0.00 0.00 36.38 31.38 3hr6 s VAL 310 CO 0.34 -0.80 0.48 0.35 0.00 0.00 0.00 175.10 175.47 3hr6 n THR 311 N 6.40 0.00 -3.47 3.92 -2.24 0.37 -1.30 114.28 117.97 3hr6 n THR 311 Ca 0.08 -0.34 -0.13 0.00 -2.27 0.00 0.00 64.05 61.39 3hr6 n THR 311 Cb 0.48 0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.98 3hr6 n THR 311 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3hr6 s LYS 312 N -3.12 1.21 0.06 -0.78 -2.85 -1.20 -4.82 119.74 108.24 3hr6 s LYS 312 Ca -0.04 -0.37 -0.31 0.00 -1.00 0.00 0.00 55.97 54.26 3hr6 s LYS 312 Cb 0.12 0.55 -0.06 0.00 -2.06 0.00 0.00 37.83 36.39 3hr6 s LYS 312 CO 0.74 -0.50 1.21 -1.14 0.10 0.00 0.00 175.35 175.76 3hr6 s GLN 313 N -3.27 4.43 0.24 1.78 0.74 -1.26 -4.81 119.66 117.51 3hr6 s GLN 313 Ca -0.01 1.78 -0.31 0.00 0.05 0.00 0.00 55.36 56.87 3hr6 s GLN 313 Cb -0.01 -3.35 -0.11 0.00 1.10 0.00 0.00 33.01 30.64 3hr6 s GLN 313 CO -0.09 -0.27 1.62 -2.14 -0.55 0.00 0.00 175.29 173.86 3hr6 s PRO 314 N 1.09 4.15 0.51 1.67 0.02 -1.26 -4.86 135.00 136.31 3hr6 s PRO 314 Ca 0.59 2.53 0.19 0.00 0.02 0.00 0.00 61.00 64.33 3hr6 s PRO 314 Cb -0.30 -3.07 1.27 0.00 0.02 0.00 0.00 34.50 32.43 3hr6 s PRO 314 CO 0.29 -0.65 2.06 0.93 -0.33 0.00 0.00 177.00 179.30 3hr6 h GLU 315 N 5.75 0.08 -0.44 5.54 5.08 -1.93 -0.59 114.58 128.07 3hr6 h GLU 315 Ca -0.45 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 3hr6 h GLU 315 Cb 1.21 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3hr6 h GLU 315 CO 0.86 0.05 0.00 0.27 -1.00 0.00 0.00 179.01 179.19 3hr6 n ASN 316 N -4.46 4.20 0.00 1.42 6.94 -1.26 -4.65 115.26 117.45 3hr6 n ASN 316 Ca 0.04 -2.61 0.00 0.00 -0.02 0.00 0.00 54.58 51.99 3hr6 n ASN 316 Cb 0.35 -0.51 0.00 0.00 -2.36 0.00 0.00 39.78 37.26 3hr6 n ASN 316 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3hr6 n GLY 317 N 0.36 1.04 3.41 4.83 0.00 -0.23 -1.75 105.19 112.85 3hr6 n GLY 317 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 3hr6 n GLY 317 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hr6 s GLN 318 N -0.25 2.96 -0.54 1.61 -1.52 -1.26 -0.76 119.66 119.90 3hr6 s GLN 318 Ca 0.00 -0.99 -0.16 0.00 -1.95 0.00 0.00 55.36 52.25 3hr6 s GLN 318 Cb 0.00 -3.75 0.13 0.00 -0.22 0.00 0.00 33.01 29.16 3hr6 s GLN 318 CO 0.00 -0.65 0.51 -1.17 -0.25 0.00 0.00 175.29 173.72 3hr6 s LEU 319 N 1.59 6.15 -0.08 2.90 2.96 -0.28 -4.81 118.68 127.11 3hr6 s LEU 319 Ca 0.03 -1.77 0.04 0.00 -0.22 0.00 0.00 54.13 52.21 3hr6 s LEU 319 Cb -0.19 -2.21 -0.01 0.00 0.50 0.00 0.00 46.19 44.28 3hr6 s LEU 319 CO 0.07 -0.87 -0.20 -1.81 -1.32 0.00 0.00 176.35 172.23 3hr6 s ASP 320 N 3.59 3.49 0.00 3.68 1.11 -1.26 -0.50 116.67 126.79 3hr6 s ASP 320 Ca 0.03 -0.41 0.02 0.00 0.18 0.00 0.00 52.55 52.37 3hr6 s ASP 320 Cb -0.30 -1.10 -0.01 0.00 1.07 0.00 0.00 42.92 42.58 3hr6 s ASP 320 CO 0.03 0.23 -0.06 0.21 1.18 0.00 0.00 175.17 176.76 3hr6 s ASN 321 N -0.08 0.75 0.07 0.27 2.47 -0.12 -4.15 114.94 114.14 3hr6 s ASN 321 Ca -0.04 -0.19 0.02 0.00 0.42 0.00 0.00 52.86 53.06 3hr6 s ASN 321 Cb -0.14 -0.06 -0.03 0.00 -1.45 0.00 0.00 41.25 39.57 3hr6 s ASN 321 CO 0.04 0.03 -0.06 -1.10 -3.72 0.00 0.00 177.10 172.28 3hr6 s GLN 322 N -0.41 0.66 0.41 0.43 -0.21 -1.26 -1.69 119.66 117.58 3hr6 s GLN 322 Ca 0.00 -1.05 0.07 0.00 0.02 0.00 0.00 55.36 54.40 3hr6 s GLN 322 Cb -0.04 -0.18 -0.08 0.00 1.00 0.00 0.00 33.01 33.72 3hr6 s GLN 322 CO -0.00 -0.00 0.01 0.00 -2.12 0.00 0.00 175.29 173.18 3hr6 s ALA 323 N -2.65 3.18 0.01 6.09 0.00 -1.26 -4.16 121.76 122.96 3hr6 s ALA 323 Ca 0.01 -2.30 -0.00 0.00 0.00 0.00 0.00 51.96 49.67 3hr6 s ALA 323 Cb -0.01 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.24 3hr6 s ALA 323 CO -0.03 -0.12 -0.01 -1.58 0.00 0.00 0.00 175.76 174.03 3hr6 s TRP 324 N -2.70 0.10 -0.14 0.00 0.52 0.58 0.61 118.94 117.91 3hr6 s TRP 324 Ca 0.35 -0.20 -0.02 0.00 0.02 0.00 0.00 56.10 56.25 3hr6 s TRP 324 Cb 0.10 -0.07 -0.02 0.00 -1.15 0.00 0.00 33.47 32.32 3hr6 s TRP 324 CO 0.18 -0.08 -0.07 0.54 0.02 0.00 0.00 176.95 177.54 3hr6 s VAL 325 N -0.59 3.66 -0.10 4.03 0.11 -0.22 -0.94 120.40 126.34 3hr6 s VAL 325 Ca -0.07 -0.45 0.02 0.00 -2.93 0.00 0.00 61.98 58.56 3hr6 s VAL 325 Cb -0.04 -2.57 0.01 0.00 -1.53 0.00 0.00 36.38 32.25 3hr6 s VAL 325 CO -0.00 0.52 -0.17 -0.22 -3.33 0.00 0.00 175.10 171.89 3hr6 s LEU 326 N 0.17 1.83 -0.25 2.54 2.96 0.01 0.42 118.68 126.36 3hr6 s LEU 326 Ca -0.03 -0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 53.38 3hr6 s LEU 326 Cb -0.14 -1.14 -0.15 0.00 0.50 0.00 0.00 46.19 45.26 3hr6 s LEU 326 CO 0.03 0.06 3.30 -0.81 -1.32 0.00 0.00 176.35 177.62 3hr6 n PRO 327 N 3.92 2.26 -3.50 0.98 -0.04 -1.26 -0.55 135.00 136.82 3hr6 n PRO 327 Ca -0.20 -1.54 -0.13 0.00 -0.04 0.00 0.00 63.50 61.59 3hr6 n PRO 327 Cb 0.52 -2.10 -0.04 0.00 -0.04 0.00 0.00 33.50 31.84 3hr6 n PRO 327 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3hr6 s SER 328 N 1.45 -0.54 -0.63 3.54 0.15 -1.12 -3.68 113.70 112.87 3hr6 s SER 328 Ca 0.64 0.32 0.01 0.00 0.70 0.00 0.00 55.95 57.63 3hr6 s SER 328 Cb 0.33 0.49 0.16 0.00 -1.71 0.00 0.00 66.02 65.29 3hr6 s SER 328 CO -0.08 -0.68 0.42 0.20 1.20 0.00 0.00 173.24 174.30 3hr6 s ASN 329 N -1.88 4.91 0.49 5.45 0.01 -1.26 -3.65 114.94 119.00 3hr6 s ASN 329 Ca -0.03 -3.16 -0.23 0.00 -0.71 0.00 0.00 52.86 48.73 3hr6 s ASN 329 Cb -0.01 -1.75 -0.07 0.00 0.41 0.00 0.00 41.25 39.84 3hr6 s ASN 329 CO -0.02 -0.25 1.34 -2.84 -1.51 0.00 0.00 177.10 173.81 3hr6 s PRO 330 N -0.50 3.50 0.28 -0.60 0.02 -1.26 -4.91 135.00 131.53 3hr6 s PRO 330 Ca 0.19 2.20 0.14 0.00 0.02 0.00 0.00 61.00 63.55 3hr6 s PRO 330 Cb -0.19 -2.46 0.26 0.00 0.02 0.00 0.00 34.50 32.13 3hr6 s PRO 330 CO -0.05 -0.89 1.53 1.79 -0.33 0.00 0.00 177.00 179.05 3hr6 h THR 331 N 1.88 1.13 -2.82 0.99 1.35 -2.04 -3.45 112.91 109.95 3hr6 h THR 331 Ca -0.50 -2.22 -0.49 0.00 -0.55 0.00 0.00 66.41 62.64 3hr6 h THR 331 Cb 1.27 2.31 -0.00 0.00 -1.73 0.00 0.00 68.15 70.00 3hr6 h THR 331 CO 0.59 0.57 -0.24 0.00 -0.25 0.00 0.00 175.52 176.19 3hr6 s ALA 332 N -3.21 3.74 -0.27 6.62 0.00 -1.26 -5.02 121.76 122.36 3hr6 s ALA 332 Ca 0.01 -0.86 -0.29 0.00 0.00 0.00 0.00 51.96 50.82 3hr6 s ALA 332 Cb 0.10 -2.08 -0.01 0.00 0.00 0.00 0.00 23.12 21.13 3hr6 s ALA 332 CO 0.74 0.15 1.52 -0.65 0.00 0.00 0.00 175.76 177.53 3hr6 s GLN 333 N -3.93 3.77 -0.12 0.00 -0.21 -1.26 -4.94 119.66 112.98 3hr6 s GLN 333 Ca 0.40 1.46 -0.23 0.00 0.02 0.00 0.00 55.36 57.01 3hr6 s GLN 333 Cb -0.10 -4.00 -0.03 0.00 1.00 0.00 0.00 33.01 29.88 3hr6 s GLN 333 CO 0.33 -1.31 0.69 -0.46 -2.12 0.00 0.00 175.29 172.42 3hr6 s TRP 334 N 5.12 3.50 -0.45 0.91 -0.00 -1.26 -5.03 118.94 121.72 3hr6 s TRP 334 Ca 0.67 1.15 -0.18 0.00 -0.00 0.00 0.00 56.10 57.75 3hr6 s TRP 334 Cb -0.21 -2.83 0.04 0.00 -0.00 0.00 0.00 33.47 30.47 3hr6 s TRP 334 CO 0.28 -0.03 0.48 0.34 -0.00 0.00 0.00 176.95 178.03 3hr6 s ASP 335 N 0.95 6.20 0.36 5.86 -1.08 -1.26 -4.95 116.67 122.74 3hr6 s ASP 335 Ca 0.35 -0.82 0.26 0.00 -0.52 0.00 0.00 52.55 51.82 3hr6 s ASP 335 Cb -0.17 -2.24 1.23 0.00 -1.46 0.00 0.00 42.92 40.28 3hr6 s ASP 335 CO 0.15 -0.68 1.79 1.55 0.52 0.00 0.00 175.17 178.50 3hr6 h PRO 336 N 8.80 0.00 -0.63 4.34 0.13 -1.93 -2.05 132.00 140.65 3hr6 h PRO 336 Ca -0.27 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.50 3hr6 h PRO 336 Cb 1.11 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.02 3hr6 h PRO 336 CO 0.85 0.00 0.15 0.39 -0.23 0.00 0.00 178.00 179.16 3hr6 n GLU 337 N -2.44 2.21 -2.33 0.86 1.02 -1.26 -4.75 120.64 113.94 3hr6 n GLU 337 Ca 0.00 -3.26 -0.25 0.00 -0.02 0.00 0.00 57.16 53.64 3hr6 n GLU 337 Cb 0.16 -2.01 0.06 0.00 -0.02 0.00 0.00 31.44 29.63 3hr6 n GLU 337 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 3hr6 s GLU 338 N -3.37 2.39 0.00 3.49 2.12 -0.77 -5.09 118.70 117.46 3hr6 s GLU 338 Ca 0.51 -0.32 0.00 0.00 0.36 0.00 0.00 54.97 55.52 3hr6 s GLU 338 Cb 0.44 -2.25 0.00 0.00 0.26 0.00 0.00 34.13 32.58 3hr6 s GLU 338 CO 0.03 -1.04 0.00 -1.13 -0.54 0.00 0.00 175.26 172.58 3hr6 n SER 339 N -2.74 0.00 -3.73 -1.70 3.41 -1.26 -5.00 113.62 102.60 3hr6 n SER 339 Ca 0.07 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.50 3hr6 n SER 339 Cb 0.60 -0.08 0.12 0.00 -0.26 0.00 0.00 64.21 64.58 3hr6 n SER 339 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hr6 n GLY 340 N 3.20 -2.29 0.26 5.00 0.00 -1.26 -4.71 105.19 105.38 3hr6 n GLY 340 Ca 0.00 -0.62 0.09 0.00 0.00 0.00 0.00 46.02 45.49 3hr6 n GLY 340 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hr6 h ASP 341 N -2.36 0.00 0.11 1.61 5.19 -1.99 -2.22 116.42 116.76 3hr6 h ASP 341 Ca -0.25 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.16 3hr6 h ASP 341 Cb 0.76 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.27 3hr6 h ASP 341 CO 0.16 0.06 -0.10 0.00 -3.12 0.00 0.00 179.24 176.23 3hr6 n ALA 342 N -2.48 2.77 -1.94 3.45 0.00 -1.26 -4.87 120.51 116.19 3hr6 n ALA 342 Ca -0.03 -0.40 -0.42 0.00 0.00 0.00 0.00 53.44 52.59 3hr6 n ALA 342 Cb 0.14 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.38 3hr6 n ALA 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hr6 s ALA 343 N -2.22 3.69 0.00 0.00 0.00 -0.84 -4.87 121.76 117.53 3hr6 s ALA 343 Ca 0.33 1.32 -0.31 0.00 0.00 0.00 0.00 51.96 53.30 3hr6 s ALA 343 Cb 0.20 -3.58 -0.10 0.00 0.00 0.00 0.00 23.12 19.64 3hr6 s ALA 343 CO 0.41 -0.75 1.94 1.28 0.00 0.00 0.00 175.76 178.65 3hr6 n LEU 344 N 3.26 3.94 -4.58 0.00 4.77 -1.26 -4.35 117.00 118.78 3hr6 n LEU 344 Ca 0.11 0.93 -0.41 0.00 -0.03 0.00 0.00 56.01 56.60 3hr6 n LEU 344 Cb 0.40 -1.48 -0.07 0.00 -2.33 0.00 0.00 43.42 39.93 3hr6 n LEU 344 CO 0.61 0.12 0.27 -0.60 -1.33 0.00 0.00 177.39 176.46 3hr6 s ARG 345 N 4.24 3.76 0.70 3.23 6.06 -0.67 -4.98 118.95 131.30 3hr6 s ARG 345 Ca 0.90 0.03 -0.08 0.00 -2.50 0.00 0.00 55.73 54.07 3hr6 s ARG 345 Cb -0.52 -3.77 0.05 0.00 0.06 0.00 0.00 34.95 30.77 3hr6 s ARG 345 CO 0.45 -0.59 1.04 0.20 -2.50 0.00 0.00 175.30 173.90 3hr6 s GLY 346 N 1.71 1.64 -0.34 8.12 0.00 -1.26 -4.28 107.32 112.90 3hr6 s GLY 346 Ca 0.21 -0.71 -0.16 0.00 0.00 0.00 0.00 44.72 44.06 3hr6 s GLY 346 CO 0.13 -0.32 0.40 -0.29 0.00 0.00 0.00 173.10 173.01 3hr6 s MET 347 N -5.28 3.57 0.40 2.90 1.75 0.17 -4.23 119.30 118.57 3hr6 s MET 347 Ca 0.59 -0.36 -0.25 0.00 -1.25 0.00 0.00 55.69 54.42 3hr6 s MET 347 Cb -0.11 -3.81 -0.09 0.00 2.84 0.00 0.00 34.83 33.67 3hr6 s MET 347 CO 0.47 -0.56 1.13 -1.25 -0.65 0.00 0.00 175.02 174.16 3hr6 s PRO 348 N 2.11 4.09 1.00 4.11 0.04 -1.26 -1.05 135.00 144.03 3hr6 s PRO 348 Ca 0.13 1.74 -0.12 0.00 0.04 0.00 0.00 61.00 62.79 3hr6 s PRO 348 Cb -0.16 -2.64 0.19 0.00 0.04 0.00 0.00 34.50 31.92 3hr6 s PRO 348 CO 0.12 -0.26 1.09 -1.54 0.04 0.00 0.00 177.00 176.45 3hr6 s SER 349 N -1.26 2.63 0.69 6.66 1.04 0.20 -4.20 113.70 119.46 3hr6 s SER 349 Ca 0.57 1.20 -0.17 0.00 0.48 0.00 0.00 55.95 58.04 3hr6 s SER 349 Cb -0.28 -1.87 0.00 0.00 0.10 0.00 0.00 66.02 63.97 3hr6 s SER 349 CO 0.35 -3.13 1.11 -1.54 0.98 0.00 0.00 173.24 171.01 3hr6 n SER 350 N -4.18 1.13 -4.84 7.02 3.41 0.76 -4.78 113.62 112.16 3hr6 n SER 350 Ca 0.05 0.73 -0.34 0.00 -0.26 0.00 0.00 58.87 59.06 3hr6 n SER 350 Cb 0.57 -1.47 -0.06 0.00 -0.26 0.00 0.00 64.21 62.99 3hr6 n SER 350 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3hr6 s ARG 351 N -3.36 4.09 -0.10 4.33 0.52 -1.26 -4.26 118.95 118.90 3hr6 s ARG 351 Ca 0.77 0.73 0.04 0.00 -0.52 0.00 0.00 55.73 56.75 3hr6 s ARG 351 Cb -0.36 -2.60 0.00 0.00 0.52 0.00 0.00 34.95 32.52 3hr6 s ARG 351 CO 0.46 0.24 -0.23 0.08 0.02 0.00 0.00 175.30 175.87 3hr6 s VAL 352 N -1.82 2.03 -0.17 3.52 1.01 -0.68 -4.35 120.40 119.94 3hr6 s VAL 352 Ca 0.50 -1.