#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ob1 s ILE 2 N 0.00 5.01 -0.23 2.12 1.09 -1.26 -5.04 121.20 122.89 1ob1 s ILE 2 Ca 0.00 1.53 -0.01 0.00 -1.10 0.00 0.00 60.65 61.07 1ob1 s ILE 2 Cb 0.00 -4.08 0.02 0.00 -1.06 0.00 0.00 42.46 37.34 1ob1 s ILE 2 CO 0.00 0.22 -0.09 -0.69 -0.10 0.00 0.00 174.94 174.28 1ob1 s VAL 3 N 0.94 2.71 -0.14 2.92 1.01 -1.26 -4.64 120.40 121.95 1ob1 s VAL 3 Ca 0.39 -0.96 -0.06 0.00 0.00 0.00 0.00 61.98 61.35 1ob1 s VAL 3 Cb -0.18 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 1ob1 s VAL 3 CO 0.19 0.30 0.09 -0.04 0.00 0.00 0.00 175.10 175.64 1ob1 s MET 4 N 1.33 3.56 -0.12 2.72 1.00 -1.26 -3.38 119.30 123.14 1ob1 s MET 4 Ca 0.02 -0.26 0.01 0.00 0.00 0.00 0.00 55.69 55.46 1ob1 s MET 4 Cb -0.16 -3.13 -0.01 0.00 0.00 0.00 0.00 34.83 31.53 1ob1 s MET 4 CO -0.06 0.58 -0.15 0.95 0.00 0.00 0.00 175.02 176.34 1ob1 s THR 5 N -0.49 2.90 -0.13 2.05 -4.23 -0.73 -3.71 115.64 111.29 1ob1 s THR 5 Ca 0.11 -0.72 -0.06 0.00 -1.18 0.00 0.00 61.69 59.83 1ob1 s THR 5 Cb -0.12 -2.20 -0.04 0.00 1.34 0.00 0.00 72.50 71.49 1ob1 s THR 5 CO 0.02 0.53 0.10 -1.10 -0.54 0.00 0.00 174.62 173.63 1ob1 s GLN 6 N 0.26 3.54 -0.08 3.99 -0.21 -1.26 -2.59 119.66 123.31 1ob1 s GLN 6 Ca -0.10 -0.23 0.04 0.00 0.02 0.00 0.00 55.36 55.08 1ob1 s GLN 6 Cb -0.16 -3.15 0.00 0.00 1.00 0.00 0.00 33.01 30.71 1ob1 s GLN 6 CO 0.06 0.61 -0.20 0.99 -2.12 0.00 0.00 175.29 174.63 1ob1 s THR 7 N -0.57 1.73 0.62 -0.19 2.01 -1.07 -3.96 115.64 114.21 1ob1 s THR 7 Ca 0.12 -0.84 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 1ob1 s THR 7 Cb -0.12 -1.51 0.13 0.00 0.01 0.00 0.00 72.50 71.01 1ob1 s THR 7 CO 0.02 0.49 0.85 -2.65 -0.69 0.00 0.00 174.62 172.64 1ob1 n PRO 8 N 3.48 -0.10 -0.03 4.92 -0.02 -1.26 -2.55 135.00 139.44 1ob1 n PRO 8 Ca -0.20 -2.16 -0.16 0.00 -2.02 0.00 0.00 63.50 58.97 1ob1 n PRO 8 Cb 0.53 -0.61 -0.08 0.00 -0.02 0.00 0.00 33.50 33.31 1ob1 n PRO 8 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ob1 h ALA 9 N -0.72 0.20 -3.99 3.55 0.00 -1.80 -3.41 119.26 113.09 1ob1 h ALA 9 Ca -0.28 -0.49 -0.53 0.00 0.00 0.00 0.00 54.91 53.61 1ob1 h ALA 9 Cb 0.99 -0.01 -0.26 0.00 0.00 0.00 0.00 17.79 18.51 1ob1 h ALA 9 CO 0.29 0.36 -0.82 0.42 0.00 0.00 0.00 179.25 179.49 1ob1 s ILE 10 N -3.71 1.45 0.00 0.00 1.09 -1.26 -0.95 121.20 117.82 1ob1 s ILE 10 Ca -0.13 -1.07 -0.06 0.00 -1.10 0.00 0.00 60.65 58.28 1ob1 s ILE 10 Cb 0.05 -1.26 -0.00 0.00 -1.06 0.00 0.00 42.46 40.19 1ob1 s ILE 10 CO 0.82 0.16 0.12 -0.04 -0.10 0.00 0.00 174.94 175.90 1ob1 s MET 11 N -1.06 0.45 0.02 2.79 -1.94 0.18 -4.89 119.30 114.84 1ob1 s MET 11 Ca 0.05 -0.40 0.00 0.00 -1.71 0.00 0.00 55.69 53.64 1ob1 s MET 11 Cb -0.08 0.19 -0.02 0.00 2.01 0.00 0.00 34.83 36.93 1ob1 s MET 11 CO 0.01 -0.10 -0.03 -1.54 -0.01 0.00 0.00 175.02 173.35 1ob1 s SER 12 N -1.33 0.27 0.02 3.03 1.04 -1.26 0.24 113.70 115.71 1ob1 s SER 12 Ca -0.14 -0.40 -0.28 0.00 0.48 0.00 0.00 55.95 55.61 1ob1 s SER 12 Cb -0.08 0.07 0.07 0.00 0.10 0.00 0.00 66.02 66.18 1ob1 s SER 12 CO 0.01 -0.23 0.63 0.00 0.98 0.00 0.00 173.24 174.64 1ob1 s ALA 13 N -1.15 -1.66 0.22 5.32 0.00 -1.00 -4.84 121.76 118.65 1ob1 s ALA 13 Ca -0.12 1.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.55 1ob1 s ALA 13 Cb -0.08 0.27 -0.08 0.00 0.00 0.00 0.00 23.12 23.23 1ob1 s ALA 13 CO -0.01 -0.49 1.12 -0.06 0.00 0.00 0.00 175.76 176.33 1ob1 s PHE 14 N -1.99 3.54 -0.08 0.00 0.40 -1.26 -1.30 117.98 117.29 1ob1 s PHE 14 Ca -0.07 1.59 -0.35 0.00 -0.60 0.00 0.00 56.93 57.50 1ob1 s PHE 14 Cb -0.00 -3.32 -0.12 0.00 0.51 0.00 0.00 43.02 40.08 1ob1 s PHE 14 CO 0.03 -0.74 1.82 1.28 0.70 0.00 0.00 175.22 178.31 1ob1 n LEU 15 N 1.97 3.26 0.00 -0.37 4.77 -1.26 -0.71 117.00 124.66 1ob1 n LEU 15 Ca 0.02 1.00 0.00 0.00 -0.03 0.00 0.00 56.01 57.00 1ob1 n LEU 15 Cb 0.45 -1.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.19 1ob1 n LEU 15 CO 0.54 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1ob1 n GLY 16 N 4.24 1.44 3.73 -0.72 0.00 0.12 -4.93 105.19 109.06 1ob1 n GLY 16 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 1ob1 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ob1 s GLU 17 N -0.07 1.66 0.08 1.61 2.02 0.11 -4.24 118.70 119.88 1ob1 s GLU 17 Ca 0.00 1.17 -0.24 0.00 0.02 0.00 0.00 54.97 55.93 1ob1 s GLU 17 Cb 0.00 -1.83 -0.06 0.00 0.10 0.00 0.00 34.13 32.34 1ob1 s GLU 17 CO 0.00 -2.06 0.71 0.50 0.02 0.00 0.00 175.26 174.43 1ob1 s ARG 18 N -4.84 4.45 0.01 1.61 3.52 -1.21 -0.50 118.95 121.99 1ob1 s ARG 18 Ca 0.63 1.00 0.05 0.00 -0.13 0.00 0.00 55.73 57.27 1ob1 s ARG 18 Cb -0.19 -3.31 -0.01 0.00 -1.56 0.00 0.00 34.95 29.88 1ob1 s ARG 18 CO 0.57 0.45 -0.15 0.08 -0.81 0.00 0.00 175.30 175.44 1ob1 s VAL 19 N -0.60 1.16 -0.07 7.11 1.01 -0.49 -4.96 120.40 123.56 1ob1 s VAL 19 Ca 0.35 -0.76 -0.08 0.00 0.00 0.00 0.00 61.98 61.49 1ob1 s VAL 19 Cb -0.21 -0.99 0.02 0.00 0.00 0.00 0.00 36.38 35.20 1ob1 s VAL 19 CO 0.23 0.22 0.22 0.28 0.00 0.00 0.00 175.10 176.05 1ob1 s THR 20 N -0.51 0.01 -0.02 3.92 -1.32 -1.26 0.53 115.64 116.99 1ob1 s THR 20 Ca 0.05 -0.09 -0.01 0.00 -1.21 0.00 0.00 61.69 60.43 1ob1 s THR 20 Cb -0.06 -0.35 0.01 0.00 -1.51 0.00 0.00 72.50 70.59 1ob1 s THR 20 CO 0.00 -0.05 0.03 0.00 -2.21 0.00 0.00 174.62 172.39 1ob1 s MET 21 N -0.09 0.01 0.32 7.08 0.23 -0.04 -4.91 119.30 121.90 1ob1 s MET 21 Ca -0.02 0.10 0.00 0.00 -1.03 0.00 0.00 55.69 54.75 1ob1 s MET 21 Cb -0.02 -0.09 -0.04 0.00 -1.53 0.00 0.00 34.83 33.15 1ob1 s MET 21 CO 0.01 -0.07 0.52 0.95 -2.03 0.00 0.00 175.02 174.40 1ob1 s THR 22 N 0.44 5.12 -0.30 3.16 -4.23 -1.06 -0.97 115.64 117.80 1ob1 s THR 22 Ca -0.04 -0.45 -0.01 0.00 -1.18 0.00 0.00 61.69 60.02 1ob1 s THR 22 Cb -0.05 -3.84 0.13 0.00 1.34 0.00 0.00 72.50 70.08 1ob1 s THR 22 CO -0.01 -0.49 0.28 0.00 -0.54 0.00 0.00 174.62 173.86 1ob1 s THR 24 N 2.21 4.55 0.30 0.00 -4.23 -1.07 -1.89 115.64 115.52 1ob1 s THR 24 Ca 0.10 -1.07 0.06 0.00 -1.18 0.00 0.00 61.69 59.60 1ob1 s THR 24 Cb -0.14 -3.33 -0.06 0.00 1.34 0.00 0.00 72.50 70.30 1ob1 s THR 24 CO -0.30 -0.12 -0.01 0.00 -0.54 0.00 0.00 174.62 173.65 1ob1 s ALA 25 N -1.77 2.41 -2.00 3.99 0.00 0.39 -1.77 121.76 123.00 1ob1 s ALA 25 Ca 0.31 -1.99 0.14 0.00 0.00 0.00 0.00 51.96 50.43 1ob1 s ALA 25 Cb -0.10 0.35 0.85 0.00 0.00 0.00 0.00 23.12 24.22 1ob1 s ALA 25 CO 0.24 -0.16 1.28 0.25 0.00 0.00 0.00 175.76 177.37 1ob1 n THR 26 N -0.65 0.00 -3.47 0.00 -2.24 -1.22 -4.87 114.28 101.84 1ob1 n THR 26 Ca -0.04 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.39 1ob1 n THR 26 Cb 0.65 -0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 68.20 1ob1 n THR 26 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ob1 s SER 27 N -1.89 6.73 -0.91 3.42 0.15 -1.26 -5.07 113.70 114.87 1ob1 s SER 27 Ca 0.21 0.93 -0.01 0.00 0.70 0.00 0.00 55.95 57.79 1ob1 s SER 27 Cb 0.10 -2.23 0.26 0.00 -1.71 0.00 0.00 66.02 62.43 1ob1 s SER 27 CO 0.16 0.14 1.00 0.18 1.20 0.00 0.00 173.24 175.92 1ob1 n LEU 28 N 0.87 4.82 -0.36 3.45 4.77 0.12 -4.91 117.00 125.76 1ob1 n LEU 28 Ca -0.07 -5.22 0.30 0.00 -0.03 0.00 0.00 56.01 50.99 1ob1 n LEU 28 Cb 0.52 -1.08 0.55 0.00 -2.33 0.00 0.00 43.42 41.09 1ob1 n LEU 28 CO 0.42 1.70 1.13 0.28 -1.33 0.00 0.00 177.39 179.59 1ob1 h SER 29 N 5.47 0.39 -1.28 -1.43 0.02 -1.98 -2.57 113.55 112.16 1ob1 h SER 29 Ca 0.18 0.20 -0.75 0.00 -0.84 0.00 0.00 61.79 60.58 1ob1 h SER 29 Cb 0.73 0.17 -0.14 0.00 0.14 0.00 0.00 62.40 63.30 1ob1 h SER 29 CO 1.00 -0.23 2.25 -1.54 -1.14 0.00 0.00 176.83 177.16 1ob1 n SER 30 N -5.01 7.30 0.00 3.07 3.41 -1.26 -4.88 113.62 116.25 1ob1 n SER 30 Ca 0.35 -3.16 0.00 0.00 -0.26 0.00 0.00 58.87 55.80 1ob1 n SER 30 Cb 1.19 -1.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 1ob1 n SER 30 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ob1 n SER 31 N 2.16 0.00 -3.51 4.04 7.64 -0.97 -4.47 113.62 118.51 1ob1 n SER 31 Ca 0.56 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 60.03 1ob1 n SER 31 Cb 0.28 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.47 1ob1 n SER 31 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1ob1 n TYR 32 N 0.00 2.68 -4.06 1.43 4.02 -1.26 -3.28 117.16 116.69 1ob1 n TYR 32 Ca 0.00 -2.91 -0.34 0.00 -0.01 0.00 0.00 57.90 54.64 1ob1 n TYR 32 Cb 0.00 -2.11 -0.15 0.00 -0.02 0.00 0.00 39.34 37.06 1ob1 n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1ob1 s LEU 33 N -0.76 2.51 0.23 7.72 2.96 -1.26 -1.00 118.68 129.07 1ob1 s LEU 33 Ca 0.56 -0.52 0.09 0.00 -0.22 0.00 0.00 54.13 54.04 1ob1 s LEU 33 Cb 0.17 -1.60 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 1ob1 s LEU 33 CO -0.07 -0.00 -0.03 -1.00 -1.32 0.00 0.00 176.35 173.93 1ob1 s HIS 34 N 1.34 2.69 -0.01 5.38 3.76 -0.65 0.11 115.29 127.92 1ob1 s HIS 34 Ca 0.05 -0.21 0.07 0.00 -0.15 0.00 0.00 55.06 54.82 1ob1 s HIS 34 Cb -0.14 -1.24 -0.02 0.00 1.11 0.00 0.00 32.58 32.30 1ob1 s HIS 34 CO -0.08 0.58 -0.24 -1.58 -0.85 0.00 0.00 174.74 172.58 1ob1 s TRP 35 N -2.10 2.11 0.04 1.40 0.52 0.34 0.47 118.94 121.71 1ob1 s TRP 35 Ca 0.29 -0.40 0.06 0.00 0.02 0.00 0.00 56.10 56.08 1ob1 s TRP 35 Cb -0.07 -1.34 -0.02 0.00 -1.15 0.00 0.00 33.47 30.89 1ob1 s TRP 35 CO 0.18 -0.01 -0.18 0.71 0.02 0.00 0.00 176.95 177.67 1ob1 s TYR 36 N -0.59 1.58 -0.06 -1.98 1.51 0.63 -0.30 117.35 118.13 1ob1 s TYR 36 Ca 0.09 -0.36 0.01 0.00 -1.01 0.00 0.00 57.07 55.81 1ob1 s TYR 36 Cb -0.09 -0.94 -0.03 0.00 -0.11 0.00 0.00 41.96 40.79 1ob1 s TYR 36 CO -0.00 0.06 -0.09 -1.14 -1.11 0.00 0.00 175.55 173.27 1ob1 s GLN 37 N -1.08 2.70 0.00 -0.62 0.74 0.11 -0.97 119.66 120.54 1ob1 s GLN 37 Ca 0.05 -0.58 0.02 0.00 0.05 0.00 0.00 55.36 54.90 1ob1 s GLN 37 Cb -0.08 -2.54 -0.01 0.00 1.10 0.00 0.00 33.01 31.48 1ob1 s GLN 37 CO 0.01 0.65 -0.07 -1.14 -0.55 0.00 0.00 175.29 174.19 1ob1 s GLN 38 N -0.78 0.53 -0.03 1.67 0.74 0.65 0.11 119.66 122.55 1ob1 s GLN 38 Ca 0.12 -0.31 -0.01 0.00 0.05 0.00 0.00 55.36 55.21 1ob1 s GLN 38 Cb -0.11 -0.49 0.02 0.00 1.10 0.00 0.00 33.01 33.54 1ob1 s GLN 38 CO 0.01 0.13 0.05 0.15 -0.55 0.00 0.00 175.29 175.08 1ob1 s LYS 39 N -0.37 0.01 0.10 1.67 1.02 -1.26 -1.72 119.74 119.19 1ob1 s LYS 39 Ca 0.01 0.17 -0.35 0.00 0.02 0.00 0.00 55.97 55.82 1ob1 s LYS 39 Cb -0.04 -0.14 -0.18 0.00 -0.52 0.00 0.00 37.83 36.95 1ob1 s LYS 39 CO -0.00 -0.11 0.96 -2.30 -0.92 0.00 0.00 175.35 172.98 1ob1 n PRO 40 N 3.78 0.32 -1.76 -1.68 -0.02 -1.26 -2.35 135.00 132.03 1ob1 n PRO 40 Ca -0.22 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 1ob1 n PRO 40 Cb 0.54 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 1ob1 n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ob1 n GLY 41 N 1.80 0.73 3.56 -1.23 0.00 -1.26 -5.05 105.19 103.74 1ob1 n GLY 41 Ca 0.18 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.42 1ob1 n GLY 41 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ob1 s SER 42 N -2.83 -0.34 0.57 1.61 0.01 -0.99 -5.15 113.70 106.59 1ob1 s SER 42 Ca 0.00 0.25 -0.15 0.00 1.31 0.00 0.00 55.95 57.36 1ob1 s SER 42 Cb 0.00 0.30 -0.05 0.00 0.21 0.00 0.00 66.02 66.48 1ob1 s SER 42 CO 0.00 -0.40 1.02 -0.44 0.41 0.00 0.00 173.24 173.84 1ob1 s SER 43 N -1.57 6.19 0.65 2.44 0.01 -1.26 -4.58 113.70 115.58 1ob1 s SER 43 Ca 0.01 1.62 -0.17 0.00 1.31 0.00 0.00 55.95 58.73 1ob1 s SER 43 Cb -0.01 -2.51 -0.03 0.00 0.21 0.00 0.00 66.02 63.68 1ob1 s SER 43 CO -0.02 -0.89 0.90 -2.65 0.41 0.00 0.00 173.24 170.99 1ob1 n PRO 44 N -2.05 0.69 -4.87 12.44 -0.02 -1.26 -4.74 135.00 135.19 1ob1 n PRO 44 Ca 0.07 0.28 -0.33 0.00 -2.02 0.00 0.00 63.50 61.51 1ob1 n PRO 44 Cb 