#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g01 s ILE 22 N 0.00 5.09 -0.56 7.28 1.01 -1.26 -5.41 121.20 127.35 3g01 s ILE 22 Ca 0.00 1.19 -0.03 0.00 0.00 0.00 0.00 60.65 61.81 3g01 s ILE 22 Cb 0.00 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.54 3g01 s ILE 22 CO 0.00 0.24 0.49 0.61 0.00 0.00 0.00 174.94 176.28 3g01 n GLY 23 N 3.37 0.26 3.32 6.18 0.00 -1.26 -4.95 105.19 112.10 3g01 n GLY 23 Ca -0.03 -0.26 -0.17 0.00 0.00 0.00 0.00 46.02 45.55 3g01 n GLY 23 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g01 s GLY 24 N -3.26 1.31 0.35 -0.02 0.00 -1.26 -4.88 107.32 99.57 3g01 s GLY 24 Ca 0.19 -1.61 -0.05 0.00 0.00 0.00 0.00 44.72 43.25 3g01 s GLY 24 CO 0.31 -1.71 0.63 -1.31 0.00 0.00 0.00 173.10 171.02 3g01 s ASN 25 N -3.27 6.40 0.19 1.64 0.02 -1.07 -4.80 114.94 114.05 3g01 s ASN 25 Ca 0.21 0.77 -0.30 0.00 -1.02 0.00 0.00 52.86 52.51 3g01 s ASN 25 Cb 0.00 -2.17 -0.08 0.00 0.02 0.00 0.00 41.25 39.02 3g01 s ASN 25 CO 0.05 -0.31 1.23 -0.70 0.02 0.00 0.00 177.10 177.39 3g01 s GLU 26 N -3.95 4.46 0.60 -0.60 2.12 -1.26 -1.28 118.70 118.79 3g01 s GLU 26 Ca 0.45 1.94 -0.15 0.00 0.36 0.00 0.00 54.97 57.56 3g01 s GLU 26 Cb -0.10 -3.22 -0.03 0.00 0.26 0.00 0.00 34.13 31.03 3g01 s GLU 26 CO 0.34 -0.14 1.05 0.96 -0.54 0.00 0.00 175.26 176.93 3g01 s ILE 27 N -0.03 3.90 0.11 -3.70 -0.00 -0.77 -4.89 121.20 115.82 3g01 s ILE 27 Ca 0.54 0.87 -0.32 0.00 -0.00 0.00 0.00 60.65 61.74 3g01 s ILE 27 Cb -0.34 -3.42 -0.11 0.00 -0.00 0.00 0.00 42.46 38.59 3g01 s ILE 27 CO 0.37 -0.57 1.83 -1.20 -0.00 0.00 0.00 174.94 175.37 3g01 n SER 28 N -2.13 3.93 -4.66 4.36 7.64 -1.26 -4.90 113.62 116.60 3g01 n SER 28 Ca 0.08 0.99 -0.44 0.00 1.01 0.00 0.00 58.87 60.51 3g01 n SER 28 Cb 0.53 -1.52 -0.02 0.00 -1.01 0.00 0.00 64.21 62.19 3g01 n SER 28 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3g01 n PRO 29 N 5.59 1.91 -1.55 1.43 -0.02 -1.26 -1.78 135.00 139.32 3g01 n PRO 29 Ca 0.18 0.67 -0.19 0.00 -2.02 0.00 0.00 63.50 62.15 3g01 n PRO 29 Cb 0.36 -2.24 -0.08 0.00 -0.02 0.00 0.00 33.50 31.52 3g01 n PRO 29 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3g01 n HIS 30 N 0.95 -0.02 1.53 6.00 8.25 -1.26 -4.84 115.22 125.83 3g01 n HIS 30 Ca 0.09 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.69 3g01 n HIS 30 Cb 0.33 -3.16 0.65 0.00 1.12 0.00 0.00 29.99 28.93 3g01 n HIS 30 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3g01 n SER 31 N -1.01 0.60 -3.21 0.41 3.41 -0.74 -4.02 113.62 109.07 3g01 n SER 31 Ca -0.19 -0.84 -0.24 0.00 -0.26 0.00 0.00 58.87 57.35 3g01 n SER 31 Cb 0.61 -0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 64.46 3g01 n SER 31 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3g01 n ARG 32 N -0.74 1.46 0.00 4.33 1.74 -1.26 -5.00 116.66 117.19 3g01 n ARG 32 Ca 0.17 -3.76 0.03 0.00 -0.77 0.00 0.00 57.85 53.52 3g01 n ARG 32 Cb 0.26 -1.67 0.16 0.00 -1.02 0.00 0.00 32.46 30.19 3g01 n ARG 32 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3g01 n PRO 33 N 0.83 0.13 0.01 5.56 -0.04 -1.26 -1.75 135.00 138.49 3g01 n PRO 33 Ca 0.25 0.11 0.11 0.00 -0.04 0.00 0.00 63.50 63.93 3g01 n PRO 33 Cb 0.52 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 3g01 n PRO 33 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3g01 n TYR 34 N -1.13 0.15 -1.86 0.54 0.18 -1.14 -1.48 117.16 112.41 3g01 n TYR 34 Ca 0.04 0.04 -0.40 0.00 1.88 0.00 0.00 57.90 59.46 3g01 n TYR 34 Cb 0.03 -0.34 0.01 0.00 -0.38 0.00 0.00 39.34 38.66 3g01 n TYR 34 CO 0.00 0.00 0.00 -1.64 -2.08 0.00 0.00 176.86 173.14 3g01 s MET 35 N -3.21 3.82 -0.07 -3.48 -1.94 -0.72 -1.22 119.30 112.48 3g01 s MET 35 Ca 0.02 2.38 0.04 0.00 -1.71 0.00 0.00 55.69 56.42 3g01 s MET 35 Cb 0.15 -2.73 0.00 0.00 2.01 0.00 0.00 34.83 34.26 3g01 s MET 35 CO 0.84 -0.70 -0.18 0.00 -0.01 0.00 0.00 175.02 174.97 3g01 s ALA 36 N -1.20 1.66 -0.44 3.03 0.00 -0.61 -4.35 121.76 119.85 3g01 s ALA 36 Ca 0.59 -0.69 -0.19 0.00 0.00 0.00 0.00 51.96 51.67 3g01 s ALA 36 Cb -0.43 -0.63 0.03 0.00 0.00 0.00 0.00 23.12 22.08 3g01 s ALA 36 CO 0.56 0.23 0.53 -0.47 0.00 0.00 0.00 175.76 176.60 3g01 s TYR 37 N 0.37 3.12 -0.34 0.00 5.04 -0.54 -2.52 117.35 122.47 3g01 s TYR 37 Ca -0.13 -0.29 -0.10 0.00 -2.44 0.00 0.00 57.07 54.11 3g01 s TYR 37 Cb -0.15 -3.13 0.01 0.00 0.35 0.00 0.00 41.96 39.04 3g01 s TYR 37 CO 0.05 -0.80 0.17 -0.47 -1.34 0.00 0.00 175.55 173.16 3g01 s TYR 38 N 2.43 3.21 -0.10 4.97 6.04 0.13 -0.56 117.35 133.47 3g01 s TYR 38 Ca 0.16 -0.84 -0.01 0.00 0.04 0.00 0.00 57.07 56.41 3g01 s TYR 38 Cb -0.16 -2.38 -0.03 0.00 -1.04 0.00 0.00 41.96 38.35 3g01 s TYR 38 CO 0.15 -0.57 -0.03 -2.00 -1.54 0.00 0.00 175.55 171.55 3g01 s GLU 39 N 1.56 3.11 0.17 4.97 2.12 0.85 -0.24 118.70 131.25 3g01 s GLU 39 Ca 0.03 -0.49 -0.14 0.00 0.36 0.00 0.00 54.97 54.73 3g01 s GLU 39 Cb -0.18 -2.76 0.01 0.00 0.26 0.00 0.00 34.13 31.46 3g01 s GLU 39 CO 0.06 0.55 0.40 -0.59 -0.54 0.00 0.00 175.26 175.14 3g01 s PHE 40 N -0.48 0.07 -0.17 5.30 -0.12 -0.17 -1.47 117.98 120.94 3g01 s PHE 40 Ca 0.08 -0.42 -0.04 0.00 -0.05 0.00 0.00 56.93 56.50 3g01 s PHE 40 Cb -0.12 0.19 -0.03 0.00 -0.63 0.00 0.00 43.02 42.43 3g01 s PHE 40 CO 0.02 -0.79 -0.03 -0.51 -0.05 0.00 0.00 175.22 173.85 3g01 s LEU 41 N -2.90 3.21 0.91 -1.99 1.43 -0.25 0.98 118.68 120.08 3g01 s LEU 41 Ca 0.11 -0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 52.92 3g01 s LEU 41 Cb 0.01 -1.78 0.14 0.00 0.03 0.00 0.00 46.19 44.59 3g01 s LEU 41 CO -0.04 0.14 1.14 -1.59 0.23 0.00 0.00 176.35 176.23 3g01 s LYS 42 N 0.56 1.16 -0.16 1.70 0.00 -0.49 -0.55 119.74 121.96 3g01 s LYS 42 Ca -0.03 0.27 -0.41 0.00 0.00 0.00 0.00 55.97 55.80 3g01 s LYS 42 Cb -0.14 -1.84 -0.18 0.00 0.00 0.00 0.00 37.83 35.66 3g01 s LYS 42 CO 0.03 -2.18 1.43 0.28 0.00 0.00 0.00 175.35 174.90 3g01 n VAL 43 N -3.75 0.07 -3.39 1.79 0.31 -1.26 -3.13 118.33 108.97 3g01 n VAL 43 Ca 0.07 -0.01 -0.14 0.00 -0.01 0.00 0.00 64.34 64.25 3g01 n VAL 43 Cb 0.59 -0.63 0.01 0.00 -0.91 0.00 0.00 33.84 32.91 3g01 n VAL 43 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3g01 n GLY 44 N 2.99 -1.21 0.00 2.92 0.00 -1.26 -4.50 105.19 104.13 3g01 n GLY 44 Ca 0.24 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.77 3g01 n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g01 n GLY 45 N -1.68 2.24 3.64 -0.02 0.00 -1.18 -5.06 105.19 103.13 3g01 n GLY 45 Ca -0.11 -0.67 -0.64 0.00 0.00 0.00 0.00 46.02 44.59 3g01 n GLY 45 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3g01 n LYS 46 N 0.00 0.21 -2.27 1.61 4.81 -1.26 -4.54 118.16 116.71 3g01 n LYS 46 Ca 0.00 0.07 -0.42 0.00 -0.87 0.00 0.00 58.31 57.10 3g01 n LYS 46 Cb 0.00 -1.62 -0.03 0.00 0.02 0.00 0.00 35.03 33.40 3g01 n LYS 46 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 3g01 s LYS 47 N 3.74 4.40 0.23 1.64 0.00 -1.26 -1.40 119.74 127.08 3g01 s LYS 47 Ca 1.07 1.97 0.07 0.00 0.00 0.00 0.00 55.97 59.07 3g01 s LYS 47 Cb -1.42 -3.25 -0.05 0.00 0.00 0.00 0.00 37.83 33.11 