#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h03 s VAL 6 N 0.00 4.58 -0.32 12.58 1.01 0.88 -4.89 120.40 134.24 3h03 s VAL 6 Ca 0.00 2.06 -0.17 0.00 0.00 0.00 0.00 61.98 63.86 3h03 s VAL 6 Cb 0.00 -4.31 -0.01 0.00 0.00 0.00 0.00 36.38 32.05 3h03 s VAL 6 CO 0.00 0.27 0.48 -0.69 0.00 0.00 0.00 175.10 175.16 3h03 s VAL 7 N 0.27 5.06 -0.23 2.92 1.01 -1.26 -0.53 120.40 127.64 3h03 s VAL 7 Ca 0.48 0.48 -0.08 0.00 0.00 0.00 0.00 61.98 62.86 3h03 s VAL 7 Cb -0.23 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 3h03 s VAL 7 CO 0.29 -0.08 0.09 -0.69 0.00 0.00 0.00 175.10 174.71 3h03 s VAL 8 N 2.30 4.68 -0.13 2.92 1.01 -0.29 -0.59 120.40 130.29 3h03 s VAL 8 Ca 0.18 -0.06 -0.07 0.00 0.00 0.00 0.00 61.98 62.04 3h03 s VAL 8 Cb -0.16 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 3h03 s VAL 8 CO 0.12 0.37 0.10 0.28 0.00 0.00 0.00 175.10 175.97 3h03 s THR 9 N 1.14 5.17 0.19 3.92 -1.32 0.09 -0.16 115.64 124.67 3h03 s THR 9 Ca 0.05 0.09 0.01 0.00 -1.21 0.00 0.00 61.69 60.63 3h03 s THR 9 Cb -0.14 -3.27 -0.00 0.00 -1.51 0.00 0.00 72.50 67.58 3h03 s THR 9 CO 0.04 0.57 0.23 1.07 -2.21 0.00 0.00 174.62 174.31 3h03 n THR 10 N 2.46 0.00 -4.04 5.08 5.66 0.45 -2.40 114.28 121.49 3h03 n THR 10 Ca -0.19 -1.11 -0.13 0.00 -3.05 0.00 0.00 64.05 59.58 3h03 n THR 10 Cb 0.54 0.63 -0.12 0.00 -1.55 0.00 0.00 70.33 69.82 3h03 n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 3h03 s ILE 11 N -2.68 0.34 -0.87 1.09 2.07 -1.26 -0.15 121.20 119.73 3h03 s ILE 11 Ca 0.18 -0.71 -0.25 0.00 -1.41 0.00 0.00 60.65 58.46 3h03 s ILE 11 Cb 0.00 -0.39 0.03 0.00 0.13 0.00 0.00 42.46 42.23 3h03 s ILE 11 CO 0.13 -0.25 1.44 -0.76 -1.91 0.00 0.00 174.94 173.58 3h03 s LEU 12 N -1.03 3.33 -0.07 8.50 1.43 -1.26 -4.33 118.68 125.24 3h03 s LEU 12 Ca -0.08 -0.88 -0.03 0.00 -1.03 0.00 0.00 54.13 52.12 3h03 s LEU 12 Cb -0.07 -2.56 0.04 0.00 0.03 0.00 0.00 46.19 43.62 3h03 s LEU 12 CO -0.00 -1.78 0.07 -0.70 0.23 0.00 0.00 176.35 174.17 3h03 s GLU 13 N 5.55 -0.03 0.32 1.70 2.56 -1.05 -4.98 118.70 122.77 3h03 s GLU 13 Ca 0.44 0.27 -0.28 0.00 0.00 0.00 0.00 54.97 55.41 3h03 s GLU 13 Cb -0.04 -0.82 -0.09 0.00 2.00 0.00 0.00 34.13 35.17 3h03 s GLU 13 CO 0.03 -0.41 1.06 -1.12 -0.56 0.00 0.00 175.26 174.27 3h03 s SER 14 N 2.16 7.13 -0.24 -1.70 0.01 -1.26 -0.24 113.70 119.56 3h03 s SER 14 Ca 0.04 2.15 0.10 0.00 1.31 0.00 0.00 55.95 59.55 3h03 s SER 14 Cb -0.13 -2.61 0.66 0.00 0.21 0.00 0.00 66.02 64.15 3h03 s SER 14 CO -0.04 -0.23 1.60 -0.81 0.41 0.00 0.00 173.24 174.16 3h03 n PRO 15 N 0.77 3.75 0.04 12.44 -0.04 -1.26 -4.93 135.00 145.77 3h03 n PRO 15 Ca 0.01 -2.60 -0.12 0.00 -0.04 0.00 0.00 63.50 60.74 3h03 n PRO 15 Cb 0.47 -2.11 -0.09 0.00 -0.04 0.00 0.00 33.50 31.73 3h03 n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3h03 h TYR 16 N 2.76 -0.15 -3.20 0.54 0.05 -0.95 0.45 116.97 116.47 3h03 h TYR 16 Ca 0.12 -0.00 -0.30 0.00 0.05 0.00 0.00 58.73 58.60 3h03 h TYR 16 Cb 1.93 0.05 -0.36 0.00 1.01 0.00 0.00 36.73 39.37 3h03 h TYR 16 CO 1.02 0.32 -0.66 0.08 -1.05 0.00 0.00 178.16 177.86 3h03 s VAL 17 N -3.82 -0.18 0.06 -2.88 1.01 -0.53 -1.02 120.40 113.05 3h03 s VAL 17 Ca -0.14 0.33 0.01 0.00 0.00 0.00 0.00 61.98 62.18 3h03 s VAL 17 Cb 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 36.12 3h03 s VAL 17 CO 0.56 0.14 -0.05 -0.04 0.00 0.00 0.00 175.10 175.71 3h03 s MET 18 N 1.99 0.62 -0.03 2.72 -1.94 0.50 -2.51 119.30 120.66 3h03 s MET 18 Ca 0.01 -1.08 -0.25 0.00 -1.71 0.00 0.00 55.69 52.66 3h03 s MET 18 Cb -0.12 -0.04 -0.04 0.00 2.01 0.00 0.00 34.83 36.64 3h03 s MET 18 CO -0.05 -0.04 0.76 -1.64 -0.01 0.00 0.00 175.02 174.04 3h03 s MET 19 N -3.07 4.47 0.60 2.03 -1.94 -1.26 -1.12 119.30 119.00 3h03 s MET 19 Ca 0.02 1.02 -0.19 0.00 -1.71 0.00 0.00 55.69 54.82 3h03 s MET 19 Cb 0.01 -3.43 -0.03 0.00 2.01 0.00 0.00 34.83 33.39 3h03 s MET 19 CO -0.05 0.11 1.28 0.15 -0.01 0.00 0.00 175.02 176.49 3h03 s LYS 20 N 0.60 2.89 0.39 2.03 1.02 -0.40 -4.86 119.74 121.41 3h03 s LYS 20 Ca 0.40 2.02 0.14 0.00 0.02 0.00 0.00 55.97 58.55 3h03 s LYS 20 Cb -0.19 -2.00 0.98 0.00 -0.52 0.00 0.00 37.83 36.10 3h03 s LYS 20 CO 0.21 -1.32 1.85 0.87 -0.92 0.00 0.00 175.35 176.04 3h03 h LYS 21 N 0.95 0.50 -0.86 1.68 1.79 -1.95 -0.81 116.57 117.87 3h03 h LYS 21 Ca -0.51 -0.03 -0.48 0.00 -2.18 0.00 0.00 60.65 57.45 3h03 h LYS 21 Cb 1.31 -0.11 -0.27 0.00 -1.58 0.00 0.00 32.23 31.58 3h03 h LYS 21 CO 0.55 0.33 0.49 0.27 -1.08 0.00 0.00 179.45 180.01 3h03 n ASN 22 N -4.55 4.32 0.15 0.86 6.94 -1.26 -4.69 115.26 117.04 3h03 n ASN 22 Ca 0.19 -3.69 0.16 0.00 -0.02 0.00 0.00 54.58 51.22 3h03 n ASN 22 Cb 0.62 -0.81 0.74 0.00 -2.36 0.00 0.00 39.78 37.97 3h03 n ASN 22 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 3h03 h HIS 23 N 1.25 0.00 0.00 -2.53 2.07 -1.42 -1.49 115.15 113.03 3h03 h HIS 23 Ca 0.54 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.06 3h03 h HIS 23 Cb 2.16 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.14 3h03 h HIS 23 CO 1.42 0.00 0.00 -1.91 -3.07 0.00 0.00 177.93 174.37 3h03 n GLU 24 N -4.19 0.17 0.00 5.12 4.07 -1.26 -1.96 120.64 122.60 3h03 n GLU 24 Ca 0.03 0.45 0.08 0.00 -0.06 0.00 0.00 57.16 57.66 3h03 n GLU 24 Cb 0.35 -1.86 0.01 0.00 -0.06 0.00 0.00 31.44 29.87 3h03 n GLU 24 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 3h03 n MET 25 N -2.20 1.60 -3.69 5.31 2.81 -0.56 -5.00 117.12 115.39 3h03 n MET 25 Ca 0.02 -0.92 -0.21 0.00 -1.81 0.00 0.00 57.70 54.77 3h03 n MET 25 Cb 0.19 -1.31 -0.04 0.00 -0.71 0.00 0.00 33.22 31.36 3h03 n MET 25 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3h03 s LEU 26 N -2.02 3.37 0.06 4.03 1.43 -0.83 -5.14 118.68 119.58 3h03 s LEU 26 Ca 0.15 -0.77 0.03 0.00 -1.03 0.00 0.00 54.13 52.51 3h03 s LEU 26 Cb 0.14 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 3h03 s LEU 26 CO 0.40 -0.59 -0.09 -0.70 0.23 0.00 0.00 176.35 175.60 3h03 s GLU 27 N -4.07 0.64 4.85 1.70 2.12 -1.26 -4.81 118.70 117.87 3h03 s GLU 27 Ca 0.46 -0.88 0.00 0.00 0.36 0.00 0.00 54.97 54.91 3h03 s GLU 27 Cb -0.02 -0.42 0.00 0.00 0.26 0.00 0.00 34.13 33.94 3h03 s GLU 27 CO 0.27 0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.47 3h03 n GLY 28 N 1.22 2.69 0.34 -1.50 0.00 -1.26 -2.58 105.19 104.10 3h03 n GLY 28 Ca -0.21 -0.33 0.17 0.00 0.00 0.00 0.00 46.02 45.65 3h03 n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3h03 h ASN 29 N 7.34 0.00 0.59 1.61 2.35 -1.92 -2.41 115.58 123.13 3h03 h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3h03 h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3h03 h ASN 29 CO 0.00 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 175.16 3h03 n GLU 30 N -4.06 0.17 0.22 0.81 4.71 -1.07 -2.66 120.64 118.77 3h03 n GLU 30 Ca 0.03 0.45 0.15 0.00 -0.01 0.00 0.00 57.16 57.78 3h03 n GLU 30 Cb 0.36 -1.85 0.58 0.00 -1.01 0.00 0.00 31.44 29.52 3h03 n GLU 30 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3h03 h ARG 31 N 0.00 0.00 -6.30 3.49 3.08 -1.56 -3.46 114.38 109.63 3h03 h ARG 31 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 3h03 h ARG 31 Cb 0.29 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.24 3h03 h ARG 31 CO 0.00 0.00 -0.65 0.71 -1.07 0.00 0.00 179.97 178.96 3h03 s TYR 32 N -3.51 2.80 0.14 3.04 2.02 -1.09 -1.27 117.35 119.48 3h03 s TYR 32 Ca 0.03 -0.17 -0.09 0.00 -0.37 0.00 0.00 57.07 56.47 3h03 s TYR 32 Cb 0.09 -1.32 -0.00 0.00 -0.40 0.00 0.00 41.96 40.32 3h03 s TYR 32 CO 0.51 0.55 0.26 -1.83 -1.57 0.00 0.00 175.55 173.46 3h03 s GLU 33 N -3.19 1.04 0.00 -0.62 -1.05 -0.28 -4.83 118.70 109.78 3h03 s GLU 33 Ca 0.29 -1.07 0.00 0.00 -0.15 0.00 0.00 54.97 54.03 3h03 s GLU 33 Cb -0.08 0.37 0.00 0.00 -0.44 0.00 0.00 34.13 33.98 3h03 s GLU 33 CO 0.19 -0.37 0.00 0.41 0.95 0.00 0.00 175.26 176.44 3h03 n GLY 34 N -0.16 2.05 0.14 -3.83 0.00 -1.26 -0.37 105.19 101.76 3h03 n GLY 34 Ca -0.10 -1.93 -0.10 0.00 0.00 0.00 0.00 46.02 43.88 3h03 n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3h03 h TYR 35 N 0.00 -0.24 0.00 1.61 5.03 -0.39 -1.54 116.97 121.44 3h03 h TYR 35 Ca 0.00 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.28 3h03 h TYR 35 Cb 0.00 0.12 -0.01 0.00 1.55 0.00 0.00 36.73 38.39 3h03 h TYR 35 CO 0.00 -0.15 -0.20 0.00 -1.32 0.00 0.00 178.16 176.50 3h03 h VAL 37 N 0.00 1.32 -0.46 0.00 2.07 -1.46 0.18 116.25 117.90 3h03 h VAL 37 Ca -0.00 -1.26 -0.03 0.00 0.82 0.00 0.00 66.70 66.23 3h03 h VAL 37 Cb 0.72 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 3h03 h VAL 37 CO 0.03 0.38 0.18 0.44 0.02 0.00 0.00 177.57 178.62 3h03 h ASP 38 N 0.11 0.64 -0.57 0.57 3.45 -0.95 -2.61 116.42 117.05 3h03 h ASP 38 Ca 0.04 -0.17 -0.00 0.00 0.43 0.00 0.00 57.03 57.32 3h03 h ASP 38 Cb 0.66 -0.17 -0.03 0.00 -0.56 0.00 0.00 39.33 39.24 3h03 h ASP 38 CO 0.04 0.64 