#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ob3 n GLU 2 N 0.00 -5.57 -3.21 3.17 4.07 -1.26 -4.53 120.64 113.31 1ob3 n GLU 2 Ca 0.00 0.66 -0.11 0.00 -0.06 0.00 0.00 57.16 57.64 1ob3 n GLU 2 Cb 0.00 -5.13 0.05 0.00 -0.06 0.00 0.00 31.44 26.30 1ob3 n GLU 2 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1ob3 n LYS 3 N -3.66 -2.00 -4.88 5.31 5.02 -1.26 -4.93 118.16 111.76 1ob3 n LYS 3 Ca -0.14 1.02 -0.31 0.00 -2.02 0.00 0.00 58.31 56.86 1ob3 n LYS 3 Cb 0.60 -5.80 -0.14 0.00 -0.02 0.00 0.00 35.03 29.68 1ob3 n LYS 3 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1ob3 s TYR 4 N -3.29 2.55 0.30 2.13 1.51 -1.26 -3.34 117.35 115.95 1ob3 s TYR 4 Ca 0.34 -0.27 0.04 0.00 -1.01 0.00 0.00 57.07 56.17 1ob3 s TYR 4 Cb -0.05 -1.52 -0.06 0.00 -0.11 0.00 0.00 41.96 40.22 1ob3 s TYR 4 CO 0.74 0.17 0.04 -3.38 -1.11 0.00 0.00 175.55 172.01 1ob3 s HIS 5 N -0.79 1.88 -1.26 2.71 -3.43 0.50 -4.86 115.29 110.05 1ob3 s HIS 5 Ca 0.12 -0.94 -0.06 0.00 -0.80 0.00 0.00 55.06 53.38 1ob3 s HIS 5 Cb -0.10 -1.19 0.01 0.00 -1.43 0.00 0.00 32.58 29.86 1ob3 s HIS 5 CO 0.02 0.00 1.09 0.41 -2.00 0.00 0.00 174.74 174.26 1ob3 n GLY 6 N -0.62 -0.44 3.62 -1.38 0.00 -1.26 -1.66 105.19 103.44 1ob3 n GLY 6 Ca -0.03 0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1ob3 n GLY 6 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ob3 s LEU 7 N -6.80 3.76 -0.15 0.99 1.02 -1.26 -4.37 118.68 111.87 1ob3 s LEU 7 Ca 0.42 1.73 0.00 0.00 0.02 0.00 0.00 54.13 56.30 1ob3 s LEU 7 Cb -0.19 -3.53 -0.00 0.00 0.02 0.00 0.00 46.19 42.50 1ob3 s LEU 7 CO 0.69 -1.51 -0.15 -0.70 0.02 0.00 0.00 176.35 174.71 1ob3 s GLU 8 N 5.28 3.22 -0.09 1.70 2.12 0.05 -4.96 118.70 126.02 1ob3 s GLU 8 Ca 0.82 -0.75 -0.30 0.00 0.36 0.00 0.00 54.97 55.11 1ob3 s GLU 8 Cb -0.28 -2.62 -0.03 0.00 0.26 0.00 0.00 34.13 31.46 1ob3 s GLU 8 CO 0.33 0.03 1.23 0.21 -0.54 0.00 0.00 175.26 176.52 1ob3 s LYS 9 N 0.78 4.31 0.00 4.30 2.20 -1.26 0.00 119.74 130.07 1ob3 s LYS 9 Ca -0.06 1.68 0.06 0.00 -0.36 0.00 0.00 55.97 57.29 1ob3 s LYS 9 Cb -0.15 -3.62 0.03 0.00 -1.51 0.00 0.00 37.83 32.58 1ob3 s LYS 9 CO 0.00 -0.53 0.62 0.44 -0.36 0.00 0.00 175.35 175.53 1ob3 n ILE 10 N 4.84 0.00 0.00 5.43 -5.35 0.21 -4.91 119.36 119.59 1ob3 n ILE 10 Ca 0.12 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 1ob3 n ILE 10 Cb 0.46 1.11 0.00 0.00 -1.74 0.00 0.00 39.64 39.47 1ob3 n ILE 10 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ob3 n GLY 11 N 0.47 2.24 3.53 3.28 0.00 -1.11 -4.98 105.19 108.62 1ob3 n GLY 11 Ca 0.03 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 1ob3 n GLY 11 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ob3 s GLU 12 N -2.00 3.45 0.72 1.61 2.56 -1.26 -0.75 118.70 123.03 1ob3 s GLU 12 Ca 0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 54.97 54.64 1ob3 s GLU 12 Cb 0.00 -3.87 0.14 0.00 2.00 0.00 0.00 34.13 32.41 1ob3 s GLU 12 CO 0.00 -0.75 0.99 0.41 -0.56 0.00 0.00 175.26 175.35 1ob3 n GLY 13 N 4.91 0.68 0.20 -1.50 0.00 0.17 -4.94 105.19 104.71 1ob3 n GLY 13 Ca -0.05 -2.03 -0.06 0.00 0.00 0.00 0.00 46.02 43.88 1ob3 n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ob3 h THR 14 N -0.59 1.02 -0.33 2.61 2.02 -2.00 -3.00 112.91 112.64 1ob3 h THR 14 Ca -0.33 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1ob3 h THR 14 Cb 1.22 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 1ob3 h THR 14 CO 0.35 0.10 0.00 -1.22 0.37 0.00 0.00 175.52 175.12 1ob3 n TYR 15 N -4.84 0.55 -2.71 3.16 4.02 -1.26 -5.08 117.16 111.00 1ob3 n TYR 15 Ca 0.03 -0.57 0.00 0.00 -0.01 0.00 0.00 57.90 57.36 1ob3 n TYR 15 Cb 0.09 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.33 1ob3 n TYR 15 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ob3 n GLY 16 N 0.33 -1.23 3.77 2.72 0.00 -1.13 -0.55 105.19 109.10 1ob3 n GLY 16 Ca 0.13 -1.36 -0.38 0.00 0.00 0.00 0.00 46.02 44.41 1ob3 n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ob3 s VAL 17 N -2.65 5.02 -0.18 1.61 0.11 -1.12 0.43 120.40 123.62 1ob3 s VAL 17 Ca 0.00 1.02 -0.09 0.00 -2.93 0.00 0.00 61.98 59.99 1ob3 s VAL 17 Cb 0.00 -3.82 -0.05 0.00 -1.53 0.00 0.00 36.38 30.98 1ob3 s VAL 17 CO 0.00 0.45 0.11 -0.69 -3.33 0.00 0.00 175.10 171.63 1ob3 s VAL 18 N -0.26 5.19 0.05 2.04 1.01 0.07 -1.74 120.40 126.77 1ob3 s VAL 18 Ca 0.27 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.42 1ob3 s VAL 18 Cb -0.17 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 1ob3 s VAL 18 CO 0.14 0.47 -0.15 -0.31 0.00 0.00 0.00 175.10 175.24 1ob3 s TYR 19 N 0.19 2.63 0.09 5.22 1.51 0.30 -0.62 117.35 126.67 1ob3 s TYR 19 Ca 0.07 -0.21 -0.17 0.00 -1.01 0.00 0.00 57.07 55.75 1ob3 s TYR 19 Cb -0.12 -1.47 -0.07 0.00 -0.11 0.00 0.00 41.96 40.20 1ob3 s TYR 19 CO -0.01 0.30 0.54 0.21 -1.11 0.00 0.00 175.55 175.49 1ob3 s LYS 20 N -1.57 4.10 0.22 -0.62 2.20 0.10 -0.05 119.74 124.12 1ob3 s LYS 20 Ca 0.16 0.62 -0.16 0.00 -0.36 0.00 0.00 55.97 56.24 1ob3 s LYS 20 Cb -0.11 -3.14 0.01 0.00 -1.51 0.00 0.00 37.83 33.08 1ob3 s LYS 20 CO 0.07 0.60 0.51 0.00 -0.36 0.00 0.00 175.35 176.17 1ob3 s ALA 21 N -1.21 -0.65 0.05 3.13 0.00 -0.21 -0.77 121.76 122.10 1ob3 s ALA 21 Ca 0.31 -0.52 0.09 0.00 0.00 0.00 0.00 51.96 51.84 1ob3 s ALA 21 Cb -0.18 0.92 -0.03 0.00 0.00 0.00 0.00 23.12 23.84 1ob3 s ALA 21 CO 0.18 -0.84 -0.25 -0.65 0.00 0.00 0.00 175.76 174.20 1ob3 s GLN 22 N -3.94 1.71 0.59 0.00 -0.21 -0.67 -1.26 119.66 115.88 1ob3 s GLN 22 Ca 0.15 -1.08 -0.10 0.00 0.02 0.00 0.00 55.36 54.35 1ob3 s GLN 22 Cb -0.01 -1.87 0.14 0.00 1.00 0.00 0.00 33.01 32.26 1ob3 s GLN 22 CO 0.03 0.48 0.74 0.27 -2.12 0.00 0.00 175.29 174.69 1ob3 n ASN 23 N 1.79 -0.25 -0.22 5.90 0.23 -1.10 -0.37 115.26 121.24 1ob3 n ASN 23 Ca -0.17 -1.20 0.01 0.00 -0.53 0.00 0.00 54.58 52.68 1ob3 n ASN 23 Cb 0.52 -0.58 0.02 0.00 -2.08 0.00 0.00 39.78 37.66 1ob3 n ASN 23 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1ob3 n ASN 24 N -3.60 0.52 -0.61 0.53 2.85 -1.21 -3.03 115.26 110.71 1ob3 n ASN 24 Ca 0.09 -2.01 0.07 0.00 -0.11 0.00 0.00 54.58 52.62 1ob3 n ASN 24 Cb 0.33 -0.17 0.08 0.00 1.24 0.00 0.00 39.78 41.26 1ob3 n ASN 24 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 1ob3 n TYR 25 N -0.26 0.08 0.00 1.20 4.02 -1.26 -5.00 117.16 115.93 1ob3 n TYR 25 Ca 0.01 -0.06 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 1ob3 n TYR 25 Cb 0.11 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.43 1ob3 n TYR 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ob3 n GLY 26 N 0.82 2.59 3.77 2.72 0.00 -1.17 -5.05 105.19 108.86 1ob3 n GLY 26 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 1ob3 n GLY 26 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ob3 s GLU 27 N -0.28 3.84 -0.16 1.61 2.02 -1.26 -4.80 118.70 119.68 1ob3 s GLU 27 Ca 0.00 1.85 -0.17 0.00 0.02 0.00 0.00 54.97 56.68 1ob3 s GLU 27 Cb 0.00 -2.52 -0.04 0.00 0.10 0.00 0.00 34.13 31.67 1ob3 s GLU 27 CO 0.00 -0.50 0.42 0.99 0.02 0.00 0.00 175.26 176.19 1ob3 s THR 28 N -1.46 5.21 0.20 3.63 2.01 -1.26 -2.70 115.64 121.26 1ob3 s THR 28 Ca 0.61 0.80 0.05 0.00 0.31 0.00 0.00 61.69 63.47 1ob3 s THR 28 Cb -0.31 -3.76 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 1ob3 s THR 28 CO 0.38 0.31 -0.08 -0.36 -0.69 0.00 0.00 174.62 174.18 1ob3 s PHE 29 N 0.86 1.51 -0.08 4.92 0.40 -0.39 -4.44 117.98 120.77 1ob3 s PHE 29 Ca 0.22 -0.76 -0.11 0.00 -0.60 0.00 0.00 56.93 55.68 1ob3 s PHE 29 Cb -0.15 -0.80 -0.05 0.00 0.51 0.00 0.00 43.02 42.54 1ob3 s PHE 29 CO 0.08 0.12 0.26 0.00 0.70 0.00 0.00 175.22 176.39 1ob3 s ALA 30 N -3.25 3.78 -0.11 5.36 0.00 0.35 -1.04 121.76 126.84 1ob3 s ALA 30 Ca 0.22 -0.45 0.04 0.00 0.00 0.00 0.00 51.96 51.77 1ob3 s ALA 30 Cb 0.03 -2.18 0.00 0.00 0.00 0.00 0.00 23.12 20.97 1ob3 s ALA 30 CO 0.05 0.51 -0.23 -0.51 0.00 0.00 0.00 175.76 175.58 1ob3 s LEU 31 N -0.89 2.12 -0.27 0.00 1.43 0.93 -0.71 118.68 121.28 1ob3 s LEU 31 Ca 0.19 -0.56 -0.00 0.00 -1.03 0.00 0.00 54.13 52.73 1ob3 s LEU 31 Cb -0.14 -1.42 0.05 0.00 0.03 0.00 0.00 46.19 44.70 1ob3 s LEU 31 CO 0.08 0.15 -0.05 -0.75 0.23 0.00 0.00 176.35 176.00 1ob3 s LYS 32 N 0.40 2.46 -0.44 1.70 2.20 0.41 -0.54 119.74 125.93 1ob3 s LYS 32 Ca -0.17 -1.22 -0.22 0.00 -0.36 0.00 0.00 55.97 53.99 1ob3 s LYS 32 Cb -0.18 -3.03 0.02 0.00 -1.51 0.00 0.00 37.83 33.14 1ob3 s LYS 32 CO 0.08 -0.55 0.72 0.21 -0.36 0.00 0.00 175.35 175.45 1ob3 s LYS 33 N 1.22 3.39 0.01 4.03 2.20 -0.71 -0.86 119.74 129.02 1ob3 s LYS 33 Ca -0.05 -0.18 -0.30 0.00 -0.36 0.00 0.00 55.97 55.08 1ob3 s LYS 33 Cb -0.19 -3.93 -0.06 0.00 -1.51 0.00 0.00 37.83 32.14 1ob3 s LYS 33 CO -0.03 -1.04 1.48 0.42 -0.36 0.00 0.00 175.35 175.81 1ob3 s ILE 34 N 3.07 3.53 -0.22 5.43 -1.09 0.26 -2.78 121.20 129.39 1ob3 s ILE 34 Ca 0.27 0.91 -0.29 0.00 -2.23 0.00 0.00 60.65 59.31 1ob3 s ILE 34 Cb -0.13 -3.59 -0.01 0.00 -1.58 0.00 0.00 42.46 37.15 1ob3 s ILE 34 CO 0.21 -0.01 1.41 -0.60 -1.23 0.00 0.00 174.94 174.72 1ob3 s ARG 35 N 2.57 3.98 -0.45 2.79 3.52 0.29 -4.53 118.95 127.12 1ob3 s ARG 35 Ca 0.67 1.54 -0.16 0.00 -0.13 0.00 0.00 55.73 57.65 1ob3 s ARG 35 Cb -0.34 -3.91 0.05 0.00 -1.56 0.00 0.00 34.95 29.20 1ob3 s ARG 35 CO 0.28 -1.05 0.39 -0.51 -0.81 0.00 0.00 175.30 173.60 1ob3 s LEU 36 N 4.38 5.35 0.18 -0.88 1.43 -1.26 -4.94 118.68 122.93 1ob3 s LEU 36 Ca 0.62 -1.11 -0.18 0.00 -1.03 0.00 0.00 54.13 52.43 1ob3 s LEU 36 Cb -0.22 -2.22 0.13 0.00 0.03 0.00 0.00 46.19 43.91 1ob3 s LEU 36 CO 0.23 -0.61 1.64 -0.08 0.23 0.00 0.00 176.35 177.76 1ob3 h GLU 37 N 8.74 -0.08 -3.99 1.70 4.57 -1.99 -3.33 114.58 120.19 1ob3 h GLU 37 Ca -0.28 0.01 -0.69 