3g01 s LYS 47 CO 0.76 -0.27 -0.10 -1.64 0.00 0.00 0.00 175.35 174.10 3g01 s MET 48 N 0.44 1.39 0.03 1.78 1.00 0.28 -4.93 119.30 119.29 3g01 s MET 48 Ca 0.59 -1.66 0.00 0.00 0.00 0.00 0.00 55.69 54.62 3g01 s MET 48 Cb -0.34 -1.05 -0.02 0.00 0.00 0.00 0.00 34.83 33.41 3g01 s MET 48 CO 0.34 0.10 -0.04 -0.59 0.00 0.00 0.00 175.02 174.83 3g01 s PHE 49 N -3.06 0.35 0.20 -0.03 -0.12 -1.26 -1.00 117.98 113.05 3g01 s PHE 49 Ca 0.25 -0.59 0.03 0.00 -0.05 0.00 0.00 56.93 56.58 3g01 s PHE 49 Cb 0.02 -0.24 -0.05 0.00 -0.63 0.00 0.00 43.02 42.12 3g01 s PHE 49 CO 0.08 -0.20 -0.03 0.00 -0.05 0.00 0.00 175.22 175.03 3g01 s GLY 51 N -3.24 1.75 0.00 0.00 0.00 0.87 -0.69 107.32 106.01 3g01 s GLY 51 Ca 0.24 -1.27 0.00 0.00 0.00 0.00 0.00 44.72 43.70 3g01 s GLY 51 CO 0.05 -0.64 0.00 0.61 0.00 0.00 0.00 173.10 173.12 3g01 n GLY 52 N -3.31 -1.16 3.30 0.20 0.00 -1.05 -3.65 105.19 99.52 3g01 n GLY 52 Ca 0.13 -0.94 -0.14 0.00 0.00 0.00 0.00 46.02 45.07 3g01 n GLY 52 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3g01 s PHE 53 N -2.35 -0.35 0.01 1.61 -0.71 -0.23 -1.58 117.98 114.38 3g01 s PHE 53 Ca 0.00 0.69 -0.30 0.00 -1.04 0.00 0.00 56.93 56.28 3g01 s PHE 53 Cb 0.00 0.16 -0.05 0.00 -1.21 0.00 0.00 43.02 41.92 3g01 s PHE 53 CO 0.00 -0.36 1.36 -1.17 -1.34 0.00 0.00 175.22 173.71 3g01 s LEU 54 N -0.75 4.32 -0.15 -1.99 2.96 -0.36 -0.62 118.68 122.09 3g01 s LEU 54 Ca -0.08 2.08 0.07 0.00 -0.22 0.00 0.00 54.13 55.98 3g01 s LEU 54 Cb -0.04 -3.56 -0.14 0.00 0.50 0.00 0.00 46.19 42.95 3g01 s LEU 54 CO 0.04 -0.68 -0.05 1.33 -1.32 0.00 0.00 176.35 175.67 3g01 n VAL 55 N 4.55 0.93 -4.21 1.68 0.24 -0.15 -0.26 118.33 121.11 3g01 n VAL 55 Ca 0.12 -0.47 -0.13 0.00 -2.04 0.00 0.00 64.34 61.83 3g01 n VAL 55 Cb 0.44 -0.86 -0.10 0.00 -1.47 0.00 0.00 33.84 31.85 3g01 n VAL 55 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 3g01 s ARG 56 N -2.32 1.24 0.29 7.34 3.00 -1.16 -4.60 118.95 122.73 3g01 s ARG 56 Ca -0.14 -1.66 0.03 0.00 0.00 0.00 0.00 55.73 53.96 3g01 s ARG 56 Cb 0.05 0.26 0.64 0.00 0.00 0.00 0.00 34.95 35.89 3g01 s ARG 56 CO 0.46 -0.40 1.78 -0.44 0.00 0.00 0.00 175.30 176.70 3g01 h ASP 57 N 2.58 0.70 -0.06 0.23 3.45 -1.97 -2.08 116.42 119.28 3g01 h ASP 57 Ca -0.35 0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.20 3g01 h ASP 57 Cb 1.25 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.99 3g01 h ASP 57 CO 0.52 0.28 0.00 1.17 -1.57 0.00 0.00 179.24 179.64 3g01 n LYS 58 N -4.79 1.64 -4.64 3.56 4.81 -1.26 0.17 118.16 117.64 3g01 n LYS 58 Ca 0.20 -1.65 -0.28 0.00 -0.87 0.00 0.00 58.31 55.72 3g01 n LYS 58 Cb 0.50 -1.36 -0.17 0.00 0.02 0.00 0.00 35.03 34.02 3g01 n LYS 58 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 3g01 s PHE 59 N -1.50 1.93 -0.10 5.64 0.08 -0.78 -0.28 117.98 122.97 3g01 s PHE 59 Ca 0.23 -0.83 0.02 0.00 0.12 0.00 0.00 56.93 56.46 3g01 s PHE 59 Cb 0.16 -1.37 -0.02 0.00 -0.57 0.00 0.00 43.02 41.22 3g01 s PHE 59 CO 0.23 -0.41 -0.16 0.08 -0.10 0.00 0.00 175.22 174.87 3g01 s VAL 60 N 0.77 2.83 0.06 -0.44 1.01 -0.57 -0.97 120.40 123.08 3g01 s VAL 60 Ca -0.11 -0.77 -0.09 0.00 0.00 0.00 0.00 61.98 61.01 3g01 s VAL 60 Cb -0.16 -2.14 -0.06 0.00 0.00 0.00 0.00 36.38 34.03 3g01 s VAL 60 CO 0.02 0.55 0.37 -0.76 0.00 0.00 0.00 175.10 175.28 3g01 s LEU 61 N 0.00 4.35 0.00 3.92 1.02 0.21 0.39 118.68 128.58 3g01 s LEU 61 Ca -0.05 0.74 0.00 0.00 0.02 0.00 0.00 54.13 54.83 3g01 s LEU 61 Cb -0.14 -2.92 0.00 0.00 0.02 0.00 0.00 46.19 43.14 3g01 s LEU 61 CO 0.04 0.19 0.00 1.07 0.02 0.00 0.00 176.35 177.67 3g01 n THR 62 N 0.93 0.00 -3.68 5.49 5.66 0.16 -1.07 114.28 121.77 3g01 n THR 62 Ca -0.09 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.54 3g01 n THR 62 Cb 0.52 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.24 3g01 n THR 62 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3g01 s ALA 63 N -1.11 3.76 0.54 1.79 0.00 -1.26 -0.66 121.76 124.82 3g01 s ALA 63 Ca 0.00 -0.47 0.22 0.00 0.00 0.00 0.00 51.96 51.72 3g01 s ALA 63 Cb 0.00 -2.19 1.44 0.00 0.00 0.00 0.00 23.12 22.36 3g01 s ALA 63 CO 0.00 0.46 2.12 0.00 0.00 0.00 0.00 175.76 178.34 3g01 h ALA 64 N 5.26 2.02 0.00 0.00 0.00 -1.71 -1.62 119.26 123.22 3g01 h ALA 64 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3g01 h ALA 64 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3g01 h ALA 64 CO 0.63 -0.21 0.00 -2.39 0.00 0.00 0.00 179.25 177.28 3g01 n HIS 65 N -4.28 0.00 -2.30 0.00 1.44 -1.26 -3.86 115.22 104.96 3g01 n HIS 65 Ca 0.01 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.31 3g01 n HIS 65 Cb 0.25 -0.22 0.00 0.00 0.12 0.00 0.00 29.99 30.15 3g01 n HIS 65 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3g01 s LYS 67 N -1.20 3.51 0.00 0.00 -0.14 -1.25 -4.97 119.74 115.68 3g01 s LYS 67 Ca 0.45 -0.14 -0.20 0.00 -1.36 0.00 0.00 55.97 54.72 3g01 s LYS 67 Cb 0.14 -3.21 0.07 0.00 -1.68 0.00 0.00 37.83 33.15 3g01 s LYS 67 CO -0.04 0.73 0.90 0.41 -0.76 0.00 0.00 175.35 176.59 3g01 n GLY 68 N 2.12 0.39 3.96 -3.33 0.00 -1.26 -4.83 105.19 102.24 3g01 n GLY 68 Ca -0.20 -1.00 -0.22 0.00 0.00 0.00 0.00 46.02 44.60 3g01 n GLY 68 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g01 s ARG 69 N -2.01 2.76 -1.06 1.61 1.81 0.29 -4.66 118.95 117.68 3g01 s ARG 69 Ca 0.21 -0.58 -0.19 0.00 -1.72 0.00 0.00 55.73 53.45 3g01 s ARG 69 Cb -0.01 -2.48 0.01 0.00 -0.45 0.00 0.00 34.95 32.02 3g01 s ARG 69 CO 0.00 -0.56 0.71 -1.13 -0.68 0.00 0.00 175.30 173.64 3g01 n SER 70 N -2.28 -5.07 -4.76 0.23 3.41 -1.26 -1.09 113.62 102.79 3g01 n SER 70 Ca 0.05 -1.02 -0.39 0.00 -0.26 0.00 0.00 58.87 57.25 3g01 n SER 70 Cb 0.59 -2.63 -0.05 0.00 -0.26 0.00 0.00 64.21 61.86 3g01 n SER 70 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3g01 s MET 71 N -5.97 4.70 -0.06 4.33 1.00 -1.26 -4.44 119.30 117.61 3g01 s MET 71 Ca 0.34 1.56 -0.20 0.00 0.00 0.00 0.00 55.69 57.39 3g01 s MET 71 Cb -0.15 -3.13 0.04 0.00 0.00 0.00 0.00 34.83 31.59 3g01 s MET 71 CO 0.90 0.35 0.46 0.99 0.00 0.00 0.00 175.02 177.71 3g01 s THR 72 N -1.28 0.03 -0.09 2.05 2.01 -0.54 -1.86 115.64 115.95 3g01 s THR 72 Ca 0.45 -0.23 0.02 0.00 0.31 0.00 0.00 61.69 62.24 3g01 s THR 72 Cb -0.26 -0.74 0.01 0.00 0.01 0.00 0.00 72.50 71.52 3g01 s THR 72 CO 0.33 -0.13 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.30 3g01 s VAL 73 N -0.93 1.38 -0.20 3.82 1.01 0.52 -0.10 120.40 125.90 3g01 s VAL 73 Ca -0.10 -0.59 -0.07 0.00 0.00 0.00 0.00 61.98 61.22 3g01 s VAL 73 Cb -0.03 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 3g01 s VAL 73 CO 0.05 0.41 0.06 -0.89 0.00 0.00 0.00 175.10 174.74 3g01 s THR 74 N 0.87 4.67 0.26 3.92 2.01 0.27 0.39 115.64 128.04 3g01 s THR 74 Ca -0.10 -0.07 0.10 0.00 0.31 0.00 0.00 61.69 61.93 3g01 s THR 74 Cb -0.15 -3.12 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 3g01 s THR 74 CO 0.01 0.43 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.57 3g01 s LEU 75 N 0.64 3.10 -0.78 4.42 1.43 -0.11 -1.47 118.68 125.92 3g01 s LEU 