0.35 0.25 -1.57 0.00 0.00 179.24 178.94 3h03 h LEU 39 N 0.61 0.69 -0.75 1.55 5.85 -0.87 -2.13 115.31 120.26 3h03 h LEU 39 Ca 0.15 -0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3h03 h LEU 39 Cb 0.20 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 3h03 h LEU 39 CO -0.01 0.54 0.46 0.00 -0.34 0.00 0.00 178.44 179.09 3h03 h ALA 40 N 1.18 1.00 -0.58 1.25 0.00 -0.80 0.41 119.26 121.72 3h03 h ALA 40 Ca 0.21 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3h03 h ALA 40 Cb -0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3h03 h ALA 40 CO -0.04 0.21 0.24 0.00 0.00 0.00 0.00 179.25 179.66 3h03 h ALA 41 N 1.35 0.75 -0.19 0.00 0.00 -1.12 -1.35 119.26 118.70 3h03 h ALA 41 Ca 0.32 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3h03 h ALA 41 Cb 0.10 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3h03 h ALA 41 CO -0.15 0.35 0.07 0.93 0.00 0.00 0.00 179.25 180.46 3h03 h GLU 42 N 0.80 0.29 -0.51 0.00 4.39 -0.80 -1.24 114.58 117.50 3h03 h GLU 42 Ca 0.20 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.87 3h03 h GLU 42 Cb 0.18 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.75 3h03 h GLU 42 CO -0.02 0.37 0.30 0.82 -1.16 0.00 0.00 179.01 179.31 3h03 h ILE 43 N 0.15 1.04 -0.32 3.13 1.08 -0.77 -1.54 117.51 120.28 3h03 h ILE 43 Ca 0.06 -0.20 -0.09 0.00 -0.39 0.00 0.00 64.86 64.24 3h03 h ILE 43 Cb 0.19 0.40 -0.02 0.00 -3.07 0.00 0.00 36.82 34.32 3h03 h ILE 43 CO -0.00 0.11 -0.18 0.00 -0.69 0.00 0.00 178.15 177.38 3h03 h ALA 44 N 1.23 1.09 0.14 1.87 0.00 -1.17 -1.68 119.26 120.74 3h03 h ALA 44 Ca 0.21 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3h03 h ALA 44 Cb 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3h03 h ALA 44 CO -0.10 0.56 -0.07 -0.22 0.00 0.00 0.00 179.25 179.42 3h03 h LYS 45 N 0.52 -0.18 0.00 0.00 3.64 -0.73 0.16 116.57 119.98 3h03 h LYS 45 Ca 0.09 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3h03 h LYS 45 Cb 0.61 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 3h03 h LYS 45 CO 0.04 0.01 0.00 0.72 -2.27 0.00 0.00 179.45 177.96 3h03 n HIS 46 N -5.10 0.00 0.35 1.91 8.25 -0.62 -2.89 115.22 117.12 3h03 n HIS 46 Ca -0.09 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.42 3h03 n HIS 46 Cb 0.16 -0.23 -0.06 0.00 1.12 0.00 0.00 29.99 30.98 3h03 n HIS 46 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h03 n GLY 48 N 1.41 0.19 3.12 0.00 0.00 0.49 -5.04 105.19 105.37 3h03 n GLY 48 Ca 0.01 -0.25 -0.11 0.00 0.00 0.00 0.00 46.02 45.67 3h03 n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h03 s PHE 49 N -3.15 0.76 0.09 1.61 -0.12 -0.70 -5.05 117.98 111.43 3h03 s PHE 49 Ca 0.11 -0.82 -0.07 0.00 -0.05 0.00 0.00 56.93 56.11 3h03 s PHE 49 Cb -0.05 -0.46 -0.05 0.00 -0.63 0.00 0.00 43.02 41.83 3h03 s PHE 49 CO 0.31 -0.17 0.36 0.15 -0.05 0.00 0.00 175.22 175.83 3h03 s LYS 50 N -3.17 3.65 0.12 1.99 1.02 -1.26 -4.63 119.74 117.45 3h03 s LYS 50 Ca 0.04 -0.01 -0.07 0.00 0.02 0.00 0.00 55.97 55.95 3h03 s LYS 50 Cb 0.01 -2.94 -0.01 0.00 -0.52 0.00 0.00 37.83 34.36 3h03 s LYS 50 CO -0.04 0.53 0.19 1.52 -0.92 0.00 0.00 175.35 176.63 3h03 s TYR 51 N -1.50 0.37 -0.11 3.18 1.13 -1.26 -0.09 117.35 119.07 3h03 s TYR 51 Ca 0.36 -0.78 0.01 0.00 -1.41 0.00 0.00 57.07 55.25 3h03 s TYR 51 Cb -0.13 -0.14 0.02 0.00 -1.10 0.00 0.00 41.96 40.61 3h03 s TYR 51 CO 0.21 -0.59 -0.12 0.21 -2.51 0.00 0.00 175.55 172.75 3h03 s LYS 52 N -3.93 1.92 -0.03 -3.49 2.20 0.31 -4.87 119.74 111.84 3h03 s LYS 52 Ca 0.12 -0.44 -0.27 0.00 -0.36 0.00 0.00 55.97 55.02 3h03 s LYS 52 Cb 0.05 -1.73 -0.03 0.00 -1.51 0.00 0.00 37.83 34.61 3h03 s LYS 52 CO -0.05 -0.13 0.86 -0.51 -0.36 0.00 0.00 175.35 175.16 3h03 s LEU 53 N 1.20 4.34 0.05 5.43 1.43 -1.26 -1.14 118.68 128.73 3h03 s LEU 53 Ca -0.03 1.45 0.05 0.00 -1.03 0.00 0.00 54.13 54.57 3h03 s LEU 53 Cb -0.14 -3.36 -0.02 0.00 0.03 0.00 0.00 46.19 42.70 3h03 s LEU 53 CO -0.04 -0.20 -0.14 0.42 0.23 0.00 0.00 176.35 176.62 3h03 s THR 54 N 0.95 1.12 -0.19 5.49 -4.23 0.78 -4.88 115.64 114.67 3h03 s THR 54 Ca 0.46 -1.08 -0.13 0.00 -1.18 0.00 0.00 61.69 59.75 3h03 s THR 54 Cb -0.20 -1.03 -0.05 0.00 1.34 0.00 0.00 72.50 72.57 3h03 s THR 54 CO 0.24 -0.05 0.26 -0.63 -0.54 0.00 0.00 174.62 173.89 3h03 s ILE 55 N -0.96 5.31 0.12 2.99 -1.09 -1.26 -0.41 121.20 125.90 3h03 s ILE 55 Ca 0.01 0.45 -0.35 0.00 -2.23 0.00 0.00 60.65 58.52 3h03 s ILE 55 Cb -0.08 -3.60 -0.15 0.00 -1.58 0.00 0.00 42.46 37.04 3h03 s ILE 55 CO 0.02 0.36 1.44 0.55 -1.23 0.00 0.00 174.94 176.08 3h03 n VAL 56 N 3.83 0.03 -0.15 2.92 3.14 0.79 -4.88 118.33 124.00 3h03 n VAL 56 Ca -0.12 -0.01 -0.03 0.00 -2.96 0.00 0.00 64.34 61.22 3h03 n VAL 56 Cb 0.52 -1.12 0.06 0.00 -1.06 0.00 0.00 33.84 32.23 3h03 n VAL 56 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 3h03 h GLY 57 N 5.09 0.59 -0.73 7.55 0.00 -1.94 -2.82 103.07 110.81 3h03 h GLY 57 Ca -0.46 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 46.84 3h03 h GLY 57 CO 0.82 -0.06 0.00 2.09 0.00 0.00 0.00 176.54 179.39 3h03 n ASP 58 N -5.10 1.58 -2.95 0.19 5.68 -1.26 -4.93 116.55 109.76 3h03 n ASP 58 Ca 0.05 -1.68 -0.22 0.00 -0.50 0.00 0.00 54.79 52.44 3h03 n ASP 58 Cb 0.23 -0.09 0.02 0.00 -1.14 0.00 0.00 41.12 40.14 3h03 n ASP 58 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h03 n GLY 59 N 1.12 -0.51 3.41 6.12 0.00 -1.06 -4.96 105.19 109.30 3h03 n GLY 59 Ca 0.16 0.10 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 3h03 n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h03 s LYS 60 N -5.62 1.52 -0.13 1.61 1.02 -1.26 -5.07 119.74 111.81 3h03 s LYS 60 Ca 0.26 -1.64 -0.11 0.00 0.02 0.00 0.00 55.97 54.50 3h03 s LYS 60 Cb -0.12 -1.57 -0.08 0.00 -0.52 0.00 0.00 37.83 35.54 3h03 s LYS 60 CO 0.32 0.30 0.14 1.88 -0.92 0.00 0.00 175.35 177.06 3h03 h TYR 61 N 2.61 0.00 0.00 3.18 -1.99 -1.93 -2.64 116.97 116.21 3h03 h TYR 61 Ca -0.41 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.32 3h03 h TYR 61 Cb 1.24 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.97 3h03 h TYR 61 CO 0.75 0.39 0.00 0.41 -0.00 0.00 0.00 178.16 179.71 3h03 n GLY 62 N 1.66 0.58 3.05 3.88 0.00 -1.26 -1.59 105.19 111.51 3h03 n GLY 62 Ca -0.08 0.56 -0.10 0.00 0.00 0.00 0.00 46.02 46.40 3h03 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h03 s ALA 63 N 0.00 -0.09 -0.24 4.61 0.00 -1.26 -4.94 121.76 119.84 3h03 s ALA 63 Ca 0.00 -0.38 -0.10 0.00 0.00 0.00 0.00 51.96 51.48 3h03 s ALA 63 Cb 0.00 0.14 -0.05 0.00 0.00 0.00 0.00 23.12 23.21 3h03 s ALA 63 CO 0.00 -0.19 0.14 0.50 0.00 0.00 0.00 175.76 176.20 3h03 s ARG 64 N -1.51 4.00 -0.02 0.00 3.52 -1.26 -1.17 118.95 122.50 3h03 s ARG 64 Ca -0.15 -0.31 -0.30 0.00 -0.13 0.00 0.00 55.73 54.84 3h03 s ARG 64 Cb -0.08 -3.48 -0.05 0.00 -1.56 0.00 0.00 34.95 29.78 3h03 s ARG 64 CO -0.00 0.04 1.40 0.34 -0.81 0.00 0.00 175.30 176.27 3h03 s ASP 65 N 1.09 6.85 0.37 -2.12 2.15 -0.67 -4.89 116.67 119.46 3h03 s ASP 65 Ca 0.07 2.08 0.08 0.00 0.43 0.00 0.00 52.55 55.21 3h03 s ASP 65 Cb -0.14 -2.56 0.82 0.00 -0.30 0.00 0.00 42.92 40.74 3h03 s ASP 65 CO 0.04 -0.73 1.93 0.00 -0.17 0.00 0.00 175.17 176.24 3h03 h ALA 66 N 7.96 1.81 -3.00 3.66 0.00 -1.96 0.33 119.26 128.07 3h03 h ALA 66 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3h03 h ALA 66 Cb 1.17 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3h03 h ALA 66 CO 0.91 0.03 0.00 -0.25 0.00 0.00 0.00 179.25 179.94 3h03 n ASP 67 N -4.50 0.00 0.28 0.00 8.00 -1.26 -4.18 116.55 114.88 3h03 n ASP 67 Ca 0.13 0.20 0.17 0.00 0.71 0.00 0.00 54.79 56.00 3h03 n ASP 67 Cb 0.34 0.00 0.95 0.00 -0.02 0.00 0.00 41.12 42.40 3h03 n ASP 67 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 3h03 h THR 68 N 0.00 0.36 -0.41 -3.53 1.35 -1.99 -3.45 112.91 105.25 3h03 h THR 68 Ca 0.00 0.00 -0.18 0.00 -0.55 0.00 0.00 66.41 65.68 3h03 h THR 68 Cb 0.00 0.93 -0.07 0.00 -1.73 0.00 0.00 68.15 67.28 3h03 h THR 68 CO 0.00 0.00 -0.16 0.29 -0.25 0.00 0.00 175.52 175.40 3h03 n LYS 69 N -3.61 -0.80 -3.50 4.72 4.01 0.12 -4.99 118.16 114.11 3h03 n LYS 69 Ca -0.02 0.76 -0.37 0.00 -0.51 0.00 0.00 58.31 58.17 3h03 n LYS 69 Cb 0.17 -4.67 -0.06 0.00 -0.51 0.00 0.00 35.03 29.95 3h03 n LYS 69 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3h03 s ILE 70 N -2.22 5.22 0.03 -0.18 1.01 -1.25 -4.77 121.20 119.04 3h03 s ILE 70 Ca 0.00 0.69 -0.25 0.00 0.00 0.00 0.00 60.65 61.10 3h03 s ILE 70 Cb 0.00 -3.68 -0.05 0.00 0.01 0.00 0.00 42.46 38.74 3h03 s ILE 70 CO 0.00 0.44 0.75 0.26 0.00 0.00 0.00 174.94 176.39 3h03 s TRP 71 N -0.00 3.71 0.18 3.97 0.52 -1.26 -1.66 118.94 124.40 3h03 s TRP 71 Ca 0.20 1.43 0.02 0.00 0.02 0.00 0.00 56.10 57.78 3h03 s TRP 71 Cb -0.14 -2.82 0.02 0.00 -1.15 0.00 0.00 33.47 29.39 3h03 s TRP 71 CO 0.08 0.24 0.20 0.27 0.02 0.00 0.00 176.95 177.76 3h03 n ASN 