0.00 -1.18 0.00 0.00 59.36 57.22 1ob3 h GLU 37 Cb 1.11 0.02 -0.35 0.00 -0.16 0.00 0.00 28.75 29.37 1ob3 h GLU 37 CO 0.84 -0.05 -0.46 0.15 -1.18 0.00 0.00 179.01 178.30 1ob3 s LYS 38 N -6.16 2.28 0.26 1.92 1.02 -1.26 -4.96 119.74 112.83 1ob3 s LYS 38 Ca -0.14 -2.21 -0.03 0.00 0.02 0.00 0.00 55.97 53.61 1ob3 s LYS 38 Cb 0.16 -3.64 0.41 0.00 -0.52 0.00 0.00 37.83 34.23 1ob3 s LYS 38 CO 0.71 -1.12 1.86 1.49 -0.92 0.00 0.00 175.35 177.37 1ob3 h GLU 39 N 7.47 1.04 0.00 1.68 4.81 -1.97 -2.19 114.58 125.42 1ob3 h GLU 39 Ca -0.07 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1ob3 h GLU 39 Cb 0.99 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.14 1ob3 h GLU 39 CO 0.70 0.69 0.00 -0.44 -0.73 0.00 0.00 179.01 179.23 1ob3 h ASP 40 N 1.07 0.00 -0.46 1.04 3.32 -1.94 -3.28 116.42 116.17 1ob3 h ASP 40 Ca 0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1ob3 h ASP 40 Cb 0.22 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1ob3 h ASP 40 CO -0.19 0.00 0.30 -0.08 -1.72 0.00 0.00 179.24 177.54 1ob3 h GLU 41 N 0.00 0.61 0.00 3.56 4.81 -1.82 -3.49 114.58 118.25 1ob3 h GLU 41 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1ob3 h GLU 41 Cb 0.72 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1ob3 h GLU 41 CO 0.00 0.42 0.00 0.41 -0.73 0.00 0.00 179.01 179.11 1ob3 n GLY 42 N -1.18 0.76 3.29 1.92 0.00 -1.24 -4.93 105.19 103.82 1ob3 n GLY 42 Ca 0.02 -1.89 -0.34 0.00 0.00 0.00 0.00 46.02 43.81 1ob3 n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ob3 s ILE 43 N -2.14 3.01 0.74 -0.61 1.01 -1.26 -5.08 121.20 116.88 1ob3 s ILE 43 Ca 0.00 -0.63 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 1ob3 s ILE 43 Cb 0.00 -2.32 0.04 0.00 0.01 0.00 0.00 42.46 40.19 1ob3 s ILE 43 CO 0.00 0.48 1.08 -2.16 0.00 0.00 0.00 174.94 174.34 1ob3 s PRO 44 N 1.08 2.51 0.27 2.79 0.04 -1.26 -4.90 135.00 135.52 1ob3 s PRO 44 Ca 0.00 1.05 -0.01 0.00 0.04 0.00 0.00 61.00 62.08 1ob3 s PRO 44 Cb -0.15 -1.93 0.36 0.00 0.04 0.00 0.00 34.50 32.82 1ob3 s PRO 44 CO -0.02 -1.43 1.77 0.66 0.04 0.00 0.00 177.00 178.01 1ob3 h SER 45 N -0.97 0.72 -0.92 6.66 4.64 -1.99 -1.78 113.55 119.90 1ob3 h SER 45 Ca -0.44 -0.17 0.14 0.00 -0.47 0.00 0.00 61.79 60.85 1ob3 h SER 45 Cb 1.22 -0.19 -0.09 0.00 -0.31 0.00 0.00 62.40 63.03 1ob3 h SER 45 CO 0.54 0.80 0.54 0.74 -0.87 0.00 0.00 176.83 178.57 1ob3 h THR 46 N 0.70 0.80 -0.14 2.95 2.02 -1.99 -1.23 112.91 116.02 1ob3 h THR 46 Ca 0.14 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 1ob3 h THR 46 Cb 0.45 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1ob3 h THR 46 CO 0.02 0.14 -0.00 0.74 0.37 0.00 0.00 175.52 176.79 1ob3 h THR 47 N 0.78 1.25 -0.86 3.16 2.02 -1.70 -1.75 112.91 115.81 1ob3 h THR 47 Ca 0.49 -0.83 0.06 0.00 0.77 0.00 0.00 66.41 66.90 1ob3 h THR 47 Cb 0.62 1.52 -0.06 0.00 -1.74 0.00 0.00 68.15 68.49 1ob3 h THR 47 CO -0.32 0.24 0.54 0.40 0.37 0.00 0.00 175.52 176.75 1ob3 h ILE 48 N -0.01 1.05 -0.50 3.11 1.08 -1.16 -1.68 117.51 119.41 1ob3 h ILE 48 Ca 0.04 -0.34 -0.04 0.00 -0.39 0.00 0.00 64.86 64.13 1ob3 h ILE 48 Cb 0.37 -0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 34.08 1ob3 h ILE 48 CO 0.01 0.18 0.15 0.03 -0.69 0.00 0.00 178.15 177.83 1ob3 h ARG 49 N 0.99 0.78 0.00 2.37 3.08 -1.04 0.11 114.38 120.67 1ob3 h ARG 49 Ca 0.37 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 60.22 1ob3 h ARG 49 Cb 0.16 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1ob3 h ARG 49 CO -0.17 0.74 -0.15 0.93 -1.07 0.00 0.00 179.97 180.25 1ob3 h GLU 50 N 0.68 0.00 0.22 0.04 4.39 -0.80 -1.70 114.58 117.41 1ob3 h GLU 50 Ca 0.16 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.54 1ob3 h GLU 50 Cb 0.29 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 28.96 1ob3 h GLU 50 CO -0.00 0.15 -1.49 0.82 -1.16 0.00 0.00 179.01 177.32 1ob3 h ILE 51 N 0.00 1.19 -0.39 3.13 2.04 -0.97 -3.38 117.51 119.13 1ob3 h ILE 51 Ca -0.00 -2.61 -0.08 0.00 1.00 0.00 0.00 64.86 63.17 1ob3 h ILE 51 Cb 0.64 2.97 -0.02 0.00 -0.74 0.00 0.00 36.82 39.67 1ob3 h ILE 51 CO 0.02 0.81 -0.08 0.28 0.00 0.00 0.00 178.15 179.17 1ob3 h SER 52 N 0.06 0.66 0.21 1.72 0.02 -0.46 -1.46 113.55 114.30 1ob3 h SER 52 Ca -0.27 -0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 60.49 1ob3 h SER 52 Cb 2.08 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 64.44 1ob3 h SER 52 CO 0.23 0.78 -0.04 -0.29 -1.14 0.00 0.00 176.83 176.37 1ob3 h ILE 53 N 0.62 0.33 0.00 3.27 2.10 -1.49 -1.64 117.51 120.69 1ob3 h ILE 53 Ca 0.11 -0.22 0.00 0.00 1.08 0.00 0.00 64.86 65.84 1ob3 h ILE 53 Cb 0.51 1.16 0.00 0.00 -1.09 0.00 0.00 36.82 37.40 1ob3 h ILE 53 CO 0.03 0.04 0.00 -0.07 -1.08 0.00 0.00 178.15 177.07 1ob3 h LEU 54 N 0.00 0.00 -2.25 2.19 3.38 -1.43 -1.65 115.31 115.55 1ob3 h LEU 54 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1ob3 h LEU 54 Cb 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1ob3 h LEU 54 CO 0.00 0.00 -0.05 0.11 0.09 0.00 0.00 178.44 178.59 1ob3 h LYS 55 N 0.00 0.00 0.00 1.13 1.57 -1.43 -2.01 116.57 115.83 1ob3 h LYS 55 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ob3 h LYS 55 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1ob3 h LYS 55 CO 0.00 0.05 0.00 0.39 -0.57 0.00 0.00 179.45 179.32 1ob3 n GLU 56 N -3.54 0.07 -2.62 3.15 1.02 -0.62 -4.64 120.64 113.46 1ob3 n GLU 56 Ca -0.02 0.28 -0.42 0.00 -0.02 0.00 0.00 57.16 56.98 1ob3 n GLU 56 Cb 0.17 -1.63 -0.03 0.00 -0.02 0.00 0.00 31.44 29.93 1ob3 n GLU 56 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1ob3 s LEU 57 N -3.52 3.52 -0.31 -4.62 1.43 -0.75 -4.95 118.68 109.47 1ob3 s LEU 57 Ca 0.07 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.06 1ob3 s LEU 57 Cb 0.10 -2.96 0.10 0.00 0.03 0.00 0.00 46.19 43.46 1ob3 s LEU 57 CO 0.34 -1.52 0.06 -0.54 0.23 0.00 0.00 176.35 174.92 1ob3 s LYS 58 N 4.94 1.18 -0.23 1.70 1.02 -1.26 -4.71 119.74 122.38 1ob3 s LYS 58 Ca 0.39 -1.44 -0.21 0.00 0.02 0.00 0.00 55.97 54.73 1ob3 s LYS 58 Cb -0.09 -2.63 0.06 0.00 -0.52 0.00 0.00 37.83 34.66 1ob3 s LYS 58 CO 0.22 -0.92 0.62 -1.58 -0.92 0.00 0.00 175.35 172.77 1ob3 s HIS 59 N 1.26 -0.69 0.06 3.18 2.46 -1.26 -5.04 115.29 115.26 1ob3 s HIS 59 Ca 0.08 1.68 0.31 0.00 0.47 0.00 0.00 55.06 57.60 1ob3 s HIS 59 Cb -0.18 0.24 1.56 0.00 -0.13 0.00 0.00 32.58 34.07 1ob3 s HIS 59 CO -0.15 -0.33 1.95 0.66 -2.47 0.00 0.00 174.74 174.39 1ob3 h SER 60 N 5.22 0.00 -0.25 9.88 4.64 -1.97 -2.15 113.55 128.92 1ob3 h SER 60 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1ob3 h SER 60 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1ob3 h SER 60 CO 0.12 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.67 1ob3 n ASN 61 N -2.65 3.64 -4.14 4.97 3.02 -1.26 -4.77 115.26 114.07 1ob3 n ASN 61 Ca -0.01 -2.89 -0.31 0.00 -0.03 0.00 0.00 54.58 51.34 1ob3 n ASN 61 Cb 0.13 -0.49 -0.17 0.00 -0.61 0.00 0.00 39.78 38.64 1ob3 n ASN 61 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ob3 s ILE 62 N -2.58 1.88 -0.16 2.41 -1.09 -0.81 -0.87 121.20 119.97 1ob3 s ILE 62 Ca 0.39 -0.87 -0.36 0.00 -2.23 0.00 0.00 60.65 57.57 1ob3 s ILE 62 Cb 0.31 -1.67 -0.13 0.00 -1.58 0.00 0.00 42.46 39.39 1ob3 s ILE 62 CO 0.09 0.51 1.84 0.52 -1.23 0.00 0.00 174.94 176.68 1ob3 n VAL 63 N 4.06 0.49 -2.42 2.92 0.31 -0.72 -4.59 118.33 118.36 1ob3 n VAL 63 Ca -0.20 -0.09 -0.42 0.00 -0.01 0.00 0.00 64.34 63.62 1ob3 n VAL 63 Cb 0.52 -1.64 -0.03 0.00 -0.91 0.00 0.00 33.84 31.77 1ob3 n VAL 63 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1ob3 s LYS 64 N 3.93 4.42 -0.23 5.55 2.20 -1.26 -4.89 119.74 129.46 1ob3 s LYS 64 Ca 0.95 1.76 -0.18 0.00 -0.36 0.00 0.00 55.97 58.15 1ob3 s LYS 64 Cb -0.83 -3.38 -0.03 0.00 -1.51 0.00 0.00 37.83 32.08 1ob3 s LYS 64 CO 0.57 -0.29 0.49 -1.17 -0.36 0.00 0.00 175.35 174.59 1ob3 s LEU 65 N 1.23 4.11 -0.20 5.43 2.96 -1.26 -1.49 118.68 129.45 1ob3 s LEU 65 Ca 0.58 0.57 -0.04 0.00 -0.22 0.00 0.00 54.13 55.02 1ob3 s LEU 65 Cb -0.29 -2.65 -0.21 0.00 0.50 0.00 0.00 46.19 43.55 1ob3 s LEU 65 CO 0.28 -0.20 0.03 -1.22 -1.32 0.00 0.00 176.35 173.92 1ob3 n TYR 66 N 5.04 0.59 -3.64 5.38 4.02 0.32 -4.63 117.16 124.23 1ob3 n TYR 66 Ca -0.05 0.14 -0.13 0.00 -0.01 0.00 0.00 57.90 57.84 1ob3 n TYR 66 Cb 0.50 -1.07 -0.06 0.00 -0.02 0.00 0.00 39.34 38.69 1ob3 n TYR 66 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1ob3 s ASP 67 N -6.84 -0.33 -0.23 7.72 2.15 -1.11 -5.00 116.67 113.03 1ob3 s ASP 67 Ca -0.30 0.08 0.02 0.00 0.43 0.00 0.00 52.55 52.78 1ob3 s ASP 67 Cb 0.08 0.44 0.06 0.00 -0.30 0.00 0.00 42.92 43.20 1ob3 s ASP 67 CO 0.66 -0.66 -0.09 -0.69 -0.17 0.00 0.00 175.17 174.22 1ob3 s VAL 68 N -2.35 1.80 -0.32 1.11 1.01 -1.26 -1.19 120.40 119.20 1ob3 s VAL 68 Ca -0.06 -1.32 -0.07 0.00 0.00 0.00 0.00 61.98 60.53 1ob3 s VAL 68 Cb -0.01 -1.95 0.02 0.00 0.00 0.00 0.00 36.38 34.43 1ob3 s VAL 68 CO -0.01 0.00 0.11 -0.63 0.00 0.00 0.00 175.10 174.56 1ob3 s ILE 69 N 1.29 4.06 -0.36 2.22 1.01 -0.10 -5.00 121.20 124.31 1ob3 s ILE 69 Ca -0.06 -0.78 -0.01 0.00 0.00 0.00 0.00 60.65 59.80 1ob3 s ILE 69 Cb -0.19 -3.15 0.09 0.00 0.01 0.00 0.00 42.46 39.22 1ob3 s ILE 69 CO -0.06 -0.01 0.10 -2.28 0.00 0.00 0.00 174.94 172.68 1ob3 s HIS 70 N 1.50 3.51 -0.10 3.97 2.46 -1.26 -1.07 115.29 124.29 1ob3 s HIS 70 Ca 0.02 -2.36 -0.04 0.00 0.47 0.00 0.00 55.06 53.15 1ob3 s HIS 70 Cb -0.18 -2.77 0.05 0.00 -0.13 0.00 0.00 32.58 29.55 1ob3 s HIS 70 CO 0.03 -0.91 0.17 0.95 -2.47 0.00 0.00 174.74 172.51 1ob3 s THR 71 N 1.13 -0.28 -0.63 0.89 -4.23 -1.03 -5.02 115.64 106.47 1ob3 s THR 71 Ca 0.04 0.29 -0.06 0.00 -1.18 0.00 0.00 61.69 60.78 1ob3 s