75 Ca 0.03 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.44 3g01 s LEU 75 Cb -0.13 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.46 3g01 s LEU 75 CO 0.02 0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.22 3g01 n GLY 76 N -0.81 0.93 3.88 -3.19 0.00 -1.25 -0.61 105.19 104.14 3g01 n GLY 76 Ca -0.06 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.93 3g01 n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g01 s ALA 77 N -2.28 3.65 0.00 4.61 0.00 -1.26 -3.81 121.76 122.68 3g01 s ALA 77 Ca 0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 51.96 51.56 3g01 s ALA 77 Cb 0.00 -2.32 -0.01 0.00 0.00 0.00 0.00 23.12 20.80 3g01 s ALA 77 CO 0.00 0.57 -0.04 1.58 0.00 0.00 0.00 175.76 177.87 3g01 n HIS 78 N -0.02 0.00 -2.89 0.00 -0.00 -1.26 -4.71 115.22 106.34 3g01 n HIS 78 Ca -0.01 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.74 3g01 n HIS 78 Cb 0.52 -0.06 -0.05 0.00 -0.12 0.00 0.00 29.99 30.29 3g01 n HIS 78 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 3g01 s ASN 79 N -5.13 6.34 0.42 0.26 2.47 -1.26 -2.77 114.94 115.28 3g01 s ASN 79 Ca -0.03 -0.36 0.29 0.00 0.42 0.00 0.00 52.86 53.18 3g01 s ASN 79 Cb 0.00 -2.41 1.28 0.00 -1.45 0.00 0.00 41.25 38.67 3g01 s ASN 79 CO 0.05 -1.14 1.87 -0.29 -3.72 0.00 0.00 177.10 173.88 3g01 h ILE 80 N 6.00 0.00 -0.45 -5.21 -0.00 -1.81 -2.69 117.51 113.35 3g01 h ILE 80 Ca -0.26 -0.30 0.00 0.00 -0.00 0.00 0.00 64.86 64.30 3g01 h ILE 80 Cb 1.08 1.14 0.00 0.00 -0.00 0.00 0.00 36.82 39.04 3g01 h ILE 80 CO 1.05 0.00 0.00 0.29 -0.00 0.00 0.00 178.15 179.49 3g01 n LYS 81 N -2.65 3.07 -4.64 2.19 5.02 -1.26 -4.87 118.16 115.01 3g01 n LYS 81 Ca 0.01 -2.06 -0.26 0.00 -2.02 0.00 0.00 58.31 53.98 3g01 n LYS 81 Cb 0.23 -1.76 -0.14 0.00 -0.02 0.00 0.00 35.03 33.34 3g01 n LYS 81 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3g01 s ALA 82 N -1.83 1.86 -0.68 7.82 0.00 -1.02 -5.07 121.76 122.85 3g01 s ALA 82 Ca 0.37 -1.12 -0.26 0.00 0.00 0.00 0.00 51.96 50.94 3g01 s ALA 82 Cb 0.24 -0.36 -0.03 0.00 0.00 0.00 0.00 23.12 22.98 3g01 s ALA 82 CO 0.17 0.42 1.87 0.15 0.00 0.00 0.00 175.76 178.36 3g01 s LYS 83 N -1.29 2.62 -0.11 0.00 3.01 -1.26 -4.97 119.74 117.75 3g01 s LYS 83 Ca 0.08 0.40 -0.04 0.00 -1.01 0.00 0.00 55.97 55.40 3g01 s LYS 83 Cb -0.09 -4.53 -0.04 0.00 -1.01 0.00 0.00 37.83 32.17 3g01 s LYS 83 CO 0.02 -2.85 0.03 -1.21 0.51 0.00 0.00 175.35 171.85 3g01 s GLU 84 N 7.00 3.29 0.34 1.68 2.02 -1.26 -5.01 118.70 126.76 3g01 s GLU 84 Ca 0.67 -0.35 0.02 0.00 0.02 0.00 0.00 54.97 55.33 3g01 s GLU 84 Cb -0.11 -2.94 0.62 0.00 0.10 0.00 0.00 34.13 31.80 3g01 s GLU 84 CO 0.16 0.61 1.98 1.05 0.02 0.00 0.00 175.26 179.08 3g01 h GLU 85 N 5.50 0.87 0.00 1.61 -0.00 -1.95 -2.55 114.58 118.06 3g01 h GLU 85 Ca -0.48 -0.05 0.00 0.00 -0.00 0.00 0.00 59.36 58.83 3g01 h GLU 85 Cb 1.19 -0.20 0.00 0.00 -0.00 0.00 0.00 28.75 29.75 3g01 h GLU 85 CO 0.58 0.57 0.00 1.79 -0.00 0.00 0.00 179.01 181.96 3g01 h THR 86 N 0.89 0.00 -4.06 -1.06 1.35 -1.95 -3.46 112.91 104.62 3g01 h THR 86 Ca 0.29 -0.24 -0.49 0.00 -0.55 0.00 0.00 66.41 65.42 3g01 h THR 86 Cb 0.04 1.15 0.06 0.00 -1.73 0.00 0.00 68.15 67.66 3g01 h THR 86 CO -0.08 0.00 0.43 -1.10 -0.25 0.00 0.00 175.52 174.52 3g01 s GLN 87 N -3.79 3.59 -0.32 4.72 -0.21 -0.96 -4.40 119.66 118.29 3g01 s GLN 87 Ca -0.01 1.57 -0.02 0.00 0.02 0.00 0.00 55.36 56.92 3g01 s GLN 87 Cb 0.10 -2.14 0.11 0.00 1.00 0.00 0.00 33.01 32.09 3g01 s GLN 87 CO 0.44 -0.64 0.15 -0.65 -2.12 0.00 0.00 175.29 172.47 3g01 s GLN 88 N -3.11 0.41 -0.79 2.91 -0.21 0.22 -4.94 119.66 114.16 3g01 s GLN 88 Ca 0.69 -0.90 -0.23 0.00 0.02 0.00 0.00 55.36 54.94 3g01 s GLN 88 Cb -0.23 -1.36 0.07 0.00 1.00 0.00 0.00 33.01 32.50 3g01 s GLN 88 CO 0.27 -1.08 1.13 0.42 -2.12 0.00 0.00 175.29 173.90 3g01 s ILE 89 N 1.66 4.25 -0.22 1.08 1.09 -1.26 -0.93 121.20 126.87 3g01 s ILE 89 Ca 0.12 -0.56 -0.05 0.00 -1.10 0.00 0.00 60.65 59.05 3g01 s ILE 89 Cb -0.19 -4.80 -0.02 0.00 -1.06 0.00 0.00 42.46 36.39 3g01 s ILE 89 CO -0.23 -1.61 0.01 -0.63 -0.10 0.00 0.00 174.94 172.39 3g01 s ILE 90 N 4.18 3.95 0.67 2.92 1.09 0.16 -4.93 121.20 129.24 3g01 s ILE 90 Ca 0.30 -0.31 -0.14 0.00 -1.10 0.00 0.00 60.65 59.40 3g01 s ILE 90 Cb -0.10 -2.81 0.01 0.00 -1.06 0.00 0.00 42.46 38.50 3g01 s ILE 90 CO 0.04 0.40 1.11 -2.84 -0.10 0.00 0.00 174.94 173.54 3g01 s PRO 91 N 1.25 2.74 0.01 2.79 0.02 -1.26 -0.35 135.00 140.20 3g01 s PRO 91 Ca 0.04 1.35 -0.20 0.00 0.02 0.00 0.00 61.00 62.21 3g01 s PRO 91 Cb -0.15 -1.95 -0.06 0.00 0.02 0.00 0.00 34.50 32.37 3g01 s PRO 91 CO 0.01 -1.29 0.57 0.08 -0.33 0.00 0.00 177.00 176.05 3g01 s VAL 92 N -2.42 4.89 -0.15 3.83 1.01 -0.78 -2.38 120.40 124.41 3g01 s VAL 92 Ca 0.66 1.20 -0.14 0.00 0.00 0.00 0.00 61.98 63.70 3g01 s VAL 92 Cb -0.20 -3.90 -0.24 0.00 0.00 0.00 0.00 36.38 32.04 3g01 s VAL 92 CO 0.43 0.45 0.36 0.00 0.00 0.00 0.00 175.10 176.34 3g01 h ALA 93 N 5.40 0.32 -2.89 5.51 0.00 -0.66 -3.45 119.26 123.50 3g01 h ALA 93 Ca -0.46 -1.27 -0.18 0.00 0.00 0.00 0.00 54.91 52.99 3g01 h ALA 93 Cb 1.20 0.67 -0.30 0.00 0.00 0.00 0.00 17.79 19.37 3g01 h ALA 93 CO 0.68 1.01 -0.46 0.21 0.00 0.00 0.00 179.25 180.69 3g01 s LYS 94 N -2.48 0.22 -0.20 0.00 2.20 -0.95 -5.00 119.74 113.53 3g01 s LYS 94 Ca -0.24 0.67 -0.18 0.00 -0.36 0.00 0.00 55.97 55.86 3g01 s LYS 94 Cb 0.06 -0.05 -0.03 0.00 -1.51 0.00 0.00 37.83 36.29 3g01 s LYS 94 CO 0.71 -0.20 0.48 0.00 -0.36 0.00 0.00 175.35 175.98 3g01 s ALA 95 N 1.71 3.55 -0.70 3.13 0.00 -1.26 -0.36 121.76 127.82 3g01 s ALA 95 Ca -0.06 -0.45 0.01 0.00 0.00 0.00 0.00 51.96 51.46 3g01 s ALA 95 Cb -0.11 -2.76 0.17 0.00 0.00 0.00 0.00 23.12 20.43 3g01 s ALA 95 CO -0.09 -0.41 0.51 0.42 0.00 0.00 0.00 175.76 176.18 3g01 s ILE 96 N 1.57 3.42 0.67 0.00 -1.09 0.97 -5.00 121.20 121.74 3g01 s ILE 96 Ca 0.22 -3.68 -0.15 0.00 -2.23 0.00 0.00 60.65 54.82 3g01 s ILE 96 Cb -0.15 -3.22 0.00 0.00 -1.58 0.00 0.00 42.46 37.51 3g01 s ILE 96 CO 0.09 -0.96 1.12 -2.16 -1.23 0.00 0.00 174.94 171.81 3g01 s PRO 97 N -0.88 2.72 0.27 2.79 0.04 -1.26 -1.85 135.00 136.83 3g01 s PRO 97 Ca 0.22 1.44 -0.31 0.00 0.04 0.00 0.00 61.00 62.39 3g01 s PRO 97 Cb -0.13 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.35 3g01 s PRO 97 CO -0.09 -1.32 1.62 1.58 0.04 0.00 0.00 177.00 178.82 3g01 n HIS 98 N -2.45 2.79 0.24 0.56 -0.00 -0.54 -4.85 115.22 110.97 3g01 n HIS 98 Ca 0.11 0.21 0.07 0.00 0.46 0.00 0.00 57.72 58.57 3g01 n HIS 98 Cb 0.52 -2.61 0.33 0.00 -0.12 0.00 0.00 29.99 28.11 3g01 n HIS 98 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 3g01 n PRO 99 N 2.59 0.08 -0.51 1.57 -0.04 -1.26 -1.33 135.00 136.10 3g01 n PRO 99 Ca 0.11 0.47 0.08 0.00 -0.04 0.00 0.00 63.50 64.11 3g01 n PRO 99 Cb 0.36 -1.71 0.29 0.00 -0.04 0.00 0.00 33.50 32.40 3g01 n PRO 99 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3g01 n ASP 100 N -1.86 4.21 -4.73 3.54 8.00 -1.26 -5.01 116.55 119.43 3g01 n ASP 100 Ca 0.01 -2.71 -0.42 0.00 0.71 0.00 