72 N 2.97 1.07 0.00 2.95 0.23 -0.32 -4.28 115.26 117.88 3h03 n ASN 72 Ca -0.02 -1.55 0.00 0.00 -0.53 0.00 0.00 54.58 52.48 3h03 n ASN 72 Cb 0.50 -0.08 0.00 0.00 -2.08 0.00 0.00 39.78 38.12 3h03 n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3h03 n GLY 73 N 2.79 0.94 0.32 4.83 0.00 -1.26 -1.91 105.19 110.90 3h03 n GLY 73 Ca 0.03 -0.71 -0.03 0.00 0.00 0.00 0.00 46.02 45.30 3h03 n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3h03 h MET 74 N 0.00 0.95 -0.89 1.61 2.86 -0.90 -1.52 114.93 117.04 3h03 h MET 74 Ca 0.00 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 3h03 h MET 74 Cb 0.00 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.46 3h03 h MET 74 CO 0.00 0.79 0.57 0.28 1.06 0.00 0.00 176.91 179.61 3h03 h VAL 75 N 0.93 1.23 -0.45 -2.22 2.07 -1.57 -1.65 116.25 114.59 3h03 h VAL 75 Ca 0.21 -0.45 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 3h03 h VAL 75 Cb 0.22 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 3h03 h VAL 75 CO -0.02 0.23 0.22 1.23 0.02 0.00 0.00 177.57 179.25 3h03 h GLY 76 N 1.21 0.70 1.52 2.17 0.00 -0.75 -1.28 103.07 106.63 3h03 h GLY 76 Ca 0.32 -0.35 0.07 0.00 0.00 0.00 0.00 47.33 47.38 3h03 h GLY 76 CO -0.07 0.33 0.17 0.83 0.00 0.00 0.00 176.54 177.80 3h03 h GLU 77 N 0.59 0.00 0.02 4.80 5.08 -0.45 -0.53 114.58 124.08 3h03 h GLU 77 Ca 0.16 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3h03 h GLU 77 Cb 0.12 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3h03 h GLU 77 CO -0.02 0.00 -0.01 -0.07 -1.00 0.00 0.00 179.01 177.91 3h03 h LEU 78 N 0.00 -0.02 -1.85 1.33 3.38 -0.67 0.63 115.31 118.11 3h03 h LEU 78 Ca 0.11 -0.54 -0.03 0.00 0.09 0.00 0.00 57.88 57.52 3h03 h LEU 78 Cb 0.46 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 3h03 h LEU 78 CO -0.00 0.74 -0.13 0.58 0.09 0.00 0.00 178.44 179.71 3h03 h VAL 79 N -0.98 0.82 -0.66 1.22 2.07 -1.03 -2.17 116.25 115.51 3h03 h VAL 79 Ca -0.00 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3h03 h VAL 79 Cb 0.56 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3h03 h VAL 79 CO 0.00 0.13 0.00 -1.22 0.02 0.00 0.00 177.57 176.51 3h03 n TYR 80 N -3.98 1.14 -2.37 1.57 4.01 -0.23 -4.97 117.16 112.32 3h03 n TYR 80 Ca -0.02 -0.51 -0.10 0.00 -0.16 0.00 0.00 57.90 57.11 3h03 n TYR 80 Cb 0.22 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 3h03 n TYR 80 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h03 n GLY 81 N 1.40 0.01 0.08 2.72 0.00 -0.82 -4.95 105.19 103.63 3h03 n GLY 81 Ca 0.24 -0.41 -0.02 0.00 0.00 0.00 0.00 46.02 45.83 3h03 n GLY 81 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h03 n LYS 82 N -2.13 0.64 -4.05 1.61 4.76 0.21 -4.96 118.16 114.24 3h03 n LYS 82 Ca -0.09 0.12 -0.08 0.00 -2.87 0.00 0.00 58.31 55.39 3h03 n LYS 82 Cb 0.58 -1.70 -0.10 0.00 -1.84 0.00 0.00 35.03 31.96 3h03 n LYS 82 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3h03 s ALA 83 N -2.86 0.38 -0.21 7.82 0.00 -0.44 -5.00 121.76 121.45 3h03 s ALA 83 Ca -0.05 -0.99 0.22 0.00 0.00 0.00 0.00 51.96 51.14 3h03 s ALA 83 Cb 0.09 0.22 -0.17 0.00 0.00 0.00 0.00 23.12 23.26 3h03 s ALA 83 CO 0.83 -0.29 0.76 -0.25 0.00 0.00 0.00 175.76 176.81 3h03 n ASP 84 N 0.64 0.41 -3.57 0.00 8.00 0.25 -4.37 116.55 117.90 3h03 n ASP 84 Ca -0.18 0.05 -0.16 0.00 0.71 0.00 0.00 54.79 55.22 3h03 n ASP 84 Cb 0.59 1.27 -0.06 0.00 -0.02 0.00 0.00 41.12 42.89 3h03 n ASP 84 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3h03 s ILE 85 N -3.41 0.00 -0.19 0.53 2.07 -0.95 -4.44 121.20 114.81 3h03 s ILE 85 Ca -0.03 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 59.18 3h03 s ILE 85 Cb 0.13 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.71 3h03 s ILE 85 CO 0.85 0.00 -0.09 0.00 -1.91 0.00 0.00 174.94 173.79 3h03 s ALA 86 N -0.48 2.70 -0.31 1.50 0.00 0.24 -0.73 121.76 124.69 3h03 s ALA 86 Ca -0.06 -1.09 0.02 0.00 0.00 0.00 0.00 51.96 50.83 3h03 s ALA 86 Cb -0.02 -1.50 0.09 0.00 0.00 0.00 0.00 23.12 21.69 3h03 s ALA 86 CO 0.06 -0.22 0.03 0.42 0.00 0.00 0.00 175.76 176.05 3h03 s ILE 87 N 1.12 1.77 0.14 0.00 1.01 -1.01 -1.63 121.20 122.60 3h03 s ILE 87 Ca 0.01 -1.85 -0.25 0.00 0.00 0.00 0.00 60.65 58.57 3h03 s ILE 87 Cb -0.14 -2.23 0.08 0.00 0.01 0.00 0.00 42.46 40.17 3h03 s ILE 87 CO -0.02 -0.49 1.05 0.00 0.00 0.00 0.00 174.94 175.48 3h03 s ALA 88 N 1.19 -1.73 -1.07 9.38 0.00 -1.26 -4.57 121.76 123.69 3h03 s ALA 88 Ca 0.06 0.01 -0.17 0.00 0.00 0.00 0.00 51.96 51.87 3h03 s ALA 88 Cb -0.19 0.66 -0.08 0.00 0.00 0.00 0.00 23.12 23.52 3h03 s ALA 88 CO -0.12 -1.06 2.11 -0.35 0.00 0.00 0.00 175.76 176.35 3h03 n PRO 89 N -0.58 2.16 -3.49 0.00 -0.04 -1.26 -4.64 135.00 127.15 3h03 n PRO 89 Ca -0.05 -2.08 -0.40 0.00 -0.04 0.00 0.00 63.50 60.93 3h03 n PRO 89 Cb 0.60 -2.98 -0.10 0.00 -0.04 0.00 0.00 33.50 30.98 3h03 n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3h03 s LEU 90 N 1.33 4.32 0.27 1.53 2.96 -1.26 -5.01 118.68 122.82 3h03 s LEU 90 Ca 0.53 -0.18 -0.29 0.00 -0.22 0.00 0.00 54.13 53.96 3h03 s LEU 90 Cb 0.14 -2.23 -0.10 0.00 0.50 0.00 0.00 46.19 44.50 3h03 s LEU 90 CO 0.02 -0.22 1.31 -0.89 -1.32 0.00 0.00 176.35 175.25 3h03 s THR 91 N 1.87 2.93 -0.37 3.68 2.01 -1.26 -1.66 115.64 122.83 3h03 s THR 91 Ca 0.09 0.85 -0.29 0.00 0.31 0.00 0.00 61.69 62.65 3h03 s THR 91 Cb -0.17 -3.54 0.01 0.00 0.01 0.00 0.00 72.50 68.82 3h03 s THR 91 CO 0.11 0.17 1.22 -0.63 -0.69 0.00 0.00 174.62 174.80 3h03 s ILE 92 N -0.57 4.20 0.16 1.82 1.01 0.15 -4.85 121.20 123.12 3h03 s ILE 92 Ca 0.53 1.31 0.06 0.00 0.00 0.00 0.00 60.65 62.54 3h03 s ILE 92 Cb -0.38 -4.35 -0.04 0.00 0.01 0.00 0.00 42.46 37.69 3h03 s ILE 92 CO 0.46 -0.68 -0.12 0.42 0.00 0.00 0.00 174.94 175.02 3h03 s THR 93 N 4.42 1.37 0.09 2.92 -4.23 -1.26 -4.78 115.64 114.17 3h03 s THR 93 Ca 0.52 -2.04 -0.27 0.00 -1.18 0.00 0.00 61.69 58.72 3h03 s THR 93 Cb -0.12 -1.85 -0.13 0.00 1.34 0.00 0.00 72.50 71.74 3h03 s THR 93 CO 0.25 -0.64 1.67 0.25 -0.54 0.00 0.00 174.62 175.62 3h03 h LEU 94 N 2.85 -0.45 -1.45 4.79 5.85 -1.98 -0.24 115.31 124.68 3h03 h LEU 94 Ca -0.38 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.44 3h03 h LEU 94 Cb 1.20 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 42.34 3h03 h LEU 94 CO 0.61 -0.27 0.43 -0.37 -0.34 0.00 0.00 178.44 178.50 3h03 h VAL 95 N -0.40 1.02 0.02 1.05 -1.51 -2.00 -1.90 116.25 112.52 3h03 h VAL 95 Ca -0.01 -0.23 -0.27 0.00 -1.23 0.00 0.00 66.70 64.96 3h03 h VAL 95 Cb 0.36 0.29 0.02 0.00 -2.13 0.00 0.00 31.29 29.83 3h03 h VAL 95 CO -0.01 0.12 -1.06 0.03 -1.23 0.00 0.00 177.57 175.42 3h03 h ARG 96 N 0.67 0.66 0.00 5.19 3.08 -1.90 -3.14 114.38 118.94 3h03 h ARG 96 Ca 0.28 -0.73 0.00 0.00 0.07 0.00 0.00 59.98 59.60 3h03 h ARG 96 Cb 0.24 0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.51 3h03 h ARG 96 CO -0.09 1.31 0.00 1.49 -1.07 0.00 0.00 179.97 181.61 3h03 h GLU 97 N 0.36 0.00 0.00 0.04 4.57 -0.38 -0.78 114.58 118.39 3h03 h GLU 97 Ca -0.13 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.01 3h03 h GLU 97 Cb 1.72 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.30 3h03 h GLU 97 CO 0.21 0.00 -0.20 0.93 -1.18 0.00 0.00 179.01 178.76 3h03 h GLU 98 N 0.00 0.00 0.00 1.92 5.08 -1.31 -3.35 114.58 116.92 3h03 h GLU 98 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3h03 h GLU 98 Cb 0.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 3h03 h GLU 98 CO 0.00 0.20 -1.34 1.33 -1.00 0.00 0.00 179.01 178.20 3h03 n VAL 99 N -3.21 0.05 -4.23 3.13 0.24 -0.43 -5.06 118.33 108.81 3h03 n VAL 99 Ca 0.02 -0.18 -0.14 0.00 -2.04 0.00 0.00 64.34 62.01 3h03 n VAL 99 Cb 0.53 0.21 -0.10 0.00 -1.47 0.00 0.00 33.84 33.01 3h03 n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 3h03 s ILE 100 N -2.46 0.11 -0.08 1.34 -4.36 -0.45 -4.43 121.20 110.86 3h03 s ILE 100 Ca -0.03 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.34 3h03 s ILE 100 Cb 0.04 -2.52 -0.03 0.00 1.25 0.00 0.00 42.46 41.20 3h03 s ILE 100 CO 0.30 0.00 0.02 -1.81 0.24 0.00 0.00 174.94 173.68 3h03 s ASP 101 N -3.21 5.36 -0.02 4.36 1.01 0.77 -4.23 116.67 120.71 3h03 s ASP 101 Ca 0.39 0.17 0.02 0.00 0.71 0.00 0.00 52.55 53.84 3h03 s ASP 101 Cb 0.07 -1.53 -0.03 0.00 1.01 0.00 0.00 42.92 42.43 3h03 s ASP 101 CO 0.14 0.37 -0.06 -0.36 0.21 0.00 0.00 175.17 175.48 3h03 s PHE 102 N -0.92 2.93 0.98 4.23 0.08 -1.26 -1.03 117.98 122.99 3h03 s PHE 102 Ca 0.14 -0.00 -0.16 0.00 0.12 0.00 0.00 56.93 57.03 3h03 s PHE 102 Cb -0.11 -1.65 0.20 0.00 -0.57 0.00 0.00 43.02 40.89 3h03 s PHE 102 CO 0.03 0.38 1.29 -1.54 -0.10 0.00 0.00 175.22 175.28 3h03 s SER 103 N -1.29 2.99 0.72 1.36 1.04 0.13 -4.94 113.70 113.71 3h03 s SER 103 Ca 0.16 0.35 -0.14 0.00 0.48 0.00 0.00 55.95 56.81 3h03 s SER 103 Cb -0.11 -0.45 0.03 0.00 0.10 0.00 0.00 66.02 65.59 3h03 s SER 103 CO 0.06 -2.82 1.13 -0.54 0.98 0.00 0.00 173.24 172.06 3h03 s LYS 104 N -5.81 2.40 0.30 4.02 -0.14 -1.26 -4.54 119.74 114.70 3h03 s LYS 104 Ca 0.73 1.45 -0.30 0.00 -1.36 0.00 0.00 55.97 56.49 3h03 s LYS 104 Cb -0.05 -1.89 -0.11 0.00 -1.68 0.00 0.00 37.83 34.09 3h03 s LYS 104 CO 0.53 -1.57 1.58 -1.25 -0.76 0.00 0.00 175.35 173.88 3h03 s PRO 105 N -4.23 4.13 0.00 -1.68 0.04 -1.26 -4.57 135.00 127.43 3h03 s PRO 105 Ca 0.68 2.57 0.22 0.00 0.04 0.00 0.00 61.00 64.50 3h03 s PRO 105 Cb -0.22 -3.02 -0.13 0.00 0.04 0.00 0.00 34.50 31.17 3h03 s PRO 105 CO 0.46 -0.62 0.98 1.97 0.04 0.00 0.00 177.00 179.83 3h03 n PHE 106 N 2.08 0.00 -3.68 0.56 1.16 -0.27 -4.93 117.46 112.38 3h03 n PHE 106 Ca 0.08 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.53 3h03 n PHE 106 Cb 0.38 -0.02 -0.09 0.00 -1.61 0.00 0.00 39.48 38.14 3h03 n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 3h03 s MET 107 N -2.88 0.63 0.14 3.97 0.00 -1.25 -4.97 119.30 114.93 3h03 s MET 107 Ca 0.11 0.84 0.04 0.00 0.00 0.00 0.00 55.69 56.67 3h03 s MET 107 Cb 0.17 0.25 -0.04 0.00 0.00 0.00 0.00 34.83 35.21 3h03 s MET 107 CO 0.79 -0.10 0.15 -1.12 0.00 0.00 0.00 175.02 174.75 3h03 s SER 108 N 0.60 5.69 0.34 1.11 0.01 -1.26 -1.48 113.70 118.72 3h03 s SER 108 Ca -0.02 -0.03 -0.17 0.00 1.31 0.00 0.00 55.95 57.03 3h03 s SER 108 Cb -0.05 -1.55 0.06 0.00 0.21 0.00 0.00 66.02 64.69 3h03 s SER 108 CO -0.03 0.10 0.86 -1.48 0.41 0.00 0.00 173.24 173.09 3h03 s LEU 109 N -2.92 0.02 0.13 2.44 2.34 -0.17 -4.91 118.68 115.63 3h03 s LEU 109 Ca 0.31 -1.07 -0.26 0.00 0.06 0.00 0.00 54.13 53.18 3h03 s LEU 109 Cb -0.11 2.67 0.07 0.00 -0.56 0.00 0.00 46.19 48.26 3h03 s LEU 109 CO 0.24 -1.55 0.98 -0.83 -1.06 0.00 0.00 176.35 174.13 3h03 s GLY 110 N -3.17 -0.26 0.23 -3.48 0.00 -1.26 -1.21 107.32 98.17 3h03 s GLY 110 Ca 0.17 0.22 -0.30 0.00 0.00 0.00 0.00 44.72 44.81 3h03 s GLY 110 CO 0.10 0.03 1.31 -0.42 0.00 0.00 0.00 173.10 174.12 3h03 s ILE 111 N -3.22 3.11 0.21 0.90 1.01 -1.26 -0.41 121.20 121.55 3h03 s ILE 111 Ca 0.12 0.95 -0.00 0.00 0.00 0.00 0.00 60.65 61.72 3h03 s ILE 111 Cb -0.01 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 3h03 s ILE 111 CO 0.01 0.16 0.11 -0.94 0.00 0.00 0.00 174.94 174.29 3h03 s SER 112 N 0.14 0.49 -0.14 3.58 1.04 0.41 -0.02 113.70 119.20 3h03 s SER 112 Ca 0.55 -1.37 -0.03 0.00 0.48 0.00 0.00 55.95 55.57 3h03 s SER 112 Cb -0.37 0.31 -0.03 0.00 0.10 0.00 0.00 66.02 66.03 3h03 s SER 112 CO 0.41 -0.80 -0.04 -0.63 0.98 0.00 0.00 173.24 173.16 3h03 s ILE 113 N -4.02 3.88 -0.15 -1.02 1.01 -1.25 -1.39 121.20 118.26 3h03 s ILE 113 Ca 0.38 -0.37 -0.01 0.00 0.00 0.00 0.00 60.65 60.65 3h03 s ILE 113 Cb 0.07 -2.68 -0.01 0.00 0.01 0.00 0.00 42.46 39.85 3h03 s ILE 113 CO 0.12 0.51 -0.12 -0.32 0.00 0.00 0.00 174.94 175.13 3h03 s MET 114 N 0.19 3.37 0.21 2.79 -2.45 0.19 -1.23 119.30 122.38 3h03 s MET 114 Ca -0.02 -0.68 0.06 0.00 -1.25 0.00 0.00 55.69 53.80 3h03 s MET 114 Cb -0.14 -2.70 -0.05 0.00 1.25 0.00 0.00 34.83 33.20 3h03 s MET 114 CO 0.03 0.13 -0.09 0.96 1.05 0.00 0.00 175.02 177.09 3h03 s ILE 115 N 0.58 1.46 0.18 10.11 -4.36 -0.14 -1.28 121.20 127.74 3h03 s ILE 115 Ca -0.07 -2.13 -0.28 0.00 -0.26 0.00 0.00 60.65 57.91 3h03 s ILE 115 Cb -0.15 -2.12 -0.08 0.00 1.25 0.00 0.00 42.46 41.36 3h03 s ILE 115 CO 0.03 -0.54 0.87 -0.75 0.24 0.00 0.00 174.94 174.80 3h03 s LYS 116 N -3.72 4.70 0.15 0.37 2.20 -1.26 -0.61 119.74 121.57 3h03 s LYS 116 Ca 0.23 1.33 -0.34 0.00 -0.36 0.00 0.00 55.97 56.84 3h03 s LYS 116 Cb 0.02 -3.29 -0.13 0.00 -1.51 0.00 0.00 37.83 32.91 3h03 s LYS 116 CO 0.06 0.48 1.63 1.63 -0.36 0.00 0.00 175.35 178.79 3h03 n LYS 117 N 1.81 2.25 0.00 4.03 5.02 0.37 -2.01 118.16 129.63 3h03 n LYS 117 Ca -0.03 0.81 0.00 0.00 -2.02 0.00 0.00 58.31 57.08 3h03 n LYS 117 Cb 0.48 -2.60 0.00 0.00 -0.02 0.00 0.00 35.03 32.89 3h03 n LYS 117 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h03 n GLY 118 N 3.58 2.03 3.66 0.72 0.00 -1.26 -4.97 105.19 108.95 3h03 n GLY 118 Ca 0.17 -0.66 -0.48 0.00 0.00 0.00 0.00 46.02 45.06 3h03 n GLY 118 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3h03 n THR 119 N 0.00 0.09 -1.46 2.61 -1.04 -0.85 -4.85 114.28 108.77 3h03 n THR 119 Ca 0.00 -0.02 -0.40 0.00 -2.04 0.00 0.00 64.05 61.60 3h03 n THR 119 Cb 0.00 -1.42 -0.02 0.00 -1.82 0.00 0.00 70.33 67.07 3h03 n THR 119 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3h03 n PRO 120 N 3.74 3.17 -3.73 -2.82 -0.04 -1.26 -4.82 135.00 129.24 3h03 n PRO 120 Ca 0.18 -2.33 -0.16 0.00 -0.04 0.00 0.00 63.50 61.16 3h03 n PRO 120 Cb 0.26 -3.00 -0.16 0.00 -0.04 0.00 0.00 33.50 30.56 3h03 n PRO 120 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3h03 s ILE 121 N 2.79 -0.10 0.00 0.52 -1.09 -1.26 -5.01 121.20 117.05 3h03 s ILE 121 Ca 0.58 0.27 0.00 0.00 -2.23 0.00 0.00 60.65 59.27 3h03 s ILE 121 Cb 0.16 -0.17 0.00 0.00 -1.58 0.00 0.00 42.46 40.87 3h03 s ILE 121 CO -0.07 0.11 0.42 -0.62 -1.23 0.00 0.00 174.94 173.56 3h03 n GLU 122 N 4.59 0.06 -3.81 2.79 1.02 -1.26 -4.96 120.64 119.06 3h03 n GLU 122 Ca -0.19 -0.42 -0.03 0.00 -0.02 0.00 0.00 57.16 56.50 3h03 n GLU 122 Cb 0.50 -0.92 0.00 0.00 -0.02 0.00 0.00 31.44 31.01 3h03 n GLU 122 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3h03 s SER 123 N -0.13 -0.07 0.27 1.62 1.04 -1.26 -3.06 113.70 112.10 3h03 s SER 123 Ca 0.00 -0.56 0.01 0.00 0.48 0.00 0.00 55.95 55.89 3h03 s SER 123 Cb 0.00 0.49 0.36 0.00 0.10 0.00 0.00 66.02 66.98 3h03 s SER 123 CO 0.00 -0.95 1.70 0.00 0.98 0.00 0.00 173.24 174.96 3h03 h ALA 124 N 2.00 1.05 -0.68 5.32 0.00 -1.94 -2.39 119.26 122.62 3h03 h ALA 124 Ca -0.26 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.30 3h03 h ALA 124 Cb 1.22 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 3h03 h ALA 124 CO 0.31 0.58 0.44 1.49 0.00 0.00 0.00 179.25 182.07 3h03 h GLU 125 N 0.46 0.87 -0.27 0.00 4.22 -1.95 -0.22 114.58 117.69 3h03 h GLU 125 Ca 0.06 -0.05 -0.01 0.00 0.08 0.00 0.00 59.36 59.45 3h03 h GLU 125 Cb 0.70 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3h03 h GLU 125 CO 0.05 0.57 0.15 -0.44 -2.18 0.00 0.00 179.01 177.16 3h03 h ASP 126 N 0.89 0.33 -0.84 1.04 3.45 -1.85 -2.70 116.42 116.75 3h03 h ASP 126 Ca 0.26 -0.08 -0.02 0.00 0.43 0.00 0.00 57.03 57.61 3h03 h ASP 126 Cb -0.06 -0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 38.58 3h03 h ASP 126 CO -0.07 0.32 0.45 -0.07 -1.57 0.00 0.00 179.24 178.30 3h03 h LEU 127 N 0.32 1.06 -1.47 1.55 3.38 -1.01 -3.03 115.31 116.12 3h03 h LEU 127 Ca 0.09 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3h03 h LEU 127 Cb 0.06 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 3h03 h LEU 127 CO -0.02 0.87 -0.15 0.77 0.09 0.00 0.00 178.44 180.01 3h03 h SER 128 N 1.18 0.00 -0.40 -0.43 4.64 -0.82 -3.08 113.55 114.63 3h03 h SER 128 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3h03 h SER 128 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3h03 h SER 128 CO -0.04 0.15 0.00 0.29 -0.87 0.00 0.00 176.83 176.35 3h03 n LYS 129 N -3.39 2.20 -4.24 4.77 5.02 -1.04 -4.84 118.16 116.64 3h03 n LYS 129 Ca -0.00 -1.83 -0.14 0.00 -2.02 0.00 0.00 58.31 54.32 3h03 n LYS 129 Cb 0.34 -1.44 -0.10 0.00 -0.02 0.00 0.00 35.03 33.81 3h03 n LYS 129 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 3h03 s GLN 130 N -1.48 1.29 0.00 1.97 1.03 -1.17 -5.09 119.66 116.22 3h03 s GLN 130 Ca 0.36 -1.69 0.00 0.00 0.04 0.00 0.00 55.36 54.07 3h03 s GLN 130 Cb 0.20 0.14 0.00 0.00 0.03 0.00 0.00 33.01 33.38 3h03 s GLN 130 CO 0.27 -0.39 0.00 -2.37 -2.54 0.00 0.00 175.29 170.27 3h03 n THR 131 N -0.34 0.00 0.20 3.63 5.66 -1.26 -4.85 114.28 117.32 3h03 n THR 131 Ca 0.02 -0.06 0.06 0.00 -3.05 0.00 0.00 64.05 61.02 3h03 n THR 131 Cb 0.66 0.49 0.40 0.00 -1.55 0.00 0.00 70.33 70.33 3h03 n THR 131 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 3h03 h GLU 132 N 0.00 0.00 -4.93 1.09 4.11 -1.97 -3.38 114.58 109.50 3h03 h GLU 132 Ca 0.00 0.00 -0.68 0.00 0.07 0.00 0.00 59.36 58.75 3h03 h GLU 132 Cb 0.00 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.07 3h03 h GLU 132 CO 0.00 0.34 -0.22 0.42 0.07 0.00 0.00 179.01 179.63 3h03 s ILE 133 N -3.84 5.10 0.64 -1.06 1.01 -1.26 -4.93 121.20 116.86 3h03 s ILE 133 Ca -0.01 -0.17 -0.13 0.00 0.00 0.00 0.00 60.65 60.34 3h03 s ILE 133 Cb 0.12 -3.97 -0.02 0.00 0.01 0.00 0.00 42.46 38.60 3h03 s ILE 133 CO 0.68 -0.31 1.05 0.00 0.00 0.00 0.00 174.94 176.36 3h03 s ALA 134 N 2.13 2.80 -0.11 9.38 0.00 0.04 -4.86 121.76 131.14 3h03 s ALA 134 Ca 0.13 0.15 -0.20 0.00 0.00 0.00 0.00 51.96 52.03 3h03 s ALA 134 Cb -0.17 -3.17 0.05 0.00 0.00 0.00 0.00 23.12 19.83 3h03 s ALA 134 CO 0.13 -0.94 0.50 1.52 0.00 0.00 0.00 175.76 176.98 3h03 s TYR 135 N -2.87 -0.48 0.00 0.00 1.13 -1.26 0.02 117.35 113.88 3h03 s TYR 135 Ca 0.59 1.01 0.00 