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.46 3hr6 s VAL 352 Cb -0.12 -1.76 0.05 0.00 0.00 0.00 0.00 36.38 34.54 3hr6 s VAL 352 CO 0.19 0.55 0.01 -0.55 0.00 0.00 0.00 175.10 175.30 3hr6 s SER 353 N 0.41 2.76 -0.14 3.32 0.15 0.00 -0.95 113.70 119.25 3hr6 s SER 353 Ca -0.17 -0.70 -0.12 0.00 0.70 0.00 0.00 55.95 55.66 3hr6 s SER 353 Cb -0.18 -0.67 -0.05 0.00 -1.71 0.00 0.00 66.02 63.41 3hr6 s SER 353 CO 0.08 -0.26 0.24 -0.44 1.20 0.00 0.00 173.24 174.05 3hr6 s SER 354 N 1.80 6.42 -0.14 5.45 0.01 0.35 -0.54 113.70 127.05 3hr6 s SER 354 Ca -0.00 0.49 -0.06 0.00 1.31 0.00 0.00 55.95 57.69 3hr6 s SER 354 Cb -0.16 -2.14 -0.04 0.00 0.21 0.00 0.00 66.02 63.88 3hr6 s SER 354 CO -0.07 0.21 0.08 -0.54 0.41 0.00 0.00 173.24 173.32 3hr6 s LYS 355 N -0.06 3.58 0.22 12.44 -0.14 0.94 -1.13 119.74 135.60 3hr6 s LYS 355 Ca 0.15 -0.28 0.12 0.00 -1.36 0.00 0.00 55.97 54.59 3hr6 s LYS 355 Cb -0.13 -3.12 -0.05 0.00 -1.68 0.00 0.00 37.83 32.86 3hr6 s LYS 355 CO 0.04 0.54 -0.22 -0.06 -0.76 0.00 0.00 175.35 174.89 3hr6 s PHE 356 N -0.39 2.31 0.19 3.18 0.40 0.06 -0.40 117.98 123.33 3hr6 s PHE 356 Ca 0.10 -0.35 -0.03 0.00 -0.60 0.00 0.00 56.93 56.06 3hr6 s PHE 356 Cb -0.12 -1.09 -0.03 0.00 0.51 0.00 0.00 43.02 42.29 3hr6 s PHE 356 CO 0.02 0.58 0.16 0.20 0.70 0.00 0.00 175.22 176.87 3hr6 s GLY 357 N -2.98 1.20 -0.10 4.36 0.00 0.46 -2.16 107.32 108.11 3hr6 s GLY 357 Ca 0.24 -1.53 -0.06 0.00 0.00 0.00 0.00 44.72 43.37 3hr6 s GLY 357 CO 0.12 -1.28 0.24 1.62 0.00 0.00 0.00 173.10 173.80 3hr6 s GLN 358 N -4.11 0.23 -0.16 2.90 0.74 0.53 -2.08 119.66 117.71 3hr6 s GLN 358 Ca 0.33 0.47 -0.04 0.00 0.05 0.00 0.00 55.36 56.17 3hr6 s GLN 358 Cb 0.06 -0.04 -0.03 0.00 1.10 0.00 0.00 33.01 34.11 3hr6 s GLN 358 CO 0.09 -0.12 -0.04 0.42 -0.55 0.00 0.00 175.29 175.09 3hr6 s ILE 359 N 0.89 3.84 -0.20 -2.34 1.01 -0.12 -2.00 121.20 122.27 3hr6 s ILE 359 Ca -0.06 -0.37 -0.02 0.00 0.00 0.00 0.00 60.65 60.19 3hr6 s ILE 359 Cb -0.07 -2.69 -0.00 0.00 0.01 0.00 0.00 42.46 39.71 3hr6 s ILE 359 CO -0.06 0.49 -0.09 -0.89 0.00 0.00 0.00 174.94 174.39 3hr6 s THR 360 N 0.47 3.07 -0.13 2.92 2.01 0.01 -0.52 115.64 123.47 3hr6 s THR 360 Ca -0.04 -0.61 -0.16 0.00 0.31 0.00 0.00 61.69 61.20 3hr6 s THR 360 Cb -0.14 -2.36 -0.04 0.00 0.01 0.00 0.00 72.50 69.96 3hr6 s THR 360 CO 0.03 0.46 0.40 -0.63 -0.69 0.00 0.00 174.62 174.19 3hr6 s ILE 361 N 1.24 5.23 -0.36 1.82 1.01 0.95 0.11 121.20 131.20 3hr6 s ILE 361 Ca 0.03 0.78 0.00 0.00 0.00 0.00 0.00 60.65 61.46 3hr6 s ILE 361 Cb -0.14 -3.74 0.10 0.00 0.01 0.00 0.00 42.46 38.69 3hr6 s ILE 361 CO -0.04 0.37 0.11 -1.61 0.00 0.00 0.00 174.94 173.77 3hr6 s GLU 362 N 0.46 1.84 -0.10 2.79 2.02 0.21 -1.70 118.70 124.23 3hr6 s GLU 362 Ca 0.22 -1.77 -0.10 0.00 0.02 0.00 0.00 54.97 53.34 3hr6 s GLU 362 Cb -0.14 -3.36 -0.05 0.00 0.10 0.00 0.00 34.13 30.68 3hr6 s GLU 362 CO 0.08 -0.95 0.23 0.21 0.02 0.00 0.00 175.26 174.85 3hr6 s LYS 363 N 1.05 3.72 0.18 1.61 2.47 0.81 -0.93 119.74 128.65 3hr6 s LYS 363 Ca 0.07 0.05 0.04 0.00 -1.56 0.00 0.00 55.97 54.57 3hr6 s LYS 363 Cb -0.21 -3.24 -0.05 0.00 -1.46 0.00 0.00 37.83 32.87 3hr6 s LYS 363 CO -0.05 0.66 -0.07 -1.54 0.16 0.00 0.00 175.35 174.50 3hr6 s SER 364 N -0.77 1.87 -0.19 1.43 1.04 0.79 -4.35 113.70 113.52 3hr6 s SER 364 Ca 0.17 -1.08 0.01 0.00 0.48 0.00 0.00 55.95 55.52 3hr6 s SER 364 Cb -0.13 -0.01 0.04 0.00 0.10 0.00 0.00 66.02 66.01 3hr6 s SER 364 CO 0.06 -0.38 -0.10 -0.36 0.98 0.00 0.00 173.24 173.45 3hr6 s PHE 365 N -3.33 2.28 -1.21 5.02 0.08 -0.25 0.13 117.98 120.70 3hr6 s PHE 365 Ca 0.21 -1.48 -0.03 0.00 0.12 0.00 0.00 56.93 55.76 3hr6 s PHE 365 Cb 0.03 -1.58 0.00 0.00 -0.57 0.00 0.00 43.02 40.91 3hr6 s PHE 365 CO 0.04 -0.72 0.05 -0.25 -0.10 0.00 0.00 175.22 174.24 3hr6 n ASP 366 N 4.72 0.41 0.00 1.36 8.00 0.10 -0.93 116.55 130.22 3hr6 n ASP 366 Ca -0.14 -1.02 0.00 0.00 0.71 0.00 0.00 54.79 54.34 3hr6 n ASP 366 Cb 0.47 -1.27 0.00 0.00 -0.02 0.00 0.00 41.12 40.30 3hr6 n ASP 366 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hr6 n GLY 367 N -2.23 1.49 3.74 0.44 0.00 -1.26 -5.02 105.19 102.34 3hr6 n GLY 367 Ca -0.25 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.49 3hr6 n GLY 367 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hr6 s ASN 368 N -3.18 5.24 0.22 1.61 -0.87 -0.10 -5.03 114.94 112.84 3hr6 s ASN 368 Ca 0.00 -0.16 -0.31 0.00 -1.57 0.00 0.00 52.86 50.82 3hr6 s ASN 368 Cb 0.00 -1.30 -0.15 0.00 -0.02 0.00 0.00 41.25 39.78 3hr6 s ASN 368 CO 0.00 0.13 1.21 0.41 -2.57 0.00 0.00 177.10 176.27 3hr6 n THR 369 N 0.14 1.19 -0.22 1.60 -1.04 -1.26 -1.09 114.28 113.60 3hr6 n THR 369 Ca -0.09 -0.30 -0.08 0.00 -2.04 0.00 0.00 64.05 61.54 3hr6 n THR 369 Cb 0.53 -1.09 0.03 0.00 -1.82 0.00 0.00 70.33 67.98 3hr6 n THR 369 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 3hr6 h PRO 370 N 3.29 0.97 0.00 -2.82 0.11 -1.76 -3.44 132.00 128.35 3hr6 h PRO 370 Ca -0.43 -0.24 0.00 0.00 0.11 0.00 0.00 66.00 65.44 3hr6 h PRO 370 Cb 1.32 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3hr6 h PRO 370 CO 0.69 0.90 0.00 0.41 -0.21 0.00 0.00 178.00 179.79 3hr6 n GLY 371 N -0.63 -0.55 0.17 -0.55 0.00 0.01 -4.12 105.19 99.52 3hr6 n GLY 371 Ca 0.03 -1.11 0.04 0.00 0.00 0.00 0.00 46.02 44.98 3hr6 n GLY 371 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hr6 h ALA 372 N -0.45 0.88 -0.26 4.61 0.00 -1.93 -3.27 119.26 118.85 3hr6 h ALA 372 Ca 0.00 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3hr6 h ALA 372 Cb 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3hr6 h ALA 372 CO 0.00 0.56 -0.00 -0.40 0.00 0.00 0.00 179.25 179.40 3hr6 n ASP 373 N -3.45 3.65 -3.69 0.00 5.75 -1.26 -4.94 116.55 112.61 3hr6 n ASP 373 Ca 0.00 -3.11 -0.20 0.00 -0.01 0.00 0.00 54.79 51.48 3hr6 n ASP 373 Cb 0.59 -0.55 -0.18 0.00 -1.03 0.00 0.00 41.12 39.95 3hr6 n ASP 373 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3hr6 s ARG 374 N -2.88 -0.04 0.02 0.11 0.52 -1.23 -4.76 118.95 110.69 3hr6 s ARG 374 Ca 0.42 0.35 0.00 0.00 -0.52 0.00 0.00 55.73 55.98 3hr6 s ARG 374 Cb 0.35 -0.51 -0.02 0.00 0.52 0.00 0.00 34.95 35.29 3hr6 s ARG 374 CO 0.08 -0.31 -0.03 0.95 0.02 0.00 0.00 175.30 176.01 3hr6 s THR 375 N 2.05 0.10 0.18 0.02 -4.23 -1.26 -4.56 115.64 107.94 3hr6 s THR 375 Ca 0.04 -0.85 0.07 0.00 -1.18 0.00 0.00 61.69 59.77 3hr6 s THR 375 Cb -0.12 -0.24 -0.04 0.00 1.34 0.00 0.00 72.50 73.43 3hr6 s THR 375 CO -0.03 -0.47 -0.15 0.00 -0.54 0.00 0.00 174.62 173.43 3hr6 s ALA 376 N -1.36 1.90 -0.04 3.99 0.00 -1.26 -2.81 121.76 122.18 3hr6 s ALA 376 Ca -0.15 -1.56 0.05 0.00 0.00 0.00 0.00 51.96 50.31 3hr6 s ALA 376 Cb -0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 22.92 3hr6 s ALA 376 CO -0.01 0.10 -0.19 0.99 0.00 0.00 0.00 175.76 176.65 3hr6 s THR 377 N -2.67 1.54 0.07 0.00 2.01 -0.44 -0.92 115.64 115.22 3hr6 s THR 377 Ca 0.19 -0.80 0.06 0.00 0.31 0.00 0.00 61.69 61.45 3hr6 s THR 377 Cb -0.02 -1.30 -0.03 0.00 0.01 0.00 0.00 72.50 71.16 3hr6 s THR 377 CO 0.06 0.44 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.91 3hr6 s PHE 378 N -0.15 1.33 0.09 4.92 0.08 0.06 -0.34 117.98 123.97 3hr6 s PHE 378 Ca 0.00 -0.42 0.09 0.00 0.12 0.00 0.00 56.93 56.72 3hr6 s PHE 378 Cb -0.10 -0.76 -0.04 0.00 -0.57 0.00 0.00 43.02 41.55 3hr6 s PHE 378 CO 0.01 0.08 -0.20 -0.65 -0.10 0.00 0.00 175.22 174.36 3hr6 s GLN 379 N -1.57 1.83 -0.09 0.44 -0.21 -0.07 -0.46 119.66 119.52 3hr6 s GLN 379 Ca 0.01 -1.13 -0.13 0.00 0.02 0.00 0.00 55.36 54.13 3hr6 s GLN 379 Cb -0.09 -2.10 -0.05 0.00 1.00 0.00 0.00 33.01 31.77 3hr6 s GLN 379 CO 0.02 0.50 0.32 -1.17 -2.12 0.00 0.00 175.29 172.84 3hr6 s LEU 380 N -1.81 4.36 0.26 2.90 2.96 -1.26 -0.78 118.68 125.32 3hr6 s LEU 380 Ca 0.16 0.69 0.01 0.00 -0.22 0.00 0.00 54.13 54.77 3hr6 s LEU 380 Cb -0.10 -2.41 -0.03 0.00 0.50 0.00 0.00 46.19 44.14 3hr6 s LEU 380 CO 0.07 0.24 0.23 -1.00 -1.32 0.00 0.00 176.35 174.58 3hr6 s HIS 381 N -0.42 1.34 -0.04 5.38 3.76 0.08 -0.35 115.29 125.05 3hr6 s HIS 381 Ca 0.19 -1.45 0.02 0.00 -0.15 0.00 0.00 55.06 53.68 3hr6 s HIS 381 Cb -0.14 -0.54 -0.03 0.00 1.11 0.00 0.00 32.58 32.97 3hr6 s HIS 381 CO 0.08 -0.79 -0.07 1.03 -0.85 0.00 0.00 174.74 174.15 3hr6 s ARG 382 N -3.80 2.66 0.14 1.40 1.81 -1.26 -0.66 118.95 119.24 3hr6 s ARG 382 Ca 0.38 -0.63 0.08 0.00 -1.72 0.00 0.00 55.73 53.85 3hr6 s ARG 382 Cb 0.04 -2.55 -0.04 0.00 -0.45 0.00 0.00 34.95 31.95 3hr6 s ARG 382 CO 0.18 0.64 -0.19 0.00 -0.68 0.00 0.00 175.30 175.25 3hr6 s GLU 384 N -2.44 1.79 0.48 0.00 0.41 0.68 -0.34 118.70 119.28 3hr6 s GLU 384 Ca 0.12 -0.04 0.23 0.00 -0.41 0.00 0.00 54.97 54.87 3hr6 s GLU 384 Cb -0.07 -1.97 1.26 0.00 -1.78 0.00 0.00 34.13 31.57 3hr6 s GLU 384 CO 0.06 -1.67 1.90 0.00 -0.49 0.00 0.00 175.26 175.06 3hr6 h ALA 385 N -1.08 2.45 -0.00 5.21 0.00 -1.95 -0.10 119.26 123.79 3hr6 h ALA 385 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3hr6 h ALA 385 Cb 1.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3hr6 h ALA 385 CO 0.61 -0.69 0.00 -0.40 0.00 0.00 0.00 179.25 178.76 3hr6 n ASP 386 N -4.41 0.03 0.00 0.00 5.68 -1.26 -4.89 116.55 111.70 3hr6 n ASP 386 Ca 0.17 -1.13 0.00 0.00 -0.50 0.00 0.00 54.79 53.33 3hr6 n ASP 386 Cb 0.74 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.72 3hr6 n ASP 386 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hr6 n GLY 387 N 0.94 1.14 3.82 6.12 0.00 -0.05 -5.05 105.19 112.11 3hr6 n GLY 387 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 3hr6 n GLY 387 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hr6 s SER 388 N -2.92 6.60 0.35 1.61 1.04 -1.26 -4.53 113.70 114.59 3hr6 s SER 388 Ca 0.00 1.69 -0.29 0.00 0.48 0.00 0.00 55.95 57.84 3hr6 s SER 388 Cb 0.00 -2.53 -0.11 0.00 0.10 0.00 0.00 66.02 63.48 3hr6 s SER 388 CO 0.00 -0.60 1.48 -0.76 0.98 0.00 0.00 173.24 174.34 3hr6 s LEU 389 N -3.71 4.34 0.34 2.42 1.43 -1.26 -0.23 118.68 122.01 3hr6 s LEU 389 Ca 0.62 2.98 -0.27 0.00 -1.03 0.00 0.00 54.13 56.43 3hr6 s LEU 389 Cb -0.11 -3.66 -0.13 0.00 0.03 0.00 0.00 46.19 42.32 3hr6 s LEU 389 CO 0.24 -0.83 1.10 0.52 0.23 0.00 0.00 176.35 177.60 3hr6 n VAL 390 N 0.85 2.11 -1.64 -1.59 0.31 -0.70 -4.65 118.33 113.02 3hr6 n VAL 390 Ca 0.02 -0.50 -0.47 0.00 -0.01 0.00 0.00 64.34 63.38 3hr6 n VAL 390 Cb 0.39 -1.22 -0.04 0.00 -0.91 0.00 0.00 33.84 32.06 3hr6 n VAL 390 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3hr6 n LYS 391 N 0.52 1.79 -2.19 5.55 4.81 -1.26 -1.84 118.16 125.54 3hr6 n LYS 391 Ca 0.08 0.64 -0.17 0.00 -0.87 0.00 0.00 58.31 57.99 3hr6 n LYS 391 Cb 0.35 -2.33 -0.02 0.00 0.02 0.00 0.00 35.03 33.04 3hr6 n LYS 391 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 3hr6 n SER 392 N 2.82 -4.90 -4.67 3.14 7.64 -1.26 -4.90 113.62 111.49 3hr6 n SER 392 Ca 0.16 0.16 -0.42 0.00 1.01 0.00 0.00 58.87 59.78 3hr6 n SER 392 Cb 0.26 -4.18 -0.03 0.00 -1.01 0.00 0.00 64.21 59.26 3hr6 n SER 392 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3hr6 s ASP 393 N -2.14 6.77 0.49 6.43 2.15 -0.77 -5.00 116.67 124.60 3hr6 s ASP 393 Ca 0.00 2.09 -0.11 0.00 0.43 0.00 0.00 52.55 54.96 3hr6 s ASP 393 Cb 0.00 -2.54 -0.06 0.00 -0.30 0.00 0.00 42.92 40.02 3hr6 s ASP 393 CO 0.00 -0.84 0.88 -2.16 -0.17 0.00 0.00 175.17 172.88 3hr6 s PRO 394 N 3.49 3.75 0.50 4.34 0.04 -1.26 -4.98 135.00 140.88 3hr6 s PRO 394 Ca 0.67 0.61 -0.23 0.00 0.04 0.00 0.00 61.00 62.09 3hr6 s PRO 394 Cb -0.30 -2.26 -0.06 0.00 0.04 0.00 0.00 34.50 31.91 3hr6 s PRO 394 CO 0.25 -0.23 1.39 -2.14 0.04 0.00 0.00 177.00 176.31 3hr6 s PRO 395 N -4.32 3.40 -0.01 0.56 0.02 -1.26 -4.73 135.00 128.67 3hr6 s PRO 395 Ca 0.53 2.32 -0.24 0.00 0.02 0.00 0.00 61.00 63.63 3hr6 s PRO 395 Cb -0.10 -2.44 -0.05 0.00 0.02 0.00 0.00 34.50 31.93 3hr6 s PRO 395 CO 0.38 -1.01 0.74 0.42 -0.33 0.00 0.00 177.00 177.20 3hr6 s ILE 396 N -1.26 4.88 -0.14 2.83 1.01 0.53 -5.00 121.20 124.05 3hr6 s ILE 396 Ca 0.67 1.56 -0.12 0.00 0.00 0.00 0.00 60.65 62.76 3hr6 s ILE 396 Cb -0.42 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 37.92 3hr6 s ILE 396 CO 0.52 0.31 0.24 -0.55 0.00 0.00 0.00 174.94 175.46 3hr6 s SER 397 N 0.34 6.43 -0.10 3.58 0.15 -1.26 -4.54 113.70 118.31 3hr6 s SER 397 Ca 0.39 0.51 -0.01 0.00 