0.00 54.79 52.38 3g01 n ASP 100 Cb 0.10 -0.52 -0.03 0.00 -0.02 0.00 0.00 41.12 40.65 3g01 n ASP 100 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3g01 s TYR 101 N -2.30 2.98 -0.25 1.24 5.04 -0.44 -4.68 117.35 118.94 3g01 s TYR 101 Ca 0.43 0.64 0.02 0.00 -2.44 0.00 0.00 57.07 55.72 3g01 s TYR 101 Cb 0.31 -3.98 0.06 0.00 0.35 0.00 0.00 41.96 38.70 3g01 s TYR 101 CO 0.14 -3.54 -0.10 1.21 -1.34 0.00 0.00 175.55 171.92 3g01 s ASN 102 N 0.95 4.25 0.42 4.32 3.84 -1.10 -5.00 114.94 122.63 3g01 s ASN 102 Ca 0.69 -1.32 0.13 0.00 0.21 0.00 0.00 52.86 52.56 3g01 s ASN 102 Cb -0.45 -1.45 0.99 0.00 -0.55 0.00 0.00 41.25 39.79 3g01 s ASN 102 CO 0.35 -0.20 1.98 -0.65 -2.79 0.00 0.00 177.10 175.80 3g01 h PRO 103 N 7.82 0.44 -0.55 0.43 0.11 -1.95 0.20 132.00 138.51 3g01 h PRO 103 Ca -0.19 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.86 3g01 h PRO 103 Cb 1.05 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.04 3g01 h PRO 103 CO 0.45 0.29 0.24 -0.44 -0.21 0.00 0.00 178.00 178.33 3g01 h ASP 104 N 0.45 0.71 0.00 -2.05 3.32 -1.99 -3.24 116.42 113.63 3g01 h ASP 104 Ca 0.28 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.25 3g01 h ASP 104 Cb 0.49 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3g01 h ASP 104 CO -0.08 0.63 0.00 -0.90 -1.72 0.00 0.00 179.24 177.17 3g01 n ASP 105 N -4.35 0.91 -3.88 6.45 5.68 -1.16 -5.02 116.55 115.19 3g01 n ASP 105 Ca 0.05 -1.04 -0.27 0.00 -0.50 0.00 0.00 54.79 53.03 3g01 n ASP 105 Cb 0.15 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.14 3g01 n ASP 105 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3g01 n ARG 106 N -0.02 -4.62 -2.13 0.11 1.74 0.70 -4.90 116.66 107.55 3g01 n ARG 106 Ca 0.00 0.54 -0.40 0.00 -0.77 0.00 0.00 57.85 57.22 3g01 n ARG 106 Cb 0.04 -5.15 -0.02 0.00 -1.02 0.00 0.00 32.46 26.32 3g01 n ARG 106 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3g01 s SER 107 N -3.89 6.73 -1.29 0.55 0.01 -1.18 -3.64 113.70 110.99 3g01 s SER 107 Ca 0.31 2.65 -0.13 0.00 1.31 0.00 0.00 55.95 60.09 3g01 s SER 107 Cb -0.16 -2.65 0.01 0.00 0.21 0.00 0.00 66.02 63.43 3g01 s SER 107 CO 0.85 -0.56 0.55 0.59 0.41 0.00 0.00 173.24 175.08 3g01 n ASN 108 N 0.70 -2.57 -4.52 2.44 4.13 -1.26 -2.72 115.26 111.46 3g01 n ASN 108 Ca 0.01 -1.09 -0.43 0.00 1.68 0.00 0.00 54.58 54.74 3g01 n ASN 108 Cb 0.42 -2.78 0.00 0.00 -1.54 0.00 0.00 39.78 35.89 3g01 n ASN 108 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 3g01 n ASP 109 N -2.72 5.02 -3.71 6.41 2.03 -1.24 -4.36 116.55 117.98 3g01 n ASP 109 Ca -0.20 -2.94 -0.14 0.00 0.52 0.00 0.00 54.79 52.03 3g01 n ASP 109 Cb 0.63 -1.68 -0.09 0.00 -0.72 0.00 0.00 41.12 39.26 3g01 n ASP 109 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3g01 s ILE 110 N 3.23 0.01 -0.12 5.18 2.07 -1.26 -4.08 121.20 126.23 3g01 s ILE 110 Ca 0.50 -0.08 -0.11 0.00 -1.41 0.00 0.00 60.65 59.55 3g01 s ILE 110 Cb 0.02 -0.65 0.03 0.00 0.13 0.00 0.00 42.46 41.99 3g01 s ILE 110 CO 0.05 -0.04 0.32 -0.32 -1.91 0.00 0.00 174.94 173.04 3g01 s MET 111 N -0.10 0.37 -0.01 3.50 -2.45 0.17 -1.46 119.30 119.31 3g01 s MET 111 Ca -0.03 0.46 -0.06 0.00 -1.25 0.00 0.00 55.69 54.81 3g01 s MET 111 Cb -0.03 0.17 -0.05 0.00 1.25 0.00 0.00 34.83 36.17 3g01 s MET 111 CO 0.02 -0.05 0.25 -0.51 1.05 0.00 0.00 175.02 175.77 3g01 s LEU 112 N 0.23 4.37 -0.26 4.11 1.43 -0.77 -0.66 118.68 127.13 3g01 s LEU 112 Ca -0.01 0.53 0.02 0.00 -1.03 0.00 0.00 54.13 53.65 3g01 s LEU 112 Cb -0.03 -2.60 0.06 0.00 0.03 0.00 0.00 46.19 43.65 3g01 s LEU 112 CO -0.00 0.27 -0.10 -0.76 0.23 0.00 0.00 176.35 175.99 3g01 s LEU 113 N -1.69 3.47 -0.22 1.79 1.43 0.16 -0.02 118.68 123.60 3g01 s LEU 113 Ca 0.26 -1.36 -0.28 0.00 -1.03 0.00 0.00 54.13 51.73 3g01 s LEU 113 Cb -0.13 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.52 3g01 s LEU 113 CO 0.15 -0.19 0.98 -0.75 0.23 0.00 0.00 176.35 176.76 3g01 s LYS 114 N 1.13 4.26 0.51 1.70 2.47 0.51 -1.52 119.74 128.79 3g01 s LYS 114 Ca -0.08 1.24 -0.15 0.00 -1.56 0.00 0.00 55.97 55.43 3g01 s LYS 114 Cb -0.20 -3.63 -0.07 0.00 -1.46 0.00 0.00 37.83 32.47 3g01 s LYS 114 CO -0.05 -0.56 0.95 -0.51 0.16 0.00 0.00 175.35 175.34 3g01 s LEU 115 N 2.97 3.61 0.51 5.43 1.43 0.62 0.01 118.68 133.26 3g01 s LEU 115 Ca 0.42 1.47 0.29 0.00 -1.03 0.00 0.00 54.13 55.28 3g01 s LEU 115 Cb -0.15 -4.41 1.31 0.00 0.03 0.00 0.00 46.19 42.96 3g01 s LEU 115 CO 0.08 -0.59 1.98 -0.37 0.23 0.00 0.00 176.35 177.68 3g01 h VAL 116 N 0.80 0.41 -3.07 -1.59 -1.51 -1.78 -3.42 116.25 106.09 3g01 h VAL 116 Ca -0.47 -0.71 -0.09 0.00 -1.23 0.00 0.00 66.70 64.20 3g01 h VAL 116 Cb 1.19 1.51 -0.17 0.00 -2.13 0.00 0.00 31.29 31.68 3g01 h VAL 116 CO 0.62 0.12 -0.17 0.00 -1.23 0.00 0.00 177.57 176.91 3g01 s ARG 117 N -3.88 0.84 0.59 5.19 1.70 -1.26 -5.04 118.95 117.10 3g01 s ARG 117 Ca -0.01 -0.35 -0.19 0.00 -0.47 0.00 0.00 55.73 54.72 3g01 s ARG 117 Cb 0.11 0.37 -0.06 0.00 -0.57 0.00 0.00 34.95 34.81 3g01 s ARG 117 CO 0.58 -0.27 0.89 0.09 -1.08 0.00 0.00 175.30 175.51 3g01 n ASN 118 N 0.69 0.47 -4.77 -2.89 3.02 -1.26 -4.82 115.26 105.71 3g01 n ASN 118 Ca -0.19 0.80 -0.39 0.00 -0.03 0.00 0.00 54.58 54.77 3g01 n ASN 118 Cb 0.59 -1.35 -0.04 0.00 -0.61 0.00 0.00 39.78 38.36 3g01 n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g01 s ALA 119 N -1.54 3.27 -0.02 5.41 0.00 0.13 -4.96 121.76 124.04 3g01 s ALA 119 Ca 0.74 0.77 -0.25 0.00 0.00 0.00 0.00 51.96 53.23 3g01 s ALA 119 Cb -0.43 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.37 3g01 s ALA 119 CO 0.49 -0.12 0.76 0.15 0.00 0.00 0.00 175.76 177.03 3g01 s LYS 120 N -1.85 4.47 -0.13 0.00 3.01 -1.26 -4.90 119.74 119.08 3g01 s LYS 120 Ca 0.49 1.01 -0.29 0.00 -1.01 0.00 0.00 55.97 56.17 3g01 s LYS 120 Cb -0.27 -3.42 -0.04 0.00 -1.01 0.00 0.00 37.83 33.10 3g01 s LYS 120 CO 0.34 0.13 1.53 1.03 0.51 0.00 0.00 175.35 178.89 3g01 s ARG 121 N 0.53 4.10 0.30 1.68 1.81 -1.26 -4.76 118.95 121.35 3g01 s ARG 121 Ca 0.40 1.91 0.06 0.00 -1.72 0.00 0.00 55.73 56.37 3g01 s ARG 121 Cb -0.19 -3.93 -0.02 0.00 -0.45 0.00 0.00 34.95 30.35 3g01 s ARG 121 CO 0.21 -0.91 0.20 0.25 -0.68 0.00 0.00 175.30 174.37 3g01 n THR 122 N 5.67 0.00 0.26 0.02 -2.24 -1.15 -5.00 114.28 111.84 3g01 n THR 122 Ca 0.17 -2.05 0.14 0.00 -2.27 0.00 0.00 64.05 60.03 3g01 n THR 122 Cb 0.44 0.93 0.67 0.00 -2.10 0.00 0.00 70.33 70.27 3g01 n THR 122 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 3g01 h ARG 123 N 0.00 0.00 -0.00 -0.78 -0.00 -1.99 -2.96 114.38 108.65 3g01 h ARG 123 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.76 3g01 h ARG 123 Cb 1.02 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.99 3g01 h ARG 123 CO 0.34 0.00 -0.51 0.00 -0.00 0.00 0.00 179.97 179.80 3g01 n ALA 124 N -1.85 3.42 -3.63 0.08 0.00 -1.26 -4.86 120.51 112.41 3g01 n ALA 124 Ca -0.01 -0.32 -0.29 0.00 0.00 0.00 0.00 53.44 52.82 3g01 n ALA 124 Cb 0.11 -0.40 -0.15 0.00 0.00 0.00 0.00 19.45 19.00 3g01 n ALA 124 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3g01 