0.54 -2.13 -0.16 0.00 -0.02 0.00 0.00 33.50 31.73 1ob1 n PRO 44 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1ob1 s LYS 45 N -2.90 3.20 0.08 -0.52 1.02 0.29 -4.90 119.74 116.00 1ob1 s LYS 45 Ca 0.74 -0.78 -0.30 0.00 0.02 0.00 0.00 55.97 55.65 1ob1 s LYS 45 Cb -0.39 -2.50 -0.09 0.00 -0.52 0.00 0.00 37.83 34.33 1ob1 s LYS 45 CO 0.49 0.14 1.88 -1.17 -0.92 0.00 0.00 175.35 175.76 1ob1 s LEU 46 N 0.49 4.41 -0.13 3.17 2.96 -1.26 0.06 118.68 128.38 1ob1 s LEU 46 Ca -0.12 2.69 -0.05 0.00 -0.22 0.00 0.00 54.13 56.43 1ob1 s LEU 46 Cb -0.16 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 42.92 1ob1 s LEU 46 CO 0.05 -1.02 -0.15 1.87 -1.32 0.00 0.00 176.35 175.78 1ob1 n TRP 47 N 6.58 0.00 -3.81 5.38 -0.00 0.59 -4.70 117.44 121.48 1ob1 n TRP 47 Ca 0.19 0.00 -0.14 0.00 -0.00 0.00 0.00 57.50 57.55 1ob1 n TRP 47 Cb 0.40 -0.46 -0.15 0.00 -0.00 0.00 0.00 31.31 31.10 1ob1 n TRP 47 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 1ob1 s ILE 48 N -2.23 -0.03 -0.00 5.87 1.01 -0.72 -1.28 121.20 123.81 1ob1 s ILE 48 Ca -0.17 0.12 0.07 0.00 0.00 0.00 0.00 60.65 60.66 1ob1 s ILE 48 Cb 0.06 -0.08 -0.02 0.00 0.01 0.00 0.00 42.46 42.44 1ob1 s ILE 48 CO 0.23 0.05 -0.22 -0.72 0.00 0.00 0.00 174.94 174.28 1ob1 s TYR 49 N 0.61 1.97 -1.05 3.97 1.13 0.74 0.13 117.35 124.84 1ob1 s TYR 49 Ca -0.05 -0.37 -0.10 0.00 -1.41 0.00 0.00 57.07 55.14 1ob1 s TYR 49 Cb -0.07 -1.25 -0.05 0.00 -1.10 0.00 0.00 41.96 39.50 1ob1 s TYR 49 CO -0.02 -0.01 0.86 2.41 -2.51 0.00 0.00 175.55 176.29 1ob1 n THR 50 N 2.39 -8.20 0.00 -3.49 -1.04 -1.10 -2.19 114.28 100.66 1ob1 n THR 50 Ca -0.16 -1.14 0.00 0.00 -2.04 0.00 0.00 64.05 60.71 1ob1 n THR 50 Cb 0.52 -5.86 0.00 0.00 -1.82 0.00 0.00 70.33 63.17 1ob1 n THR 50 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1ob1 n THR 51 N -3.41 0.00 -0.19 12.58 -1.04 0.31 -3.92 114.28 118.61 1ob1 n THR 51 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 1ob1 n THR 51 Cb 0.60 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.11 1ob1 n THR 51 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1ob1 n SER 52 N 1.32 0.09 -4.66 8.00 3.41 -1.25 -3.11 113.62 117.43 1ob1 n SER 52 Ca 0.00 -0.40 -0.42 0.00 -0.26 0.00 0.00 58.87 57.79 1ob1 n SER 52 Cb 0.00 0.24 -0.04 0.00 -0.26 0.00 0.00 64.21 64.15 1ob1 n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1ob1 s ASN 53 N -0.24 6.94 0.18 4.04 0.01 -0.93 -4.48 114.94 120.47 1ob1 s ASN 53 Ca 0.00 1.16 -0.30 0.00 -0.71 0.00 0.00 52.86 53.01 1ob1 s ASN 53 Cb 0.00 -2.46 -0.08 0.00 0.41 0.00 0.00 41.25 39.12 1ob1 s ASN 53 CO 0.00 -0.47 1.14 -0.76 -1.51 0.00 0.00 177.10 175.49 1ob1 s LEU 54 N 2.51 4.47 0.99 0.60 1.43 -1.26 -0.19 118.68 127.23 1ob1 s LEU 54 Ca 0.38 2.15 -0.14 0.00 -1.03 0.00 0.00 54.13 55.49 1ob1 s LEU 54 Cb -0.16 -3.61 0.18 0.00 0.03 0.00 0.00 46.19 42.64 1ob1 s LEU 54 CO 0.10 -0.28 1.14 0.00 0.23 0.00 0.00 176.35 177.54 1ob1 s ALA 55 N -0.19 1.39 0.72 4.21 0.00 -0.40 -4.87 121.76 122.60 1ob1 s ALA 55 Ca 0.50 -0.61 -0.14 0.00 0.00 0.00 0.00 51.96 51.71 1ob1 s ALA 55 Cb -0.31 -3.01 0.03 0.00 0.00 0.00 0.00 23.12 19.84 1ob1 s ALA 55 CO 0.36 -2.67 1.16 -1.54 0.00 0.00 0.00 175.76 173.07 1ob1 s SER 56 N -3.92 4.48 0.00 0.00 1.04 -1.26 -2.92 113.70 111.11 1ob1 s SER 56 Ca 0.66 2.17 0.00 0.00 0.48 0.00 0.00 55.95 59.27 1ob1 s SER 56 Cb -0.14 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.41 1ob1 s SER 56 CO 0.55 -2.06 0.00 0.61 0.98 0.00 0.00 173.24 173.32 1ob1 n GLY 57 N -0.07 1.95 3.69 7.32 0.00 -1.26 -4.97 105.19 111.85 1ob1 n GLY 57 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1ob1 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ob1 s VAL 58 N -2.12 4.98 0.64 1.61 1.01 -1.15 -5.04 120.40 120.33 1ob1 s VAL 58 Ca 0.00 1.48 -0.17 0.00 0.00 0.00 0.00 61.98 63.29 1ob1 s VAL 58 Cb 0.00 -4.07 -0.01 0.00 0.00 0.00 0.00 36.38 32.30 1ob1 s VAL 58 CO 0.00 0.15 1.21 -2.16 0.00 0.00 0.00 175.10 174.29 1ob1 s PRO 59 N 1.47 2.69 0.00 2.72 0.04 -1.26 -4.91 135.00 135.74 1ob1 s PRO 59 Ca 0.37 1.80 0.24 0.00 0.04 0.00 0.00 61.00 63.44 1ob1 s PRO 59 Cb -0.17 -1.90 1.38 0.00 0.04 0.00 0.00 34.50 33.85 1ob1 s PRO 59 CO 0.15 -1.42 1.79 -1.13 0.04 0.00 0.00 177.00 176.43 1ob1 n SER 60 N -2.00 0.00 0.08 6.66 3.41 -1.26 -2.15 113.62 118.36 1ob1 n SER 60 Ca 0.14 -0.60 0.11 0.00 -0.26 0.00 0.00 58.87 58.25 1ob1 n SER 60 Cb 0.50 -0.06 0.43 0.00 -0.26 0.00 0.00 64.21 64.82 1ob1 n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1ob1 n ARG 61 N -1.06 0.13 -3.63 4.33 1.85 -1.26 -4.60 116.66 112.42 1ob1 n ARG 61 Ca 0.17 0.33 -0.35 0.00 -1.00 0.00 0.00 57.85 57.00 1ob1 n ARG 61 Cb 0.10 -1.73 -0.05 0.00 -1.05 0.00 0.00 32.46 29.72 1ob1 n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1ob1 s PHE 62 N -3.19 3.59 0.24 2.89 0.40 -0.91 -0.13 117.98 120.87 1ob1 s PHE 62 Ca 0.06 0.73 -0.14 0.00 -0.60 0.00 0.00 56.93 56.98 1ob1 s PHE 62 Cb 0.10 -2.11 0.00 0.00 0.51 0.00 0.00 43.02 41.52 1ob1 s PHE 62 CO 0.38 0.56 0.50 -1.54 0.70 0.00 0.00 175.22 175.82 1ob1 s SER 63 N -1.67 -0.12 -0.05 1.36 1.04 -0.69 -5.00 113.70 108.57 1ob1 s SER 63 Ca 0.30 -0.83 -0.11 0.00 0.48 0.00 0.00 55.95 55.79 1ob1 s SER 63 Cb -0.14 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.59 1ob1 s SER 63 CO 0.17 -1.14 0.25 -0.83 0.98 0.00 0.00 173.24 172.67 1ob1 s GLY 64 N -2.99 -0.13 0.02 7.32 0.00 -1.26 -1.23 107.32 109.05 1ob1 s GLY 64 Ca 0.19 0.41 -0.23 0.00 0.00 0.00 0.00 44.72 45.09 1ob1 s GLY 64 CO 0.07 0.26 0.53 -1.35 0.00 0.00 0.00 173.10 172.62 1ob1 s SER 65 N -0.69 -0.46 0.00 1.64 1.04 -0.92 -4.13 113.70 110.19 1ob1 s SER 65 Ca -0.08 0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.63 1ob1 s SER 65 Cb -0.04 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1ob1 s SER 