0.70 0.00 0.00 55.95 57.54 3hr6 s SER 397 Cb -0.19 -2.15 0.03 0.00 -1.71 0.00 0.00 66.02 61.99 3hr6 s SER 397 CO 0.21 0.21 -0.05 -0.76 1.20 0.00 0.00 173.24 174.05 3hr6 s LEU 398 N -0.09 1.02 -1.53 3.45 1.43 0.14 -4.79 118.68 118.31 3hr6 s LEU 398 Ca 0.15 -0.23 -0.06 0.00 -1.03 0.00 0.00 54.13 52.96 3hr6 s LEU 398 Cb -0.13 -0.70 0.06 0.00 0.03 0.00 0.00 46.19 45.45 3hr6 s LEU 398 CO 0.04 -0.13 0.48 -0.67 0.23 0.00 0.00 176.35 176.30 3hr6 n ASP 399 N 4.93 -1.14 -0.15 2.29 2.03 0.38 -1.37 116.55 123.52 3hr6 n ASP 399 Ca -0.12 -1.05 -0.02 0.00 0.52 0.00 0.00 54.79 54.12 3hr6 n ASP 399 Cb 0.50 -2.74 -0.01 0.00 -0.72 0.00 0.00 41.12 38.16 3hr6 n ASP 399 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hr6 n GLY 400 N -1.86 0.45 3.52 0.27 0.00 -1.26 -4.96 105.19 101.36 3hr6 n GLY 400 Ca -0.18 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 3hr6 n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hr6 s LYS 401 N -1.30 2.60 -0.02 1.61 -0.14 -0.47 -5.00 119.74 117.02 3hr6 s LYS 401 Ca 0.00 -0.63 0.03 0.00 -1.36 0.00 0.00 55.97 54.00 3hr6 s LYS 401 Cb 0.00 -2.47 0.04 0.00 -1.68 0.00 0.00 37.83 33.73 3hr6 s LYS 401 CO 0.00 0.64 0.93 0.00 -0.76 0.00 0.00 175.35 176.16 3hr6 n GLN 402 N 2.25 2.04 -3.89 1.68 10.64 -1.26 -0.69 117.38 128.15 3hr6 n GLN 402 Ca -0.17 -1.46 -0.09 0.00 -1.83 0.00 0.00 57.00 53.45 3hr6 n GLN 402 Cb 0.52 -0.96 -0.08 0.00 -0.86 0.00 0.00 30.24 28.87 3hr6 n GLN 402 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.06 173.40 3hr6 s GLU 403 N -1.06 0.83 -0.05 2.61 -1.05 -1.26 -4.64 118.70 114.08 3hr6 s GLU 403 Ca 0.05 -1.00 -0.01 0.00 -0.15 0.00 0.00 54.97 53.85 3hr6 s GLU 403 Cb 0.04 0.33 0.03 0.00 -0.44 0.00 0.00 34.13 34.09 3hr6 s GLU 403 CO 0.00 -0.26 0.02 -0.06 0.95 0.00 0.00 175.26 175.92 3hr6 s PHE 404 N -3.87 0.42 -0.16 4.83 0.08 0.39 -4.97 117.98 114.70 3hr6 s PHE 404 Ca 0.06 -0.01 -0.05 0.00 0.12 0.00 0.00 56.93 57.05 3hr6 s PHE 404 Cb 0.05 -0.64 -0.03 0.00 -0.57 0.00 0.00 43.02 41.83 3hr6 s PHE 404 CO -0.10 -0.25 0.02 0.08 -0.10 0.00 0.00 175.22 174.86 3hr6 s VAL 405 N 1.87 4.38 0.39 -0.44 1.01 -1.26 -0.76 120.40 125.59 3hr6 s VAL 405 Ca 0.02 -0.19 -0.26 0.00 0.00 0.00 0.00 61.98 61.56 3hr6 s VAL 405 Cb -0.12 -2.94 -0.09 0.00 0.00 0.00 0.00 36.38 33.23 3hr6 s VAL 405 CO -0.04 0.49 1.19 0.42 0.00 0.00 0.00 175.10 177.17 3hr6 s THR 406 N 0.20 3.07 0.79 3.92 -4.23 -0.10 -4.66 115.64 114.63 3hr6 s THR 406 Ca 0.01 0.93 -0.04 0.00 -1.18 0.00 0.00 61.69 61.41 3hr6 s THR 406 Cb -0.13 -3.53 0.16 0.00 1.34 0.00 0.00 72.50 70.34 3hr6 s THR 406 CO 0.02 0.10 1.08 -0.83 -0.54 0.00 0.00 174.62 174.45 3hr6 s GLY 407 N -1.04 1.76 0.50 3.99 0.00 -0.57 -4.56 107.32 107.39 3hr6 s GLY 407 Ca 0.56 -1.74 0.17 0.00 0.00 0.00 0.00 44.72 43.71 3hr6 s GLY 407 CO 0.41 -1.08 2.08 1.46 0.00 0.00 0.00 173.10 175.96 3hr6 h GLN 408 N -0.81 0.13 -0.04 2.90 4.20 -1.88 0.47 115.11 120.07 3hr6 h GLN 408 Ca -0.37 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.34 3hr6 h GLN 408 Cb 1.25 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.00 3hr6 h GLN 408 CO 0.37 0.09 0.00 -0.40 -0.67 0.00 0.00 178.83 178.21 3hr6 n ASP 409 N -4.49 0.52 0.00 1.46 5.75 -1.26 -0.81 116.55 117.72 3hr6 n ASP 409 Ca 0.02 -1.45 0.00 0.00 -0.01 0.00 0.00 54.79 53.35 3hr6 n ASP 409 Cb 0.24 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.30 3hr6 n ASP 409 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hr6 n GLY 410 N 0.92 1.46 3.82 6.12 0.00 0.16 -4.76 105.19 112.90 3hr6 n GLY 410 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 3hr6 n GLY 410 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hr6 s LYS 411 N -0.25 4.18 -0.03 1.61 -0.14 -1.26 -0.13 119.74 123.72 3hr6 s LYS 411 Ca 0.00 0.73 -0.00 0.00 -1.36 0.00 0.00 55.97 55.34 3hr6 s LYS 411 Cb 0.00 -3.10 0.03 0.00 -1.68 0.00 0.00 37.83 33.08 3hr6 s LYS 411 CO 0.00 0.55 0.02 0.00 -0.76 0.00 0.00 175.35 175.16 3hr6 s ALA 412 N -1.28 0.27 -0.21 5.17 0.00 -0.69 -1.52 121.76 123.51 3hr6 s ALA 412 Ca 0.34 0.18 -0.05 0.00 0.00 0.00 0.00 51.96 52.43 3hr6 s ALA 412 Cb -0.18 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.51 3hr6 s ALA 412 CO 0.20 -0.21 -0.00 0.08 0.00 0.00 0.00 175.76 175.83 3hr6 s VAL 413 N 1.38 3.85 -0.55 0.00 1.01 -1.26 -0.03 120.40 124.79 3hr6 s VAL 413 Ca -0.05 -0.34 -0.07 0.00 0.00 0.00 0.00 61.98 61.52 3hr6 s VAL 413 Cb -0.13 -2.75 0.14 0.00 0.00 0.00 0.00 36.38 33.64 3hr6 s VAL 413 CO -0.03 0.42 0.41 -0.76 0.00 0.00 0.00 175.10 175.14 3hr6 s LEU 414 N 1.18 5.66 0.28 3.92 1.02 0.32 -4.99 118.68 126.07 3hr6 s LEU 414 Ca 0.03 -2.29 0.07 0.00 0.02 0.00 0.00 54.13 51.96 3hr6 s LEU 414 Cb -0.14 -1.97 -0.03 0.00 0.02 0.00 0.00 46.19 44.06 3hr6 s LEU 414 CO 0.01 -0.57 0.20 -0.94 0.02 0.00 0.00 176.35 175.07 3hr6 s SER 415 N 1.96 5.32 -0.52 2.29 1.04 -1.26 -0.95 113.70 121.58 3hr6 s SER 415 Ca 0.11 -0.38 -0.00 0.00 0.48 0.00 0.00 55.95 56.15 3hr6 s SER 415 Cb -0.22 -1.20 0.00 0.00 0.10 0.00 0.00 66.02 64.70 3hr6 s SER 415 CO -0.03 -0.13 0.04 0.61 0.98 0.00 0.00 173.24 174.71 3hr6 n GLY 416 N -1.20 0.16 3.62 7.32 0.00 -1.19 -4.78 105.19 109.11 3hr6 n GLY 416 Ca -0.06 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 44.93 3hr6 n GLY 416 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hr6 s ILE 417 N -2.40 4.37 -0.28 -0.61 1.01 -0.89 -1.01 121.20 121.40 3hr6 s ILE 417 Ca 0.02 1.47 -0.29 0.00 0.00 0.00 0.00 60.65 61.85 3hr6 s ILE 417 Cb -0.01 -4.50 0.01 0.00 0.01 0.00 0.00 42.46 37.97 3hr6 s ILE 417 CO 0.02 -0.74 1.07 -2.28 0.00 0.00 0.00 174.94 173.02 3hr6 s HIS 418 N 4.03 3.22 -0.11 3.97 5.65 -1.26 -0.40 115.29 130.38 3hr6 s HIS 418 Ca 0.46 1.30 0.04 0.00 0.25 0.00 0.00 55.06 57.12 3hr6 s HIS 418 Cb -0.10 -3.52 -0.24 0.00 -1.18 0.00 0.00 32.58 27.54 3hr6 s HIS 418 CO 0.23 -0.68 0.41 1.28 -0.65 0.00 0.00 174.74 175.34 3hr6 n LEU 419 N 6.65 1.72 0.00 8.88 4.77 0.47 -4.76 117.00 134.73 3hr6 n LEU 419 Ca 0.12 