s VAL 125 N -2.02 0.31 0.01 0.00 1.01 -1.12 -3.86 120.40 114.73 3g01 s VAL 125 Ca 0.04 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.12 3g01 s VAL 125 Cb 0.08 -1.17 -0.01 0.00 0.00 0.00 0.00 36.38 35.28 3g01 s VAL 125 CO 0.45 -0.61 0.03 -0.13 0.00 0.00 0.00 175.10 174.84 3g01 s ARG 126 N 1.92 0.34 0.54 2.72 1.81 -0.55 -2.92 118.95 122.81 3g01 s ARG 126 Ca 0.07 -0.48 -0.16 0.00 -1.72 0.00 0.00 55.73 53.44 3g01 s ARG 126 Cb -0.17 0.13 -0.06 0.00 -0.45 0.00 0.00 34.95 34.40 3g01 s ARG 126 CO -0.27 -0.07 1.01 -2.14 -0.68 0.00 0.00 175.30 173.15 3g01 s PRO 127 N -1.30 3.75 -0.16 3.54 0.02 -1.26 -2.89 135.00 136.69 3g01 s PRO 127 Ca -0.14 1.03 -0.13 0.00 0.02 0.00 0.00 61.00 61.78 3g01 s PRO 127 Cb -0.08 -2.10 -0.05 0.00 0.02 0.00 0.00 34.50 32.29 3g01 s PRO 127 CO -0.00 -0.44 0.26 -1.17 -0.33 0.00 0.00 177.00 175.31 3g01 s LEU 128 N -4.23 4.24 0.40 -5.54 2.96 0.64 -4.88 118.68 112.28 3g01 s LEU 128 Ca 0.60 0.46 -0.27 0.00 -0.22 0.00 0.00 54.13 54.70 3g01 s LEU 128 Cb -0.12 -2.32 -0.10 0.00 0.50 0.00 0.00 46.19 44.15 3g01 s LEU 128 CO 0.33 0.13 1.48 0.20 -1.32 0.00 0.00 176.35 177.17 3g01 s ASN 129 N 0.38 6.17 0.58 3.68 0.02 -1.26 -4.57 114.94 119.94 3g01 s ASN 129 Ca 0.15 3.04 -0.16 0.00 -1.02 0.00 0.00 52.86 54.87 3g01 s ASN 129 Cb -0.13 -2.67 -0.04 0.00 0.02 0.00 0.00 41.25 38.43 3g01 s ASN 129 CO 0.03 -0.99 1.04 -0.76 0.02 0.00 0.00 177.10 176.44 3g01 s LEU 130 N -2.30 3.52 0.62 0.60 1.43 -1.26 -0.97 118.68 120.31 3g01 s LEU 130 Ca 0.55 1.77 -0.16 0.00 -1.03 0.00 0.00 54.13 55.26 3g01 s LEU 130 Cb -0.46 -4.53 -0.02 0.00 0.03 0.00 0.00 46.19 41.21 3g01 s LEU 130 CO 0.62 -1.06 1.11 -2.16 0.23 0.00 0.00 176.35 175.09 3g01 s PRO 131 N -4.09 3.02 0.38 1.29 0.04 -1.25 -4.75 135.00 129.64 3g01 s PRO 131 Ca 0.63 1.43 -0.28 0.00 0.04 0.00 0.00 61.00 62.82 3g01 s PRO 131 Cb -0.15 -1.98 -0.10 0.00 0.04 0.00 0.00 34.50 32.31 3g01 s PRO 131 CO 0.36 -1.08 1.43 1.03 0.04 0.00 0.00 177.00 178.78 3g01 s ARG 132 N -3.86 4.08 0.44 4.56 1.81 -1.26 -4.88 118.95 119.84 3g01 s ARG 132 Ca 0.68 2.45 0.30 0.00 -1.72 0.00 0.00 55.73 57.45 3g01 s ARG 132 Cb -0.21 -2.93 1.44 0.00 -0.45 0.00 0.00 34.95 32.81 3g01 s ARG 132 CO 0.37 -0.51 1.60 0.07 -0.68 0.00 0.00 175.30 176.15 3g01 h ARG 133 N 2.95 0.05 -0.54 3.54 0.11 -1.98 0.36 114.38 118.88 3g01 h ARG 133 Ca -0.50 -0.00 -0.10 0.00 0.10 0.00 0.00 59.98 59.47 3g01 h ARG 133 Cb 1.24 -0.01 -0.06 0.00 1.11 0.00 0.00 29.97 32.25 3g01 h ARG 133 CO 0.64 0.04 0.10 0.27 0.10 0.00 0.00 179.97 181.12 3g01 n ASN 134 N -4.74 4.62 -4.65 0.08 2.04 -1.26 -4.95 115.26 106.39 3g01 n ASN 134 Ca 0.38 -3.15 -0.43 0.00 -0.44 0.00 0.00 54.58 50.95 3g01 n ASN 134 Cb 1.47 -0.67 -0.02 0.00 -2.53 0.00 0.00 39.78 38.03 3g01 n ASN 134 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3g01 s ALA 135 N -2.92 3.60 -0.96 -2.53 0.00 0.13 -4.97 121.76 114.10 3g01 s ALA 135 Ca 0.51 0.49 -0.13 0.00 0.00 0.00 0.00 51.96 52.83 3g01 s ALA 135 Cb 0.41 -3.67 0.23 0.00 0.00 0.00 0.00 23.12 20.09 3g01 s ALA 135 CO 0.12 -1.33 0.95 -1.01 0.00 0.00 0.00 175.76 174.48 3g01 s HIS 136 N 3.80 3.90 -0.20 0.00 3.76 -1.26 -4.96 115.29 120.33 3g01 s HIS 136 Ca 0.59 -2.22 -0.29 0.00 -0.15 0.00 0.00 55.06 52.99 3g01 s HIS 136 Cb -0.23 -3.88 -0.01 0.00 1.11 0.00 0.00 32.58 29.58 3g01 s HIS 136 CO 0.19 -1.02 1.21 0.54 -0.85 0.00 0.00 174.74 174.81 3g01 s VAL 137 N -0.15 4.36 0.06 -0.90 0.11 -1.26 -5.02 120.40 117.61 3g01 s VAL 137 Ca 0.25 1.63 0.01 0.00 -2.93 0.00 0.00 61.98 60.94 3g01 s VAL 137 Cb -0.09 -4.10 -0.03 0.00 -1.53 0.00 0.00 36.38 30.63 3g01 s VAL 137 CO -0.08 -0.20 -0.06 -0.54 -3.33 0.00 0.00 175.10 170.89 3g01 s LYS 138 N 3.52 0.61 0.11 1.54 3.01 -1.26 -5.09 119.74 122.18 3g01 s LYS 138 Ca 0.52 -0.97 -0.36 0.00 -1.01 0.00 0.00 55.97 54.15 3g01 s LYS 138 Cb -0.19 -0.16 -0.16 0.00 -1.01 0.00 0.00 37.83 36.30 3g01 s LYS 138 CO 0.14 -0.00 1.31 -2.30 0.51 0.00 0.00 175.35 175.01 3g01 n PRO 139 N 0.85 1.20 0.00 -1.68 -0.02 -1.26 -1.32 135.00 132.77 3g01 n PRO 139 Ca -0.19 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 3g01 n PRO 139 Cb 0.57 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 3g01 n PRO 139 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g01 n GLY 140 N 2.45 2.17 3.76 -1.23 0.00 -0.60 -5.00 105.19 106.73 3g01 n GLY 140 Ca 0.18 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3g01 n GLY 140 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3g01 n ASP 141 N 0.01 3.67 -4.58 1.61 8.00 -0.44 -4.73 116.55 120.10 3g01 n ASP 141 Ca 0.00 1.21 -0.35 0.00 0.71 0.00 0.00 54.79 56.36 3g01 n ASP 141 Cb 0.00 -1.60 -0.11 0.00 -0.02 0.00 0.00 41.12 39.39 3g01 n ASP 141 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3g01 s GLU 142 N -1.84 3.87 0.41 -1.24 2.02 -1.26 -1.68 118.70 118.99 3g01 s GLU 142 Ca 0.55 -0.39 0.03 0.00 0.02 0.00 0.00 54.97 55.19 3g01 s GLU 142 Cb -0.49 -3.24 -0.03 0.00 0.10 0.00 0.00 34.13 30.47 3g01 s GLU 142 CO 0.61 0.14 0.11 0.00 0.02 0.00 0.00 175.26 176.14 3g01 s TYR 144 N -3.17 1.45 0.03 0.00 1.51 -0.80 -0.15 117.35 116.22 3g01 s TYR 144 Ca 0.23 -0.28 0.06 0.00 -1.01 0.00 0.00 57.07 56.07 3g01 s TYR 144 Cb 0.03 -0.93 -0.03 0.00 -0.11 0.00 0.00 41.96 40.92 3g01 s TYR 144 CO 0.13 -0.02 -0.16 0.08 -1.11 0.00 0.00 175.55 174.47 3g01 s VAL 145 N -0.41 2.95 0.06 0.71 1.01 -0.59 -0.90 120.40 123.23 3g01 s VAL 145 Ca 0.06 -1.10 0.03 0.00 0.00 0.00 0.00 61.98 60.97 3g01 s VAL 145 Cb -0.06 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 3g01 s VAL 145 CO -0.00 0.35 -0.10 0.00 0.00 0.00 0.00 175.10 175.35 3g01 s ALA 146 N -0.93 0.81 -0.09 5.51 0.00 -1.26 -1.10 121.76 124.70 3g01 s ALA 146 Ca 0.15 -0.88 -0.31 0.00 0.00 0.00 0.00 51.96 50.93 3g01 s ALA 146 Cb -0.11 -0.00 0.10 0.00 0.00 0.00 0.00 23.12 23.12 3g01 s ALA 146 CO 0.06 0.04 1.37 0.20 0.00 0.00 0.00 175.76 177.43 3g01 s GLY 147 N -1.70 -0.24 0.00 0.00 0.00 -0.46 -4.66 107.32 100.26 3g01 s GLY 147 Ca -0.06 0.22 0.18 0.00 0.00 0.00 0.00 44.72 45.06 3g01 s GLY 147 CO 0.01 6.27 1.20 0.79 0.00 0.00 0.00 173.10 181.37 3g01 n TRP 148 N -0.94 0.29 -0.50 1.90 8.01 -1.26 -0.83 117.44 124.11 3g01 n TRP 148 Ca 0.05 -0.19 -0.29 0.00 -1.31 0.00 0.00 57.50 55.76 3g01 n TRP 148 Cb 0.59 -0.00 0.25 0.00 -2.01 0.00 0.00 31.31 30.13 3g01 n TRP 148 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3g01 n GLY 149 N 1.06 -2.17 3.77 6.99 0.00 -1.26 -4.52 105.19 109.06 3g01 n GLY 149 Ca 0.14 -1.12 -0.37 0.00 0.00 0.00 0.00 46.02 44.66 3g01 n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g01 s LYS 150 N -4.21 3.92 0.06 1.61 3.01 -1.26 -4.10 119.74 118.78 3g01 s LYS 150 Ca 0.66 1.77 -0.08 0.00 -1.01 0.00 0.00 55.97 57.32 3g01 s LYS 150 Cb -0.23 -2.53 -0.30 0.00 -1.01 0.00 0.00 37.83 33.76 3g01 s LYS 150 CO 0.66 -0.41 1.11 -0.24 0.51 0.00 0.00 175.35 176.97 3g01 h VAL 151 N 2.09 1.43 0.00 3.17 3.04 -2.01 -3.28 116.25 120.69 3g01 h VAL 151 Ca -0.49 -2.91 0.00 