THR 71 Cb -0.21 -0.35 0.01 0.00 1.34 0.00 0.00 72.50 73.28 1ob3 s THR 71 CO -0.04 0.10 0.66 0.29 -0.54 0.00 0.00 174.62 175.09 1ob3 n LYS 72 N 5.33 -1.69 -2.90 3.99 4.76 -1.26 -3.03 118.16 123.35 1ob3 n LYS 72 Ca -0.05 1.68 -0.20 0.00 -2.87 0.00 0.00 58.31 56.88 1ob3 n LYS 72 Cb 0.50 -5.57 0.01 0.00 -1.84 0.00 0.00 35.03 28.13 1ob3 n LYS 72 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1ob3 n LYS 73 N -1.28 -3.33 -3.79 1.97 5.02 -1.26 -4.95 118.16 110.53 1ob3 n LYS 73 Ca 0.03 0.70 -0.13 0.00 -2.02 0.00 0.00 58.31 56.89 1ob3 n LYS 73 Cb 0.50 -5.42 -0.13 0.00 -0.02 0.00 0.00 35.03 29.95 1ob3 n LYS 73 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1ob3 s ARG 74 N -5.55 0.12 -0.09 1.97 0.52 -1.17 -5.00 118.95 109.75 1ob3 s ARG 74 Ca 0.22 0.26 -0.01 0.00 -0.52 0.00 0.00 55.73 55.68 1ob3 s ARG 74 Cb -0.11 -0.04 0.03 0.00 0.52 0.00 0.00 34.95 35.35 1ob3 s ARG 74 CO 0.27 -0.08 -0.04 -1.17 0.02 0.00 0.00 175.30 174.30 1ob3 s LEU 75 N 0.54 0.94 -0.05 2.53 2.96 -1.26 -2.46 118.68 121.88 1ob3 s LEU 75 Ca -0.04 -0.20 0.04 0.00 -0.22 0.00 0.00 54.13 53.71 1ob3 s LEU 75 Cb -0.05 -0.66 0.00 0.00 0.50 0.00 0.00 46.19 45.98 1ob3 s LEU 75 CO -0.02 -0.15 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.01 1ob3 s VAL 76 N 1.77 1.39 -0.14 1.68 1.01 -0.23 -0.58 120.40 125.31 1ob3 s VAL 76 Ca 0.04 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.30 1ob3 s VAL 76 Cb -0.13 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1ob3 s VAL 76 CO -0.06 0.40 0.02 -0.76 0.00 0.00 0.00 175.10 174.70 1ob3 s LEU 77 N 0.18 3.64 -0.27 3.92 1.43 -0.04 -0.93 118.68 126.61 1ob3 s LEU 77 Ca -0.07 0.08 -0.09 0.00 -1.03 0.00 0.00 54.13 53.02 1ob3 s LEU 77 Cb -0.13 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 1ob3 s LEU 77 CO 0.03 0.26 0.12 -0.69 0.23 0.00 0.00 176.35 176.30 1ob3 s VAL 78 N -0.17 4.69 0.18 -1.59 1.01 -0.33 -0.45 120.40 123.74 1ob3 s VAL 78 Ca 0.06 -0.08 0.06 0.00 0.00 0.00 0.00 61.98 62.02 1ob3 s VAL 78 Cb -0.12 -3.23 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 1ob3 s VAL 78 CO 0.02 0.28 -0.13 -0.36 0.00 0.00 0.00 175.10 174.91 1ob3 s PHE 79 N 1.67 1.52 0.30 5.22 0.40 0.11 -0.52 117.98 126.67 1ob3 s PHE 79 Ca 0.06 -0.64 -0.29 0.00 -0.60 0.00 0.00 56.93 55.46 1ob3 s PHE 79 Cb -0.16 -0.73 -0.13 0.00 0.51 0.00 0.00 43.02 42.51 1ob3 s PHE 79 CO 0.06 0.24 1.24 -1.91 0.70 0.00 0.00 175.22 175.55 1ob3 n GLU 80 N -0.24 1.87 -3.71 0.44 2.13 -0.56 -0.50 120.64 120.07 1ob3 n GLU 80 Ca -0.09 0.66 -0.35 0.00 0.66 0.00 0.00 57.16 58.03 1ob3 n GLU 80 Cb 0.60 -2.20 -0.08 0.00 0.27 0.00 0.00 31.44 30.03 1ob3 n GLU 80 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1ob3 s HIS 81 N -0.79 3.40 0.06 4.31 5.65 -1.26 -4.46 115.29 122.20 1ob3 s HIS 81 Ca 0.60 0.34 0.07 0.00 0.25 0.00 0.00 55.06 56.33 1ob3 s HIS 81 Cb -0.63 -2.18 -0.03 0.00 -1.18 0.00 0.00 32.58 28.55 1ob3 s HIS 81 CO 0.58 0.26 -0.21 -0.51 -0.65 0.00 0.00 174.74 174.22 1ob3 s LEU 82 N 0.44 2.21 0.15 8.88 1.02 -1.26 -4.98 118.68 125.14 1ob3 s LEU 82 Ca 0.09 -0.57 0.25 0.00 0.02 0.00 0.00 54.13 53.91 1ob3 s LEU 82 Cb -0.11 -0.93 0.49 0.00 0.02 0.00 0.00 46.19 45.66 1ob3 s LEU 82 CO -0.01 0.12 1.47 0.47 0.02 0.00 0.00 176.35 178.42 1ob3 n ASP 83 N 1.61 0.74 -4.17 2.29 10.43 -1.25 -4.91 116.55 121.30 1ob3 n ASP 83 Ca -0.18 0.27 -0.10 0.00 2.57 0.00 0.00 54.79 57.35 1ob3 n ASP 83 Cb 0.53 -0.15 -0.10 0.00 1.84 0.00 0.00 41.12 43.24 1ob3 n ASP 83 CO 0.00 0.00 0.00 -1.58 -1.07 0.00 0.00 177.20 174.55 1ob3 s GLN 84 N -3.15 0.85 0.15 -1.24 2.00 -1.05 -5.03 119.66 112.20 1ob3 s GLN 84 Ca 0.08 -1.36 -0.02 0.00 -2.00 0.00 0.00 55.36 52.05 1ob3 s GLN 84 Cb 0.13 -0.10 -0.04 0.00 0.80 0.00 0.00 33.01 33.80 1ob3 s GLN 84 CO 0.68 -0.08 0.11 0.16 -0.50 0.00 0.00 175.29 175.67 1ob3 s ASP 85 N -3.04 0.23 0.28 6.67 3.84 -1.26 -0.83 116.67 122.56 1ob3 s ASP 85 Ca 0.14 -1.20 0.03 0.00 -0.00 0.00 0.00 52.55 51.52 1ob3 s ASP 85 Cb 0.06 0.34 0.43 0.00 -1.38 0.00 0.00 42.92 42.37 1ob3 s ASP 85 CO -0.04 -0.78 1.73 0.25 -0.00 0.00 0.00 175.17 176.33 1ob3 h LEU 86 N 2.76 0.48 -0.26 2.11 5.85 -0.95 -0.95 115.31 124.35 1ob3 h LEU 86 Ca -0.35 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.25 1ob3 h LEU 86 Cb 1.21 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 1ob3 h LEU 86 CO 0.56 0.72 0.07 0.50 -0.34 0.00 0.00 178.44 179.94 1ob3 h LYS 87 N 0.42 0.17 -0.28 1.25 3.64 -1.83 0.70 116.57 120.65 1ob3 h LYS 87 Ca 0.06 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.28 1ob3 h LYS 87 Cb 0.65 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 1ob3 h LYS 87 CO 0.05 0.11 -0.44 0.87 -2.27 0.00 0.00 179.45 177.77 1ob3 h LYS 88 N 0.18 0.72 -0.03 1.90 1.57 -1.83 -0.97 116.57 118.11 1ob3 h LYS 88 Ca 0.12 -0.40 -0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1ob3 h LYS 88 Cb 0.11 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 1ob3 h LYS 88 CO -0.14 1.02 0.01 1.25 -0.57 0.00 0.00 179.45 181.02 1ob3 h LEU 89 N 0.58 0.04 -1.76 2.94 5.85 -0.97 -2.95 115.31 119.04 1ob3 h LEU 89 Ca 0.04 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 1ob3 h LEU 89 Cb 1.00 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.01 1ob3 h LEU 89 CO 0.09 0.14 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.20 1ob3 h LEU 90 N -0.07 0.06 -2.52 2.25 3.38 -0.73 -2.08 115.31 115.60 1ob3 h LEU 90 Ca 0.01 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ob3 h LEU 90 Cb 0.12 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1ob3 h LEU 90 CO -0.00 0.14 -0.02 0.44 0.09 0.00 0.00 178.44 179.09 1ob3 h ASP 91 N 0.07 0.00 -0.20 -0.43 3.45 -1.00 -2.46 116.42 115.85 1ob3 h ASP 91 Ca 0.02 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.48 1ob3 h ASP 91 Cb 0.17 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.94 1ob3 h ASP 91 CO 0.01 0.02 0.00 1.33 -1.57 0.00 0.00 179.24 179.03 1ob3 n VAL 92 N -3.43 1.53 -3.78 -1.35 0.24 -0.81 -4.89 118.33 105.84 1ob3 n VAL 92 Ca -0.03 -1.47 -0.35 0.00 -2.04 0.00 0.00 64.34 60.46 1ob3 n VAL 92 Cb 0.12 0.16 -0.11 0.00 -1.47 0.00 0.00 33.84 32.54 1ob3 n VAL 92 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ob3 n GLU 94 N 3.32 2.72 -0.77 0.00 2.13 -1.26 -0.88 120.64 125.90 1ob3 n GLU 94 Ca 0.08 0.98 0.00 0.00 0.66 0.00 0.00 57.16 58.88 1ob3 n GLU 94 Cb 0.36 -2.84 0.00 0.00 0.27 0.00 0.00 31.44 29.23 1ob3 n GLU 94 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ob3 n GLY 95 N 4.03 0.94 3.75 8.31 0.00 -1.26 -4.85 105.19 116.11 1ob3 n GLY 95 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1ob3 n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ob3 n GLY 96 N -2.00 -1.78 3.90 -0.02 0.00 -0.06 -3.63 105.19 101.61 1ob3 n GLY 96 Ca 0.00 -1.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.05 1ob3 n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ob3 s LEU 97 N 0.00 4.23 0.50 0.99 1.43 0.50 -4.86 118.68 121.46 1ob3 s LEU 97 Ca 0.00 0.57 -0.23 0.00 -1.03 0.00 0.00 54.13 53.44 1ob3 s LEU 97 Cb 0.00 -3.32 -0.07 0.00 0.03 0.00 0.00 46.19 42.83 1ob3 s LEU 97 CO 0.00 -0.01 1.31 -0.62 0.23 0.00 0.00 176.35 177.26 1ob3 n GLU 98 N -0.24 1.78 -0.22 1.70 -0.58 -1.26 -4.73 120.64 117.10 1ob3 n GLU 98 Ca -0.03 0.65 0.06 0.00 -0.42 0.00 0.00 57.16 57.42 1ob3 n GLU 98 Cb 0.52 -2.48 0.32 0.00 -0.57 0.00 0.00 31.44 29.23 1ob3 n GLU 98 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1ob3 h SER 99 N 1.69 0.74 -0.03 1.62 4.64 -1.97 -1.08 113.55 119.16 1ob3 h SER 99 Ca -0.50 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.68 1ob3 h SER 99 Cb 1.30 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 1ob3 h SER 99 CO 0.58 0.48 -0.46 1.62 -0.87 0.00 0.00 176.83 178.17 1ob3 h VAL 100 N 0.84 1.31 -0.36 0.95 3.04 -1.98 -1.64 116.25 118.41 1ob3 h VAL 100 Ca 0.33 -1.66 -0.09 0.00 -1.01 0.00 0.00 66.70 64.27 1ob3 h VAL 100 Cb 0.23 1.63 -0.01 0.00 -2.01 0.00 0.00 31.29 31.14 1ob3 h VAL 100 CO -0.11 0.52 -0.13 0.74 -1.01 0.00 0.00 177.57 177.58 1ob3 h THR 101 N 0.46 1.28 -0.62 3.17 2.02 -1.61 -1.97 112.91 115.65 1ob3 h THR 101 Ca 0.03 -1.22 -0.05 0.00 0.77 0.00 0.00 66.41 65.94 1ob3 h THR 101 Cb 0.98 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 68.69 1ob3 h THR 101 CO 0.09 0.40 0.20 0.00 0.37 0.00 0.00 175.52 176.58 1ob3 h ALA 102 N 0.81 1.18 -0.56 6.16 0.00 -1.13 -0.76 119.26 124.96 1ob3 h ALA 102 Ca 0.09 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1ob3 h ALA 102 Cb 0.65 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1ob3 h ALA 102 CO 0.04 0.57 0.03 -0.22 0.00 0.00 0.00 179.25 179.68 1ob3 h LYS 103 N 0.91 0.97 -0.18 0.00 3.64 -1.26 0.45 116.57 121.09 1ob3 h LYS 103 Ca 0.20 -0.29 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1ob3 h LYS 103 Cb 0.25 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1ob3 h LYS 103 CO -0.01 0.96 0.07 1.03 -2.27 0.00 0.00 179.45 179.23 1ob3 h SER 104 N 0.85 0.25 -0.82 4.20 0.87 -0.97 -0.39 113.55 117.55 1ob3 h SER 104 Ca 0.16 -0.17 -0.04 0.00 -1.23 0.00 0.00 61.79 60.51 1ob3 h SER 104 Cb 0.50 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.35 1ob3 h SER 104 CO 0.02 0.36 0.35 -0.26 -0.53 0.00 0.00 176.83 176.78 1ob3 h PHE 105 N 0.14 1.23 -0.47 2.24 0.05 -0.99 -2.38 116.94 116.76 1ob3 h PHE 105 Ca 0.06 -0.08 -0.02 0.00 3.82 0.00 0.00 57.97 61.75 1ob3 h PHE 105 Cb 0.19 -0.37 -0.02 0.00 2.00 0.00 0.00 35.95 37.74 1ob3 h PHE 105 CO -0.01 0.91 0.20 1.25 -0.18 0.00 0.00 178.31 180.48 1ob3 h LEU 106 N 1.19 0.64 -0.68 1.54 5.85 -0.69 -0.34 115.31 122.82 1ob3 h LEU 106 Ca 0.28 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.88 