65 CO 0.02 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.18 1ob1 n GLY 66 N 0.60 1.51 3.78 7.32 0.00 -1.26 -0.89 105.19 116.25 1ob1 n GLY 66 Ca -0.19 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 44.73 1ob1 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ob1 s SER 67 N 0.00 0.01 0.00 1.61 1.04 -0.48 -4.97 113.70 110.91 1ob1 s SER 67 Ca 0.00 -1.02 0.00 0.00 0.48 0.00 0.00 55.95 55.41 1ob1 s SER 67 Cb 0.00 0.79 0.00 0.00 0.10 0.00 0.00 66.02 66.91 1ob1 s SER 67 CO 0.00 -1.53 0.00 0.61 0.98 0.00 0.00 173.24 173.30 1ob1 n GLY 68 N -0.51 1.09 0.02 7.32 0.00 -1.26 -1.51 105.19 110.35 1ob1 n GLY 68 Ca -0.06 0.56 0.07 0.00 0.00 0.00 0.00 46.02 46.60 1ob1 n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ob1 n THR 69 N 0.00 0.16 -4.58 2.61 -2.24 -1.26 0.16 114.28 109.14 1ob1 n THR 69 Ca 0.00 -0.49 -0.34 0.00 -2.27 0.00 0.00 64.05 60.96 1ob1 n THR 69 Cb 0.00 -0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.09 1ob1 n THR 69 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ob1 s SER 70 N -4.37 4.57 0.08 3.42 1.04 -0.57 -0.46 113.70 117.42 1ob1 s SER 70 Ca -0.07 -0.12 -0.05 0.00 0.48 0.00 0.00 55.95 56.19 1ob1 s SER 70 Cb 0.11 -1.45 -0.02 0.00 0.10 0.00 0.00 66.02 64.76 1ob1 s SER 70 CO 0.80 0.26 0.09 -0.31 0.98 0.00 0.00 173.24 175.05 1ob1 s TYR 71 N -0.20 0.40 -0.09 5.02 1.51 -0.79 -1.38 117.35 121.81 1ob1 s TYR 71 Ca 0.02 -0.87 -0.30 0.00 -1.01 0.00 0.00 57.07 54.91 1ob1 s TYR 71 Cb -0.13 -0.24 0.08 0.00 -0.11 0.00 0.00 41.96 41.56 1ob1 s TYR 71 CO 0.03 -0.48 0.75 -1.54 -1.11 0.00 0.00 175.55 173.19 1ob1 s SER 72 N -2.91 -0.61 -0.05 2.29 1.04 -0.07 0.20 113.70 113.59 1ob1 s SER 72 Ca 0.08 0.73 -0.02 0.00 0.48 0.00 0.00 55.95 57.23 1ob1 s SER 72 Cb 0.06 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.74 1ob1 s SER 72 CO -0.09 -0.52 0.07 -0.22 0.98 0.00 0.00 173.24 173.46 1ob1 s LEU 73 N -1.00 3.89 0.02 2.42 0.20 -0.15 -2.15 118.68 121.90 1ob1 s LEU 73 Ca -0.08 0.20 0.02 0.00 0.69 0.00 0.00 54.13 54.95 1ob1 s LEU 73 Cb -0.01 -2.11 -0.01 0.00 -0.43 0.00 0.00 46.19 43.63 1ob1 s LEU 73 CO 0.07 0.32 -0.06 -0.89 -0.29 0.00 0.00 176.35 175.51 1ob1 s THR 74 N -1.08 0.40 -0.18 3.68 2.01 -0.37 -0.86 115.64 119.25 1ob1 s THR 74 Ca 0.19 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.54 1ob1 s THR 74 Cb -0.12 -0.43 0.03 0.00 0.01 0.00 0.00 72.50 71.99 1ob1 s THR 74 CO 0.09 -0.18 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.05 1ob1 s ILE 75 N -0.82 1.82 0.01 1.82 1.01 0.19 -1.70 121.20 123.54 1ob1 s ILE 75 Ca -0.05 -0.88 -0.03 0.00 0.00 0.00 0.00 60.65 59.69 1ob1 s ILE 75 Cb -0.06 -1.72 -0.01 0.00 0.01 0.00 0.00 42.46 40.68 1ob1 s ILE 75 CO 0.00 0.42 1.05 0.28 0.00 0.00 0.00 174.94 176.69 1ob1 h SER 76 N 7.98 -0.16 -3.34 3.58 0.02 -0.81 -1.29 113.55 119.53 1ob1 h SER 76 Ca -0.39 0.02 -0.50 0.00 -0.84 0.00 0.00 61.79 60.09 1ob1 h SER 76 Cb 1.13 0.07 -0.35 0.00 0.14 0.00 0.00 62.40 63.38 1ob1 h SER 76 CO 0.56 -0.03 -0.80 -0.94 -1.14 0.00 0.00 176.83 174.48 1ob1 s SER 77 N -2.94 1.76 0.06 3.07 1.04 -1.26 -3.33 113.70 112.10 1ob1 s SER 77 Ca -0.01 -0.26 -0.30 0.00 0.48 0.00 0.00 55.95 55.86 1ob1 s SER 77 Cb 0.01 -0.75 -0.05 0.00 0.10 0.00 0.00 66.02 65.33 1ob1 s SER 77 CO 0.05 -0.04 1.07 -0.32 0.98 0.00 0.00 173.24 174.98 1ob1 s MET 78 N 1.12 4.54 -0.05 4.02 1.75 0.35 -4.77 119.30 126.26 1ob1 s MET 78 Ca -0.06 1.58 0.05 0.00 -1.25 0.00 0.00 55.69 56.01 1ob1 s MET 78 Cb -0.14 -3.39 -0.02 0.00 2.84 0.00 0.00 34.83 34.12 1ob1 s MET 78 CO -0.01 -0.07 -0.20 -1.21 -0.65 0.00 0.00 175.02 172.88 1ob1 s GLU 79 N 0.71 2.44 0.00 4.11 0.41 -1.26 0.11 118.70 125.21 1ob1 s GLU 79 Ca 0.53 -0.81 0.00 0.00 -0.41 0.00 0.00 54.97 54.28 1ob1 s GLU 79 Cb -0.25 -2.24 0.00 0.00 -1.78 0.00 0.00 34.13 29.86 1ob1 s GLU 79 CO 0.30 0.53 0.00 0.00 -0.49 0.00 0.00 175.26 175.59 1ob1 n ALA 80 N 2.56 0.00 0.13 5.21 0.00 -1.26 0.11 120.51 127.26 1ob1 n ALA 80 Ca -0.17 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.41 1ob1 n ALA 80 Cb 0.52 0.00 0.67 0.00 0.00 0.00 0.00 19.45 20.63 1ob1 n ALA 80 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ob1 h GLU 81 N 0.00 0.00 0.00 0.00 3.07 -2.02 -1.91 114.58 113.73 1ob1 h GLU 81 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1ob1 h GLU 81 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1ob1 h GLU 81 CO 0.00 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.36 1ob1 n ASP 82 N -4.45 0.28 -4.59 1.42 8.00 0.31 -4.63 116.55 112.89 1ob1 n ASP 82 Ca 0.03 0.56 -0.42 0.00 0.71 0.00 0.00 54.79 55.68 1ob1 n ASP 82 Cb 0.35 -0.63 -0.03 0.00 -0.02 0.00 0.00 41.12 40.79 1ob1 n ASP 82 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ob1 s ALA 83 N -3.12 2.57 0.07 2.24 0.00 -0.72 -4.82 121.76 117.98 1ob1 s ALA 83 Ca 0.07 0.45 -0.11 0.00 0.00 0.00 0.00 51.96 52.36 1ob1 s ALA 83 Cb 0.10 -4.11 0.04 0.00 0.00 0.00 0.00 23.12 19.15 1ob1 s ALA 83 CO 0.34 -3.06 0.54 0.00 0.00 0.00 0.00 175.76 173.58 1ob1 n ALA 84 N 12.01 -1.43 -2.87 0.00 0.00 -0.99 -4.97 120.51 122.25 1ob1 n ALA 84 Ca 0.28 -0.48 -0.34 0.00 0.00 0.00 0.00 53.44 52.91 1ob1 n ALA 84 Cb 0.47 0.23 -0.11 0.00 0.00 0.00 0.00 19.45 20.04 1ob1 n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ob1 s THR 85 N -2.26 4.12 -0.15 0.00 2.01 -0.70 0.10 115.64 118.76 1ob1 s THR 85 Ca 0.12 -0.28 -0.00 0.00 0.31 0.00 0.00 61.69 61.84 1ob1 s THR 85 Cb -0.01 -2.80 -0.00 0.00 0.01 0.00 0.00 72.50 69.69 1ob1 s THR 85 CO 0.02 0.51 -0.14 -0.31 -0.69 0.00 0.00 174.62 174.00 1ob1 s TYR 86 N 0.13 2.79 -0.03 4.92 1.51 -0.14 -0.25 117.35 126.29 1ob1 s TYR 86 Ca 0.00 -0.95 0.03 0.00 -1.01 0.00 0.00 57.07 55.15 1ob1 s TYR 86 Cb -0.13 -1.89 -0.03 0.00 -0.11 0.00 0.00 41.96 39.80 1ob1 s TYR 86 CO 0.02 -0.42 -0.12 0.71 -1.11 