0.00 -1.41 0.00 0.00 57.07 57.26 3h03 s TYR 135 Cb -0.14 0.22 0.00 0.00 -1.10 0.00 0.00 41.96 40.95 3h03 s TYR 135 CO 0.48 -0.39 0.00 0.41 -2.51 0.00 0.00 175.55 173.53 3h03 n GLY 136 N 1.88 2.47 1.29 5.49 0.00 -1.02 -4.80 105.19 110.50 3h03 n GLY 136 Ca -0.17 -0.96 -0.06 0.00 0.00 0.00 0.00 46.02 44.83 3h03 n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h03 n THR 137 N 0.00 0.00 -1.88 2.61 -2.24 -1.23 -1.25 114.28 110.28 3h03 n THR 137 Ca 0.00 -0.74 -0.39 0.00 -2.27 0.00 0.00 64.05 60.65 3h03 n THR 137 Cb 0.00 0.43 0.02 0.00 -2.10 0.00 0.00 70.33 68.68 3h03 n THR 137 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3h03 s LEU 138 N 0.00 4.02 0.00 3.22 1.43 -1.26 -1.35 118.68 124.74 3h03 s LEU 138 Ca 0.12 2.75 0.13 0.00 -1.03 0.00 0.00 54.13 56.10 3h03 s LEU 138 Cb -0.00 -4.10 0.78 0.00 0.03 0.00 0.00 46.19 42.90 3h03 s LEU 138 CO 0.09 -1.25 1.21 -0.90 0.23 0.00 0.00 176.35 175.72 3h03 n ASP 139 N -0.50 0.00 -3.49 2.29 3.85 0.42 -4.56 116.55 114.56 3h03 n ASP 139 Ca 0.07 -0.41 -0.16 0.00 -0.71 0.00 0.00 54.79 53.59 3h03 n ASP 139 Cb 0.44 -0.00 -0.05 0.00 -1.35 0.00 0.00 41.12 40.16 3h03 n ASP 139 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 3h03 s SER 140 N -2.00 -0.62 0.00 -1.12 0.15 -1.26 -5.05 113.70 103.80 3h03 s SER 140 Ca 0.20 0.46 0.00 0.00 0.70 0.00 0.00 55.95 57.30 3h03 s SER 140 Cb 0.09 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 64.96 3h03 s SER 140 CO 0.15 -0.74 0.00 0.61 1.20 0.00 0.00 173.24 174.46 3h03 n GLY 141 N 0.45 0.76 0.25 9.45 0.00 -1.26 -4.77 105.19 110.07 3h03 n GLY 141 Ca -0.18 -2.31 -0.14 0.00 0.00 0.00 0.00 46.02 43.39 3h03 n GLY 141 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3h03 h SER 142 N 0.00 -0.56 -0.52 1.61 0.87 -1.99 -2.27 113.55 110.69 3h03 h SER 142 Ca 0.00 0.05 0.07 0.00 -1.23 0.00 0.00 61.79 60.68 3h03 h SER 142 Cb 0.00 0.19 -0.06 0.00 -0.44 0.00 0.00 62.40 62.09 3h03 h SER 142 CO 0.00 -0.32 0.18 0.74 -0.53 0.00 0.00 176.83 176.89 3h03 h THR 143 N -0.48 0.80 -0.29 2.23 2.02 -1.95 0.65 112.91 115.89 3h03 h THR 143 Ca -0.01 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.05 3h03 h THR 143 Cb 0.43 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 3h03 h THR 143 CO -0.03 0.06 0.19 0.50 0.37 0.00 0.00 175.52 176.62 3h03 h LYS 144 N 0.35 0.38 0.00 6.66 3.64 -1.78 -2.45 116.57 123.38 3h03 h LYS 144 Ca 0.25 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.56 3h03 h LYS 144 Cb 0.29 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3h03 h LYS 144 CO -0.27 0.26 -0.23 0.93 -2.27 0.00 0.00 179.45 177.87 3h03 h GLU 145 N 0.39 0.00 -0.40 1.90 4.39 -0.79 -2.19 114.58 117.89 3h03 h GLU 145 Ca 0.11 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.82 3h03 h GLU 145 Cb -0.04 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 3h03 h GLU 145 CO -0.02 0.23 0.24 0.35 -1.16 0.00 0.00 179.01 178.65 3h03 h PHE 146 N 0.00 0.46 -0.18 4.33 3.57 -0.40 -2.32 116.94 122.39 3h03 h PHE 146 Ca -0.00 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.39 3h03 h PHE 146 Cb 0.49 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.08 3h03 h PHE 146 CO 0.00 0.27 -0.36 0.74 -2.23 0.00 0.00 178.31 176.73 3h03 h PHE 147 N 0.49 0.72 -0.84 0.41 -1.00 -1.38 -2.76 116.94 112.59 3h03 h PHE 147 Ca 0.16 -0.26 0.11 0.00 2.81 0.00 0.00 57.97 60.79 3h03 h PHE 147 Cb -0.01 -0.13 -0.08 0.00 3.61 0.00 0.00 35.95 39.34 3h03 h PHE 147 CO -0.07 1.00 0.47 -0.09 -1.61 0.00 0.00 178.31 178.02 3h03 h ARG 148 N 0.24 0.72 -0.30 1.51 2.43 -1.27 -2.64 114.38 115.07 3h03 h ARG 148 Ca 0.01 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3h03 h ARG 148 Cb 0.96 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 3h03 h ARG 148 CO 0.08 0.48 0.00 2.89 -1.51 0.00 0.00 179.97 181.91 3h03 n ARG 149 N -4.78 2.34 -2.38 0.20 1.85 -0.89 -4.98 116.66 108.02 3h03 n ARG 149 Ca 0.15 -2.01 -0.41 0.00 -1.00 0.00 0.00 57.85 54.59 3h03 n ARG 149 Cb 0.34 -1.49 -0.04 0.00 -1.05 0.00 0.00 32.46 30.22 3h03 n ARG 149 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 3h03 s SER 150 N -1.58 7.13 0.00 2.89 0.15 -1.00 -4.91 113.70 116.39 3h03 s SER 150 Ca 0.36 2.34 0.22 0.00 0.70 0.00 0.00 55.95 59.57 3h03 s SER 150 Cb 0.21 -2.63 0.06 0.00 -1.71 0.00 0.00 66.02 61.95 3h03 s SER 150 CO 0.31 -0.27 1.11 0.29 1.20 0.00 0.00 173.24 175.88 3h03 n LYS 151 N 1.40 1.60 -2.33 5.44 4.01 -1.26 -4.51 118.16 122.51 3h03 n LYS 151 Ca 0.00 -1.28 -0.41 0.00 -0.51 0.00 0.00 58.31 56.11 3h03 n LYS 151 Cb 0.44 -1.44 -0.03 0.00 -0.51 0.00 0.00 35.03 33.49 3h03 n LYS 151 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3h03 s ILE 152 N -2.21 3.57 0.15 -0.18 -1.09 -1.26 -4.89 121.20 115.29 3h03 s ILE 152 Ca 0.21 1.24 -0.26 0.00 -2.23 0.00 0.00 60.65 59.60 3h03 s ILE 152 Cb 0.18 -3.79 0.00 0.00 -1.58 0.00 0.00 42.46 37.27 3h03 s ILE 152 CO 0.45 0.16 1.58 0.00 -1.23 0.00 0.00 174.94 175.91 3h03 h ALA 153 N 5.81 -0.40 -0.78 9.38 0.00 -1.99 0.17 119.26 131.46 3h03 h ALA 153 Ca -0.44 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 3h03 h ALA 153 Cb 1.21 0.82 -0.04 0.00 0.00 0.00 0.00 17.79 19.78 3h03 h ALA 153 CO 0.78 -0.84 0.49 0.28 0.00 0.00 0.00 179.25 179.96 3h03 h VAL 154 N -0.34 1.21 -0.12 0.00 2.07 -1.99 -1.61 116.25 115.48 3h03 h VAL 154 Ca 0.13 -0.44 -0.16 0.00 0.82 0.00 0.00 66.70 67.05 3h03 h VAL 154 Cb 0.58 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 3h03 h VAL 154 CO -0.53 0.22 -0.61 -0.26 0.02 0.00 0.00 177.57 176.41 3h03 h PHE 155 N 1.07 0.52 -0.67 1.57 0.04 -1.84 -1.79 116.94 115.83 3h03 h PHE 155 Ca 0.28 -0.20 -0.06 0.00 2.80 0.00 0.00 57.97 60.79 3h03 h PHE 155 Cb -0.07 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 37.96 3h03 h PHE 155 CO -0.01 0.91 0.17 0.22 -0.60 0.00 0.00 178.31 179.00 3h03 h ASP 156 N 0.30 0.99 -0.42 2.17 3.58 -0.43 0.08 116.42 122.69 3h03 h ASP 156 Ca -0.01 -0.20 -0.06 0.00 0.42 0.00 0.00 57.03 57.18 3h03 h ASP 156 Cb 1.15 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.92 3h03 h ASP 156 CO 0.11 0.95 0.01 0.50 -2.88 0.00 0.00 179.24 177.93 3h03 h LYS 157 N 1.01 0.74 -0.68 0.28 3.64 -1.13 0.14 116.57 120.56 3h03 h LYS 157 Ca 0.21 -0.23 -0.06 0.00 -1.27 0.00 0.00 60.65 59.31 3h03 h LYS 157 Cb 0.34 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 3h03 h LYS 157 CO -0.00 0.81 0.20 0.52 -2.27 0.00 0.00 179.45 178.71 3h03 h MET 158 N 0.58 1.07 -0.39 1.90 2.86 -1.02 -2.16 114.93 117.77 3h03 h MET 158 Ca 0.12 -0.23 -0.08 0.00 -2.06 0.00 0.00 59.70 57.44 3h03 h MET 158 Cb 0.47 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 3h03 h MET 158 CO 0.02 0.93 -0.08 2.35 1.06 0.00 0.00 176.91 181.19 3h03 h TRP 159 N 1.00 0.84 -0.68 -0.22 2.91 -0.73 -0.09 115.95 118.98 3h03 h TRP 159 Ca 0.22 -0.18 0.09 0.00 1.13 0.00 0.00 58.89 60.15 3h03 h TRP 159 Cb 0.31 -0.21 -0.04 0.00 -0.51 0.00 0.00 29.16 28.71 3h03 h TRP 159 CO 0.02 0.87 0.45 1.15 -1.03 0.00 0.00 178.44 179.91 3h03 h THR 160 N 0.56 0.94 0.19 2.65 2.02 -0.54 -0.39 112.91 118.33 3h03 h THR 160 Ca 0.10 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 3h03 h THR 160 Cb 0.59 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 3h03 h THR 160 CO 0.04 0.11 -0.09 0.22 0.37 0.00 0.00 175.52 176.16 3h03 h TYR 161 N 0.58 -0.24 -0.91 3.16 3.20 -1.01 -3.33 116.97 118.43 3h03 h TYR 161 Ca 0.31 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.28 3h03 h TYR 161 Cb 0.44 0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.72 3h03 h TYR 161 CO -0.00 0.11 0.58 0.52 -1.64 0.00 0.00 178.16 177.74 3h03 h MET 162 N -0.96 0.85 0.00 1.82 2.86 -0.65 -1.21 114.93 117.64 3h03 h MET 162 Ca -0.03 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 3h03 h MET 162 Cb 0.46 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 3h03 h MET 162 CO 0.04 0.56 -0.19 0.07 1.06 0.00 0.00 176.91 178.46 3h03 h ARG 163 N 0.87 0.00 -0.01 1.72 0.11 -1.21 -3.16 114.38 112.70 3h03 h ARG 163 Ca 0.43 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.51 3h03 h ARG 163 Cb 0.46 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.54 3h03 h ARG 163 CO -0.19 0.19 -0.19 0.43 0.10 0.00 0.00 179.97 180.31 3h03 n SER 164 N -4.09 1.53 -4.77 0.08 7.64 -0.82 -5.02 113.62 108.18 3h03 n SER 164 Ca -0.02 -1.26 -0.40 0.00 1.01 0.00 0.00 58.87 58.20 3h03 n SER 164 Cb 0.26 0.35 -0.01 0.00 -1.01 0.00 0.00 64.21 63.80 3h03 n SER 164 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h03 s ALA 165 N -1.41 3.33 -0.09 -0.43 0.00 -0.52 -5.03 121.76 117.60 3h03 s ALA 165 Ca 0.11 1.27 -0.05 0.00 0.00 0.00 0.00 51.96 53.29 3h03 s ALA 165 Cb 0.10 -3.50 0.04 0.00 0.00 0.00 0.00 23.12 19.76 3h03 s ALA 165 CO 0.27 -0.81 0.22 -2.00 0.00 0.00 0.00 175.76 173.43 3h03 s GLU 166 N -2.14 0.20 0.79 0.00 -6.30 -1.26 -3.89 