1ob3 h LEU 106 Cb 0.18 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 1ob3 h LEU 106 CO -0.03 0.62 0.40 0.25 -0.34 0.00 0.00 178.44 179.35 1ob3 h LEU 107 N 0.61 0.63 -0.34 2.25 5.85 -0.91 -0.60 115.31 122.81 1ob3 h LEU 107 Ca 0.16 0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.76 1ob3 h LEU 107 Cb 0.17 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1ob3 h LEU 107 CO -0.01 0.43 -0.32 1.56 -0.34 0.00 0.00 178.44 179.75 1ob3 h GLN 108 N 0.77 0.82 -0.31 1.25 4.20 -1.09 -1.20 115.11 119.54 1ob3 h GLN 108 Ca 0.29 -0.42 0.04 0.00 0.06 0.00 0.00 58.65 58.61 1ob3 h GLN 108 Cb 0.10 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.85 1ob3 h GLN 108 CO -0.14 1.06 0.08 1.25 -0.67 0.00 0.00 178.83 180.41 1ob3 h LEU 109 N 0.61 0.06 -0.88 1.46 5.85 -0.85 -1.52 115.31 120.03 1ob3 h LEU 109 Ca 0.06 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.74 1ob3 h LEU 109 Cb 0.90 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1ob3 h LEU 109 CO 0.08 0.07 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.16 1ob3 h LEU 110 N 0.20 0.78 -0.35 2.25 3.38 -0.98 -1.23 115.31 119.37 1ob3 h LEU 110 Ca 0.14 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1ob3 h LEU 110 Cb 0.14 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1ob3 h LEU 110 CO -0.17 0.86 0.16 0.78 0.09 0.00 0.00 178.44 180.16 1ob3 h ASN 111 N 0.75 0.47 -0.58 -0.43 2.35 -0.92 0.11 115.58 117.33 1ob3 h ASN 111 Ca 0.14 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1ob3 h ASN 111 Cb 0.48 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 1ob3 h ASN 111 CO 0.02 0.48 0.37 1.23 -1.65 0.00 0.00 177.43 177.88 1ob3 h GLY 112 N 0.42 0.82 0.95 2.83 0.00 -1.08 -2.36 103.07 104.65 1ob3 h GLY 112 Ca 0.12 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 1ob3 h GLY 112 CO -0.01 0.31 0.14 -2.22 0.00 0.00 0.00 176.54 174.76 1ob3 h ILE 113 N 0.78 1.21 -0.81 2.60 2.04 -1.02 -2.21 117.51 120.11 1ob3 h ILE 113 Ca 0.21 -0.69 0.04 0.00 1.00 0.00 0.00 64.86 65.41 1ob3 h ILE 113 Cb -0.06 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 36.83 1ob3 h ILE 113 CO -0.04 0.25 0.51 0.00 0.00 0.00 0.00 178.15 178.87 1ob3 h ALA 114 N 0.99 1.07 -0.15 1.87 0.00 -0.60 0.13 119.26 122.57 1ob3 h ALA 114 Ca 0.14 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1ob3 h ALA 114 Cb 0.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1ob3 h ALA 114 CO -0.01 0.32 0.02 -0.92 0.00 0.00 0.00 179.25 178.66 1ob3 h TYR 115 N 0.99 0.03 -0.31 0.00 3.20 -1.26 -1.42 116.97 118.20 1ob3 h TYR 115 Ca 0.33 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 62.12 1ob3 h TYR 115 Cb 0.04 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 1ob3 h TYR 115 CO -0.03 0.01 -0.15 0.00 -1.64 0.00 0.00 178.16 176.34 1ob3 h HIS 117 N 0.41 1.12 0.00 0.00 3.86 -0.66 0.21 115.15 120.10 1ob3 h HIS 117 Ca 0.07 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 1ob3 h HIS 117 Cb 0.68 -0.37 -0.00 0.00 1.06 0.00 0.00 27.41 28.78 1ob3 h HIS 117 CO 0.06 0.60 -0.05 -0.44 0.86 0.00 0.00 177.93 178.96 1ob3 h ASP 118 N 1.11 0.00 -0.71 2.45 3.32 -1.14 -0.96 116.42 120.49 1ob3 h ASP 118 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 1ob3 h ASP 118 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 1ob3 h ASP 118 CO -0.15 0.05 0.00 0.54 -1.72 0.00 0.00 179.24 177.96 1ob3 n ARG 119 N -3.67 3.05 -2.77 3.56 1.74 -0.24 -4.94 116.66 113.39 1ob3 n ARG 119 Ca -0.02 -2.72 -0.22 0.00 -0.77 0.00 0.00 57.85 54.11 1ob3 n ARG 119 Cb 0.14 -1.68 0.02 0.00 -1.02 0.00 0.00 32.46 29.92 1ob3 n ARG 119 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1ob3 n ARG 120 N 1.49 -3.62 -3.86 5.56 1.74 -0.36 -4.98 116.66 112.62 1ob3 n ARG 120 Ca 0.25 0.96 -0.35 0.00 -0.77 0.00 0.00 57.85 57.93 1ob3 n ARG 120 Cb 0.71 -5.74 -0.10 0.00 -1.02 0.00 0.00 32.46 26.31 1ob3 n ARG 120 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ob3 s VAL 121 N -3.13 4.88 0.22 1.55 1.01 -0.10 -4.99 120.40 119.84 1ob3 s VAL 121 Ca 0.18 0.01 0.07 0.00 0.00 0.00 0.00 61.98 62.24 1ob3 s VAL 121 Cb -0.08 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 1ob3 s VAL 121 CO 0.23 0.40 0.12 -0.76 0.00 0.00 0.00 175.10 175.09 1ob3 s LEU 122 N 0.81 3.64 -0.10 3.92 1.43 -1.26 -3.61 118.68 123.51 1ob3 s LEU 122 Ca 0.05 -0.30 -0.09 0.00 -1.03 0.00 0.00 54.13 52.75 1ob3 s LEU 122 Cb -0.13 -2.21 -0.03 0.00 0.03 0.00 0.00 46.19 43.85 1ob3 s LEU 122 CO 0.02 0.01 -0.18 1.57 0.23 0.00 0.00 176.35 178.00 1ob3 n HIS 123 N -0.77 0.16 -0.24 0.29 -0.00 -1.26 -1.61 115.22 111.79 1ob3 n HIS 123 Ca -0.08 0.07 0.00 0.00 -0.00 0.00 0.00 57.72 57.71 1ob3 n HIS 123 Cb 0.57 -0.38 0.00 0.00 -0.00 0.00 0.00 29.99 30.18 1ob3 n HIS 123 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1ob3 n ARG 124 N -3.69 0.00 -2.80 1.57 1.74 -1.26 -4.34 116.66 107.88 1ob3 n ARG 124 Ca -0.07 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 56.99 1ob3 n ARG 124 Cb 0.27 -2.12 0.05 0.00 -1.02 0.00 0.00 32.46 29.64 1ob3 n ARG 124 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ob3 n ASP 125 N 0.00 1.48 -4.76 0.55 2.03 -1.26 -4.99 116.55 109.60 1ob3 n ASP 125 Ca 0.00 -2.16 -0.41 0.00 0.52 0.00 0.00 54.79 52.74 1ob3 n ASP 125 Cb 0.00 -0.46 -0.01 0.00 -0.72 0.00 0.00 41.12 39.92 1ob3 n ASP 125 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ob3 s LEU 126 N -3.68 4.35 0.09 -2.67 1.43 -1.26 -4.96 118.68 111.98 1ob3 s LEU 126 Ca 0.27 2.92 -0.26 0.00 -1.03 0.00 0.00 54.13 56.03 1ob3 s LEU 126 Cb 0.35 -3.65 0.08 0.00 0.03 0.00 0.00 46.19 43.01 1ob3 s LEU 126 CO -0.03 -0.84 0.74 -1.59 0.23 0.00 0.00 176.35 174.87 1ob3 s LYS 127 N -1.13 1.09 0.35 1.70 -2.85 -1.26 -4.79 119.74 112.84 1ob3 s LYS 127 Ca 0.58 -0.42 0.11 0.00 -1.00 0.00 0.00 55.97 55.25 1ob3 s LYS 127 Cb -0.46 0.49 0.90 0.00 -2.06 0.00 0.00 37.83 36.70 1ob3 s LYS 127 CO 0.53 -0.48 1.80 -1.35 0.10 0.00 0.00 175.35 175.95 1ob3 h PRO 128 N 2.00 0.59 0.00 1.78 0.11 -1.94 -0.62 132.00 133.92 1ob3 h PRO 128 Ca -0.28 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 1ob3 h PRO 128 Cb 1.28 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1ob3 h PRO 128 CO 0.34 0.39 -0.03 0.37 -0.21 0.00 0.00 178.00 178.86 1ob3 h GLN 129 N 0.60 0.00 -0.65 1.05 4.15 -1.94 -1.77 115.11 116.56 1ob3 h GLN 129 Ca 0.54 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.96 1ob3 h GLN 129 Cb 1.06 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.75 1ob3 h GLN 129 CO -0.30 0.03 0.00 0.27 -1.93 0.00 0.00 178.83 176.90 1ob3 n ASN 130 N -3.77 4.26 -4.26 -0.69 0.23 -0.24 -4.68 115.26 106.10 1ob3 n ASN 130 Ca -0.03 -2.24 -0.43 0.00 -0.53 0.00 0.00 54.58 51.35 1ob3 n ASN 130 Cb 0.12 -0.51 -0.07 0.00 -2.08 0.00 0.00 39.78 37.24 1ob3 n ASN 130 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1ob3 s LEU 131 N -1.46 5.89 0.30 -4.53 1.43 -0.67 -0.38 118.68 119.26 1ob3 s LEU 131 Ca 0.48 -1.83 -0.15 0.00 -1.03 0.00 0.00 54.13 51.60 1ob3 s LEU 131 Cb 0.28 -2.10 -0.09 0.00 0.03 0.00 0.00 46.19 44.31 1ob3 s LEU 131 CO 0.27 -0.76 0.71 -0.76 0.23 0.00 0.00 176.35 176.05 1ob3 s LEU 132 N 1.47 4.11 -0.01 1.79 1.43 0.43 -0.98 118.68 126.93 1ob3 s LEU 132 Ca 0.04 1.26 0.01 0.00 -1.03 0.00 0.00 54.13 54.41 1ob3 s LEU 132 Cb -0.28 -3.98 0.00 0.00 0.03 0.00 0.00 46.19 41.97 1ob3 s LEU 132 CO 0.01 -0.16 -0.04 -0.63 0.23 0.00 0.00 176.35 175.76 1ob3 s ILE 133 N -1.91 0.36 0.41 -0.59 1.01 -0.01 0.16 121.20 120.62 1ob3 s ILE 133 Ca 0.52 -0.17 0.05 0.00 0.00 0.00 0.00 60.65 61.05 1ob3 s ILE 133 Cb -0.11 -0.33 0.05 0.00 0.01 0.00 0.00 42.46 42.08 1ob3 s ILE 133 CO 0.18 0.12 0.42 -0.46 0.00 0.00 0.00 174.94 175.19 1ob3 n ASN 134 N 3.15 1.96 0.23 3.58 0.23 -0.54 -2.52 115.26 121.34 1ob3 n ASN 134 Ca -0.15 -2.26 0.15 0.00 -0.53 0.00 0.00 54.58 51.79 1ob3 n ASN 134 Cb 0.57 -0.15 0.50 0.00 -2.08 0.00 0.00 39.78 38.63 1ob3 n ASN 134 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 1ob3 h ARG 135 N 0.00 0.00 -0.14 -3.83 3.08 -2.01 -2.41 114.38 109.07 1ob3 h ARG 135 Ca -0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.82 1ob3 h ARG 135 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.96 1ob3 h ARG 135 CO 0.35 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.64 1ob3 n GLU 136 N -2.90 1.61 -0.86 0.04 4.71 -1.26 -4.93 120.64 117.05 1ob3 n GLU 136 Ca 0.02 -0.92 0.00 0.00 -0.01 0.00 0.00 57.16 56.25 1ob3 n GLU 136 Cb 0.36 -1.38 0.00 0.00 -1.01 0.00 0.00 31.44 29.42 1ob3 n GLU 136 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ob3 n GLY 137 N 1.07 0.54 3.74 0.62 0.00 -0.91 -5.03 105.19 105.23 1ob3 n GLY 137 Ca 0.16 -0.25 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 1ob3 n GLY 137 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ob3 s GLU 138 N -0.55 4.43 -0.13 1.61 2.02 -1.26 -4.89 118.70 119.93 1ob3 s GLU 138 Ca 0.00 0.92 -0.05 0.00 0.02 0.00 0.00 54.97 55.86 1ob3 s GLU 138 Cb 0.00 -3.39 -0.04 0.00 0.10 0.00 0.00 34.13 30.80 1ob3 s GLU 138 CO 0.00 0.22 0.03 -1.17 0.02 0.00 0.00 175.26 174.36 1ob3 s LEU 139 N 0.24 3.71 -0.03 1.80 0.20 -1.26 -1.47 118.68 121.87 1ob3 s LEU 139 Ca 0.36 0.12 0.01 0.00 0.69 0.00 0.00 54.13 55.32 1ob3 s LEU 139 Cb -0.19 -1.89 0.02 0.00 -0.43 0.00 0.00 46.19 43.70 1ob3 s LEU 139 CO 0.20 0.28 -0.03 -0.54 -0.29 0.00 0.00 176.35 175.97 1ob3 s LYS 140 N -0.31 0.55 -0.08 1.98 1.02 0.12 -4.48 119.74 118.55 1ob3 s LYS 140 Ca 0.08 -0.07 -0.22 0.00 0.02 0.00 0.00 55.97 55.78 1ob3 s LYS 140 Cb -0.12 -0.61 -0.04 0.00 -0.52 0.00 0.00 37.83 36.54 1ob3 s LYS 140 CO 0.02 -0.05 0.64 0.42 -0.92 0.00 0.00 175.35 175.46 