0.00 0.00 175.55 174.64 1ob1 s TYR 87 N 0.75 2.77 -0.10 2.71 2.02 -0.14 -0.83 117.35 124.52 1ob1 s TYR 87 Ca -0.06 -0.11 -0.04 0.00 -0.37 0.00 0.00 57.07 56.49 1ob1 s TYR 87 Cb -0.15 -1.62 -0.04 0.00 -0.40 0.00 0.00 41.96 39.75 1ob1 s TYR 87 CO 0.01 0.27 0.05 0.00 -1.57 0.00 0.00 175.55 174.31 1ob1 s HIS 89 N -0.88 2.21 -0.23 0.00 2.46 0.18 -1.85 115.29 117.18 1ob1 s HIS 89 Ca 0.13 -1.46 -0.27 0.00 0.47 0.00 0.00 55.06 53.93 1ob1 s HIS 89 Cb -0.12 -1.54 0.00 0.00 -0.13 0.00 0.00 32.58 30.79 1ob1 s HIS 89 CO 0.03 -0.71 0.92 -1.14 -2.47 0.00 0.00 174.74 171.37 1ob1 s GLN 90 N 1.46 4.23 -0.43 2.88 -0.44 -1.05 -1.63 119.66 124.69 1ob1 s GLN 90 Ca -0.01 1.13 0.05 0.00 -2.50 0.00 0.00 55.36 54.03 1ob1 s GLN 90 Cb -0.16 -3.63 0.43 0.00 -1.64 0.00 0.00 33.01 28.00 1ob1 s GLN 90 CO -0.08 -0.54 1.22 0.34 0.50 0.00 0.00 175.29 176.74 1ob1 n PHE 91 N 6.03 3.19 -0.10 1.67 7.35 -0.17 -3.77 117.46 131.66 1ob1 n PHE 91 Ca 0.08 -2.80 -0.21 0.00 -0.76 0.00 0.00 57.45 53.76 1ob1 n PHE 91 Cb 0.47 -0.27 -0.12 0.00 0.35 0.00 0.00 39.48 39.91 1ob1 n PHE 91 CO 0.00 0.00 0.00 1.58 -0.76 0.00 0.00 176.76 177.58 1ob1 n HIS 92 N -0.56 0.37 -3.64 -5.13 -0.00 -1.26 -4.82 115.22 100.17 1ob1 n HIS 92 Ca 0.42 0.09 -0.08 0.00 0.46 0.00 0.00 57.72 58.61 1ob1 n HIS 92 Cb 0.72 -1.05 -0.07 0.00 -0.12 0.00 0.00 29.99 29.48 1ob1 n HIS 92 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1ob1 s HIS 93 N -2.52 -0.98 0.38 1.57 5.65 -1.26 -5.01 115.29 113.13 1ob1 s HIS 93 Ca -0.32 2.02 -0.27 0.00 0.25 0.00 0.00 55.06 56.75 1ob1 s HIS 93 Cb 0.09 0.54 -0.11 0.00 -1.18 0.00 0.00 32.58 31.93 1ob1 s HIS 93 CO 0.62 -0.48 1.29 0.43 -0.65 0.00 0.00 174.74 175.95 1ob1 n SER 94 N 3.92 2.72 -4.78 9.88 7.64 -1.26 -3.87 113.62 127.87 1ob1 n SER 94 Ca -0.19 1.16 -0.37 0.00 1.01 0.00 0.00 58.87 60.48 1ob1 n SER 94 Cb 0.58 -1.50 -0.06 0.00 -1.01 0.00 0.00 64.21 62.22 1ob1 n SER 94 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1ob1 s PRO 95 N -2.06 4.51 -1.14 1.43 0.04 -1.26 -4.86 135.00 131.66 1ob1 s PRO 95 Ca 0.58 1.39 -0.20 0.00 0.04 0.00 0.00 61.00 62.81 1ob1 s PRO 95 Cb -0.53 -2.78 0.07 0.00 0.04 0.00 0.00 34.50 31.30 1ob1 s PRO 95 CO 0.60 0.20 1.55 0.71 0.04 0.00 0.00 177.00 180.10 1ob1 s TYR 96 N -1.59 2.72 0.77 0.56 2.02 -1.25 -4.63 117.35 115.95 1ob1 s TYR 96 Ca 0.51 -1.27 -0.11 0.00 -0.37 0.00 0.00 57.07 55.83 1ob1 s TYR 96 Cb -0.20 -4.68 0.05 0.00 -0.40 0.00 0.00 41.96 36.74 1ob1 s TYR 96 CO 0.25 -1.83 1.08 0.95 -1.57 0.00 0.00 175.55 174.44 1ob1 s THR 97 N 4.35 3.39 0.55 -0.71 -4.23 -1.25 -4.78 115.64 112.96 1ob1 s THR 97 Ca 0.48 0.45 0.08 0.00 -1.18 0.00 0.00 61.69 61.52 1ob1 s THR 97 Cb 0.01 -3.12 0.06 0.00 1.34 0.00 0.00 72.50 70.80 1ob1 s THR 97 CO -0.02 -0.59 0.63 -0.36 -0.54 0.00 0.00 174.62 173.75 1ob1 s PHE 98 N -3.05 1.60 0.33 3.99 0.40 -1.26 -2.52 117.98 117.47 1ob1 s PHE 98 Ca 0.60 -0.74 0.08 0.00 -0.60 0.00 0.00 56.93 56.28 1ob1 s PHE 98 Cb -0.15 -2.12 -0.04 0.00 0.51 0.00 0.00 43.02 41.22 1ob1 s PHE 98 CO 0.55 -0.85 0.12 0.20 0.70 0.00 0.00 175.22 175.94 1ob1 s GLY 99 N -4.50 1.92 0.50 4.36 0.00 -0.77 -4.41 107.32 104.42 1ob1 s GLY 99 Ca 0.52 -1.81 0.29 0.00 0.00 0.00 0.00 44.72 43.72 1ob1 s GLY 99 CO 0.32 -1.76 1.84 -1.33 0.00 0.00 0.00 173.10 172.18 1ob1 h GLY 100 N 1.59 0.30 0.00 0.20 0.00 -1.90 -3.44 103.07 99.81 1ob1 h GLY 100 Ca -0.44 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1ob1 h GLY 100 CO 0.63 -0.02 0.00 0.61 0.00 0.00 0.00 176.54 177.76 1ob1 n GLY 101 N -1.67 -0.49 2.84 4.60 0.00 -1.26 -4.98 105.19 104.23 1ob1 n GLY 101 Ca 0.22 -1.54 -0.27 0.00 0.00 0.00 0.00 46.02 44.43 1ob1 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ob1 s THR 102 N -3.07 0.84 -0.57 2.61 2.01 -0.01 -4.53 115.64 112.92 1ob1 s THR 102 Ca 0.00 -0.40 -0.25 0.00 0.31 0.00 0.00 61.69 61.35 1ob1 s THR 102 Cb 0.00 -1.04 0.04 0.00 0.01 0.00 0.00 72.50 71.51 1ob1 s THR 102 CO 0.00 0.15 1.01 -0.75 -0.69 0.00 0.00 174.62 174.34 1ob1 s LYS 103 N 1.76 3.36 -0.19 4.92 2.20 -0.12 -0.97 119.74 130.69 1ob1 s LYS 103 Ca 0.02 -0.18 -0.23 0.00 -0.36 0.00 0.00 55.97 55.22 1ob1 s LYS 103 Cb -0.14 -4.06 -0.02 0.00 -1.51 0.00 0.00 37.83 32.10 1ob1 s LYS 103 CO -0.07 -1.58 0.75 -1.17 -0.36 0.00 0.00 175.35 172.92 1ob1 s LEU 104 N 4.26 4.15 0.50 5.43 0.20 0.29 0.48 118.68 133.99 1ob1 s LEU 104 Ca 0.33 1.02 0.02 0.00 0.69 0.00 0.00 54.13 56.19 1ob1 s LEU 104 Cb -0.11 -3.09 -0.02 0.00 -0.43 0.00 0.00 46.19 42.53 1ob1 s LEU 104 CO 0.20 -0.37 0.01 -1.61 -0.29 0.00 0.00 176.35 174.29 1ob1 s GLU 105 N 2.16 2.16 -0.16 1.98 2.02 0.67 -2.35 118.70 125.19 1ob1 s GLU 105 Ca 0.34 -2.36 -0.05 0.00 0.02 0.00 0.00 54.97 52.93 1ob1 s GLU 105 Cb -0.16 -1.56 -0.03 0.00 0.10 0.00 0.00 34.13 32.48 1ob1 s GLU 105 CO 0.11 -0.32 -0.00 0.42 0.02 0.00 0.00 175.26 175.48 1ob1 s ILE 106 N -2.85 4.19 0.01 -1.63 1.01 -1.26 -2.37 121.20 118.31 1ob1 s ILE 106 Ca 0.10 -0.25 -0.26 0.00 0.00 0.00 0.00 60.65 60.24 1ob1 s ILE 106 Cb 0.03 -2.85 -0.05 0.00 0.01 0.00 0.00 42.46 39.60 1ob1 s ILE 106 CO 0.05 0.49 0.79 -0.54 0.00 0.00 0.00 174.94 175.74 1ob1 s LYS 106 N 0.24 4.50 0.15 2.79 1.02 -0.42 -4.77 119.74 123.26 1ob1 s LYS 106 Ca -0.00 1.09 -0.06 0.00 0.02 0.00 0.00 55.97 57.02 1ob1 s LYS 106 Cb -0.13 -3.40 -0.02 0.00 -0.52 0.00 0.00 37.83 33.76 1ob1 s LYS 106 CO 0.02 0.18 0.20 -0.98 -0.92 0.00 0.00 175.35 173.85 1ob1 s ARG 107 N 0.31 1.07 0.57 1.68 1.70 -1.26 -4.61 118.95 118.42 1ob1 s ARG 107 Ca 0.41 -1.27 -0.20 0.00 -0.47 0.00 0.00 55.73 54.19 1ob1 s ARG 107 Cb -0.20 0.33 -0.04 0.00 -0.57 0.00 0.00 34.95 34.47 1ob1 s ARG 107 CO 0.23 -0.36 1.29 0.00 -1.08 0.00 0.00 175.30 175.38 1ob1 s ALA 108 N -4.00 2.66 1.04 7.88 0.00 -1.26 -4.96 121.76 123.12 1ob1 s ALA 108 Ca 0.20 1.20 -0.15 0.00 0.00 