118.70 106.10 3h03 s GLU 166 Ca 0.55 0.44 -0.14 0.00 -2.50 0.00 0.00 54.97 53.31 3h03 s GLU 166 Cb -0.39 -0.06 0.04 0.00 0.00 0.00 0.00 34.13 33.72 3h03 s GLU 166 CO 0.51 -0.13 0.98 -2.30 0.02 0.00 0.00 175.26 174.34 3h03 n PRO 167 N 3.87 0.24 -1.59 4.30 -0.02 -1.26 -5.06 135.00 135.47 3h03 n PRO 167 Ca -0.22 0.14 -0.47 0.00 -2.02 0.00 0.00 63.50 60.94 3h03 n PRO 167 Cb 0.54 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.75 3h03 n PRO 167 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3h03 n SER 168 N -2.28 1.40 -0.61 2.55 2.88 -1.25 -4.87 113.62 111.44 3h03 n SER 168 Ca 0.12 1.16 0.13 0.00 -1.33 0.00 0.00 58.87 58.95 3h03 n SER 168 Cb 0.50 -1.26 0.36 0.00 -0.75 0.00 0.00 64.21 63.06 3h03 n SER 168 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3h03 n VAL 169 N 1.04 0.00 -3.38 2.46 0.24 -1.26 -4.91 118.33 112.52 3h03 n VAL 169 Ca 0.13 -0.32 -0.33 0.00 -2.04 0.00 0.00 64.34 61.78 3h03 n VAL 169 Cb 0.28 0.83 -0.06 0.00 -1.47 0.00 0.00 33.84 33.43 3h03 n VAL 169 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 3h03 s PHE 170 N -2.07 3.48 0.18 6.34 0.40 -1.26 -3.58 117.98 121.47 3h03 s PHE 170 Ca 0.33 0.96 0.10 0.00 -0.60 0.00 0.00 56.93 57.72 3h03 s PHE 170 Cb 0.20 -2.31 -0.04 0.00 0.51 0.00 0.00 43.02 41.38 3h03 s PHE 170 CO 0.35 0.31 -0.22 0.14 0.70 0.00 0.00 175.22 176.50 3h03 s VAL 171 N -1.71 2.14 -0.11 -0.44 -7.23 -0.46 -4.81 120.40 107.79 3h03 s VAL 171 Ca 0.45 -1.96 0.14 0.00 -1.81 0.00 0.00 61.98 58.80 3h03 s VAL 171 Cb -0.12 -1.99 0.03 0.00 0.56 0.00 0.00 36.38 34.85 3h03 s VAL 171 CO 0.20 -0.17 1.43 0.03 -0.31 0.00 0.00 175.10 176.29 3h03 h ARG 172 N 3.30 0.00 -4.07 4.82 3.08 -1.96 0.12 114.38 119.67 3h03 h ARG 172 Ca -0.45 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.46 3h03 h ARG 172 Cb 1.20 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 31.13 3h03 h ARG 172 CO 0.48 0.57 -0.35 0.95 -1.07 0.00 0.00 179.97 180.54 3h03 s THR 173 N -2.95 0.01 0.17 2.04 -4.23 -1.26 -4.86 115.64 104.56 3h03 s THR 173 Ca 0.03 -1.66 -0.09 0.00 -1.18 0.00 0.00 61.69 58.79 3h03 s THR 173 Cb 0.08 -2.29 0.03 0.00 1.34 0.00 0.00 72.50 71.66 3h03 s THR 173 CO 0.75 -0.04 1.59 0.74 -0.54 0.00 0.00 174.62 177.13 3h03 h THR 174 N 2.44 1.27 -0.79 3.99 2.02 -1.99 -1.90 112.91 117.94 3h03 h THR 174 Ca -0.31 -1.30 0.04 0.00 0.77 0.00 0.00 66.41 65.61 3h03 h THR 174 Cb 1.25 1.00 -0.05 0.00 -1.74 0.00 0.00 68.15 68.60 3h03 h THR 174 CO 0.44 0.46 0.50 0.00 0.37 0.00 0.00 175.52 177.29 3h03 h ALA 175 N 0.93 1.05 -0.35 6.16 0.00 -1.99 -0.61 119.26 124.45 3h03 h ALA 175 Ca 0.13 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 3h03 h ALA 175 Cb 0.71 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3h03 h ALA 175 CO 0.05 0.29 -0.22 1.49 0.00 0.00 0.00 179.25 180.87 3h03 h GLU 176 N 0.96 0.68 -0.03 0.00 4.81 -1.91 -0.22 114.58 118.87 3h03 h GLU 176 Ca 0.32 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3h03 h GLU 176 Cb 0.04 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 3h03 h GLU 176 CO -0.12 0.84 0.01 0.78 -0.73 0.00 0.00 179.01 179.79 3h03 h GLY 177 N 0.99 0.05 0.97 1.92 0.00 -0.52 -1.03 103.07 105.45 3h03 h GLY 177 Ca 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 3h03 h GLY 177 CO 0.05 0.03 0.23 -2.08 0.00 0.00 0.00 176.54 174.77 3h03 h VAL 178 N -0.16 1.20 -0.52 4.60 2.07 -1.06 -1.87 116.25 120.50 3h03 h VAL 178 Ca 0.01 -0.57 -0.03 0.00 0.82 0.00 0.00 66.70 66.93 3h03 h VAL 178 Cb 0.22 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 3h03 h VAL 178 CO -0.00 0.22 0.18 0.00 0.02 0.00 0.00 177.57 177.99 3h03 h ALA 179 N 1.07 1.34 -0.50 1.67 0.00 -1.00 -1.62 119.26 120.22 3h03 h ALA 179 Ca 0.17 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3h03 h ALA 179 Cb 0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3h03 h ALA 179 CO -0.02 0.48 0.10 -0.09 0.00 0.00 0.00 179.25 179.73 3h03 h ARG 180 N 0.75 0.82 -0.31 0.00 2.43 -0.71 -1.21 114.38 116.14 3h03 h ARG 180 Ca 0.18 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 3h03 h ARG 180 Cb 0.20 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 3h03 h ARG 180 CO -0.01 0.80 0.17 0.28 -1.51 0.00 0.00 179.97 179.70 3h03 h VAL 181 N 0.70 1.13 0.00 0.20 2.07 -0.92 -0.87 116.25 118.56 3h03 h VAL 181 Ca 0.15 -0.33 -0.06 0.00 0.82 0.00 0.00 66.70 67.29 3h03 h VAL 181 Cb 0.37 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 3h03 h VAL 181 CO 0.01 0.13 -0.27 0.03 0.02 0.00 0.00 177.57 177.48 3h03 h ARG 182 N 0.39 0.00 -0.01 1.57 3.08 -1.06 -3.20 114.38 115.15 3h03 h ARG 182 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 3h03 h ARG 182 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 3h03 h ARG 182 CO -0.02 0.27 -0.34 1.63 -1.07 0.00 0.00 179.97 180.44 3h03 n LYS 183 N -4.04 1.64 -0.00 0.04 5.02 -0.48 -4.45 118.16 115.88 3h03 n LYS 183 Ca -0.02 -0.83 0.12 0.00 -2.02 0.00 0.00 58.31 55.56 3h03 n LYS 183 Cb 0.34 -1.29 0.68 0.00 -0.02 0.00 0.00 35.03 34.74 3h03 n LYS 183 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3h03 n SER 184 N -0.10 0.16 -3.73 4.39 7.64 -0.34 -4.92 113.62 116.72 3h03 n SER 184 Ca 0.07 -1.29 -0.22 0.00 1.01 0.00 0.00 58.87 58.44 3h03 n SER 184 Cb 0.35 -0.01 0.02 0.00 -1.01 0.00 0.00 64.21 63.57 3h03 n SER 184 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3h03 n LYS 185 N -0.76 -4.55 -1.01 1.43 5.02 -1.26 -1.70 118.16 115.32 3h03 n LYS 185 Ca 0.18 0.59 -0.00 0.00 -2.02 0.00 0.00 58.31 57.05 3h03 n LYS 185 Cb 0.11 -5.06 -0.00 0.00 -0.02 0.00 0.00 35.03 30.06 3h03 n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h03 n GLY 186 N -1.63 0.40 0.95 0.72 0.00 -1.26 -4.91 105.19 99.46 3h03 n GLY 186 Ca -0.30 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 45.75 3h03 n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h03 n LYS 187 N -2.04 2.54 -3.77 1.61 4.76 -0.69 -4.79 118.16 115.77 3h03 n LYS 187 Ca -0.00 -2.21 -0.13 0.00 -2.87 0.00 0.00 58.31 53.09 3h03 n LYS 187 Cb 0.13 -1.41 -0.14 0.00 -1.84 0.00 0.00 35.03 31.78 3h03 n LYS 187 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3h03 s TYR 188 N -1.09 -0.16 -0.01 2.13 5.04 -1.25 -0.78 117.35 121.22 3h03 s TYR 188 Ca 0.33 0.45 0.06 0.00 -2.44 0.00 0.00 57.07 55.48 3h03 s TYR 188 Cb 0.18 -0.04 -0.03 0.00 0.35 0.00 0.00 41.96 42.43 3h03 s TYR 188 CO 0.24 -0.14 -0.19 0.00 -1.34 0.00 0.00 175.55 174.13 3h03 s ALA 189 N 0.84 2.51 -0.12 3.97 0.00 0.10 -4.54 121.76 124.52 3h03 s ALA 189 Ca -0.06 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.81 3h03 s ALA 189 Cb -0.08 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.24 3h03 s ALA 189 CO -0.04 0.55 -0.13 -0.47 0.00 0.00 0.00 175.76 175.67 3h03 s TYR 190 N -0.77 2.80 -0.31 0.00 5.04 -0.41 -2.43 117.35 121.28 3h03 s TYR 190 Ca 0.12 -0.58 -0.14 0.00 -2.44 0.00 0.00 57.07 54.04 3h03 s TYR 190 Cb -0.10 -1.82 -0.03 0.00 0.35 0.00 0.00 41.96 40.36 3h03 s TYR 190 CO 0.02 -0.16 0.30 -0.51 -1.34 0.00 0.00 175.55 173.86 3h03 s LEU 191 N 0.21 4.25 0.33 6.97 1.43 -0.38 -0.63 118.68 130.84 3h03 s LEU 191 Ca -0.08 -0.08 -0.05 0.00 -1.03 0.00 0.00 54.13 52.90 3h03 s LEU 191 Cb -0.15 -2.27 0.00 0.00 0.03 0.00 0.00 46.19 43.80 3h03 s LEU 191 CO 0.05 -0.21 0.48 -1.48 0.23 0.00 0.00 176.35 175.42 3h03 s LEU 192 N 1.92 0.87 0.25 1.79 2.34 -0.48 -4.60 118.68 120.76 3h03 s LEU 192 Ca 0.10 -1.39 -0.31 0.00 0.06 0.00 0.00 54.13 52.60 3h03 s LEU 192 Cb -0.16 1.54 -0.11 0.00 -0.56 0.00 0.00 46.19 46.90 3h03 s LEU 192 CO 0.11 -1.28 1.63 -1.61 -1.06 0.00 0.00 176.35 174.14 3h03 s GLU 193 N -3.18 4.13 0.28 1.48 2.02 -1.26 -0.44 118.70 121.73 3h03 s GLU 193 Ca 0.29 2.56 0.02 0.00 0.02 0.00 0.00 54.97 57.86 3h03 s GLU 193 Cb -0.00 -3.05 0.59 0.00 0.10 0.00 0.00 34.13 31.76 3h03 s GLU 193 CO 0.18 -0.67 1.81 0.66 0.02 0.00 0.00 175.26 177.26 3h03 h SER 194 N 5.70 0.83 -0.60 -0.19 4.64 -1.04 -1.56 113.55 121.33 3h03 h SER 194 Ca -0.45 0.07 0.05 0.00 -0.47 0.00 0.00 61.79 60.98 3h03 h SER 194 Cb 1.21 -0.09 -0.05 0.00 -0.31 0.00 0.00 62.40 63.16 3h03 h SER 194 CO 0.86 0.40 0.33 0.71 -0.87 0.00 0.00 176.83 178.26 3h03 h THR 195 N 0.88 0.99 -0.37 2.95 1.35 -1.90 0.29 112.91 117.10 3h03 h THR 195 Ca 0.51 -0.22 -0.15 0.00 -0.55 0.00 0.00 66.41 66.00 3h03 h THR 195 Cb 0.60 0.30 -0.01 0.00 -1.73 0.00 0.00 68.15 67.32 3h03 h THR 195 CO -0.31 0.12 -0.35 -0.03 -0.25 0.00 0.00 175.52 174.70 3h03 h MET 196 N 0.63 0.86 0.07 4.72 -1.53 -1.77 -2.02 114.93 115.89 3h03 h MET 196 Ca 0.26 -0.43 -0.00 0.00 -3.44 0.00 0.00 59.70 56.09 3h03 h MET 196 Cb 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.18 3h03 h MET 196 CO -0.15 1.07 -0.03 -0.97 0.14 0.00 0.00 176.91 176.96 3h03 h ASN 197 N 0.71 -0.08 -0.93 1.39 -0.73 -0.62 -1.06 115.58 114.26 3h03 h ASN 197 Ca 0.07 -0.03 0.04 0.00 