1ob3 s ILE 141 N 0.67 5.08 0.06 2.17 1.01 -0.05 -0.43 121.20 129.72 1ob3 s ILE 141 Ca -0.08 1.30 0.01 0.00 0.00 0.00 0.00 60.65 61.89 1ob3 s ILE 141 Cb -0.11 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 1ob3 s ILE 141 CO -0.00 0.28 0.14 0.00 0.00 0.00 0.00 174.94 175.36 1ob3 s ALA 142 N 0.71 3.78 0.00 9.38 0.00 0.49 -1.76 121.76 134.35 1ob3 s ALA 142 Ca 0.34 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1ob3 s ALA 142 Cb -0.17 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.32 1ob3 s ALA 142 CO 0.16 0.78 0.00 -0.25 0.00 0.00 0.00 175.76 176.45 1ob3 n ASP 143 N 0.43 -1.98 -4.73 0.00 8.00 -1.26 -4.88 116.55 112.13 1ob3 n ASP 143 Ca -0.07 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.01 1ob3 n ASP 143 Cb 0.51 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.12 41.26 1ob3 n ASP 143 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1ob3 n PHE 144 N -2.66 2.75 0.00 1.24 7.35 -1.26 -2.09 117.46 122.79 1ob3 n PHE 144 Ca 0.00 0.23 0.00 0.00 -0.76 0.00 0.00 57.45 56.92 1ob3 n PHE 144 Cb 0.00 -2.60 0.00 0.00 0.35 0.00 0.00 39.48 37.23 1ob3 n PHE 144 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1ob3 n GLY 145 N 2.55 2.60 0.15 7.13 0.00 -0.64 -4.90 105.19 112.08 1ob3 n GLY 145 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1ob3 n GLY 145 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ob3 h LEU 146 N 0.00 0.00 -1.39 0.99 3.38 -1.67 -2.98 115.31 113.64 1ob3 h LEU 146 Ca 0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1ob3 h LEU 146 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1ob3 h LEU 146 CO 0.00 0.55 0.43 0.00 0.09 0.00 0.00 178.44 179.50 1ob3 h ALA 147 N 1.45 1.60 -0.24 1.53 0.00 -1.77 0.71 119.26 122.55 1ob3 h ALA 147 Ca -0.01 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1ob3 h ALA 147 Cb 0.98 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1ob3 h ALA 147 CO 0.07 0.35 -0.18 -0.09 0.00 0.00 0.00 179.25 179.40 1ob3 h ARG 148 N 0.82 0.41 -0.00 0.00 2.43 -1.84 0.28 114.38 116.48 1ob3 h ARG 148 Ca 0.25 -0.13 -0.15 0.00 -0.81 0.00 0.00 59.98 59.14 1ob3 h ARG 148 Cb -0.01 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1ob3 h ARG 148 CO -0.06 0.58 -0.57 0.00 -1.51 0.00 0.00 179.97 178.41 1ob3 h ALA 149 N 1.44 0.07 -0.00 2.80 0.00 -1.35 -3.41 119.26 118.81 1ob3 h ALA 149 Ca 0.07 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1ob3 h ALA 149 Cb 0.54 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ob3 h ALA 149 CO 0.03 0.33 -0.00 1.19 0.00 0.00 0.00 179.25 180.80 1ob3 n PHE 150 N -4.24 0.00 0.00 0.00 0.99 0.14 -4.98 117.46 109.37 1ob3 n PHE 150 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.35 1ob3 n PHE 150 Cb 0.66 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.14 1ob3 n PHE 150 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ob3 n GLY 151 N 0.04 2.08 2.03 1.37 0.00 0.99 -4.99 105.19 106.73 1ob3 n GLY 151 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1ob3 n GLY 151 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ob3 n ILE 161 N 0.00 0.00 -3.75 -0.61 5.41 -1.26 -4.55 119.36 114.60 1ob3 n ILE 161 Ca 0.00 0.00 -0.37 0.00 1.00 0.00 0.00 62.75 63.38 1ob3 n ILE 161 Cb 0.00 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 38.87 1ob3 n ILE 161 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1ob3 s VAL 162 N 0.00 5.36 -0.27 1.39 1.01 -1.26 -5.07 120.40 121.57 1ob3 s VAL 162 Ca 0.00 0.40 -0.24 0.00 0.00 0.00 0.00 61.98 62.14 1ob3 s VAL 162 Cb 0.00 -3.50 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 1ob3 s VAL 162 CO 0.00 0.59 0.79 -0.89 0.00 0.00 0.00 175.10 175.59 1ob3 s THR 163 N -0.91 4.84 -2.37 3.92 2.01 -1.26 -4.89 115.64 116.97 1ob3 s THR 163 Ca 0.17 1.39 0.21 0.00 0.31 0.00 0.00 61.69 63.77 1ob3 s THR 163 Cb -0.13 -4.10 0.11 0.00 0.01 0.00 0.00 72.50 68.38 1ob3 s THR 163 CO 0.06 -0.12 1.11 0.18 -0.69 0.00 0.00 174.62 175.17 1ob3 n LEU 164 N 6.04 2.47 0.25 4.42 4.77 -1.26 -4.67 117.00 129.02 1ob3 n LEU 164 Ca 0.04 -0.92 0.17 0.00 -0.03 0.00 0.00 56.01 55.27 1ob3 n LEU 164 Cb 0.48 0.00 0.89 0.00 -2.33 0.00 0.00 43.42 42.46 1ob3 n LEU 164 CO 0.48 0.43 1.15 -0.50 -1.33 0.00 0.00 177.39 177.61 1ob3 h TRP 165 N 3.50 0.00 -0.22 -1.77 6.55 -1.87 -2.10 115.95 120.04 1ob3 h TRP 165 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1ob3 h TRP 165 Cb 0.82 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.12 1ob3 h TRP 165 CO 0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.05 1ob3 n TYR 166 N -3.70 0.29 -3.16 0.49 4.02 -1.26 -4.58 117.16 109.27 1ob3 n TYR 166 Ca -0.00 -0.46 -0.39 0.00 -0.01 0.00 0.00 57.90 57.04 1ob3 n TYR 166 Cb 0.24 -0.03 -0.05 0.00 -0.02 0.00 0.00 39.34 39.48 1ob3 n TYR 166 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1ob3 s ARG 167 N -0.97 4.37 0.45 -0.72 0.52 -0.79 -3.84 118.95 117.98 1ob3 s ARG 167 Ca 0.15 0.75 -0.24 0.00 -0.52 0.00 0.00 55.73 55.87 1ob3 s ARG 167 Cb 0.08 -3.40 -0.07 0.00 0.52 0.00 0.00 34.95 32.08 1ob3 s ARG 167 CO 0.11 0.21 1.30 0.00 0.02 0.00 0.00 175.30 176.94 1ob3 s ALA 168 N 0.33 3.10 0.26 2.13 0.00 -1.26 -4.83 121.76 121.49 1ob3 s ALA 168 Ca 0.33 1.22 -0.01 0.00 0.00 0.00 0.00 51.96 53.50 1ob3 s ALA 168 Cb -0.18 -3.50 0.53 0.00 0.00 0.00 0.00 23.12 19.98 1ob3 s ALA 168 CO 0.16 -0.96 1.77 -1.35 0.00 0.00 0.00 175.76 175.38 1ob3 h PRO 169 N 2.23 0.63 -0.25 0.00 0.11 -1.96 -0.35 132.00 132.41 1ob3 h PRO 169 Ca -0.50 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.50 1ob3 h PRO 169 Cb 1.26 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1ob3 h PRO 169 CO 0.61 0.42 -0.15 0.38 -0.21 0.00 0.00 178.00 179.05 1ob3 h ASP 170 N 0.65 0.40 -0.31 -2.05 2.03 -1.92 0.13 116.42 115.35 1ob3 h ASP 170 Ca 0.46 -0.10 -0.05 0.00 -0.73 0.00 0.00 57.03 56.61 1ob3 h ASP 170 Cb 0.64 -0.11 -0.01 0.00 -0.83 0.00 0.00 39.33 39.02 1ob3 h ASP 170 CO -0.35 0.58 -0.02 0.58 -1.03 0.00 0.00 179.24 179.00 1ob3 h VAL 171 N 0.39 1.26 -0.02 4.15 2.07 -1.39 -0.18 116.25 122.54 1ob3 h VAL 171 Ca 0.07 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 1ob3 h VAL 171 Cb 0.49 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 1ob3 h VAL 171 CO 0.03 0.32 -0.08 -0.07 0.02 0.00 0.00 177.57 177.79 1ob3 h LEU 172 N 0.35 0.02 -2.22 2.57 3.38 -0.58 -2.36 115.31 116.47 1ob3 h LEU 172 Ca 0.09 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1ob3 h LEU 172 Cb 0.47 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1ob3 h LEU 172 CO 0.02 0.11 0.00 0.23 0.09 0.00 0.00 178.44 178.88 1ob3 n MET 173 N -4.43 2.71 0.00 1.13 2.81 -0.02 -4.93 117.12 114.38 1ob3 n MET 173 Ca -0.02 -2.02 0.00 0.00 -1.81 0.00 0.00 57.70 53.84 1ob3 n MET 173 Cb 0.16 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.07 1ob3 n MET 173 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ob3 n GLY 174 N 1.08 0.91 3.72 3.03 0.00 -0.89 -0.35 105.19 112.69 1ob3 n GLY 174 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1ob3 n GLY 174 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ob3 s SER 175 N -2.14 6.45 0.00 1.61 0.15 -0.11 -4.79 113.70 114.87 1ob3 s SER 175 Ca 0.00 2.78 0.13 0.00 0.70 0.00 0.00 55.95 59.56 1ob3 s SER 175 Cb 0.00 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.72 1ob3 s SER 175 CO 0.00 -0.92 0.76 2.29 1.20 0.00 0.00 173.24 176.57 1ob3 n LYS 176 N 3.91 1.76 -1.69 5.44 2.85 -1.26 -4.65 118.16 124.51 1ob3 n LYS 176 Ca 0.15 -0.78 -0.37 0.00 -1.05 0.00 0.00 58.31 56.26 1ob3 n LYS 176 Cb 0.36 -1.18 0.07 0.00 -0.65 0.00 0.00 35.03 33.63 1ob3 n LYS 176 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 1ob3 s LYS 177 N -1.55 2.48 0.11 -1.58 -2.85 -1.26 -4.93 119.74 110.16 1ob3 s LYS 177 Ca 0.11 2.04 -0.32 0.00 -1.00 0.00 0.00 55.97 56.81 1ob3 s LYS 177 Cb 0.10 -1.84 -0.11 0.00 -2.06 0.00 0.00 37.83 33.93 1ob3 s LYS 177 CO 0.30 -1.65 1.83 0.98 0.10 0.00 0.00 175.35 176.91 1ob3 n TYR 178 N -2.02 2.57 -3.65 1.78 9.36 -1.26 -5.00 117.16 118.94 1ob3 n TYR 178 Ca 0.16 -0.11 -0.10 0.00 3.32 0.00 0.00 57.90 61.17 1ob3 n TYR 178 Cb 0.48 -2.71 -0.08 0.00 -0.63 0.00 0.00 39.34 36.40 1ob3 n TYR 178 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1ob3 s SER 179 N 2.76 -0.79 0.59 2.98 0.15 -1.26 -5.00 113.70 113.12 1ob3 s SER 179 Ca 0.83 1.36 0.37 0.00 0.70 0.00 0.00 55.95 59.21 1ob3 s SER 179 Cb -0.51 1.28 1.74 0.00 -1.71 0.00 0.00 66.02 66.82 1ob3 s SER 179 CO 0.39 -0.23 2.12 0.71 1.20 0.00 0.00 173.24 177.43 1ob3 h THR 180 N 4.76 0.05 0.00 6.45 1.35 -1.98 -3.14 112.91 120.39 1ob3 h THR 180 Ca -0.30 -0.35 -0.03 0.00 -0.55 0.00 0.00 66.41 65.18 1ob3 h THR 180 Cb 1.20 1.33 -0.00 0.00 -1.73 0.00 0.00 68.15 68.94 1ob3 h THR 180 CO 0.15 0.01 -0.15 0.71 -0.25 0.00 0.00 175.52 176.00 1ob3 h THR 181 N 0.00 0.99 -1.00 6.82 1.35 -1.94 -2.62 112.91 116.50 1ob3 h THR 181 Ca -0.00 -0.54 0.03 0.00 -0.55 0.00 0.00 66.41 65.36 1ob3 h THR 181 Cb 0.33 1.30 -0.06 0.00 -1.73 0.00 0.00 68.15 67.99 1ob3 h THR 181 CO 0.00 0.15 0.66 0.40 -0.25 0.00 0.00 175.52 176.48 1ob3 h ILE 182 N 0.00 1.19 -0.13 6.82 2.04 -1.96 -2.10 117.51 123.37 1ob3 h ILE 182 Ca -0.00 -0.44 -0.13 0.00 1.00 0.00 0.00 64.86 65.29 1ob3 h ILE 182 Cb 0.29 -0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.14 1ob3 h ILE 182 CO 0.02 0.23 -0.47 0.44 0.00 0.00 0.00 178.15 178.37 1ob3 h ASP 183 N 1.29 0.35 -0.08 1.72 3.32 -1.71 -2.99 116.42 118.32 1ob3 h ASP 183 Ca 0.39 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 57.17 1ob3 h ASP 183 Cb -0.03 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1ob3 h ASP 183 CO -0.12 0.77 -0.28 0.40 -1.72 