0.00 0.00 51.96 53.22 1ob1 s ALA 108 Cb 0.05 -3.52 0.11 0.00 0.00 0.00 0.00 23.12 19.75 1ob1 s ALA 108 CO 0.01 -1.33 0.42 -0.25 0.00 0.00 0.00 175.76 174.61 1ob1 n ASP 109 N -1.32 -1.89 -3.39 0.00 8.00 -1.26 -4.85 116.55 111.84 1ob1 n ASP 109 Ca 0.12 0.11 -0.14 0.00 0.71 0.00 0.00 54.79 55.60 1ob1 n ASP 109 Cb 0.47 -1.15 -0.04 0.00 -0.02 0.00 0.00 41.12 40.37 1ob1 n ASP 109 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ob1 s ALA 110 N -2.37 0.61 -0.02 2.24 0.00 -1.26 -4.85 121.76 116.11 1ob1 s ALA 110 Ca 0.59 -1.42 0.08 0.00 0.00 0.00 0.00 51.96 51.21 1ob1 s ALA 110 Cb -0.18 1.14 -0.02 0.00 0.00 0.00 0.00 23.12 24.06 1ob1 s ALA 110 CO 0.66 -0.79 -0.25 0.00 0.00 0.00 0.00 175.76 175.37 1ob1 s ALA 111 N -3.23 2.19 1.39 0.00 0.00 -1.26 -3.88 121.76 116.97 1ob1 s ALA 111 Ca 0.29 -1.11 -0.21 0.00 0.00 0.00 0.00 51.96 50.93 1ob1 s ALA 111 Cb -0.00 -0.57 0.35 0.00 0.00 0.00 0.00 23.12 22.90 1ob1 s ALA 111 CO 0.18 0.53 0.90 -2.30 0.00 0.00 0.00 175.76 175.07 1ob1 n PRO 112 N 2.42 -4.11 -3.45 0.00 -0.02 -1.26 -4.26 135.00 124.31 1ob1 n PRO 112 Ca -0.16 -1.21 -0.28 0.00 -2.02 0.00 0.00 63.50 59.83 1ob1 n PRO 112 Cb 0.51 -1.99 -0.12 0.00 -0.02 0.00 0.00 33.50 31.88 1ob1 n PRO 112 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1ob1 s THR 113 N -2.20 0.09 0.37 3.45 2.01 -0.78 -4.84 115.64 113.74 1ob1 s THR 113 Ca 0.67 -1.66 -0.26 0.00 0.31 0.00 0.00 61.69 60.75 1ob1 s THR 113 Cb -0.17 -1.07 -0.09 0.00 0.01 0.00 0.00 72.50 71.18 1ob1 s THR 113 CO 0.60 -0.96 1.13 -0.69 -0.69 0.00 0.00 174.62 174.00 1ob1 s VAL 114 N 1.09 3.36 -0.24 3.82 1.01 -1.24 -3.27 120.40 124.94 1ob1 s VAL 114 Ca 0.18 1.18 -0.03 0.00 0.00 0.00 0.00 61.98 63.32 1ob1 s VAL 114 Cb -0.22 -3.68 0.12 0.00 0.00 0.00 0.00 36.38 32.60 1ob1 s VAL 114 CO 0.00 0.14 0.30 -0.44 0.00 0.00 0.00 175.10 175.11 1ob1 s SER 115 N -1.15 0.90 0.04 3.32 0.01 -0.93 -4.95 113.70 110.93 1ob1 s SER 115 Ca 0.54 -0.11 -0.19 0.00 1.31 0.00 0.00 55.95 57.50 1ob1 s SER 115 Cb -0.29 0.74 -0.06 0.00 0.21 0.00 0.00 66.02 66.61 1ob1 s SER 115 CO 0.37 -0.32 0.54 -0.51 0.41 0.00 0.00 173.24 173.73 1ob1 s ILE 116 N 2.43 4.85 -0.32 1.44 1.10 -1.26 -2.13 121.20 127.31 1ob1 s ILE 116 Ca 0.10 1.14 -0.02 0.00 -0.51 0.00 0.00 60.65 61.35 1ob1 s ILE 116 Cb -0.15 -3.87 0.12 0.00 0.15 0.00 0.00 42.46 38.71 1ob1 s ILE 116 CO -0.17 0.52 0.17 -0.36 -2.11 0.00 0.00 174.94 172.99 1ob1 s PHE 117 N -0.84 0.45 0.77 3.50 0.40 0.12 -4.99 117.98 117.39 1ob1 s PHE 117 Ca 0.28 -1.16 -0.14 0.00 -0.60 0.00 0.00 56.93 55.31 1ob1 s PHE 117 Cb -0.19 -0.88 0.06 0.00 0.51 0.00 0.00 43.02 42.52 1ob1 s PHE 117 CO 0.17 -0.83 1.15 -2.30 0.70 0.00 0.00 175.22 174.11 1ob1 n PRO 118 N 4.74 0.36 -1.31 0.24 -0.02 -1.26 -1.29 135.00 136.45 1ob1 n PRO 118 Ca 0.02 0.19 -0.40 0.00 -2.02 0.00 0.00 63.50 61.29 1ob1 n PRO 118 Cb 0.40 -2.40 0.01 0.00 -0.02 0.00 0.00 33.50 31.49 1ob1 n PRO 118 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ob1 n PRO 119 N -2.80 0.12 -0.74 0.52 -0.02 -1.07 -4.90 135.00 126.11 1ob1 n PRO 119 Ca 0.14 0.05 -0.07 0.00 -2.02 0.00 0.00 63.50 61.59 1ob1 n PRO 119 Cb 0.50 -1.14 0.05 0.00 -0.02 0.00 0.00 33.50 32.88 1ob1 n PRO 119 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ob1 n SER 120 N 2.07 0.15 0.12 2.55 3.41 -1.26 -4.84 113.62 115.81 1ob1 n SER 120 Ca 0.10 -1.19 -0.13 0.00 -0.26 0.00 0.00 58.87 57.39 1ob1 n SER 120 Cb 0.44 -0.23 -0.08 0.00 -0.26 0.00 0.00 64.21 64.08 1ob1 n SER 120 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1ob1 h SER 121 N -0.35 -0.27 -0.90 4.04 0.02 -1.98 -2.84 113.55 111.27 1ob1 h SER 121 Ca -0.10 -0.23 0.24 0.00 -0.84 0.00 0.00 61.79 60.85 1ob1 h SER 121 Cb 0.32 0.07 -0.13 0.00 0.14 0.00 0.00 62.40 62.80 1ob1 h SER 121 CO 0.09 0.12 0.36 -0.33 -1.14 0.00 0.00 176.83 175.93 1ob1 h GLU 122 N -0.71 0.31 0.17 3.45 4.39 -2.01 -3.05 114.58 117.14 1ob1 h GLU 122 Ca -0.03 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 1ob1 h GLU 122 Cb 0.49 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1ob1 h GLU 122 CO 0.05 0.21 -0.08 0.37 -1.16 0.00 0.00 179.01 178.40 1ob1 h GLN 123 N 0.32 -0.22 0.00 2.33 5.75 -1.90 -3.26 115.11 118.13 1ob1 h GLN 123 Ca 0.58 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 59.09 1ob1 h GLN 123 Cb 1.15 0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.75 1ob1 h GLN 123 CO -0.58 -0.15 0.00 1.28 -2.65 0.00 0.00 178.83 176.73 1ob1 n LEU 124 N -3.45 0.00 -0.01 -2.39 4.77 -1.07 0.58 117.00 115.43 1ob1 n LEU 124 Ca -0.03 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.03 1ob1 n LEU 124 Cb 0.09 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.05 1ob1 n LEU 124 CO 0.07 0.00 -0.67 0.41 -1.33 0.00 0.00 177.39 175.87 1ob1 n THR 125 N -0.38 0.00 0.01 -5.08 -1.04 -1.16 -4.51 114.28 102.12 1ob1 n THR 125 Ca 0.00 -0.36 -0.07 0.00 -2.04 0.00 0.00 64.05 61.58 1ob1 n THR 125 Cb 0.00 0.16 -0.12 0.00 -1.82 0.00 0.00 70.33 68.55 1ob1 n THR 125 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1ob1 h SER 126 N 0.00 0.00 0.00 8.00 0.02 0.01 -3.48 113.55 118.10 1ob1 h SER 126 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ob1 h SER 126 Cb 0.