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 3hr6 n LEU 419 Cb 0.47 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3hr6 n LEU 419 CO 0.56 0.64 0.00 0.61 -1.33 0.00 0.00 177.39 177.87 3hr6 n GLY 420 N 1.82 -1.77 2.91 -0.72 0.00 -1.21 -1.19 105.19 105.01 3hr6 n GLY 420 Ca -0.27 -1.11 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 3hr6 n GLY 420 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hr6 s THR 421 N -2.26 -0.02 -0.25 2.61 2.01 -0.16 -0.04 115.64 117.53 3hr6 s THR 421 Ca 0.00 0.06 -0.08 0.00 0.31 0.00 0.00 61.69 61.98 3hr6 s THR 421 Cb 0.00 -0.11 -0.03 0.00 0.01 0.00 0.00 72.50 72.37 3hr6 s THR 421 CO 0.00 0.02 0.09 -0.22 -0.69 0.00 0.00 174.62 173.82 3hr6 s LEU 422 N 0.33 3.57 0.27 4.42 2.96 0.30 -0.63 118.68 129.90 3hr6 s LEU 422 Ca -0.02 -0.15 -0.16 0.00 -0.22 0.00 0.00 54.13 53.57 3hr6 s LEU 422 Cb -0.04 -1.96 0.01 0.00 0.50 0.00 0.00 46.19 44.70 3hr6 s LEU 422 CO -0.01 -0.02 0.60 0.00 -1.32 0.00 0.00 176.35 175.59 3hr6 s GLN 423 N 1.56 1.69 0.10 1.98 -2.07 -0.66 -0.82 119.66 121.44 3hr6 s GLN 423 Ca 0.06 -1.16 -0.30 0.00 -1.82 0.00 0.00 55.36 52.14 3hr6 s GLN 423 Cb -0.15 0.54 -0.06 0.00 -1.09 0.00 0.00 33.01 32.25 3hr6 s GLN 423 CO 0.05 -0.74 1.09 -1.17 -1.32 0.00 0.00 175.29 173.20 3hr6 s LEU 424 N -2.98 4.43 -0.04 2.60 2.96 -1.26 -0.57 118.68 123.82 3hr6 s LEU 424 Ca 0.17 1.95 -0.02 0.00 -0.22 0.00 0.00 54.13 56.02 3hr6 s LEU 424 Cb -0.03 -3.59 0.03 0.00 0.50 0.00 0.00 46.19 43.10 3hr6 s LEU 424 CO 0.09 -0.29 0.05 -1.61 -1.32 0.00 0.00 176.35 173.26 3hr6 s GLU 425 N 0.39 -0.05 -1.43 1.98 2.02 0.75 -4.82 118.70 117.54 3hr6 s GLU 425 Ca 0.53 0.33 -0.02 0.00 0.02 0.00 0.00 54.97 55.83 3hr6 s GLU 425 Cb -0.27 -0.48 0.02 0.00 0.10 0.00 0.00 34.13 33.50 3hr6 s GLU 425 CO 0.31 -0.30 0.47 0.43 0.02 0.00 0.00 175.26 176.19 3hr6 n SER 426 N 5.08 -0.68 -0.81 -0.19 7.64 -1.26 -1.16 113.62 122.24 3hr6 n SER 426 Ca -0.08 -1.00 -0.11 0.00 1.01 0.00 0.00 58.87 58.70 3hr6 n SER 426 Cb 0.50 -3.08 -0.05 0.00 -1.01 0.00 0.00 64.21 60.57 3hr6 n SER 426 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3hr6 n ASN 427 N -2.96 -5.76 -4.20 6.43 5.15 -1.26 -4.96 115.26 107.70 3hr6 n ASN 427 Ca -0.27 0.26 -0.30 0.00 -0.60 0.00 0.00 54.58 53.67 3hr6 n ASN 427 Cb 0.67 -4.19 -0.17 0.00 -0.53 0.00 0.00 39.78 35.56 3hr6 n ASN 427 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3hr6 s VAL 428 N -1.89 1.80 0.03 3.44 0.11 -0.31 -5.08 120.40 118.50 3hr6 s VAL 428 Ca 0.00 -0.91 -0.30 0.00 -2.93 0.00 0.00 61.98 57.84 3hr6 s VAL 428 Cb 0.00 -1.55 -0.06 0.00 -1.53 0.00 0.00 36.38 33.24 3hr6 s VAL 428 CO 0.00 0.51 1.45 -0.04 -3.33 0.00 0.00 175.10 173.69 3hr6 s MET 429 N 0.10 4.27 -0.02 1.54 -1.94 -1.26 -0.18 119.30 121.81 3hr6 s MET 429 Ca -0.09 2.06 0.03 0.00 -1.71 0.00 0.00 55.69 55.97 3hr6 s MET 429 Cb -0.15 -3.54 -0.00 0.00 2.01 0.00 0.00 34.83 33.15 3hr6 s MET 429 CO 0.05 -0.59 -0.09 0.15 -0.01 0.00 0.00 175.02 174.52 3hr6 s LYS 430 N 2.30 0.87 -0.14 2.03 -0.14 0.27 -4.94 119.74 119.98 3hr6 s LYS 430 Ca 0.66 -0.31 -0.14 0.00 -1.36 0.00 0.00 55.97 54.82 3hr6 s LYS 430 Cb -0.34 -0.82 -0.05 0.00 -1.68 0.00 0.00 37.83 34.94 3hr6 s LYS 430 CO 0.28 0.15 0.30 -0.47 -0.76 0.00 0.00 175.35 174.84 3hr6 s TYR 431 N 0.04 3.49 -0.12 3.18 5.04 -1.26 -1.66 117.35 126.06 3hr6 s TYR 431 Ca -0.00 0.63 0.02 0.00 -2.44 0.00 0.00 57.07 55.28 3hr6 s TYR 431 Cb -0.07 -2.32 -0.00 0.00 0.35 0.00 0.00 41.96 39.92 3hr6 s TYR 431 CO 0.00 0.29 -0.19 0.99 -1.34 0.00 0.00 175.55 175.30 3hr6 s THR 432 N 0.27 2.46 -0.26 4.34 2.01 0.19 -4.96 115.64 119.69 3hr6 s THR 432 Ca 0.17 -0.87 -0.29 0.00 0.31 0.00 0.00 61.69 61.01 3hr6 s THR 432 Cb -0.13 -1.99 -0.00 0.00 0.01 0.00 0.00 72.50 70.38 3hr6 s THR 432 CO 0.05 0.54 1.25 -0.62 -0.69 0.00 0.00 174.62 175.15 3hr6 s ASP 433 N 0.46 6.79 0.60 3.53 -1.08 -1.26 -0.99 116.67 124.72 3hr6 s ASP 433 Ca -0.13 1.33 0.37 0.00 -0.52 0.00 0.00 52.55 53.59 3hr6 s ASP 433 Cb -0.17 -2.54 1.94 0.00 -1.46 0.00 0.00 42.92 40.69 3hr6 s ASP 433 CO 0.06 -0.95 2.22 0.00 0.52 0.00 0.00 175.17 177.01 3hr6 h ALA 434 N 8.78 1.13 -0.50 3.66 0.00 -1.48 -2.19 119.26 128.67 3hr6 h ALA 434 Ca -0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3hr6 h ALA 434 Cb 1.09 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3hr6 h ALA 434 CO 1.01 0.03 0.00 0.91 0.00 0.00 0.00 179.25 181.21 3hr6 n TRP 435 N -3.31 0.66 -1.61 0.00 7.02 -1.26 -4.24 117.44 114.69 3hr6 n TRP 435 Ca -0.02 -0.37 -0.45 0.00 -1.02 0.00 0.00 57.50 55.64 3hr6 n TRP 435 Cb 0.15 -0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.02 3hr6 n TRP 435 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3hr6 n ALA 436 N 1.38 0.08 -0.83 6.99 0.00 -0.83 -1.07 120.51 126.23 3hr6 n ALA 436 Ca 0.20 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.03 3hr6 n ALA 436 Cb 0.57 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.94 3hr6 n ALA 436 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hr6 n GLY 437 N 1.36 1.02 2.99 0.00 0.00 -1.26 -4.94 105.19 104.36 3hr6 n GLY 437 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 3hr6 n GLY 437 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hr6 s LYS 438 N -0.13 2.49 2.58 1.61 -0.14 -0.23 -5.06 119.74 120.86 3hr6 s LYS 438 Ca 0.00 -2.99 0.00 0.00 -1.36 0.00 0.00 55.97 51.62 3hr6 s LYS 438 Cb 0.00 -3.54 0.00 0.00 -1.68 0.00 0.00 37.83 32.61 3hr6 s LYS 438 CO 0.00 -1.21 0.00 0.41 -0.76 0.00 0.00 175.35 173.79 3hr6 n GLY 439 N 2.62 0.14 0.00 -3.33 0.00 -1.26 -4.65 105.19 98.71 3hr6 n GLY 439 Ca 0.14 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.22 3hr6 n GLY 439 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hr6 n THR 440 N -0.55 0.00 -3.87 2.61 -2.24 0.54 -4.89 114.28 105.89 3hr6 n THR 440 Ca 0.00 -0.08 -0.09 0.00 -2.27 0.00 0.00 64.05 61.61 3hr6 n THR 440 Cb 0.00 0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 68.73 3hr6 n THR 440 