0.00 -1.01 0.00 0.00 66.70 62.29 3g01 h VAL 151 Cb 1.24 2.94 0.00 0.00 -2.01 0.00 0.00 31.29 33.46 3g01 h VAL 151 CO 0.61 0.86 0.00 0.29 -1.01 0.00 0.00 177.57 178.32 3g01 n LYS 159 N -3.61 0.00 -4.47 4.17 4.01 -1.26 -4.99 118.16 112.02 3g01 n LYS 159 Ca -0.11 0.00 -0.25 0.00 -0.51 0.00 0.00 58.31 57.44 3g01 n LYS 159 Cb 1.04 0.00 -0.10 0.00 -0.51 0.00 0.00 35.03 35.46 3g01 n LYS 159 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 3g01 s THR 160 N 0.00 2.39 0.15 -0.18 -4.23 -1.26 -2.28 115.64 110.23 3g01 s THR 160 Ca 0.00 -2.13 -0.30 0.00 -1.18 0.00 0.00 61.69 58.08 3g01 s THR 160 Cb 0.00 -2.69 -0.08 0.00 1.34 0.00 0.00 72.50 71.08 3g01 s THR 160 CO 0.00 -0.21 1.23 -0.22 -0.54 0.00 0.00 174.62 174.88 3g01 s LEU 161 N -3.64 4.42 0.20 4.79 2.96 -1.11 -4.63 118.68 121.66 3g01 s LEU 161 Ca 0.33 2.21 0.07 0.00 -0.22 0.00 0.00 54.13 56.53 3g01 s LEU 161 Cb 0.01 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.06 3g01 s LEU 161 CO 0.17 -0.44 -0.14 -1.00 -1.32 0.00 0.00 176.35 173.62 3g01 s HIS 162 N 0.32 1.67 0.02 5.38 3.76 -0.01 -1.85 115.29 124.58 3g01 s HIS 162 Ca 0.56 -0.59 0.01 0.00 -0.15 0.00 0.00 55.06 54.89 3g01 s HIS 162 Cb -0.33 -0.78 -0.01 0.00 1.11 0.00 0.00 32.58 32.57 3g01 s HIS 162 CO 0.34 0.33 -0.03 -1.83 -0.85 0.00 0.00 174.74 172.71 3g01 s GLU 163 N -3.62 0.28 0.09 1.40 -1.05 -0.40 -1.36 118.70 114.03 3g01 s GLU 163 Ca 0.22 -0.41 0.07 0.00 -0.15 0.00 0.00 54.97 54.70 3g01 s GLU 163 Cb -0.01 -0.06 -0.03 0.00 -0.44 0.00 0.00 34.13 33.59 3g01 s GLU 163 CO 0.06 0.00 -0.19 0.14 0.95 0.00 0.00 175.26 176.22 3g01 s VAL 164 N -0.87 1.58 -0.25 1.83 -7.23 -0.26 -2.59 120.40 112.61 3g01 s VAL 164 Ca -0.08 -1.47 -0.15 0.00 -1.81 0.00 0.00 61.98 58.47 3g01 s VAL 164 Cb -0.06 -1.44 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 3g01 s VAL 164 CO -0.00 -0.08 0.38 -0.75 -0.31 0.00 0.00 175.10 174.34 3g01 s LYS 165 N -1.83 4.06 0.16 4.82 2.20 -1.26 -1.54 119.74 126.36 3g01 s LYS 165 Ca 0.05 0.09 0.11 0.00 -0.36 0.00 0.00 55.97 55.85 3g01 s LYS 165 Cb -0.10 -3.62 -0.04 0.00 -1.51 0.00 0.00 37.83 32.56 3g01 s LYS 165 CO 0.04 -0.22 -0.24 -0.51 -0.36 0.00 0.00 175.35 174.06 3g01 s LEU 166 N 1.88 2.39 -0.21 5.43 1.43 0.79 -4.95 118.68 125.43 3g01 s LEU 166 Ca 0.16 -0.81 -0.05 0.00 -1.03 0.00 0.00 54.13 52.40 3g01 s LEU 166 Cb -0.15 -1.12 -0.02 0.00 0.03 0.00 0.00 46.19 44.92 3g01 s LEU 166 CO 0.09 0.12 0.01 -0.89 0.23 0.00 0.00 176.35 175.91 3g01 s THR 167 N -1.47 3.96 0.25 5.49 2.01 -1.26 -0.35 115.64 124.28 3g01 s THR 167 Ca 0.17 -0.30 -0.31 0.00 0.31 0.00 0.00 61.69 61.55 3g01 s THR 167 Cb -0.09 -2.80 -0.12 0.00 0.01 0.00 0.00 72.50 69.50 3g01 s THR 167 CO 0.08 0.41 1.62 0.52 -0.69 0.00 0.00 174.62 176.56 3g01 n VAL 168 N 4.39 0.61 -3.97 3.82 0.31 -0.68 -1.86 118.33 120.96 3g01 n VAL 168 Ca -0.17 -0.15 -0.21 0.00 -0.01 0.00 0.00 64.34 63.80 3g01 n VAL 168 Cb 0.52 -1.90 -0.02 0.00 -0.91 0.00 0.00 33.84 31.52 3g01 n VAL 168 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3g01 s GLN 169 N 0.16 3.34 0.56 5.55 -1.52 0.11 -1.56 119.66 126.29 3g01 s GLN 169 Ca 0.69 -0.82 -0.21 0.00 -1.95 0.00 0.00 55.36 53.07 3g01 s GLN 169 Cb -0.52 -2.84 -0.05 0.00 -0.22 0.00 0.00 33.01 29.39 3g01 s GLN 169 CO 0.42 0.40 1.34 0.36 -0.25 0.00 0.00 175.29 177.56 3g01 n LYS 170 N -1.39 1.60 -0.33 2.91 2.85 -1.26 -4.57 118.16 117.97 3g01 n LYS 170 Ca -0.08 0.59 0.12 0.00 -1.05 0.00 0.00 58.31 57.89 3g01 n LYS 170 Cb 0.57 -2.55 0.33 0.00 -0.65 0.00 0.00 35.03 32.73 3g01 n LYS 170 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 3g01 h ASP 171 N 1.30 0.76 -0.74 -5.58 3.32 -1.99 -2.28 116.42 111.22 3g01 h ASP 171 Ca -0.51 0.07 0.16 0.00 0.02 0.00 0.00 57.03 56.77 3g01 h ASP 171 Cb 1.31 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 40.74 3g01 h ASP 171 CO 0.56 0.32 0.50 1.56 -1.72 0.00 0.00 179.24 180.47 3g01 h GLN 172 N 0.77 0.32 0.36 3.56 7.50 -1.98 -0.36 115.11 125.28 3g01 h GLN 172 Ca 0.53 -0.02 -0.01 0.00 0.50 0.00 0.00 58.65 59.65 3g01 h GLN 172 Cb 0.81 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 28.26 3g01 h GLN 172 CO -0.30 0.21 -0.25 0.28 -1.50 0.00 0.00 178.83 177.27 3g01 h VAL 173 N 0.33 0.47 0.00 -0.54 2.07 -1.78 -1.31 116.25 115.49 3g01 h VAL 173 Ca 0.36 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.88 3g01 h VAL 173 Cb 0.94 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3g01 h VAL 173 CO -0.10 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.49 3g01 h GLU 175 N 0.00 0.84 0.08 0.00 5.08 -0.70 0.03 114.58 119.92 3g01 h GLU 175 Ca 0.00 -0.42 -0.26 0.00 -1.00 0.00 0.00 59.36 57.68 3g01 h GLU 175 Cb 0.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 3g01 h GLU 175 CO 0.00 1.05 -1.26 0.66 -1.00 0.00 0.00 179.01 178.46 3g01 h SER 176 N 0.70 0.27 1.01 1.42 4.64 -1.20 -1.70 113.55 118.70 3g01 h SER 176 Ca 0.07 -0.32 -0.14 0.00 -0.47 0.00 0.00 61.79 60.93 3g01 h SER 176 Cb 0.91 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.89 3g01 h SER 176 CO 0.08 1.25 -0.66 -0.61 -0.87 0.00 0.00 176.83 176.03 3g01 h GLN 177 N 0.05 0.00 0.00 4.77 5.75 -1.41 -3.36 115.11 120.91 3g01 h GLN 177 Ca -0.13 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.37 3g01 h GLN 177 Cb 1.93 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.48 3g01 h GLN 177 CO 0.17 0.66 -0.20 1.19 -2.65 0.00 0.00 178.83 178.00 3g01 n PHE 178 N -3.45 0.00 0.00 3.99 3.01 -0.01 -5.06 117.46 115.95 3g01 n PHE 178 Ca 0.00 -0.28 0.00 0.00 1.01 0.00 0.00 57.45 58.18 3g01 n PHE 178 Cb 0.73 -0.06 0.00 0.00 -0.01 0.00 0.00 39.48 40.14 3g01 n PHE 178 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3g01 n GLN 179 N -0.37 0.00 0.00 -1.08 0.00 -0.64 -0.85 117.38 114.43 3g01 n GLN 179 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.03 3g01 n GLN 179 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.82 3g01 n GLN 179 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 3g01 n SER 180 N 0.00 0.00 0.14 2.61 2.88 -1.26 -4.74 113.62 113.24 3g01 n SER 180 Ca 0.00 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.53 3g01 n SER 180 Cb 0.00 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 63.61 3g01 n SER 180 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3g01 h SER 181 N 0.05 0.00 -3.36 -3.46 0.02 -1.36 -3.45 113.55 101.99 3g01 h SER 181 Ca 0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.39 3g01 h SER 181 Cb 0.00 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.48 3g01 h SER 181 CO 0.00 0.62 0.13 -0.47 -1.14 0.00 0.00 176.83 175.97 3g01 s TYR 182 N -3.45 3.55 -0.28 3.45 5.04 -1.22 -4.89 117.35 119.56 3g01 s TYR 182 Ca -0.00 1.24 0.01 0.00 -2.44 0.00 0.00 57.07 55.88 3g01 s TYR 182 Cb 0.12 -2.83 0.08 0.00 0.35 0.00 0.00 41.96 39.67 3g01 s TYR 182 CO 0.75 0.03 0.01 1.21 -1.34 0.00 0.00 175.55 176.21 3g01 s ASN 183 N 0.87 4.18 0.54 4.32 3.84 -1.26 -4.97 114.94 122.46 3g01 s ASN 183 Ca 0.37 -1.57 0.35 0.00 0.21 0.00 0.00 52.86 