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.28 1ob1 h SER 126 CO 0.00 0.92 0.00 0.61 -1.14 0.00 0.00 176.83 177.22 1ob1 n GLY 127 N 1.47 0.77 3.66 -3.77 0.00 -1.24 -5.14 105.19 100.94 1ob1 n GLY 127 Ca -0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 1ob1 n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ob1 s GLY 128 N -0.42 2.15 -0.12 -0.02 0.00 -1.26 -2.51 107.32 105.15 1ob1 s GLY 128 Ca 0.00 -2.01 -0.02 0.00 0.00 0.00 0.00 44.72 42.68 1ob1 s GLY 128 CO 0.00 -1.91 0.03 0.00 0.00 0.00 0.00 173.10 171.22 1ob1 s ALA 129 N -2.54 0.68 -0.30 3.20 0.00 0.33 -3.56 121.76 119.56 1ob1 s ALA 129 Ca 0.36 -0.27 -0.02 0.00 0.00 0.00 0.00 51.96 52.04 1ob1 s ALA 129 Cb 0.01 -0.89 0.05 0.00 0.00 0.00 0.00 23.12 22.29 1ob1 s ALA 129 CO 0.20 -0.77 -0.01 -1.12 0.00 0.00 0.00 175.76 174.07 1ob1 s SER 130 N 1.99 4.85 -0.38 0.00 0.01 -1.26 0.89 113.70 119.81 1ob1 s SER 130 Ca 0.03 -1.25 -0.20 0.00 1.31 0.00 0.00 55.95 55.84 1ob1 s SER 130 Cb -0.14 -1.71 0.01 0.00 0.21 0.00 0.00 66.02 64.39 1ob1 s SER 130 CO -0.06 -0.25 0.62 -0.69 0.41 0.00 0.00 173.24 173.27 1ob1 s VAL 131 N 1.25 4.89 -0.13 3.43 1.01 0.25 -2.61 120.40 128.49 1ob1 s VAL 131 Ca -0.05 0.40 -0.05 0.00 0.00 0.00 0.00 61.98 62.28 1ob1 s VAL 131 Cb -0.20 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 1ob1 s VAL 131 CO -0.01 -0.39 0.07 -0.69 0.00 0.00 0.00 175.10 174.08 1ob1 s VAL 132 N 2.70 4.86 -0.10 2.92 1.01 -0.41 -1.10 120.40 130.28 1ob1 s VAL 132 Ca 0.23 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.19 1ob1 s VAL 132 Cb -0.14 -3.12 0.02 0.00 0.00 0.00 0.00 36.38 33.13 1ob1 s VAL 132 CO 0.16 0.56 -0.11 0.00 0.00 0.00 0.00 175.10 175.71 1ob1 s PHE 134 N 1.18 3.08 -0.38 0.00 0.08 -0.91 -0.97 117.98 120.06 1ob1 s PHE 134 Ca -0.04 -0.41 -0.04 0.00 0.12 0.00 0.00 56.93 56.56 1ob1 s PHE 134 Cb -0.14 -2.17 0.08 0.00 -0.57 0.00 0.00 43.02 40.22 1ob1 s PHE 134 CO -0.03 -0.29 0.15 -0.51 -0.10 0.00 0.00 175.22 174.45 1ob1 s LEU 135 N 1.32 4.82 0.07 -0.37 1.02 -0.72 -2.19 118.68 122.63 1ob1 s LEU 135 Ca 0.05 -1.69 0.08 0.00 0.02 0.00 0.00 54.13 52.58 1ob1 s LEU 135 Cb -0.15 -1.83 -0.04 0.00 0.02 0.00 0.00 46.19 44.20 1ob1 s LEU 135 CO 0.03 -0.45 -0.18 0.20 0.02 0.00 0.00 176.35 175.96 1ob1 s ASN 136 N 1.69 3.83 -1.35 2.29 0.01 -1.20 -0.99 114.94 119.23 1ob1 s ASN 136 Ca 0.03 -0.48 -0.03 0.00 -0.71 0.00 0.00 52.86 51.67 1ob1 s ASN 136 Cb -0.22 -0.58 0.00 0.00 0.41 0.00 0.00 41.25 40.86 1ob1 s ASN 136 CO -0.02 0.22 0.39 0.59 -1.51 0.00 0.00 177.10 176.78 1ob1 n ASN 137 N 1.23 -5.33 -4.86 -1.22 4.13 0.03 -1.87 115.26 107.37 1ob1 n ASN 137 Ca -0.16 -0.19 -0.37 0.00 1.68 0.00 0.00 54.58 55.54 1ob1 n ASN 137 Cb 0.52 -4.23 -0.06 0.00 -1.54 0.00 0.00 39.78 34.48 1ob1 n ASN 137 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1ob1 s PHE 138 N -3.03 3.64 0.64 3.10 -0.71 -1.10 -4.37 117.98 116.16 1ob1 s PHE 138 Ca 0.19 0.72 0.06 0.00 -1.04 0.00 0.00 56.93 56.86 1ob1 s PHE 138 Cb -0.09 -2.08 0.11 0.00 -1.21 0.00 0.00 43.02 39.75 1ob1 s PHE 138 CO 0.24 0.68 0.88 -0.47 -1.34 0.00 0.00 175.22 175.21 1ob1 s TYR 139 N -1.10 1.38 0.00 3.49 6.04 -1.25 -2.22 117.35 123.69 1ob1 s TYR 139 Ca 0.21 -0.58 0.00 0.00 0.04 0.00 0.00 57.07 56.74 1ob1 s TYR 139 Cb -0.14 -2.51 0.00 0.00 -1.04 0.00 0.00 41.96 38.27 1ob1 s TYR 139 CO 0.10 -1.42 0.00 -2.30 -1.54 0.00 0.00 175.55 170.39 1ob1 n PRO 140 N -2.49 -0.79 -0.34 4.97 -0.02 -1.26 -4.41 135.00 130.65 1ob1 n PRO 140 Ca 0.16 0.76 0.36 0.00 -2.02 0.00 0.00 63.50 62.76 1ob1 n PRO 140 Cb 0.61 -0.56 0.70 0.00 -0.02 0.00 0.00 33.50 34.23 1ob1 n PRO 140 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1ob1 h LYS 141 N 4.18 0.00 -6.57 -0.52 2.10 -2.00 -3.40 116.57 110.37 1ob1 h LYS 141 Ca 0.00 0.00 -0.52 0.00 -2.00 0.00 0.00 60.65 58.13 1ob1 h LYS 141 Cb 0.00 0.00 0.04 0.00 -0.90 0.00 0.00 32.23 31.37 1ob1 h LYS 141 CO 0.00 0.00 1.04 -0.51 -2.00 0.00 0.00 179.45 177.98 1ob1 s ASP 142 N -4.44 6.44 -0.20 7.07 1.01 -1.26 -4.97 116.67 120.32 1ob1 s ASP 142 Ca -0.04 2.76 -0.28 0.00 0.71 0.00 0.00 52.55 55.70 1ob1 s ASP 142 Cb 0.21 -2.58 0.10 0.00 1.01 0.00 0.00 42.92 41.66 1ob1 s ASP 142 CO 0.72 -0.96 0.90 -0.51 0.21 0.00 0.00 175.17 175.52 1ob1 s ILE 143 N 2.00 0.00 -0.19 0.77 2.07 -1.26 -4.67 121.20 119.92 1ob1 s ILE 143 Ca 0.77 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 60.02 1ob1 s ILE 143 Cb -0.46 -1.00 0.04 0.00 0.13 0.00 0.00 42.46 41.16 1ob1 s ILE 143 CO 0.34 0.00 -0.12 0.21 -1.91 0.00 0.00 174.94 173.46 1ob1 s ASN 144 N -0.40 3.26 -0.31 4.50 3.84 -0.88 -5.00 114.94 119.95 1ob1 s ASN 144 Ca -0.01 -0.80 -0.07 0.00 0.21 0.00 0.00 52.86 52.19 1ob1 s ASN 144 Cb -0.03 -1.26 0.02 0.00 -0.55 0.00 0.00 41.25 39.43 1ob1 s ASN 144 CO 0.00 -0.11 0.10 0.68 -2.79 0.00 0.00 177.10 174.98 1ob1 s VAL 145 N 1.39 3.98 0.08 -5.21 -7.23 -1.26 0.27 120.40 112.42 1ob1 s VAL 145 Ca 0.00 -0.81 0.01 0.00 -1.81 0.00 0.00 61.98 59.38 1ob1 s VAL 145 Cb -0.15 -3.12 -0.04 0.00 0.56 0.00 0.00 36.38 33.63 1ob1 s VAL 145 CO -0.09 -0.01 0.21 -0.54 -0.31 0.00 0.00 175.10 174.36 1ob1 s LYS 146 N 1.48 3.37 -0.00 4.82 3.01 -1.13 -4.94 119.74 126.35 1ob1 s LYS 146 Ca 0.02 -0.50 0.00 0.00 -1.01 0.00 0.00 55.97 54.48 1ob1 s LYS 146 Cb -0.18 -2.99 -0.04 0.00 -1.01 0.00 0.00 37.83 33.62 1ob1 s LYS 146 CO 0.03 0.59 0.06 -1.58 0.51 0.00 0.00 175.35 174.95 1ob1 s TRP 147 N -1.54 3.22 -0.16 3.18 0.23 -1.26 -0.66 118.94 121.94 1ob1 s TRP 147 Ca 0.34 0.16 -0.04 0.00 -2.03 0.00 0.00 56.10 54.53 1ob1 s TRP 147 Cb -0.13 -1.71 0.07 0.00 0.03 0.00 0.00 33.47 31.73 1ob1 s TRP 147 CO 0.27 0.52 0.13 0.15 0.96 0.00 0.00 176.95 178.99 1ob1 s LYS 148 N -1.69 0.08 -0.70 4.98 1.02 0.88 -2.60 119.74 121.70 1ob1 s LYS 148 Ca 0.22 0.09 -0.08 0.00 0.02 0.00 0.00 55.97 56.22 1ob1 s LYS 148 Cb -0.12 -1.42 0.18 0.00 -0.52 0.00 0.00 37.83 35.95 1ob1 s LYS 148 CO 0.13 -0.61 0.58 0.42 -0.92 0.00 0.00 175.35 174.95 1ob1 s ILE 149 N 2.21 4.56 0.00 2.17 1.01 -1.26 0.35 121.20 130.25 1ob1 s ILE 149 Ca 0.04 -2.69 0.00 0.00 0.00 0.00 0.00 60.65 58.00 1ob1 s ILE 149 Cb -0.15 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.42 1ob1 s ILE 149 CO -0.09 -0.94 0.00 -0.90 0.00 0.00 0.00 174.94 173.01 1ob1 n ASP 150 N 3.77 0.00 -0.81 3.58 5.75 0.27 -3.41 116.55 125.71 1ob1 n ASP 150 Ca 0.09 0.00 0.05 0.00 -0.01 0.00 0.00 54.79 54.93 1ob1 n ASP 150 Cb 0.42 0.00 