0.00 0.00 179.24 178.30 1ob3 h ILE 184 N 0.27 1.27 -0.10 0.35 1.08 -1.42 -1.60 117.51 117.36 1ob3 h ILE 184 Ca 0.02 -1.34 0.01 0.00 -0.39 0.00 0.00 64.86 63.16 1ob3 h ILE 184 Cb 0.93 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 36.04 1ob3 h ILE 184 CO 0.08 0.43 0.02 -0.25 -0.69 0.00 0.00 178.15 177.73 1ob3 h TRP 185 N 0.47 0.03 -0.90 1.37 2.91 -1.38 -1.33 115.95 117.11 1ob3 h TRP 185 Ca 0.06 0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.16 1ob3 h TRP 185 Cb 0.72 0.00 -0.07 0.00 -0.51 0.00 0.00 29.16 29.31 1ob3 h TRP 185 CO 0.03 0.01 0.56 0.77 -1.03 0.00 0.00 178.44 178.78 1ob3 h SER 186 N 0.06 0.87 -0.63 2.65 0.02 -1.32 -1.63 113.55 113.57 1ob3 h SER 186 Ca 0.04 0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 1ob3 h SER 186 Cb 0.04 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.38 1ob3 h SER 186 CO -0.06 0.54 0.38 0.58 -1.14 0.00 0.00 176.83 177.13 1ob3 h VAL 187 N 0.99 1.05 -0.75 2.27 2.07 -0.73 -0.63 116.25 120.52 1ob3 h VAL 187 Ca 0.40 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.70 1ob3 h VAL 187 Cb 0.23 0.25 -0.05 0.00 -1.52 0.00 0.00 31.29 30.20 1ob3 h VAL 187 CO -0.19 0.14 0.48 1.23 0.02 0.00 0.00 177.57 179.24 1ob3 h GLY 188 N 0.74 1.08 1.18 2.17 0.00 -0.37 0.75 103.07 108.63 1ob3 h GLY 188 Ca 0.26 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 47.14 1ob3 h GLY 188 CO -0.12 0.31 -0.01 0.00 0.00 0.00 0.00 176.54 176.72 1ob3 h ILE 190 N 0.90 1.29 0.03 0.00 2.04 -0.69 -1.89 117.51 119.19 1ob3 h ILE 190 Ca 0.16 -1.68 0.02 0.00 1.00 0.00 0.00 64.86 64.37 1ob3 h ILE 190 Cb 0.54 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 38.25 1ob3 h ILE 190 CO 0.03 0.54 -0.20 0.15 0.00 0.00 0.00 178.15 178.67 1ob3 h PHE 191 N 0.58 -0.54 -0.72 1.37 -0.00 -0.66 0.13 116.94 117.10 1ob3 h PHE 191 Ca 0.02 0.02 0.06 0.00 -0.00 0.00 0.00 57.97 58.07 1ob3 h PHE 191 Cb 1.10 0.24 -0.06 0.00 -0.00 0.00 0.00 35.95 37.22 1ob3 h PHE 191 CO 0.08 -0.29 0.41 0.00 -0.00 0.00 0.00 178.31 178.51 1ob3 h ALA 192 N 0.52 0.98 -0.79 2.41 0.00 -1.35 -1.96 119.26 119.07 1ob3 h ALA 192 Ca 0.05 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ob3 h ALA 192 Cb 0.41 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1ob3 h ALA 192 CO -0.17 0.10 0.38 1.49 0.00 0.00 0.00 179.25 181.05 1ob3 h GLU 193 N 0.75 1.14 -0.89 0.00 4.81 -0.77 0.27 114.58 119.89 1ob3 h GLU 193 Ca 0.32 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1ob3 h GLU 193 Cb 0.20 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 1ob3 h GLU 193 CO -0.19 0.89 0.57 0.52 -0.73 0.00 0.00 179.01 180.07 1ob3 h MET 194 N 1.12 1.19 0.04 1.92 2.86 -0.14 0.50 114.93 122.42 1ob3 h MET 194 Ca 0.27 -0.09 -0.23 0.00 -2.06 0.00 0.00 59.70 57.60 1ob3 h MET 194 Cb 0.12 -0.26 -0.02 0.00 0.06 0.00 0.00 31.60 31.50 1ob3 h MET 194 CO -0.03 0.81 -1.08 -0.39 1.06 0.00 0.00 176.91 177.27 1ob3 h VAL 195 N 1.21 1.65 0.00 -2.22 -1.51 -0.97 0.14 116.25 114.56 1ob3 h VAL 195 Ca 0.32 -3.32 0.00 0.00 -1.23 0.00 0.00 66.70 62.48 1ob3 h VAL 195 Cb -0.10 2.88 0.00 0.00 -2.13 0.00 0.00 31.29 31.93 1ob3 h VAL 195 CO -0.07 0.95 -1.70 0.59 -1.23 0.00 0.00 177.57 176.12 1ob3 n ASN 196 N -3.40 0.25 0.00 4.19 3.02 0.05 -4.59 115.26 114.78 1ob3 n ASN 196 Ca -0.03 0.04 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1ob3 n ASN 196 Cb 0.97 1.56 0.00 0.00 -0.61 0.00 0.00 39.78 41.69 1ob3 n ASN 196 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ob3 n GLY 197 N 1.25 1.75 3.83 7.41 0.00 0.16 -4.29 105.19 115.31 1ob3 n GLY 197 Ca -0.03 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 1ob3 n GLY 197 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ob3 s THR 198 N -0.33 4.84 0.53 2.61 -1.32 -1.25 -4.76 115.64 115.96 1ob3 s THR 198 Ca 0.00 -0.65 -0.21 0.00 -1.21 0.00 0.00 61.69 59.62 1ob3 s THR 198 Cb 0.00 -3.35 -0.05 0.00 -1.51 0.00 0.00 72.50 67.58 1ob3 s THR 198 CO 0.00 0.11 1.21 -2.16 -2.21 0.00 0.00 174.62 171.57 1ob3 s PRO 199 N -2.49 3.32 -0.03 7.08 0.04 -1.26 -4.31 135.00 137.35 1ob3 s PRO 199 Ca 0.31 1.85 -0.21 0.00 0.04 0.00 0.00 61.00 62.99 1ob3 s PRO 199 Cb -0.12 -2.16 -0.29 0.00 0.04 0.00 0.00 34.50 31.97 1ob3 s PRO 199 CO 0.24 -0.93 0.96 1.25 0.04 0.00 0.00 177.00 178.56 1ob3 h LEU 200 N 1.42 0.47 -6.32 -3.56 5.85 -1.92 -3.39 115.31 107.86 1ob3 h LEU 200 Ca -0.50 -0.89 -0.59 0.00 0.84 0.00 0.00 57.88 56.74 1ob3 h LEU 200 Cb 1.28 -0.15 -0.40 0.00 0.37 0.00 0.00 40.66 41.75 1ob3 h LEU 200 CO 0.57 1.32 -0.81 0.49 -0.34 0.00 0.00 178.44 179.67 1ob3 n PHE 201 N -4.18 1.57 -2.33 1.25 0.99 -1.26 -4.99 117.46 108.51 1ob3 n PHE 201 Ca -0.13 -3.86 -0.43 0.00 -0.00 0.00 0.00 57.45 53.04 1ob3 n PHE 201 Cb 0.76 -0.37 0.00 0.00 -1.00 0.00 0.00 39.48 38.87 1ob3 n PHE 201 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1ob3 n PRO 202 N 1.55 3.39 -1.69 -1.08 -0.04 -1.26 -4.39 135.00 131.48 1ob3 n PRO 202 Ca 0.25 -3.37 -0.32 0.00 -0.04 0.00 0.00 63.50 60.02 1ob3 n PRO 202 Cb 0.45 -3.06 0.04 0.00 -0.04 0.00 0.00 33.50 30.89 1ob3 n PRO 202 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1ob3 s GLY 203 N 1.91 1.87 0.00 0.55 0.00 -1.26 -4.99 107.32 105.40 1ob3 s GLY 203 Ca 0.43 0.26 0.11 0.00 0.00 0.00 0.00 44.72 45.52 1ob3 s GLY 203 CO -0.01 0.58 0.59 3.33 0.00 0.00 0.00 173.10 177.59 1ob3 n VAL 204 N -2.76 0.00 -3.92 1.40 0.24 -1.26 -4.77 118.33 107.25 1ob3 n VAL 204 Ca 0.08 -0.33 -0.08 0.00 -2.04 0.00 0.00 64.34 61.98 1ob3 n VAL 204 Cb 0.53 1.08 -0.03 0.00 -1.47 0.00 0.00 33.84 33.95 1ob3 n VAL 204 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1ob3 s SER 205 N -1.69 -0.17 0.13 -1.34 1.04 -1.26 -4.95 113.70 105.46 1ob3 s SER 205 Ca 0.07 -0.77 -0.19 0.00 0.48 0.00 0.00 55.95 55.54 1ob3 s SER 205 Cb 0.09 0.67 -0.05 0.00 0.10 0.00 0.00 66.02 66.83 1ob3 s SER 205 CO 0.35 -1.27 1.79 -0.33 0.98 0.00 0.00 173.24 174.75 1ob3 h GLU 206 N 2.11 0.33 -0.68 4.02 5.08 -1.97 0.26 114.58 123.73 1ob3 h GLU 206 Ca -0.22 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.08 1ob3 h GLU 206 Cb 1.25 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 1ob3 h GLU 206 CO 0.29 0.22 0.29 0.00 -1.00 0.00 0.00 179.01 178.81 1ob3 h ALA 207 N 1.09 0.88 -0.02 3.43 0.00 -1.97 -2.15 119.26 120.52 1ob3 h ALA 207 Ca 0.09 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 1ob3 h ALA 207 Cb -0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1ob3 h ALA 207 CO -0.02 0.48 -0.73 0.22 0.00 0.00 0.00 179.25 179.20 1ob3 h ASP 208 N 0.96 0.18 -0.41 0.00 3.58 -1.86 -2.39 116.42 116.48 1ob3 h ASP 208 Ca 0.23 -0.12 -0.01 0.00 0.42 0.00 0.00 57.03 57.55 1ob3 h ASP 208 Cb 0.18 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.16 1ob3 h ASP 208 CO -0.02 0.84 0.22 -0.61 -2.88 0.00 0.00 179.24 176.79 1ob3 h GLN 209 N 0.10 0.58 -0.74 0.28 5.75 -0.27 -0.04 115.11 120.77 1ob3 h GLN 209 Ca -0.02 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 1ob3 h GLN 209 Cb 1.28 -0.11 -0.04 0.00 1.07 0.00 0.00 27.48 29.69 1ob3 h GLN 209 CO 0.11 0.47 0.42 -0.07 -2.65 0.00 0.00 178.83 177.11 1ob3 h LEU 210 N 0.54 0.91 -0.95 -2.39 3.38 -1.27 -2.23 115.31 113.30 1ob3 h LEU 210 Ca 0.15 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1ob3 h LEU 210 Cb 0.06 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1ob3 h LEU 210 CO -0.02 0.73 0.05 0.24 0.09 0.00 0.00 178.44 179.53 1ob3 h MET 211 N 1.02 0.83 -0.79 1.13 2.86 -0.93 -0.20 114.93 118.85 1ob3 h MET 211 Ca 0.26 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.67 1ob3 h MET 211 Cb 0.00 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.52 1ob3 h MET 211 CO -0.05 0.79 0.39 0.00 1.06 0.00 0.00 176.91 179.10 1ob3 h ARG 212 N 0.78 1.13 0.04 1.72 2.47 -0.65 -0.17 114.38 119.70 1ob3 h ARG 212 Ca 0.16 -0.16 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1ob3 h ARG 212 Cb 0.39 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1ob3 h ARG 212 CO 0.01 0.87 -0.02 0.82 0.56 0.00 0.00 179.97 182.21 1ob3 h ILE 213 N 1.11 1.17 -0.11 2.04 2.04 -1.04 -3.22 117.51 119.51 1ob3 h ILE 213 Ca 0.27 -0.70 -0.08 0.00 1.00 0.00 0.00 64.86 65.35 1ob3 h ILE 213 Cb 0.11 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 1ob3 h ILE 213 CO -0.04 0.18 -0.30 -0.26 0.00 0.00 0.00 178.15 177.73 1ob3 h PHE 214 N -0.36 0.22 0.00 1.37 0.05 -0.85 -0.17 116.94 117.20 1ob3 h PHE 214 Ca -0.01 -0.04 -0.02 0.00 3.82 0.00 0.00 57.97 61.72 1ob3 h PHE 214 Cb 0.33 -0.05 -0.00 0.00 2.00 0.00 0.00 35.95 38.22 1ob3 h PHE 214 CO 0.03 0.49 -0.11 -0.09 -0.18 0.00 0.00 178.31 178.45 1ob3 h ARG 215 N 0.18 0.00 0.02 1.51 2.43 -1.07 0.12 114.38 117.56 1ob3 h ARG 215 Ca 0.02 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.86 1ob3 h ARG 215 Cb 0.63 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.14 1ob3 h ARG 215 CO 0.05 0.11 -1.85 -0.89 -1.51 0.00 0.00 179.97 175.87 1ob3 n ILE 216 N -4.10 1.57 0.87 1.20 2.08 -0.65 -4.60 119.36 115.73 1ob3 n ILE 216 Ca -0.02 -0.27 0.10 0.00 0.56 0.00 0.00 62.75 63.11 1ob3 n ILE 216 Cb 0.19 -1.90 0.01 0.00 -0.75 0.00 0.00 39.64 37.19 1ob3 n ILE 216 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1ob3 n LEU 217 N -4.15 1.97 0.00 1.39 4.77 -0.17 -0.90 117.00 119.91 1ob3 n LEU 217 Ca -0.40 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 54.78 1ob3 n LEU 217 Cb 0.82 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.91 1ob3 n LEU 217 CO 0.18 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 1ob3 n GLY 218 N 1.28 1.56 3.73 -0.72 0.00 0.42 -4.41 105.19 107.04 1ob3 n GLY 218 Ca 0.09 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 1ob3 n GLY 