1.87 0.00 0.00 56.30 58.25 3h03 h ASN 197 Cb 0.92 0.02 -0.05 0.00 0.27 0.00 0.00 38.32 39.48 3h03 h ASN 197 CO 0.09 -0.03 0.61 -0.33 -0.37 0.00 0.00 177.43 177.40 3h03 h GLU 198 N -0.12 1.12 0.17 6.67 5.08 -0.38 -1.72 114.58 125.41 3h03 h GLU 198 Ca -0.01 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3h03 h GLU 198 Cb 0.10 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.10 3h03 h GLU 198 CO 0.02 0.74 -0.08 -0.92 -1.00 0.00 0.00 179.01 177.76 3h03 h TYR 199 N 1.16 -0.22 -0.22 4.33 3.20 -1.08 -3.10 116.97 121.04 3h03 h TYR 199 Ca 0.37 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.24 3h03 h TYR 199 Cb 0.04 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 3h03 h TYR 199 CO -0.00 0.08 0.13 0.82 -1.64 0.00 0.00 178.16 177.55 3h03 h ILE 200 N -0.52 1.06 0.00 1.81 1.08 -1.02 -0.64 117.51 119.28 3h03 h ILE 200 Ca -0.02 -0.14 -0.01 0.00 -0.39 0.00 0.00 64.86 64.30 3h03 h ILE 200 Cb 0.40 0.76 -0.00 0.00 -3.07 0.00 0.00 36.82 34.91 3h03 h ILE 200 CO 0.04 0.06 -0.04 -0.08 -0.69 0.00 0.00 178.15 177.45 3h03 h GLU 201 N 0.29 0.00 -0.61 2.37 4.81 -1.24 -2.02 114.58 118.18 3h03 h GLU 201 Ca 0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3h03 h GLU 201 Cb -0.01 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.37 3h03 h GLU 201 CO -0.02 0.04 0.00 1.04 -0.73 0.00 0.00 179.01 179.34 3h03 n GLN 202 N -3.51 3.16 -4.48 1.92 1.13 -0.25 -4.81 117.38 110.54 3h03 n GLN 202 Ca -0.02 -2.66 -0.31 0.00 -1.94 0.00 0.00 57.00 52.07 3h03 n GLN 202 Cb 0.14 -1.65 -0.11 0.00 0.11 0.00 0.00 30.24 28.73 3h03 n GLN 202 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3h03 s ARG 203 N -1.42 2.34 0.73 -1.09 1.81 -0.76 0.09 118.95 120.64 3h03 s ARG 203 Ca 0.45 -0.85 -0.16 0.00 -1.72 0.00 0.00 55.73 53.45 3h03 s ARG 203 Cb 0.26 -2.38 0.03 0.00 -0.45 0.00 0.00 34.95 32.42 3h03 s ARG 203 CO 0.26 0.57 1.23 1.63 -0.68 0.00 0.00 175.30 178.30 3h03 n LYS 204 N 1.40 0.65 -0.03 3.54 4.76 -1.26 -1.42 118.16 125.81 3h03 n LYS 204 Ca -0.15 0.29 0.00 0.00 -2.87 0.00 0.00 58.31 55.58 3h03 n LYS 204 Cb 0.52 -2.47 0.01 0.00 -1.84 0.00 0.00 35.03 31.26 3h03 n LYS 204 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 3h03 n PRO 205 N -2.51 1.11 -3.61 1.97 -0.04 -1.26 -4.94 135.00 125.72 3h03 n PRO 205 Ca 0.15 -0.11 -0.22 0.00 -0.04 0.00 0.00 63.50 63.28 3h03 n PRO 205 Cb 0.49 -1.32 0.06 0.00 -0.04 0.00 0.00 33.50 32.69 3h03 n PRO 205 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h03 n ASP 207 N -3.04 2.36 -4.63 0.00 5.75 -1.26 -4.99 116.55 110.74 3h03 n ASP 207 Ca -0.16 -1.68 -0.23 0.00 -0.01 0.00 0.00 54.79 52.70 3h03 n ASP 207 Cb 0.62 -0.09 -0.08 0.00 -1.03 0.00 0.00 41.12 40.54 3h03 n ASP 207 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3h03 s THR 208 N -0.99 3.16 -0.02 2.12 -4.23 -1.26 -0.47 115.64 113.94 3h03 s THR 208 Ca 0.18 -1.96 -0.04 0.00 -1.18 0.00 0.00 61.69 58.69 3h03 s THR 208 Cb 0.11 -2.79 0.00 0.00 1.34 0.00 0.00 72.50 71.16 3h03 s THR 208 CO 0.16 -0.33 0.09 -0.32 -0.54 0.00 0.00 174.62 173.68 3h03 s MET 209 N -3.68 0.24 -0.24 3.99 1.75 0.22 -4.75 119.30 116.84 3h03 s MET 209 Ca 0.32 -0.12 -0.13 0.00 -1.25 0.00 0.00 55.69 54.51 3h03 s MET 209 Cb -0.05 0.10 -0.04 0.00 2.84 0.00 0.00 34.83 37.68 3h03 s MET 209 CO 0.20 -0.05 0.28 0.21 -0.65 0.00 0.00 175.02 175.01 3h03 s LYS 210 N -0.56 4.09 0.11 4.11 2.20 -1.26 -0.97 119.74 127.45 3h03 s LYS 210 Ca -0.06 -0.07 0.09 0.00 -0.36 0.00 0.00 55.97 55.57 3h03 s LYS 210 Cb -0.04 -3.57 -0.04 0.00 -1.51 0.00 0.00 37.83 32.68 3h03 s LYS 210 CO 0.00 -0.05 -0.23 0.14 -0.36 0.00 0.00 175.35 174.86 3h03 s VAL 211 N 1.37 1.89 0.19 4.02 -7.23 -0.36 -5.02 120.40 115.26 3h03 s VAL 211 Ca 0.12 -1.60 0.00 0.00 -1.81 0.00 0.00 61.98 58.69 3h03 s VAL 211 Cb -0.14 -1.70 0.00 0.00 0.56 0.00 0.00 36.38 35.10 3h03 s VAL 211 CO 0.07 -0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.47 3h03 n GLY 212 N 1.05 -2.16 3.92 2.32 0.00 -1.17 -3.81 105.19 105.33 3h03 n GLY 212 Ca -0.19 -1.34 -0.28 0.00 0.00 0.00 0.00 46.02 44.21 3h03 n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h03 s GLY 213 N -5.72 1.66 0.48 -0.02 0.00 -1.26 -4.85 107.32 97.60 3h03 s GLY 213 Ca 0.00 -0.86 -0.23 0.00 0.00 0.00 0.00 44.72 43.63 3h03 s GLY 213 CO 0.00 -0.32 1.18 -1.31 0.00 0.00 0.00 173.10 172.65 3h03 s ASN 214 N -4.64 6.03 0.16 1.64 0.01 -1.26 -4.82 114.94 112.06 3h03 s ASN 214 Ca 0.64 2.35 0.15 0.00 -0.71 0.00 0.00 52.86 55.30 3h03 s ASN 214 Cb -0.09 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 38.91 3h03 s ASN 214 CO 0.49 -1.01 1.13 -0.07 -1.51 0.00 0.00 177.10 176.13 3h03 h LEU 215 N 1.92 0.00 0.00 0.60 3.38 -0.76 -3.47 115.31 116.98 3h03 h LEU 215 Ca -0.50 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.47 3h03 h LEU 215 Cb 1.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 3h03 h LEU 215 CO 0.60 0.57 -0.00 -0.90 0.09 0.00 0.00 178.44 178.79 3h03 n ASP 216 N -3.07 -0.01 -3.79 -0.43 5.75 -1.26 -4.92 116.55 108.82 3h03 n ASP 216 Ca -0.04 -1.01 -0.13 0.00 -0.01 0.00 0.00 54.79 53.60 3h03 n ASP 216 Cb 0.80 0.01 -0.13 0.00 -1.03 0.00 0.00 41.12 40.78 3h03 n ASP 216 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3h03 s SER 217 N -1.01 -0.19 0.32 -1.12 0.15 -1.26 -4.14 113.70 106.44 3h03 s SER 217 Ca 0.00 0.38 -0.19 0.00 0.70 0.00 0.00 55.95 56.85 3h03 s SER 217 Cb -0.00 0.36 0.04 0.00 -1.71 0.00 0.00 66.02 64.71 3h03 s SER 217 CO 0.00 -0.09 0.79 -1.59 1.20 0.00 0.00 173.24 173.55 3h03 s LYS 218 N 0.38 1.93 0.05 5.44 -2.85 -0.35 -4.99 119.74 119.35 3h03 s LYS 218 Ca -0.02 -1.17 -0.04 0.00 -1.00 0.00 0.00 55.97 53.74 3h03 s LYS 218 Cb -0.04 0.59 -0.02 0.00 -2.06 0.00 0.00 37.83 36.30 3h03 s LYS 218 CO -0.02 -0.90 0.05 0.20 0.10 0.00 0.00 175.35 174.79 3h03 s GLY 219 N -3.02 0.30 0.02 0.59 0.00 -1.26 -0.99 107.32 102.95 3h03 s GLY 219 Ca 0.14 -0.88 -0.09 0.00 0.00 0.00 0.00 44.72 43.89 3h03 s GLY 219 CO 0.09 -1.01 0.33 -0.19 0.00 0.00 0.00 173.10 172.32 3h03 s TYR 220 N -3.45 3.61 0.09 1.90 2.02 -0.55 -0.67 117.35 120.30 3h03 s TYR 220 Ca 0.02 0.73 -0.00 0.00 -0.37 0.00 0.00 57.07 57.45 3h03 s TYR 220 Cb 0.04 -2.10 -0.04 0.00 -0.40 0.00 0.00 41.96 39.46 3h03 s TYR 220 CO -0.08 0.59 -0.01 0.20 -1.57 0.00 0.00 175.55 174.68 3h03 s GLY 221 N -1.55 0.72 -0.04 0.71 0.00 -0.67 -1.12 107.32 105.38 3h03 s GLY 221 Ca 0.28 -1.33 -0.22 0.00 0.00 0.00 0.00 44.72 43.44 3h03 s GLY 221 CO 0.15 -1.38 0.66 -0.42 0.00 0.00 0.00 173.10 172.11 3h03 s ILE 222 N -3.87 4.97 -0.06 0.90 1.01 -1.26 -4.51 121.20 118.38 3h03 s ILE 222 Ca 0.13 1.37 -0.02 0.00 0.00 0.00 0.00 60.65 62.13 3h03 s ILE 222 Cb 0.07 -4.00 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 3h03 s ILE 222 CO -0.05 0.33 0.03 0.00 0.00 0.00 0.00 174.94 175.25 3h03 s ALA 223 N 0.36 3.42 0.02 9.38 0.00 -0.64 -0.69 121.76 133.60 3h03 s ALA 223 Ca 0.35 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.47 3h03 s ALA 223 Cb -0.18 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.38 3h03 s ALA 223 CO 0.18 0.62 0.03 0.95 0.00 0.00 0.00 175.76 177.53 3h03 s THR 224 N -0.99 0.11 0.75 0.00 -4.23 -0.20 -0.59 115.64 110.49 3h03 s THR 224 Ca 0.16 -0.92 -0.14 0.00 -1.18 0.00 0.00 61.69 59.61 3h03 s THR 224 Cb -0.12 -0.43 0.05 0.00 1.34 0.00 0.00 72.50 73.34 3h03 s THR 224 CO 0.06 -0.51 1.17 -2.84 -0.54 0.00 0.00 174.62 171.96 3h03 s PRO 225 N -1.68 2.12 0.30 3.99 0.02 -1.26 -0.16 135.00 138.32 3h03 s PRO 225 Ca -0.13 1.62 -0.30 0.00 0.02 0.00 0.00 61.00 62.21 3h03 s PRO 225 Cb -0.08 -1.85 -0.11 0.00 0.02 0.00 0.00 34.50 32.49 3h03 s PRO 225 CO -0.01 -1.82 1.53 0.15 -0.33 0.00 0.00 177.00 176.52 3h03 s LYS 226 N -4.12 4.16 0.00 5.54 -0.14 -1.26 -1.82 119.74 122.10 3h03 s LYS 226 Ca 0.71 2.50 0.00 0.00 -1.36 0.00 0.00 55.97 57.82 3h03 s LYS 226 Cb -0.26 -3.04 0.00 0.00 -1.68 0.00 0.00 37.83 32.86 3h03 s LYS 226 CO 0.47 -0.55 0.00 0.41 -0.76 0.00 0.00 175.35 174.92 3h03 n GLY 227 N 1.88 0.60 3.77 -3.33 0.00 -1.26 -5.00 105.19 101.85 3h03 n GLY 227 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3h03 n GLY 227 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h03 s SER 228 N -2.33 6.33 0.14 1.61 0.15 -0.76 -4.87 113.70 113.96 3h03 s SER 228 Ca 0.00 2.93 0.20 0.00 0.70 0.00 0.00 55.95 59.78 3h03 s SER 228 Cb 0.00 -2.66 0.84 0.00 -1.71 0.00 0.00 66.02 62.49 3h03 s SER 228 CO 0.00 -0.87 1.63 -1.54 1.20 0.00 0.00 173.24 173.66 3h03 n SER 229 N 0.37 0.37 0.01 5.45 3.41 -1.26 -2.82 113.62 119.14 3h03 n SER 229 Ca 0.02 0.58 -0.04 0.00 -0.26 0.00 0.00 58.87 59.17 3h03 n SER 229 Cb 0.41 -0.66 -0.11 0.00 -0.26 0.00 0.00 64.21 63.58 3h03 n SER 229 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3h03 h LEU 230 N 0.00 0.00 -0.87 1.04 3.38 -1.96 -3.42 115.31 113.48 3h03 h LEU 230 