52.23 3g01 s ASN 183 Cb -0.18 -1.25 1.66 0.00 -0.55 0.00 0.00 41.25 40.93 3g01 s ASN 183 CO 0.17 -0.31 2.06 0.08 -2.79 0.00 0.00 177.10 176.31 3g01 h ARG 184 N 7.88 0.00 -0.09 0.43 0.11 -1.97 -0.75 114.38 120.00 3g01 h ARG 184 Ca -0.13 0.00 -0.21 0.00 0.10 0.00 0.00 59.98 59.74 3g01 h ARG 184 Cb 1.04 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.13 3g01 h ARG 184 CO 0.46 0.00 -0.80 0.00 0.10 0.00 0.00 179.97 179.73 3g01 h ALA 185 N 2.03 0.44 0.00 0.08 0.00 -2.03 -3.35 119.26 116.43 3g01 h ALA 185 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3g01 h ALA 185 Cb 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3g01 h ALA 185 CO 0.00 0.74 -0.00 0.27 0.00 0.00 0.00 179.25 180.26 3g01 n ASN 186 N -3.86 2.08 -3.94 0.00 0.23 -1.01 -4.86 115.26 103.91 3g01 n ASN 186 Ca -0.06 -2.32 -0.09 0.00 -0.53 0.00 0.00 54.58 51.58 3g01 n ASN 186 Cb 0.75 -0.13 -0.09 0.00 -2.08 0.00 0.00 39.78 38.23 3g01 n ASN 186 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 3g01 s GLU 187 N -1.55 0.66 0.09 -3.83 2.02 -0.32 -0.97 118.70 114.80 3g01 s GLU 187 Ca 0.10 -0.89 0.09 0.00 0.02 0.00 0.00 54.97 54.29 3g01 s GLU 187 Cb 0.08 0.26 -0.03 0.00 0.10 0.00 0.00 34.13 34.54 3g01 s GLU 187 CO 0.01 -0.17 -0.24 0.42 0.02 0.00 0.00 175.26 175.29 3g01 s ILE 188 N -3.17 2.01 -0.28 -1.63 1.01 0.18 -4.57 121.20 114.76 3g01 s ILE 188 Ca -0.00 -1.51 -0.06 0.00 0.00 0.00 0.00 60.65 59.08 3g01 s ILE 188 Cb 0.02 -1.76 0.00 0.00 0.01 0.00 0.00 42.46 40.73 3g01 s ILE 188 CO -0.07 0.16 0.05 0.00 0.00 0.00 0.00 174.94 175.08 3g01 s VAL 190 N 1.50 1.33 0.00 0.00 -7.23 -0.60 0.04 120.40 115.44 3g01 s VAL 190 Ca 0.03 -1.11 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 3g01 s VAL 190 Cb -0.16 -1.19 0.00 0.00 0.56 0.00 0.00 36.38 35.58 3g01 s VAL 190 CO 0.01 0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.47 3g01 n GLY 191 N 1.81 -0.47 3.65 2.32 0.00 -0.78 -0.23 105.19 111.49 3g01 n GLY 191 Ca -0.18 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.42 3g01 n GLY 191 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3g01 n ASP 192 N 0.00 -0.27 -0.91 1.61 5.75 -1.26 -4.07 116.55 117.40 3g01 n ASP 192 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 3g01 n ASP 192 Cb 0.00 -2.17 0.00 0.00 -1.03 0.00 0.00 41.12 37.92 3g01 n ASP 192 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3g01 n GLY 202 N -1.41 2.94 4.52 6.12 0.00 -1.26 -4.72 105.19 111.38 3g01 n GLY 202 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.76 3g01 n GLY 202 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3g01 n ASP 203 N -1.68 0.00 -4.78 1.61 4.64 -1.26 -4.36 116.55 110.72 3g01 n ASP 203 Ca 0.00 0.00 -0.31 0.00 -1.38 0.00 0.00 54.79 53.10 3g01 n ASP 203 Cb 0.00 0.00 0.08 0.00 -1.04 0.00 0.00 41.12 40.16 3g01 n ASP 203 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3g01 s SER 204 N 0.00 4.71 -1.34 1.67 1.04 -1.26 -1.43 113.70 117.09 3g01 s SER 204 Ca 0.00 1.66 -0.16 0.00 0.48 0.00 0.00 55.95 57.93 3g01 s SER 204 Cb 0.00 -2.43 0.03 0.00 0.10 0.00 0.00 66.02 63.72 3g01 s SER 204 CO 0.00 -1.88 2.04 0.61 0.98 0.00 0.00 173.24 174.99 3g01 n GLY 205 N -1.57 3.56 3.83 7.32 0.00 -1.24 -0.09 105.19 117.00 3g01 n GLY 205 Ca 0.08 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.31 3g01 n GLY 205 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g01 s GLY 206 N 3.81 1.63 0.24 -0.02 0.00 -0.52 -3.46 107.32 109.00 3g01 s GLY 206 Ca 0.51 -0.22 -0.24 0.00 0.00 0.00 0.00 44.72 44.77 3g01 s GLY 206 CO -0.01 0.18 0.82 2.56 0.00 0.00 0.00 173.10 176.65 3g01 s PRO 207 N -5.21 4.49 -0.21 2.90 0.04 -1.26 -0.98 135.00 134.78 3g01 s PRO 207 Ca 0.59 1.14 -0.19 0.00 0.04 0.00 0.00 61.00 62.59 3g01 s PRO 207 Cb -0.13 -3.00 -0.03 0.00 0.04 0.00 0.00 34.50 31.38 3g01 s PRO 207 CO 0.53 0.42 0.53 -1.17 0.04 0.00 0.00 177.00 177.36 3g01 s LEU 208 N -1.69 4.14 -0.31 -3.56 2.96 -0.44 -4.17 118.68 115.61 3g01 s LEU 208 Ca 0.43 0.68 -0.10 0.00 -0.22 0.00 0.00 54.13 54.91 3g01 s LEU 208 Cb -0.20 -2.73 -0.01 0.00 0.50 0.00 0.00 46.19 43.75 3g01 s LEU 208 CO 0.24 -0.20 0.17 -0.69 -1.32 0.00 0.00 176.35 174.55 3g01 s VAL 209 N 1.75 4.80 -0.04 1.68 1.01 -0.08 -0.43 120.40 129.09 3g01 s VAL 209 Ca 0.24 -0.32 0.06 0.00 0.00 0.00 0.00 61.98 61.96 3g01 s VAL 209 Cb -0.15 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 3g01 s VAL 209 CO 0.10 0.07 -0.21 0.00 0.00 0.00 0.00 175.10 175.06 3g01 n LYS 211 N 2.84 -1.16 -1.46 0.00 4.01 -1.26 -0.81 118.16 120.32 3g01 n LYS 211 Ca -0.17 0.13 -0.16 0.00 -0.51 0.00 0.00 58.31 57.60 3g01 n LYS 211 Cb 0.52 -3.58 -0.07 0.00 -0.51 0.00 0.00 35.03 31.39 3g01 n LYS 211 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 3g01 n ARG 212 N -4.62 -1.31 -4.21 1.97 5.12 -1.26 -4.98 116.66 107.37 3g01 n ARG 212 Ca -0.30 1.05 -0.14 0.00 -1.93 0.00 0.00 57.85 56.53 3g01 n ARG 212 Cb 0.68 -5.31 -0.10 0.00 -1.16 0.00 0.00 32.46 26.56 3g01 n ARG 212 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3g01 s ALA 213 N -2.48 1.27 -0.55 7.54 0.00 0.01 -4.20 121.76 123.34 3g01 s ALA 213 Ca 0.00 -1.35 -0.28 0.00 0.00 0.00 0.00 51.96 50.34 3g01 s ALA 213 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.17 3g01 s ALA 213 CO 0.00 -0.08 1.56 0.00 0.00 0.00 0.00 175.76 177.24 3g01 s ALA 214 N -2.96 2.67 -0.12 0.00 0.00 -0.14 -1.22 121.76 119.99 3g01 s ALA 214 Ca 0.11 -0.57 -0.06 0.00 0.00 0.00 0.00 51.96 51.44 3g01 s ALA 214 Cb 0.00 -4.14 -0.26 0.00 0.00 0.00 0.00 23.12 18.72 3g01 s ALA 214 CO -0.00 -3.13 0.36 0.00 0.00 0.00 0.00 175.76 172.99 3g01 n ALA 215 N 10.40 0.92 -2.38 0.00 0.00 0.43 -3.90 120.51 125.99 3g01 n ALA 215 Ca 0.15 -0.61 -0.20 0.00 0.00 0.00 0.00 53.44 52.78 3g01 n ALA 215 Cb 0.50 -0.67 -0.09 0.00 0.00 0.00 0.00 19.45 19.18 3g01 n ALA 215 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3g01 s GLY 216 N -5.59 2.14 -0.08 0.00 0.00 -1.00 -0.99 107.32 101.80 3g01 s GLY 216 Ca -0.22 -1.70 -0.01 0.00 0.00 0.00 0.00 44.72 42.79 3g01 s GLY 216 CO 0.77 -1.65 -0.02 -0.42 0.00 0.00 0.00 173.10 171.78 3g01 s ILE 217 N -3.51 0.53 -0.11 0.90 1.01 -0.93 -1.32 121.20 117.77 3g01 s ILE 217 Ca 0.34 0.01 -0.38 0.00 0.00 0.00 0.00 60.65 60.62 3g01 s ILE 217 Cb 0.05 -0.64 -0.15 0.00 0.01 0.00 0.00 42.46 41.72 3g01 s ILE 217 CO 0.17 0.28 1.63 0.52 0.00 0.00 0.00 174.94 177.54 3g01 n VAL 218 N 4.97 0.23 0.05 2.92 0.31 -0.15 -1.74 118.33 124.92 3g01 n VAL 218 Ca -0.10 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 3g01 n VAL 218 Cb 0.50 -1.23 0.00 0.00 -0.91 0.00 0.00 33.84 32.20 3g01 n VAL 218 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3g01 n SER 219 N 4.56 0.84 -3.62 4.52 2.88 -0.80 -3.62 113.62 118.37 3g01 n SER 219 Ca 0.23 0.14 -0.11 0.00 -1.33 0.00 0.00 58.87 57.80 3g01 n SER 219 Cb 0.19 -0.23 -0.04 0.00 -0.75 0.00 0.00 64.21 63.37 3g01 n SER 219 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 3g01 s TYR 220 N -1.82 -0.22 0.00 0.66 -0.85 -1.06 -5.02 117.35 