218 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ob3 s THR 219 N -2.08 3.91 0.64 2.61 2.01 -0.65 -4.52 115.64 117.56 1ob3 s THR 219 Ca 0.00 1.49 -0.17 0.00 0.31 0.00 0.00 61.69 63.31 1ob3 s THR 219 Cb 0.00 -3.95 -0.01 0.00 0.01 0.00 0.00 72.50 68.55 1ob3 s THR 219 CO 0.00 0.18 1.21 -2.84 -0.69 0.00 0.00 174.62 172.48 1ob3 s PRO 220 N 0.39 2.67 0.35 4.92 0.02 -1.26 -4.87 135.00 137.22 1ob3 s PRO 220 Ca 0.55 1.81 -0.04 0.00 0.02 0.00 0.00 61.00 63.34 1ob3 s PRO 220 Cb -0.30 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.34 1ob3 s PRO 220 CO 0.32 -1.44 0.50 0.54 -0.33 0.00 0.00 177.00 176.60 1ob3 s ASN 221 N -1.76 0.83 0.27 2.53 2.20 -1.26 -5.02 114.94 112.72 1ob3 s ASN 221 Ca 0.76 -1.45 0.21 0.00 -0.94 0.00 0.00 52.86 51.45 1ob3 s ASN 221 Cb -0.30 0.68 1.01 0.00 -2.00 0.00 0.00 41.25 40.64 1ob3 s ASN 221 CO 0.38 -1.33 1.65 -1.20 -2.94 0.00 0.00 177.10 173.66 1ob3 n SER 222 N -1.40 0.57 0.01 3.54 7.64 -1.26 -0.52 113.62 122.20 1ob3 n SER 222 Ca 0.00 0.70 -0.19 0.00 1.01 0.00 0.00 58.87 60.38 1ob3 n SER 222 Cb 0.61 -0.80 -0.14 0.00 -1.01 0.00 0.00 64.21 62.88 1ob3 n SER 222 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1ob3 h LYS 223 N 0.00 0.23 0.00 1.43 1.79 -1.97 -3.19 116.57 114.87 1ob3 h LYS 223 Ca 0.00 -0.40 0.00 0.00 -2.18 0.00 0.00 60.65 58.07 1ob3 h LYS 223 Cb 0.19 0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 1ob3 h LYS 223 CO 0.00 1.11 -0.93 0.27 -1.08 0.00 0.00 179.45 178.82 1ob3 n ASN 224 N -3.42 0.63 -3.27 0.86 0.23 -1.10 -4.61 115.26 104.58 1ob3 n ASN 224 Ca -0.29 -0.27 -0.22 0.00 -0.53 0.00 0.00 54.58 53.27 1ob3 n ASN 224 Cb 1.05 0.70 -0.08 0.00 -2.08 0.00 0.00 39.78 39.38 1ob3 n ASN 224 CO 0.00 0.00 0.00 0.86 -0.93 0.00 0.00 177.26 177.19 1ob3 s TRP 225 N -3.15 0.47 0.31 -2.53 -0.11 0.32 -4.70 118.94 109.56 1ob3 s TRP 225 Ca 0.05 -1.89 -0.28 0.00 1.22 0.00 0.00 56.10 55.21 1ob3 s TRP 225 Cb 0.15 -0.65 -0.13 0.00 -1.50 0.00 0.00 33.47 31.34 1ob3 s TRP 225 CO 0.79 -0.92 1.08 -2.30 -4.62 0.00 0.00 176.95 170.98 1ob3 n PRO 226 N 2.97 1.56 -0.91 5.86 -0.02 -1.20 -1.41 135.00 141.84 1ob3 n PRO 226 Ca 0.26 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 1ob3 n PRO 226 Cb 0.49 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1ob3 n PRO 226 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1ob3 n ASN 227 N 1.06 -3.32 0.00 2.55 3.02 -1.26 -4.84 115.26 112.47 1ob3 n ASN 227 Ca 0.08 0.00 0.17 0.00 -0.03 0.00 0.00 54.58 54.80 1ob3 n ASN 227 Cb 0.33 -2.03 0.63 0.00 -0.61 0.00 0.00 39.78 38.11 1ob3 n ASN 227 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1ob3 h VAL 228 N 0.00 0.80 0.00 2.41 3.04 -1.56 -2.35 116.25 118.59 1ob3 h VAL 228 Ca 0.00 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 1ob3 h VAL 228 Cb 0.41 0.68 0.00 0.00 -2.01 0.00 0.00 31.29 30.37 1ob3 h VAL 228 CO 0.00 0.02 0.00 0.35 -1.01 0.00 0.00 177.57 176.93 1ob3 n THR 229 N -4.42 1.04 0.95 3.17 -2.24 -1.26 -2.31 114.28 109.21 1ob3 n THR 229 Ca 0.09 0.29 0.14 0.00 -2.27 0.00 0.00 64.05 62.29 1ob3 n THR 229 Cb 0.49 -1.13 0.52 0.00 -2.10 0.00 0.00 70.33 68.11 1ob3 n THR 229 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ob3 n GLU 230 N -1.76 0.03 -2.25 -0.78 1.02 -0.88 -4.85 120.64 111.17 1ob3 n GLU 230 Ca 0.03 0.02 -0.41 0.00 -0.02 0.00 0.00 57.16 56.78 1ob3 n GLU 230 Cb 0.17 -1.54 -0.03 0.00 -0.02 0.00 0.00 31.44 30.02 1ob3 n GLU 230 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1ob3 s LEU 231 N -3.19 4.44 0.40 -4.62 1.43 -0.98 -4.92 118.68 111.25 1ob3 s LEU 231 Ca 0.13 2.43 0.11 0.00 -1.03 0.00 0.00 54.13 55.77 1ob3 s LEU 231 Cb 0.18 -3.62 0.92 0.00 0.03 0.00 0.00 46.19 43.70 1ob3 s LEU 231 CO 0.57 -0.45 1.93 -0.65 0.23 0.00 0.00 176.35 177.98 1ob3 h PRO 232 N 4.65 0.54 -0.41 1.29 0.11 -1.85 -2.09 132.00 134.25 1ob3 h PRO 232 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ob3 h PRO 232 Cb 1.22 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1ob3 h PRO 232 CO 0.73 0.36 0.00 1.63 -0.21 0.00 0.00 178.00 180.51 1ob3 n LYS 233 N -4.50 3.44 -1.87 1.05 5.02 0.52 -4.98 118.16 116.84 1ob3 n LYS 233 Ca 0.13 -2.78 -0.38 0.00 -2.02 0.00 0.00 58.31 53.26 1ob3 n LYS 233 Cb 0.42 -1.84 0.04 0.00 -0.02 0.00 0.00 35.03 33.62 1ob3 n LYS 233 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1ob3 s TYR 234 N -2.33 2.35 -0.19 2.13 5.04 -0.79 -4.87 117.35 118.68 1ob3 s TYR 234 Ca 0.43 1.43 -0.02 0.00 -2.44 0.00 0.00 57.07 56.47 1ob3 s TYR 234 Cb 0.32 -3.68 0.06 0.00 0.35 0.00 0.00 41.96 39.00 1ob3 s TYR 234 CO 0.14 -2.62 0.02 0.34 -1.34 0.00 0.00 175.55 172.10 1ob3 s ASP 235 N -1.16 2.95 0.56 4.32 -1.08 -1.26 -5.01 116.67 115.99 1ob3 s ASP 235 Ca 0.73 -0.83 0.37 0.00 -0.52 0.00 0.00 52.55 52.30 1ob3 s ASP 235 Cb -0.37 -0.65 1.81 0.00 -1.46 0.00 0.00 42.92 42.25 1ob3 s ASP 235 CO 0.43 -0.29 2.11 1.55 0.52 0.00 0.00 175.17 179.49 1ob3 h PRO 236 N 8.22 0.00 -0.15 4.34 0.13 -2.00 -1.91 132.00 140.62 1ob3 h PRO 236 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1ob3 h PRO 236 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1ob3 h PRO 236 CO 0.34 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.20 1ob3 n ASN 237 N -2.95 1.57 -4.47 1.44 3.02 -1.26 -4.96 115.26 107.65 1ob3 n ASN 237 Ca -0.01 -1.69 -0.54 0.00 -0.03 0.00 0.00 54.58 52.30 1ob3 n ASN 237 Cb 0.17 -0.10 -0.06 0.00 -0.61 0.00 0.00 39.78 39.18 1ob3 n ASN 237 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1ob3 n PHE 238 N 0.26 0.31 -1.61 3.10 3.72 -0.72 -4.83 117.46 117.69 1ob3 n PHE 238 Ca 0.16 1.00 -0.45 0.00 -0.05 0.00 0.00 57.45 58.10 1ob3 n PHE 238 Cb 0.31 -2.06 -0.02 0.00 -0.94 0.00 0.00 39.48 36.77 1ob3 n PHE 238 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1ob3 n THR 239 N 1.00 1.62 -3.46 4.37 -1.04 -1.26 -4.94 114.28 110.57 1ob3 n THR 239 Ca 0.19 -0.41 -0.39 0.00 -2.04 0.00 0.00 64.05 61.41 1ob3 n THR 239 Cb 0.15 -1.07 -0.10 0.00 -1.82 0.00 0.00 70.33 67.49 1ob3 n THR 239 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1ob3 s VAL 240 N -0.74 5.22 0.06 12.58 1.01 -1.26 -4.78 120.40 132.48 1ob3 s VAL 240 Ca 0.63 0.44 0.09 0.00 0.00 0.00 0.00 61.98 63.14 1ob3 s VAL 240 Cb -0.72 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 1ob3 s VAL 240 CO 0.57 0.19 -0.26 -0.31 0.00 0.00 0.00 175.10 175.29 1ob3 s TYR 241 N 1.96 2.24 0.38 5.22 1.51 -1.26 -4.97 117.35 122.43 1ob3 s TYR 241 Ca 0.12 -0.40 -0.05 0.00 -1.01 0.00 0.00 57.07 55.73 1ob3 s TYR 241 Cb -0.16 -1.33 -0.05 0.00 -0.11 0.00 0.00 41.96 40.32 1ob3 s TYR 241 CO 0.10 0.15 0.66 -1.21 -1.11 0.00 0.00 175.55 174.14 1ob3 s GLU 242 N -1.34 3.60 0.32 -0.62 0.41 -1.26 -1.64 118.70 118.16 1ob3 s GLU 242 Ca 0.11 0.07 -0.29 0.00 -0.41 0.00 0.00 54.97 54.46 1ob3 s GLU 242 Cb -0.10 -2.53 -0.10 0.00 -1.78 0.00 0.00 34.13 29.63 1ob3 s GLU 242 CO 0.03 0.04 1.21 -1.25 -0.49 0.00 0.00 175.26 174.79 1ob3 s PRO 243 N -4.11 4.45 0.49 0.39 0.04 -1.26 -4.17 135.00 130.83 1ob3 s PRO 243 Ca 0.45 2.02 -0.11 0.00 0.04 0.00 0.00 61.00 63.40 1ob3 s PRO 243 Cb -0.10 -3.09 -0.06 0.00 0.04 0.00 0.00 34.50 31.29 1ob3 s PRO 243 CO 0.36 -0.04 0.89 -0.51 0.04 0.00 0.00 177.00 177.74 1ob3 s LEU 244 N -1.71 3.61 0.24 -3.56 1.43 -0.08 -4.92 118.68 113.69 1ob3 s LEU 244 Ca 0.48 1.27 -0.30 0.00 -1.03 0.00 0.00 54.13 54.55 1ob3 s LEU 244 Cb -0.36 -4.22 -0.09 0.00 0.03 0.00 0.00 46.19 41.55 1ob3 s LEU 244 CO 0.47 -0.58 1.27 -2.84 0.23 0.00 0.00 176.35 174.90 1ob3 s PRO 245 N -4.35 4.43 0.22 1.29 0.02 -1.26 -4.92 135.00 130.43 1ob3 s PRO 245 Ca 0.53 2.04 -0.08 0.00 0.02 0.00 0.00 61.00 63.51 1ob3 s PRO 245 Cb -0.10 -3.17 0.31 0.00 0.02 0.00 0.00 34.50 31.56 1ob3 s PRO 245 CO 0.39 -0.15 1.76 -1.49 -0.33 0.00 0.00 177.00 177.17 1ob3 h TRP 246 N 4.66 0.49 0.00 6.54 4.06 -1.96 -1.73 115.95 128.01 1ob3 h TRP 246 Ca -0.46 0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.52 1ob3 h TRP 246 Cb 1.22 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 29.25 1ob3 h TRP 246 CO 0.60 0.15 0.00 0.93 -3.56 0.00 0.00 178.44 176.56 1ob3 h GLU 247 N 0.48 0.00 0.00 0.49 3.07 -1.91 -2.71 114.58 114.00 1ob3 h GLU 247 Ca 0.33 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 59.14 1ob3 h GLU 247 Cb 0.39 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1ob3 h GLU 247 CO -0.30 0.00 -0.24 0.66 -1.40 0.00 0.00 179.01 177.74 1ob3 h SER 248 N 0.00 0.00 0.00 1.42 4.64 -1.69 -3.33 113.55 114.58 1ob3 h SER 248 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ob3 h SER 248 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1ob3 h SER 248 CO 0.00 0.24 0.00 2.22 -0.87 0.00 0.00 176.83 178.42 1ob3 n PHE 249 N -3.21 0.00 -5.24 4.77 1.16 -1.07 -5.01 117.46 108.86 1ob3 n PHE 249 Ca 0.02 -0.39 -0.30 0.00 -1.87 0.00 0.00 57.45 54.91 1ob3 n PHE 249 Cb 0.57 -0.04 -0.16 0.00 -1.61 0.00 0.00 39.48 38.24 1ob3 n PHE 249 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1ob3 s LEU 250 N -0.78 2.06 0.09 5.98 1.43 -1.05 -5.02 118.68 121.40 1ob3 s LEU 250 Ca 0.00 -0.47 0.09 0.00 -1.03 0.00 0.00 54.13 52.72 1ob3 s LEU 250 Cb 0.00 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 44.89 1ob3 s LEU 250 CO 0.00 0.31 -0.24 -0.75 0.23 0.00 0.00 176.35 175.90 1ob3 s LYS 251 N -0.65 1.38 -1.26 1.70 2.20 -1.26 -4.77 119.74 117.08 1ob3 s LYS 251 Ca 0.10 -1.16 0.00 0.00 -0.36 0.00 0.00 55.97 54.55 1ob3 s LYS 251 Cb -0.10 -1.67 0.00 0.00 -1.51 0.00 0.00 37.83 34.55 1ob3 s LYS 251 CO -0.01 0.41 0.00 0.41 -0.36 0.00 0.00 175.35 175.80 1ob3 n GLY 252 N 1.31 1.23 3.12 5.54 0.00 -1.26 -4.63 105.19 110.50 1ob3 n GLY 252 Ca -0.18 -0.47 -0.33 0.00 0.00 