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 3h03 h LEU 230 Cb 0.35 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.99 3h03 h LEU 230 CO 0.00 0.77 -0.49 0.61 0.09 0.00 0.00 178.44 179.41 3h03 n GLY 231 N 1.46 -2.21 0.20 0.83 0.00 -1.13 -1.17 105.19 103.18 3h03 n GLY 231 Ca -0.12 1.03 -0.15 0.00 0.00 0.00 0.00 46.02 46.78 3h03 n GLY 231 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3h03 h ASN 232 N 0.00 -0.38 -0.92 1.61 -1.24 -1.81 -2.50 115.58 110.33 3h03 h ASN 232 Ca 0.16 0.01 0.04 0.00 0.71 0.00 0.00 56.30 57.23 3h03 h ASN 232 Cb 0.38 0.10 -0.06 0.00 0.73 0.00 0.00 38.32 39.47 3h03 h ASN 232 CO -0.83 -0.27 0.60 0.00 -1.29 0.00 0.00 177.43 175.65 3h03 h ALA 233 N 0.22 1.43 -0.31 1.57 0.00 -1.76 -2.07 119.26 118.35 3h03 h ALA 233 Ca -0.05 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 3h03 h ALA 233 Cb 0.34 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3h03 h ALA 233 CO 0.08 0.46 -0.19 0.28 0.00 0.00 0.00 179.25 179.88 3h03 h VAL 234 N 1.13 1.26 -0.12 0.00 2.07 -1.04 -1.06 116.25 118.49 3h03 h VAL 234 Ca 0.38 -1.19 -0.03 0.00 0.82 0.00 0.00 66.70 66.68 3h03 h VAL 234 Cb 0.06 1.22 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 3h03 h VAL 234 CO -0.12 0.39 -0.04 -1.13 0.02 0.00 0.00 177.57 176.68 3h03 h ASN 235 N 0.51 0.24 0.22 0.57 -1.24 -0.93 -2.08 115.58 112.87 3h03 h ASN 235 Ca 0.08 -0.39 -0.06 0.00 0.71 0.00 0.00 56.30 56.64 3h03 h ASN 235 Cb 0.61 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.59 3h03 h ASN 235 CO 0.04 0.58 -0.25 -0.07 -1.29 0.00 0.00 177.43 176.43 3h03 h LEU 236 N -0.10 0.06 -0.38 0.34 3.38 -1.31 -2.51 115.31 114.79 3h03 h LEU 236 Ca 0.03 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3h03 h LEU 236 Cb 0.48 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 3h03 h LEU 236 CO 0.01 0.32 0.12 0.00 0.09 0.00 0.00 178.44 178.98 3h03 h ALA 237 N 1.69 0.49 -0.76 1.53 0.00 -0.99 -1.06 119.26 120.16 3h03 h ALA 237 Ca 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3h03 h ALA 237 Cb 0.48 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 3h03 h ALA 237 CO 0.03 0.13 0.43 0.28 0.00 0.00 0.00 179.25 180.13 3h03 h VAL 238 N 0.46 1.22 -0.61 0.00 2.07 -0.96 -1.07 116.25 117.36 3h03 h VAL 238 Ca 0.12 -0.53 -0.05 0.00 0.82 0.00 0.00 66.70 67.05 3h03 h VAL 238 Cb 0.25 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 3h03 h VAL 238 CO -0.00 0.24 0.17 -0.07 0.02 0.00 0.00 177.57 177.92 3h03 h LEU 239 N 1.04 0.91 -0.32 2.57 3.38 -1.27 -2.08 115.31 119.53 3h03 h LEU 239 Ca 0.27 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3h03 h LEU 239 Cb 0.01 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3h03 h LEU 239 CO -0.05 0.89 0.10 0.50 0.09 0.00 0.00 178.44 179.97 3h03 h LYS 240 N 0.88 0.50 -0.84 1.13 3.64 -0.79 -1.55 116.57 119.52 3h03 h LYS 240 Ca 0.19 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3h03 h LYS 240 Cb 0.33 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 3h03 h LYS 240 CO -0.00 0.54 0.53 -0.07 -2.27 0.00 0.00 179.45 178.18 3h03 h LEU 241 N 0.36 0.99 -0.08 5.20 3.38 -1.11 0.89 115.31 124.94 3h03 h LEU 241 Ca 0.10 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3h03 h LEU 241 Cb 0.25 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3h03 h LEU 241 CO -0.00 0.74 -0.01 -1.13 0.09 0.00 0.00 178.44 178.12 3h03 h ASN 242 N 1.15 0.14 0.02 -0.43 -0.00 -1.20 0.23 115.58 115.50 3h03 h ASN 242 Ca 0.31 -0.35 -0.03 0.00 -0.00 0.00 0.00 56.30 56.23 3h03 h ASN 242 Cb -0.09 -0.04 -0.01 0.00 -0.00 0.00 0.00 38.32 38.18 3h03 h ASN 242 CO -0.06 0.46 -0.08 -0.33 -0.00 0.00 0.00 177.43 177.42 3h03 h GLU 243 N -0.18 0.15 0.00 6.67 5.08 -0.92 -0.36 114.58 125.02 3h03 h GLU 243 Ca 0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3h03 h GLU 243 Cb 0.39 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3h03 h GLU 243 CO 0.01 0.24 0.00 1.04 -1.00 0.00 0.00 179.01 179.29 3h03 n GLN 244 N -4.36 0.02 -0.74 2.33 6.02 0.28 -4.88 117.38 116.05 3h03 n GLN 244 Ca -0.01 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 57.09 3h03 n GLN 244 Cb 0.20 -1.52 0.00 0.00 1.02 0.00 0.00 30.24 29.94 3h03 n GLN 244 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3h03 n GLY 245 N 0.92 0.78 0.29 1.08 0.00 -0.14 -4.96 105.19 103.17 3h03 n GLY 245 Ca 0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 3h03 n GLY 245 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3h03 h LEU 246 N 0.00 0.90 -0.81 0.99 5.85 -1.16 -2.29 115.31 118.80 3h03 h LEU 246 Ca 0.00 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 3h03 h LEU 246 Cb 0.00 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.76 3h03 h LEU 246 CO 0.00 0.80 0.48 -0.07 -0.34 0.00 0.00 178.44 179.31 3h03 h LEU 247 N 0.95 0.98 -0.80 2.25 3.38 -1.84 -1.32 115.31 118.91 3h03 h LEU 247 Ca 0.23 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 3h03 h LEU 247 Cb 0.15 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3h03 h LEU 247 CO -0.03 0.76 -0.29 0.44 0.09 0.00 0.00 178.44 179.42 3h03 h ASP 248 N 1.11 0.58 -0.63 -0.43 3.32 -1.85 -1.70 116.42 116.83 3h03 h ASP 248 Ca 0.29 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 3h03 h ASP 248 Cb -0.03 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 3h03 h ASP 248 CO -0.05 0.85 0.14 0.50 -1.72 0.00 0.00 179.24 178.95 3h03 h LYS 249 N 0.49 1.02 -0.50 3.56 3.64 -0.91 -1.29 116.57 122.58 3h03 h LYS 249 Ca 0.06 -0.25 -0.07 0.00 -1.27 0.00 0.00 60.65 59.12 3h03 h LYS 249 Cb 0.75 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 3h03 h LYS 249 CO 0.06 0.93 0.03 -0.07 -2.27 0.00 0.00 179.45 178.13 3h03 h LEU 250 N 0.94 0.84 -0.07 5.20 4.07 -1.06 -0.39 115.31 124.83 3h03 h LEU 250 Ca 0.20 -0.29 -0.00 0.00 0.08 0.00 0.00 57.88 57.87 3h03 h LEU 250 Cb 0.38 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.89 3h03 h LEU 250 CO 0.00 0.92 0.04 0.50 -1.08 0.00 0.00 178.44 178.83 3h03 h LYS 251 N 0.73 0.10 -0.84 1.13 1.63 -1.11 -2.03 116.57 116.18 3h03 h LYS 251 Ca 0.15 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 3h03 h LYS 251 Cb 0.47 -0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.04 3h03 h LYS 251 CO 0.02 0.12 0.54 -0.97 -3.45 0.00 0.00 179.45 175.71 3h03 h ASN 252 N 0.05 0.98 0.32 4.20 -1.24 -1.14 -1.29 115.58 117.46 3h03 h ASN 252 Ca 0.03 -0.04 -0.01 0.00 0.71 0.00 0.00 56.30 56.99 3h03 h ASN 252 Cb 0.05 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 38.85 3h03 h ASN 252 CO -0.00 0.72 -0.20 0.50 -1.29 0.00 0.00 177.43 177.16 3h03 h LYS 253 N 1.14 -0.48 0.00 6.67 3.64 -0.77 0.90 116.57 127.67 3h03 h LYS 253 Ca 0.31 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.70 3h03 h LYS 253 Cb -0.11 0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3h03 h LYS 253 CO -0.06 -0.32 -0.26 -1.49 -2.27 0.00 0.00 179.45 175.05 3h03 h TRP 254 N -0.50 0.00 0.05 1.91 4.06 -1.32 -1.91 115.95 118.24 3h03 h TRP 254 Ca -0.03 0.00 -0.38 0.00 2.06 0.00 0.00 58.89 60.54 3h03 h TRP 254 Cb 0.41 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.53 3h03 h TRP 254 CO -0.09 0.10 -2.23 0.91 -3.56 0.00 0.00 178.44 173.56 3h03 n TRP 255 N -3.06 0.59 -0.05 0.49 8.01 -0.49 -4.62 117.44 118.31 3h03 n TRP 255 Ca 0.03 0.13 -0.10 0.00 -1.31 0.00 0.00 57.50 56.25 3h03 n TRP 255 Cb 0.57 -1.08 -0.04 0.00 -2.01 0.00 0.00 31.31 28.76 3h03 n TRP 255 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 3h03 n TYR 256 N -3.44 0.00 -0.30 -5.99 4.01 -0.12 -3.93 117.16 107.39 3h03 n TYR 256 Ca -0.40 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.41 3h03 n TYR 256 Cb 1.00 -0.36 0.28 0.00 -0.31 0.00 0.00 39.34 39.95 3h03 n TYR 256 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3h03 h ASP 257 N -0.29 0.83 -0.60 7.72 3.32 -0.86 0.11 116.42 126.66 3h03 h ASP 257 Ca -0.25 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.83 3h03 h ASP 257 Cb 1.24 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.65 3h03 h ASP 257 CO -0.13 0.49 0.00 0.29 -1.72 0.00 0.00 179.24 178.17 3h03 n LYS 258 N -4.54 4.24 -1.24 3.56 5.02 -0.72 -4.97 118.16 119.50 3h03 n LYS 258 Ca 0.16 -2.93 -0.30 0.00 -2.02 0.00 0.00 58.31 53.22 3h03 n LYS 258 Cb 0.30 -2.07 0.13 0.00 -0.02 0.00 0.00 35.03 33.38 3h03 n LYS 258 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3h03 s GLY 259 N -0.81 1.62 0.00 0.72 0.00 0.39 -4.97 107.32 104.26 3h03 s GLY 259 Ca 0.51 -0.09 0.00 0.00 0.00 0.00 0.00 44.72 45.15 3h03 s GLY 259 CO 0.20 0.40 0.64 1.18 0.00 0.00 0.00 173.10 175.51 3h03 n GLU 260 N -3.84 0.38 0.00 2.90 1.02 0.11 -5.03 120.64 116.18 3h03 n GLU 260 Ca 0.07 -0.80 0.02 0.00 -0.02 0.00 0.00 57.16 56.43 3h03 n GLU 260 Cb 0.55 -0.96 0.02 0.00 -0.02 0.00 0.00 31.44 31.03 3h03 n GLU 260 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31