109.04 3g01 s TYR 220 Ca 0.00 -0.09 0.00 0.00 -0.52 0.00 0.00 57.07 56.46 3g01 s TYR 220 Cb 0.00 0.27 0.00 0.00 0.38 0.00 0.00 41.96 42.61 3g01 s TYR 220 CO 0.00 -0.71 0.00 0.41 -1.52 0.00 0.00 175.55 173.73 3g01 n GLY 221 N -0.22 5.21 0.04 5.49 0.00 -1.26 0.41 105.19 114.85 3g01 n GLY 221 Ca -0.16 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.62 3g01 n GLY 221 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3g01 n GLN 222 N 0.00 0.00 0.00 1.61 6.02 -1.26 -4.99 117.38 118.76 3g01 n GLN 222 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3g01 n GLN 222 Cb 0.00 -0.36 0.00 0.00 1.02 0.00 0.00 30.24 30.90 3g01 n GLN 222 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g01 n GLY 225 N 1.83 0.00 3.46 1.08 0.00 -1.26 -5.01 105.19 105.30 3g01 n GLY 225 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3g01 n GLY 225 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3g01 s SER 226 N 0.00 2.42 0.63 1.61 0.15 -1.26 -5.07 113.70 112.18 3g01 s SER 226 Ca 0.00 -1.57 -0.13 0.00 0.70 0.00 0.00 55.95 54.96 3g01 s SER 226 Cb 0.00 0.32 -0.02 0.00 -1.71 0.00 0.00 66.02 64.61 3g01 s SER 226 CO 0.00 -0.83 1.04 0.00 1.20 0.00 0.00 173.24 174.65 3g01 s ALA 227 N -3.32 2.83 0.57 5.45 0.00 -1.26 -4.42 121.76 121.61 3g01 s ALA 227 Ca 0.29 0.14 -0.08 0.00 0.00 0.00 0.00 51.96 52.31 3g01 s ALA 227 Cb 0.05 -3.16 -0.03 0.00 0.00 0.00 0.00 23.12 19.97 3g01 s ALA 227 CO 0.15 -0.88 0.93 -1.25 0.00 0.00 0.00 175.76 174.71 3g01 s PRO 228 N -4.69 3.48 0.29 0.00 0.04 -1.26 -4.96 135.00 127.91 3g01 s PRO 228 Ca 0.59 0.46 0.11 0.00 0.04 0.00 0.00 61.00 62.19 3g01 s PRO 228 Cb -0.13 -2.21 -0.05 0.00 0.04 0.00 0.00 34.50 32.14 3g01 s PRO 228 CO 0.47 -0.46 -0.16 1.14 0.04 0.00 0.00 177.00 178.03 3g01 s GLN 229 N -5.00 1.68 -0.13 4.56 -2.07 0.68 -4.42 119.66 114.95 3g01 s GLN 229 Ca 0.52 -1.80 -0.02 0.00 -1.82 0.00 0.00 55.36 52.24 3g01 s GLN 229 Cb -0.11 -1.67 -0.02 0.00 -1.09 0.00 0.00 33.01 30.12 3g01 s GLN 229 CO 0.50 0.25 -0.08 0.08 -1.32 0.00 0.00 175.29 174.72 3g01 s VAL 230 N -2.60 3.54 -0.04 3.63 1.01 0.16 -1.56 120.40 124.56 3g01 s VAL 230 Ca 0.30 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 61.85 3g01 s VAL 230 Cb -0.02 -2.52 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 3g01 s VAL 230 CO 0.15 0.52 -0.20 -0.36 0.00 0.00 0.00 175.10 175.21 3g01 s PHE 231 N 0.22 2.53 0.25 5.22 0.40 0.11 -1.90 117.98 124.80 3g01 s PHE 231 Ca -0.05 -0.30 -0.31 0.00 -0.60 0.00 0.00 56.93 55.67 3g01 s PHE 231 Cb -0.14 -1.57 -0.11 0.00 0.51 0.00 0.00 43.02 41.70 3g01 s PHE 231 CO 0.04 0.07 1.61 0.99 0.70 0.00 0.00 175.22 178.63 3g01 s THR 232 N -0.65 2.19 -0.64 0.64 2.01 -0.71 0.50 115.64 118.98 3g01 s THR 232 Ca 0.10 0.15 -0.26 0.00 0.31 0.00 0.00 61.69 62.00 3g01 s THR 232 Cb -0.10 -3.10 0.04 0.00 0.01 0.00 0.00 72.50 69.35 3g01 s THR 232 CO -0.00 0.02 1.11 -0.60 -0.69 0.00 0.00 174.62 174.46 3g01 s ARG 233 N 0.14 3.28 0.28 4.92 3.52 -0.14 -2.20 118.95 128.75 3g01 s ARG 233 Ca 0.67 -0.27 -0.03 0.00 -0.13 0.00 0.00 55.73 55.97 3g01 s ARG 233 Cb -0.47 -4.12 0.39 0.00 -1.56 0.00 0.00 34.95 29.19 3g01 s ARG 233 CO 0.41 -1.82 1.94 0.28 -0.81 0.00 0.00 175.30 175.30 3g01 h VAL 234 N 6.04 1.22 -0.46 7.11 2.07 -1.34 -1.35 116.25 129.55 3g01 h VAL 234 Ca -0.27 -0.47 0.13 0.00 0.82 0.00 0.00 66.70 66.91 3g01 h VAL 234 Cb 1.06 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3g01 h VAL 234 CO 1.19 0.23 0.33 0.25 0.02 0.00 0.00 177.57 179.60 3g01 h LEU 235 N 1.13 0.01 -1.56 2.57 5.85 -1.83 0.95 115.31 122.43 3g01 h LEU 235 Ca 0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.02 3g01 h LEU 235 Cb -0.07 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.96 3g01 h LEU 235 CO -0.06 0.01 0.00 0.28 -0.34 0.00 0.00 178.44 178.33 3g01 h SER 236 N 0.02 0.00 -0.00 1.25 0.02 -1.57 -3.23 113.55 110.04 3g01 h SER 236 Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3g01 h SER 236 Cb 0.86 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.40 3g01 h SER 236 CO -0.01 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.17 3g01 n PHE 237 N -2.67 0.00 -0.35 3.45 3.72 0.30 -4.71 117.46 117.20 3g01 n PHE 237 Ca -0.00 -0.01 0.09 0.00 -0.05 0.00 0.00 57.45 57.48 3g01 n PHE 237 Cb 0.18 -0.00 0.26 0.00 -0.94 0.00 0.00 39.48 38.98 3g01 n PHE 237 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3g01 h VAL 238 N 0.28 0.83 -0.17 -4.37 2.07 -1.50 0.92 116.25 114.31 3g01 h VAL 238 Ca 0.00 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 3g01 h VAL 238 Cb 0.07 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.71 3g01 h VAL 238 CO 0.00 0.16 0.04 -1.28 0.02 0.00 0.00 177.57 176.51 3g01 h SER 239 N 0.87 0.26 -0.26 0.57 0.87 -1.84 -2.29 113.55 111.72 3g01 h SER 239 Ca 0.51 -0.23 -0.05 0.00 -1.23 0.00 0.00 61.79 60.79 3g01 h SER 239 Cb 0.63 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 3g01 h SER 239 CO -0.31 0.42 0.01 -0.25 -0.53 0.00 0.00 176.83 176.17 3g01 h TRP 240 N 0.08 0.59 -0.25 2.24 7.01 -1.64 -3.00 115.95 120.99 3g01 h TRP 240 Ca 0.05 -0.06 -0.03 0.00 2.11 0.00 0.00 58.89 60.97 3g01 h TRP 240 Cb 0.27 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.14 3g01 h TRP 240 CO 0.01 0.57 0.05 0.82 -2.79 0.00 0.00 178.44 177.10 3g01 h ILE 241 N 0.55 1.22 -0.52 2.65 2.04 -0.63 -2.01 117.51 120.80 3g01 h ILE 241 Ca 0.12 -0.73 -0.03 0.00 1.00 0.00 0.00 64.86 65.22 3g01 h ILE 241 Cb 0.33 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 3g01 h ILE 241 CO 0.01 0.23 0.22 0.11 0.00 0.00 0.00 178.15 178.72 3g01 h LYS 242 N 0.22 0.78 -0.05 2.37 1.57 -1.40 -2.33 116.57 117.73 3g01 h LYS 242 Ca 0.08 -0.13 -0.13 0.00 -1.87 0.00 0.00 60.65 58.59 3g01 h LYS 242 Cb 0.30 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3g01 h LYS 242 CO 0.00 0.67 -0.57 0.87 -0.57 0.00 0.00 179.45 179.85 3g01 h LYS 243 N 0.71 0.16 -0.05 3.15 1.57 -1.51 -1.53 116.57 119.07 3g01 h LYS 243 Ca 0.18 -0.10 -0.13 0.00 -1.87 0.00 0.00 60.65 58.72 3g01 h LYS 243 Cb 0.18 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 3g01 h LYS 243 CO -0.02 0.69 -0.57 1.15 -0.57 0.00 0.00 179.45 180.13 3g01 h THR 244 N 0.12 1.39 -0.01 -0.16 2.02 -1.22 0.78 112.91 115.83 3g01 h THR 244 Ca -0.00 -1.93 -0.17 0.00 0.77 0.00 0.00 66.41 65.08 3g01 h THR 244 Cb 1.05 1.99 -0.02 0.00 -1.74 0.00 0.00 68.15 69.43 3g01 h THR 244 CO 0.08 0.56 -0.77 0.24 0.37 0.00 0.00 175.52 176.01 3g01 h MET 245 N 0.11 0.07 0.00 6.66 2.07 -1.13 -3.17 114.93 119.54 3g01 h MET 245 Ca -0.00 -0.07 -0.14 0.00 -2.07 0.00 0.00 59.70 57.42 3g01 h MET 245 Cb 1.05 0.02 -0.02 0.00 -1.87 0.00 0.00 31.60 30.77 3g01 h MET 245 CO 0.08 0.80 -0.75 0.87 1.07 0.00 0.00 176.91 178.98 3g01 h LYS 246 N 0.04 0.00 0.00 1.72 1.57 -1.14 -3.52 116.57 115.25 3g01 h LYS 246 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3g01 h LYS 246 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.66 3g01 h LYS 246 CO 0.11 0.55 0.00 0.72 -0.57 0.00 0.00 179.45 180.25