0.00 0.00 46.02 45.04 1ob3 n GLY 252 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ob3 s LEU 253 N -2.77 2.29 1.26 0.99 2.96 -1.26 -4.83 118.68 117.31 1ob3 s LEU 253 Ca 0.00 -0.72 -0.19 0.00 -0.22 0.00 0.00 54.13 53.01 1ob3 s LEU 253 Cb 0.00 -1.50 0.31 0.00 0.50 0.00 0.00 46.19 45.50 1ob3 s LEU 253 CO 0.00 -0.02 1.03 1.51 -1.32 0.00 0.00 176.35 177.55 1ob3 s ASP 254 N 1.28 0.36 0.25 3.68 3.84 -1.26 -4.70 116.67 120.12 1ob3 s ASP 254 Ca 0.04 0.92 -0.06 0.00 -0.00 0.00 0.00 52.55 53.45 1ob3 s ASP 254 Cb -0.14 -1.35 0.29 0.00 -1.38 0.00 0.00 42.92 40.33 1ob3 s ASP 254 CO -0.12 -4.50 1.91 -0.08 -0.00 0.00 0.00 175.17 172.38 1ob3 h GLU 255 N -2.83 1.25 -0.56 2.11 4.57 -1.99 -1.51 114.58 115.61 1ob3 h GLU 255 Ca -0.49 -0.07 -0.06 0.00 -1.18 0.00 0.00 59.36 57.55 1ob3 h GLU 255 Cb 1.32 -0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 29.61 1ob3 h GLU 255 CO 0.38 0.82 0.09 0.77 -1.18 0.00 0.00 179.01 179.89 1ob3 h SER 256 N 1.28 0.85 -0.26 1.04 0.02 -1.97 -1.39 113.55 113.12 1ob3 h SER 256 Ca 0.38 -0.18 -0.04 0.00 -0.84 0.00 0.00 61.79 61.10 1ob3 h SER 256 Cb -0.07 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.23 1ob3 h SER 256 CO -0.10 0.86 -0.00 1.23 -1.14 0.00 0.00 176.83 177.68 1ob3 h GLY 257 N 1.00 0.51 0.97 -3.77 0.00 -1.73 -1.00 103.07 99.05 1ob3 h GLY 257 Ca 0.18 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 1ob3 h GLY 257 CO 0.01 0.34 0.21 -2.22 0.00 0.00 0.00 176.54 174.88 1ob3 h ILE 258 N 0.25 1.15 -0.14 2.60 2.04 -1.22 -0.98 117.51 121.21 1ob3 h ILE 258 Ca 0.07 -0.39 0.05 0.00 1.00 0.00 0.00 64.86 65.59 1ob3 h ILE 258 Cb 0.43 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 1ob3 h ILE 258 CO 0.01 0.15 -0.20 -0.78 0.00 0.00 0.00 178.15 177.34 1ob3 h ASP 259 N 0.49 -0.62 -0.40 1.72 3.58 -1.08 -0.17 116.42 119.93 1ob3 h ASP 259 Ca 0.13 0.11 0.04 0.00 0.42 0.00 0.00 57.03 57.73 1ob3 h ASP 259 Cb 0.06 0.29 -0.04 0.00 1.72 0.00 0.00 39.33 41.36 1ob3 h ASP 259 CO -0.02 -0.25 0.19 0.25 -2.88 0.00 0.00 179.24 176.53 1ob3 h LEU 260 N -0.25 0.26 -0.87 2.28 5.85 -0.93 -2.15 115.31 119.50 1ob3 h LEU 260 Ca 0.10 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.88 1ob3 h LEU 260 Cb 0.40 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.36 1ob3 h LEU 260 CO -0.28 0.19 0.56 0.25 -0.34 0.00 0.00 178.44 178.82 1ob3 h LEU 261 N 0.39 0.93 -1.80 2.25 5.85 -0.77 -1.18 115.31 120.98 1ob3 h LEU 261 Ca 0.18 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1ob3 h LEU 261 Cb 0.10 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1ob3 h LEU 261 CO -0.14 0.63 0.12 0.77 -0.34 0.00 0.00 178.44 179.49 1ob3 h SER 262 N 1.08 0.22 0.88 1.25 4.64 -0.43 -0.81 113.55 120.39 1ob3 h SER 262 Ca 0.35 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.52 1ob3 h SER 262 Cb 0.01 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 1ob3 h SER 262 CO -0.12 0.17 -0.65 0.11 -0.87 0.00 0.00 176.83 175.47 1ob3 h LYS 263 N 0.26 0.00 0.07 4.77 1.79 -0.62 -3.12 116.57 119.72 1ob3 h LYS 263 Ca 0.07 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.27 1ob3 h LYS 263 Cb -0.02 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.62 1ob3 h LYS 263 CO -0.01 0.65 -1.31 0.52 -1.08 0.00 0.00 179.45 178.21 1ob3 h MET 264 N 0.00 0.16 -1.01 3.15 2.86 -0.96 -1.97 114.93 117.16 1ob3 h MET 264 Ca -0.01 -0.27 -0.35 0.00 -2.06 0.00 0.00 59.70 57.01 1ob3 h MET 264 Cb 1.27 0.10 -0.21 0.00 0.06 0.00 0.00 31.60 32.82 1ob3 h MET 264 CO 0.08 1.05 0.45 1.28 1.06 0.00 0.00 176.91 180.83 1ob3 n LEU 265 N -3.40 5.57 -4.74 1.22 4.77 -0.38 -4.21 117.00 115.83 1ob3 n LEU 265 Ca -0.09 -2.95 -0.41 0.00 -0.03 0.00 0.00 56.01 52.53 1ob3 n LEU 265 Cb 1.01 -0.74 -0.03 0.00 -2.33 0.00 0.00 43.42 41.33 1ob3 n LEU 265 CO 0.50 0.88 1.07 -0.54 -1.33 0.00 0.00 177.39 177.97 1ob3 s LYS 266 N -2.24 4.31 0.22 3.23 -0.14 -1.18 -4.93 119.74 119.01 1ob3 s LYS 266 Ca 0.39 2.20 -0.04 0.00 -1.36 0.00 0.00 55.97 57.15 1ob3 s LYS 266 Cb 0.33 -3.15 0.20 0.00 -1.68 0.00 0.00 37.83 33.52 1ob3 s LYS 266 CO 0.07 -0.37 1.65 -0.07 -0.76 0.00 0.00 175.35 175.87 1ob3 h LEU 267 N 5.42 0.80 -8.85 3.17 3.38 -1.93 -3.42 115.31 113.88 1ob3 h LEU 267 Ca -0.45 -0.27 -0.57 0.00 0.09 0.00 0.00 57.88 56.68 1ob3 h LEU 267 Cb 1.21 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 41.67 1ob3 h LEU 267 CO 0.79 0.97 0.82 -0.62 0.09 0.00 0.00 178.44 180.49 1ob3 s ASP 268 N -6.72 6.79 0.52 -0.43 -1.08 -1.26 -4.76 116.67 109.72 1ob3 s ASP 268 Ca -0.09 0.77 0.20 0.00 -0.52 0.00 0.00 52.55 52.90 1ob3 s ASP 268 Cb 0.13 -2.53 1.36 0.00 -1.46 0.00 0.00 42.92 40.42 1ob3 s ASP 268 CO 0.83 -0.99 2.13 -0.65 0.52 0.00 0.00 175.17 177.01 1ob3 h PRO 269 N 8.53 0.00 0.00 4.34 0.11 -1.97 -0.77 132.00 142.23 1ob3 h PRO 269 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1ob3 h PRO 269 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1ob3 h PRO 269 CO 1.05 0.06 0.00 -0.91 -0.21 0.00 0.00 178.00 177.99 1ob3 h ASN 270 N 0.00 0.00 -0.01 -2.05 2.35 -1.95 -2.86 115.58 111.06 1ob3 h ASN 270 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1ob3 h ASN 270 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1ob3 h ASN 270 CO 0.01 0.00 -0.55 0.00 -1.65 0.00 0.00 177.43 175.24 1ob3 n GLN 271 N -2.79 1.68 -1.91 0.81 1.13 -0.32 -4.99 117.38 111.00 1ob3 n GLN 271 Ca 0.01 -0.42 -0.41 0.00 -1.94 0.00 0.00 57.00 54.24 1ob3 n GLN 271 Cb 0.29 -1.28 -0.01 0.00 0.11 0.00 0.00 30.24 29.35 1ob3 n GLN 271 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1ob3 s ARG 272 N -2.23 4.20 0.56 -1.09 3.52 -1.05 -4.94 118.95 117.91 1ob3 s ARG 272 Ca 0.10 2.45 -0.21 0.00 -0.13 0.00 0.00 55.73 57.93 1ob3 s ARG 272 Cb 0.13 -3.03 -0.04 0.00 -1.56 0.00 0.00 34.95 30.45 1ob3 s ARG 272 CO 0.54 -0.46 1.37 -1.50 -0.81 0.00 0.00 175.30 174.44 1ob3 s ILE 273 N -0.69 2.01 0.64 4.11 2.07 -0.74 -5.03 121.20 123.58 1ob3 s ILE 273 Ca 0.55 0.01 -0.07 0.00 -1.41 0.00 0.00 60.65 59.73 1ob3 s ILE 273 Cb -0.44 -3.00 0.02 0.00 0.13 0.00 0.00 42.46 39.16 1ob3 s ILE 273 CO 0.54 -0.00 0.96 0.42 -1.91 0.00 0.00 174.94 174.95 1ob3 s THR 274 N -1.29 3.30 0.13 4.00 -4.23 -1.26 -4.89 115.64 111.39 1ob3 s THR 274 Ca 0.73 0.02 -0.19 0.00 -1.18 0.00 0.00 61.69 61.06 1ob3 s THR 274 Cb -0.41 -3.35 -0.05 0.00 1.34 0.00 0.00 72.50 70.03 1ob3 s THR 274 CO 0.48 -0.38 1.75 0.00 -0.54 0.00 0.00 174.62 175.93 1ob3 h ALA 275 N -0.36 0.25 -0.69 3.99 0.00 -1.95 0.90 119.26 121.41 1ob3 h ALA 275 Ca -0.45 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 1ob3 h ALA 275 Cb 1.27 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1ob3 h ALA 275 CO 0.61 -0.33 0.16 0.87 0.00 0.00 0.00 179.25 180.56 1ob3 h LYS 276 N 0.20 1.10 -0.74 0.00 1.57 -1.94 -1.10 116.57 115.66 1ob3 h LYS 276 Ca 0.09 -0.26 0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1ob3 h LYS 276 Cb 0.05 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 1ob3 h LYS 276 CO -0.08 0.97 0.48 1.96 -0.57 0.00 0.00 179.45 182.21 1ob3 h GLN 277 N 1.04 0.94 -0.81 3.15 4.20 -1.89 -2.74 115.11 119.00 1ob3 h GLN 277 Ca 0.22 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 1ob3 h GLN 277 Cb 0.37 -0.21 -0.04 0.00 0.30 0.00 0.00 27.48 27.90 1ob3 h GLN 277 CO 0.00 0.62 0.42 0.00 -0.67 0.00 0.00 178.83 179.21 1ob3 h ALA 278 N 1.28 1.22 0.00 3.87 0.00 -0.18 -1.84 119.26 123.61 1ob3 h ALA 278 Ca 0.28 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ob3 h ALA 278 Cb -0.08 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.38 1ob3 h ALA 278 CO -0.07 0.62 -0.02 -0.07 0.00 0.00 0.00 179.25 179.70 1ob3 h LEU 279 N 1.14 0.00 -0.21 0.00 3.38 -0.92 -1.15 115.31 117.56 1ob3 h LEU 279 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1ob3 h LEU 279 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1ob3 h LEU 279 CO -0.04 0.02 -0.06 -0.62 0.09 0.00 0.00 178.44 177.83 1ob3 n GLU 280 N -3.90 0.81 -2.30 1.13 1.02 -0.70 -4.89 120.64 111.81 1ob3 n GLU 280 Ca -0.03 -0.21 -0.34 0.00 -0.02 0.00 0.00 57.16 56.56 1ob3 n GLU 280 Cb 0.11 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.03 1ob3 n GLU 280 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1ob3 s HIS 281 N -2.34 2.80 0.52 -0.32 2.46 -0.44 -4.91 115.29 113.07 1ob3 s HIS 281 Ca 0.34 1.55 0.24 0.00 0.47 0.00 0.00 55.06 57.66 1ob3 s HIS 281 Cb 0.21 -3.18 1.36 0.00 -0.13 0.00 0.00 32.58 30.83 1ob3 s HIS 281 CO 0.44 -1.29 2.01 0.00 -2.47 0.00 0.00 174.74 173.42 1ob3 h ALA 282 N 1.16 2.43 -0.81 1.58 0.00 -1.93 -2.15 119.26 119.55 1ob3 h ALA 282 Ca -0.49 -0.02 0.21 0.00 0.00 0.00 0.00 54.91 54.61 1ob3 h ALA 282 Cb 1.24 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 1ob3 h ALA 282 CO 0.57 -0.57 0.56 -0.92 0.00 0.00 0.00 179.25 178.90 1ob3 h TYR 283 N 0.03 0.24 0.00 0.00 3.20 -1.91 -1.14 116.97 117.39 1ob3 h TYR 283 Ca 0.24 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.11 1ob3 h TYR 283 Cb 0.90 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.10 1ob3 h TYR 283 CO -0.00 0.07 -0.54 1.19 -1.64 0.00 0.00 178.16 177.24 1ob3 n PHE 284 N -4.40 0.06 0.32 -3.82 3.72 -0.81 -3.71 117.46 108.82 1ob3 n PHE 284 Ca 0.16 0.02 0.09 0.00 -0.05 0.00 0.00 57.45 57.67 1ob3 n PHE 284 Cb 0.75 -0.29 0.25 0.00 -0.94 0.00 0.00 39.48 39.24 1ob3 n PHE 284 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1ob3 n LYS 285 N -1.58 2.25 0.00 -1.08 5.02 -0.43 -5.10 118.16 117.24 1ob3 n LYS 285 Ca 0.05 -1.94 0.09 0.00 -2.02 0.00 0.00 58.31 54.49 1ob3 n LYS 285 Cb 0.35 -1.43 0.07 0.00 -0.02 0.00 0.00 35.03 34.00 1ob3 n LYS 285 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27