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3hr6 s GLU 441 N -1.75 1.10 0.58 -0.78 0.41 -1.09 -5.02 118.70 112.15 3hr6 s GLU 441 Ca 0.00 -1.03 -0.16 0.00 -0.41 0.00 0.00 54.97 53.38 3hr6 s GLU 441 Cb 0.00 0.40 -0.05 0.00 -1.78 0.00 0.00 34.13 32.70 3hr6 s GLU 441 CO 0.00 -0.41 1.04 -0.06 -0.49 0.00 0.00 175.26 175.34 3hr6 s PHE 442 N -3.91 3.14 0.07 1.61 0.08 -1.22 -0.65 117.98 117.10 3hr6 s PHE 442 Ca 0.11 1.49 -0.16 0.00 0.12 0.00 0.00 56.93 58.50 3hr6 s PHE 442 Cb 0.03 -2.94 0.03 0.00 -0.57 0.00 0.00 43.02 39.57 3hr6 s PHE 442 CO -0.04 -0.90 0.37 0.00 -0.10 0.00 0.00 175.22 174.55 3hr6 s LEU 444 N -2.27 3.28 -0.17 0.00 1.43 0.01 -0.74 118.68 120.22 3hr6 s LEU 444 Ca -0.03 -0.00 -0.01 0.00 -1.03 0.00 0.00 54.13 53.06 3hr6 s LEU 444 Cb 0.00 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 3hr6 s LEU 444 CO -0.06 0.33 -0.11 -0.69 0.23 0.00 0.00 176.35 176.05 3hr6 s VAL 445 N -0.62 2.99 -0.36 -1.59 1.01 0.04 -0.69 120.40 121.18 3hr6 s VAL 445 Ca 0.09 -0.65 -0.28 0.00 0.00 0.00 0.00 61.98 61.14 3hr6 s VAL 445 Cb -0.12 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 33.99 3hr6 s VAL 445 CO 0.02 0.49 1.05 -0.70 0.00 0.00 0.00 175.10 175.96 3hr6 s GLU 446 N 0.88 3.96 0.00 2.72 2.12 -1.26 -0.90 118.70 126.23 3hr6 s GLU 446 Ca -0.03 0.87 0.22 0.00 0.36 0.00 0.00 54.97 56.39 3hr6 s GLU 446 Cb -0.15 -3.78 -0.25 0.00 0.26 0.00 0.00 34.13 30.21 3hr6 s GLU 446 CO -0.00 -0.99 0.67 0.25 -0.54 0.00 0.00 175.26 174.64 3hr6 n THR 447 N 6.06 0.07 -3.67 -1.70 -2.24 0.54 -4.74 114.28 108.61 3hr6 n THR 447 Ca 0.11 -0.38 -0.13 0.00 -2.27 0.00 0.00 64.05 61.38 3hr6 n THR 447 Cb 0.48 0.19 -0.07 0.00 -2.10 0.00 0.00 70.33 68.83 3hr6 n THR 447 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hr6 s ALA 448 N -3.37 -1.04 0.00 6.98 0.00 -1.18 -4.96 121.76 118.19 3hr6 s ALA 448 Ca -0.03 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.34 3hr6 s ALA 448 Cb 0.14 0.27 0.00 0.00 0.00 0.00 0.00 23.12 23.53 3hr6 s ALA 448 CO 0.88 -0.42 0.00 -2.37 0.00 0.00 0.00 175.76 173.85 3hr6 n THR 449 N 0.66 0.00 -2.12 0.00 5.66 -1.26 -1.33 114.28 115.89 3hr6 n THR 449 Ca -0.19 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.52 3hr6 n THR 449 Cb 0.59 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.39 3hr6 n THR 449 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hr6 s ALA 450 N -1.88 3.13 -0.04 1.79 0.00 -1.12 -4.79 121.76 118.84 3hr6 s ALA 450 Ca 0.00 -0.38 -0.36 0.00 0.00 0.00 0.00 51.96 51.22 3hr6 s ALA 450 Cb 0.00 -2.87 -0.14 0.00 0.00 0.00 0.00 23.12 20.10 3hr6 s ALA 450 CO 0.00 -0.81 1.65 0.43 0.00 0.00 0.00 175.76 177.03 3hr6 n SER 451 N -2.72 2.64 0.00 0.00 7.64 -1.26 -2.30 113.62 117.63 3hr6 n SER 451 Ca 0.05 1.06 0.00 0.00 1.01 0.00 0.00 58.87 60.99 3hr6 n SER 451 Cb 0.56 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 62.48 3hr6 n SER 451 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hr6 n GLY 452 N 3.67 0.73 3.94 0.23 0.00 -1.26 -5.04 105.19 107.46 3hr6 n GLY 452 Ca 0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.99 3hr6 n GLY 452 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hr6 s TYR 453 N -2.85 3.45 -0.14 1.61 2.02 -0.97 -4.57 117.35 115.90 3hr6 s TYR 453 Ca 0.00 0.06 -0.15 0.00 -0.37 0.00 0.00 57.07 56.61 3hr6 s TYR 453 Cb 0.00 -1.62 -0.05 0.00 -0.40 0.00 0.00 41.96 39.89 3hr6 s TYR 453 CO 0.00 0.49 0.35 -1.21 -1.57 0.00 0.00 175.55 173.61 3hr6 s GLU 454 N -3.48 4.25 0.40 -0.62 0.41 -0.38 -4.83 118.70 114.45 3hr6 s GLU 454 Ca 0.34 0.21 -0.26 0.00 -0.41 0.00 0.00 54.97 54.85 3hr6 s GLU 454 Cb -0.10 -3.42 -0.09 0.00 -1.78 0.00 0.00 34.13 28.74 3hr6 s GLU 454 CO 0.28 0.24 1.33 -0.51 -0.49 0.00 0.00 175.26 176.12 3hr6 s LEU 455 N 0.42 4.24 -0.04 1.80 1.43 -1.26 -4.57 118.68 120.70 3hr6 s LEU 455 Ca 0.20 2.72 -0.30 0.00 -1.03 0.00 0.00 54.13 55.72 3hr6 s LEU 455 Cb -0.14 -3.85 -0.08 0.00 0.03 0.00 0.00 46.19 42.15 3hr6 s LEU 455 CO 0.06 -0.84 2.04 0.18 0.23 0.00 0.00 176.35 178.01 3hr6 n LEU 456 N 0.21 3.86 0.24 1.79 4.32 -1.26 -4.91 117.00 121.25 3hr6 n LEU 456 Ca 0.03 0.72 0.13 0.00 -0.02 0.00 0.00 56.01 56.87 3hr6 n LEU 456 Cb 0.43 -1.52 0.51 0.00 -1.62 0.00 0.00 43.42 41.22 3hr6 n LEU 456 CO 0.57 -0.05 0.87 1.55 -1.22 0.00 0.00 177.39 179.11 3hr6 h PRO 457 N 11.66 0.00 -6.42 3.23 0.13 -1.95 -3.43 132.00 135.23 3hr6 h PRO 457 Ca -0.47 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.04 3hr6 h PRO 457 Cb 1.24 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.19 3hr6 h PRO 457 CO 0.95 0.13 -0.81 0.15 -0.23 0.00 0.00 178.00 178.19 3hr6 s LYS 458 N -3.62 1.42 0.52 0.86 1.02 -1.26 -5.11 119.74 113.57 3hr6 s LYS 458 Ca 0.01 -1.46 -0.23 0.00 0.02 0.00 0.00 55.97 54.31 3hr6 s LYS 458 Cb 0.09 -1.68 -0.06 0.00 -0.52 0.00 0.00 37.83 35.66 3hr6 s LYS 458 CO 0.61 0.36 1.34 -2.30 -0.92 0.00 0.00 175.35 174.44 3hr6 n PRO 459 N 0.36 1.77 -3.38 -1.68 -0.02 -1.26 -4.83 135.00 125.95 3hr6 n PRO 459 Ca -0.13 0.64 -0.41 0.00 -2.02 0.00 0.00 63.50 61.58 3hr6 n PRO 459 Cb 0.56 -2.54 -0.09 0.00 -0.02 0.00 0.00 33.50 31.41 3hr6 n PRO 459 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hr6 s VAL 460 N -1.27 5.15 0.19 -1.45 1.01 0.13 -4.87 120.40 119.29 3hr6 s VAL 460 Ca 0.69 -0.07 -0.30 0.00 0.00 0.00 0.00 61.98 62.29 3hr6 s VAL 460 Cb -0.43 -3.89 -0.09 0.00 0.00 0.00 0.00 36.38 31.97 3hr6 s VAL 460 CO 0.52 -0.19 1.40 -0.63 0.00 0.00 0.00 175.10 176.19 3hr6 s ILE 461 N 2.05 2.99 -0.19 2.22 -1.09 -1.26 -0.81 121.20 125.11 3hr6 s ILE 461 Ca 0.12 0.79 0.01 0.00 -2.23 0.00 0.00 60.65 59.33 3hr6 s ILE 461 Cb -0.17 -3.50 0.04 0.00 -1.58 0.00 0.00 42.46 37.25 3hr6 s ILE 461 CO 0.12 0.10 -0.10 -0.69 -1.23 0.00 0.00 174.94 173.14 3hr6 s VAL 462 N 0.41 1.54 -0.37 2.92 1.01 -0.05 -4.91 120.40 120.96 3hr6 s VAL 462 Ca 0.61 -0.90 -0.26 0.00 0.00 0.00 0.00 61.98 61.42 3hr6 s VAL 462 Cb -0.39 -1.62 0.02 0.00 0.00 0.00 0.00 36.38 34.39 3hr6 s VAL 462 CO 0.37 0.19 0.94 -0.54 0.00 0.00 0.00 175.10 176.07 3hr6 s LYS 463 N 1.45 3.86 -0.24 2.72 1.02 -1.26 -3.38 119.74 123.91 3hr6 s LYS 463 Ca -0.00 0.63 -0.03 0.00 0.02 0.00 0.00 55.97 56.59 3hr6 s LYS 463 Cb -0.16 -3.80 0.11 0.00 -0.52 0.00 0.00 37.83 33.47 3hr6 s LYS 463 CO -0.08 -0.95 0.27 -1.17 -0.92 0.00 0.00 175.35 172.50 3hr6 s LEU 464 N 3.51 -0.23 0.15 3.17 2.96 -1.26 -4.75 118.68 122.23 3hr6 s LEU 464 Ca 0.39 -0.35 -0.16 0.00 -0.22 0.00 0.00 54.13 53.80 3hr6 s LEU 464 Cb -0.12 0.54 0.03 0.00 0.50 0.00 0.00 46.19 47.14 3hr6 s LEU 464 CO 0.19 -0.35 0.42 -1.83 -1.32 0.00 0.00 176.35 173.46 3hr6 s GLU 465 N 2.37 1.16 0.36 1.98 -1.05 -1.26 -4.80 118.70 117.46 3hr6 s GLU 465 Ca 0.09 -0.80 0.03 0.00 -0.15 0.00 0.00 54.97 54.15 3hr6 s GLU 465 Cb -0.15 0.47 -0.04 0.00 -0.44 0.00 0.00 34.13 33.97 3hr6 s GLU 465 CO -0.20 -0.46 0.09 0.00 0.95 0.00 0.00 175.26 175.63 3hr6 s ALA 466 N -3.84 2.61 0.20 -0.84 0.00 -1.26 -4.97 121.76 113.66 3hr6 s ALA 466 Ca 0.06 -1.64 -0.03 0.00 0.00 0.00 0.00 51.96 50.35 3hr6 s ALA 466 Cb 0.01 0.71 0.01 0.00 0.00 0.00 0.00 23.12 23.86 3hr6 s ALA 466 CO -0.08 -0.32 0.32 0.27 0.00 0.00 0.00 175.76 175.94 3hr6 n ASN 467 N -0.95 -0.91 0.26 0.00 0.23 -1.26 -4.99 115.26 107.64 3hr6 n ASN 467 Ca -0.04 -1.96 0.13 0.00 -0.53 0.00 0.00 54.58 52.18 3hr6 n ASN 467 Cb 0.66 1.61 0.81 0.00 -2.08 0.00 0.00 39.78 40.78 3hr6 n ASN 467 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3hr6 h GLU 468 N 0.00 0.00 0.00 -3.83 4.11 -1.97 -1.66 114.58 111.24 3hr6 h GLU 468 Ca -0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.27 3hr6 h GLU 468 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 3hr6 h GLU 468 CO 0.21 0.00 -0.26 -1.13 0.07 0.00 0.00 179.01 177.90 3hr6 n SER 469 N -4.08 0.50 -4.68 3.06 3.41 -1.26 -4.92 113.62 105.65 3hr6 n SER 469 Ca -0.02 0.27 -0.44 0.00 -0.26 0.00 0.00 58.87 58.43 3hr6 n SER 469 Cb 0.14 -0.26 -0.03 0.00 -0.26 0.00 0.00 64.21 63.79 3hr6 n SER 469 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3hr6 n THR 470 N -1.86 0.51 -1.32 6.66 -1.04 -0.63 -4.84 114.28 111.76 3hr6 n THR 470 Ca 0.05 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 3hr6 n THR 470 Cb 0.39 -2.09 0.00 0.00 -1.82 0.00 0.00 70.33 66.81 3hr6 n THR 470 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 3hr6 n ASN 471 N 6.25 0.10 -4.32 8.00 6.94 -1.26 -4.94 115.26 126.03 3hr6 n ASN 471 Ca 0.19 -1.41 -0.16 0.00 -0.02 0.00 0.00 54.58 53.18 3hr6 n ASN 471 Cb 0.36 -0.08 -0.10 0.00 -2.36 0.00 0.00 39.78 37.60 3hr6 n ASN 471 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 3hr6 s VAL 472 N -0.08 0.73 0.22 3.53 -7.23 -1.25 -4.90 120.40 111.42 3hr6 s VAL 472 Ca 0.01 -2.00 -0.32 0.00 -1.81 0.00 0.00 61.98 57.86 3hr6 s VAL 472 Cb 0.00 -2.49 -0.12 0.00 0.56 0.00 0.00 36.38 34.34 3hr6 s VAL 472 CO 0.00 -0.16 1.70 -0.22 -0.31 0.00 0.00 175.10 176.11 3hr6 s LEU 473 N -3.30 4.37 -0.08 1.32 2.96 -0.72 -4.65 118.68 118.59 3hr6 s LEU 473 Ca 0.33 2.86 -0.25 0.00 -0.22 0.00 0.00 54.13 56.85 3hr6 s LEU 473 Cb 0.07 -3.60 -0.03 0.00 0.50 0.00 0.00 46.19 43.13 3hr6 s LEU 473 CO 0.11 -0.96 0.79 -0.69 -1.32 0.00 0.00 176.35 174.28 3hr6 s VAL 474 N 1.02 4.97 0.09 1.68 1.01 -0.92 -4.94 120.40 123.32 3hr6 s VAL 474 Ca 0.73 1.62 0.06 0.00 0.00 0.00 0.00 61.98 64.39 3hr6 s VAL 474 Cb -0.49 -4.12 -0.03 0.00 0.00 0.00 0.00 36.38 31.73 3hr6 s VAL 474 CO 0.34 0.18 -0.16 -1.61 0.00 0.00 0.00 175.10 173.84 3hr6 s GLU 475 N 1.19 0.96 -0.02 2.72 2.02 -1.26 -0.34 118.70 123.96 3hr6 s GLU 475 Ca 0.41 -1.08 -0.00 0.00 0.02 0.00 0.00 54.97 54.31 3hr6 s GLU 475 Cb -0.18 -1.02 0.03 0.00 0.10 0.00 0.00 34.13 33.06 3hr6 s GLU 475 CO 0.19 0.22 0.03 -1.14 0.02 0.00 0.00 175.26 174.58 3hr6 s GLN 476 N -1.99 -0.03 -0.17 1.61 2.00 -0.85 -4.97 119.66 115.27 3hr6 s GLN 476 Ca 0.03 0.16 -0.13 0.00 -2.00 0.00 0.00 55.36 53.42 3hr6 s GLN 476 Cb -0.09 -0.20 -0.05 0.00 0.80 0.00 0.00 33.01 33.47 3hr6 s GLN 476 CO 0.03 -0.14 0.26 0.21 -0.50 0.00 0.00 175.29 175.16 3hr6 s LYS 477 N 0.89 4.23 -0.28 1.67 2.20 -1.26 -0.81 119.74 126.38 3hr6 s LYS 477 Ca -0.07 0.04 0.03 0.00 -0.36 0.00 0.00 55.97 55.61 3hr6 s LYS 477 Cb -0.11 -3.42 0.07 0.00 -1.51 0.00 0.00 37.83 32.87 3hr6 s LYS 477 CO -0.03 0.26 -0.06 0.08 -0.36 0.00 0.00 175.35 175.24 3hr6 s VAL 478 N 0.42 2.17 -0.18 4.02 1.01 0.12 -4.95 120.40 123.01 3hr6 s VAL 478 Ca 0.15 -1.83 -0.23 0.00 0.00 0.00 0.00 61.98 60.07 3hr6 s VAL 478 Cb -0.13 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 3hr6 s VAL 478 CO 0.03 -0.21 0.73 -0.54 0.00 0.00 0.00 175.10 175.12 3hr6 s LYS 479 N 1.06 4.26 -0.09 2.72 1.02 -1.26 -0.62 119.74 126.83 3hr6 s LYS 479 Ca -0.03 0.83 0.00 0.00 0.02 0.00 0.00 55.97 56.79 3hr6 s LYS 479 Cb -0.20 -3.57 0.02 0.00 -0.52 0.00 0.00 37.83 33.57 3hr6 s LYS 479 CO -0.06 -0.27 -0.07 0.42 -0.92 0.00 0.00 175.35 174.45 3hr6 s ILE 480 N 1.99 0.88 -0.25 2.17 1.01 -0.11 -4.96 121.20 121.94 3hr6 s ILE 480 Ca 0.34 -0.24 -0.06 0.00 0.00 0.00 0.00 60.65 60.69 3hr6 s ILE 480 Cb -0.16 -0.90 -0.01 0.00 0.01 0.00 0.00 42.46 41.40 3hr6 s ILE 480 CO 0.12 0.33 0.03 -0.62 0.00 0.00 0.00 174.94 174.80 3hr6 s ASP 481 N 1.44 4.83 0.25 3.58 2.15 -1.26 -0.15 116.67 127.50 3hr6 s ASP 481 Ca -0.01 -0.43 -0.20 0.00 0.43 0.00 0.00 52.55 52.34 3hr6 s ASP 481 Cb -0.13 -1.84 -0.09 0.00 -0.30 0.00 0.00 42.92 40.56 3hr6 s ASP 481 CO -0.04 -0.08 0.75 0.20 -0.17 0.00 0.00 175.17 175.83 3hr6 s ASN 482 N 1.53 7.06 0.08 -0.34 0.01 0.12 -4.90 114.94 118.50 3hr6 s ASN 482 Ca 0.05 1.45 0.08 0.00 -0.71 0.00 0.00 52.86 53.73 3hr6 s ASN 482 Cb -0.15 -2.43 -0.03 0.00 0.41 0.00 0.00 41.25 39.04 3hr6 s ASN 482 CO 0.01 -0.01 -0.21 -0.54 -1.51 0.00 0.00 177.10 174.83 3hr6 s LYS 483 N -2.12 1.22 0.00 -0.60 -0.14 -1.26 0.03 119.74 116.86 3hr6 s LYS 483 Ca 0.45 -1.10 0.22 0.00 -1.36 0.00 0.00 55.97 54.19 3hr6 s LYS 483 Cb -0.16 -1.44 1.34 0.00 -1.68 0.00 0.00 37.83 35.89 3hr6 s LYS 483 CO 0.21 0.35 1.71 1.63 -0.76 0.00 0.00 175.35 178.49