0.22 0.00 -1.03 0.00 0.00 41.12 40.73 1ob1 n ASP 150 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ob1 n GLY 151 N 0.17 4.45 4.76 6.12 0.00 -1.26 -4.95 105.19 114.47 1ob1 n GLY 151 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1ob1 n GLY 151 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ob1 n SER 152 N -0.86 0.00 0.00 1.61 3.41 -1.22 -4.82 113.62 111.74 1ob1 n SER 152 Ca 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 1ob1 n SER 152 Cb 0.88 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 1ob1 n SER 152 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1ob1 n GLU 153 N -1.43 0.00 -3.75 4.33 2.13 -1.21 -4.58 120.64 116.12 1ob1 n GLU 153 Ca 0.00 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.53 1ob1 n GLU 153 Cb 0.00 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 31.59 1ob1 n GLU 153 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1ob1 s ARG 154 N -0.11 1.64 0.94 5.31 6.06 -1.07 -4.85 118.95 126.87 1ob1 s ARG 154 Ca 0.00 -2.46 -0.13 0.00 -2.50 0.00 0.00 55.73 50.64 1ob1 s ARG 154 Cb 0.00 -2.64 0.16 0.00 0.06 0.00 0.00 34.95 32.52 1ob1 s ARG 154 CO 0.00 -1.22 1.16 -0.65 -2.50 0.00 0.00 175.30 172.09 1ob1 s GLN 155 N -0.25 0.92 -0.31 5.12 -0.21 -1.26 -4.61 119.66 119.06 1ob1 s GLN 155 Ca 0.21 0.16 -0.13 0.00 0.02 0.00 0.00 55.36 55.62 1ob1 s GLN 155 Cb -0.16 -1.83 0.02 0.00 1.00 0.00 0.00 33.01 32.05 1ob1 s GLN 155 CO -0.07 -2.32 0.32 0.27 -2.12 0.00 0.00 175.29 171.37 1ob1 n ASN 156 N -3.83 -7.16 0.00 5.90 6.94 -1.26 -4.74 115.26 111.11 1ob1 n ASN 156 Ca 0.08 0.61 0.00 0.00 -0.02 0.00 0.00 54.58 55.26 1ob1 n ASN 156 Cb 0.59 -3.77 0.00 0.00 -2.36 0.00 0.00 39.78 34.24 1ob1 n ASN 156 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ob1 n GLY 157 N 0.34 0.16 3.86 4.83 0.00 -1.26 -5.06 105.19 108.06 1ob1 n GLY 157 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1ob1 n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ob1 s VAL 158 N 0.00 4.74 -0.13 1.61 1.01 -1.26 -2.48 120.40 123.89 1ob1 s VAL 158 Ca 0.00 0.77 -0.03 0.00 0.00 0.00 0.00 61.98 62.72 1ob1 s VAL 158 Cb 0.00 -3.67 0.05 0.00 0.00 0.00 0.00 36.38 32.76 1ob1 s VAL 158 CO 0.00 -0.35 0.05 -0.22 0.00 0.00 0.00 175.10 174.58 1ob1 s LEU 159 N -3.41 0.59 0.08 3.92 1.98 0.29 -4.94 118.68 117.20 1ob1 s LEU 159 Ca 0.53 -0.42 0.06 0.00 -2.89 0.00 0.00 54.13 51.41 1ob1 s LEU 159 Cb -0.10 -0.36 -0.04 0.00 0.66 0.00 0.00 46.19 46.35 1ob1 s LEU 159 CO 0.24 -0.28 -0.09 0.20 -1.89 0.00 0.00 176.35 174.52 1ob1 s ASN 160 N 2.03 4.43 -0.07 3.68 0.01 -1.26 -0.29 114.94 123.47 1ob1 s ASN 160 Ca 0.02 -0.34 -0.21 0.00 -0.71 0.00 0.00 52.86 51.63 1ob1 s ASN 160 Cb -0.15 -0.88 0.05 0.00 0.41 0.00 0.00 41.25 40.68 1ob1 s ASN 160 CO -0.07 0.20 0.48 -0.55 -1.51 0.00 0.00 177.10 175.65 1ob1 s SER 161 N -2.03 -0.43 0.41 -1.22 0.15 -0.04 -4.98 113.70 105.55 1ob1 s SER 161 Ca 0.20 0.54 0.00 0.00 0.70 0.00 0.00 55.95 57.40 1ob1 s SER 161 Cb -0.11 0.58 -0.00 0.00 -1.71 0.00 0.00 66.02 64.78 1ob1 s SER 161 CO 0.12 -0.42 0.01 0.79 1.20 0.00 0.00 173.24 174.94 1ob1 n TRP 162 N 1.58 0.91 -4.35 3.44 8.01 -1.26 0.71 117.44 126.48 1ob1 n TRP 162 Ca -0.19 -2.04 -0.20 0.00 -1.31 0.00 0.00 57.50 53.77 1ob1 n TRP 162 Cb 0.56 -0.26 -0.13 0.00 -2.01 0.00 0.00 31.31 29.47 1ob1 n TRP 162 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.69 177.63 1ob1 s THR 163 N -2.51 1.08 0.98 -0.99 -4.23 -0.58 -4.92 115.64 104.48 1ob1 s THR 163 Ca 0.01 -0.97 -0.11 0.00 -1.18 0.00 0.00 61.69 59.43 1ob1 s THR 163 Cb 0.00 -0.98 0.18 0.00 1.34 0.00 0.00 72.50 73.04 1ob1 s THR 163 CO 0.01 0.01 1.10 -1.81 -0.54 0.00 0.00 174.62 173.38 1ob1 s ASP 164 N -1.10 2.51 0.31 3.99 1.11 -1.26 -4.50 116.67 117.72 1ob1 s ASP 164 Ca 0.01 1.85 -0.28 0.00 0.18 0.00 0.00 52.55 54.32 1ob1 s ASP 164 Cb -0.08 -2.42 -0.14 0.00 1.07 0.00 0.00 42.92 41.35 1ob1 s ASP 164 CO 0.01 -3.30 1.01 1.67 1.18 0.00 0.00 175.17 175.74 1ob1 n GLN 165 N -4.35 1.37 -2.38 8.23 7.27 -1.26 -4.84 117.38 121.42 1ob1 n GLN 165 Ca 0.08 0.48 -0.41 0.00 0.07 0.00 0.00 57.00 57.23 1ob1 n GLN 165 Cb 0.53 -1.87 -0.04 0.00 2.41 0.00 0.00 30.24 31.27 1ob1 n GLN 165 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1ob1 s ASP 166 N -0.57 7.13 0.00 1.69 -1.08 -0.56 -4.90 116.67 118.38 1ob1 s ASP 166 Ca 0.59 2.35 0.11 0.00 -0.52 0.00 0.00 52.55 55.08 1ob1 s ASP 166 Cb -0.68 -2.63 0.56 0.00 -1.46 0.00 0.00 42.92 38.71 1ob1 s ASP 166 CO 0.60 -0.27 1.27 -1.20 0.52 0.00 0.00 175.17 176.09 1ob1 n SER 167 N 1.40 0.00 0.00 -0.34 7.64 -1.26 -2.49 113.62 118.57 1ob1 n SER 167 Ca 0.00 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.05 1ob1 n SER 167 Cb 0.44 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 1ob1 n SER 167 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1ob1 n LYS 168 N -1.31 0.00 -0.03 1.43 5.02 -1.26 -4.82 118.16 117.19 1ob1 n LYS 168 Ca 0.05 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.43 1ob1 n LYS 168 Cb 0.09 -0.48 0.09 0.00 -0.02 0.00 0.00 35.03 34.71 1ob1 n LYS 168 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1ob1 n ASP 169 N -3.01 2.59 -3.43 4.39 5.68 -1.26 -4.98 116.55 116.53 1ob1 n ASP 169 Ca 0.00 -1.77 -0.25 0.00 -0.50 0.00 0.00 54.79 52.27 1ob1 n ASP 169 Cb 0.46 -0.04 0.04 0.00 -1.14 0.00 0.00 41.12 40.44 1ob1 n ASP 169 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1ob1 n SER 170 N 1.02 -5.46 -4.80 -1.12 7.64 -1.04 -4.99 113.62 104.88 1ob1 n SER 170 Ca 0.11 -0.48 -0.25 0.00 1.01 0.00 0.00 58.87 59.26 1ob1 n SER 170 Cb 0.46 -4.38 -0.05 0.00 -1.01 0.00 0.00 64.21 59.22 1ob1 n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1ob1 s THR 171 N -3.19 2.16 0.48 0.44 -4.23 -1.26 -4.76 115.64 105.28 1ob1 s THR 171 Ca 0.47 -1.62 0.05 0.00 -1.18 0.00 0.00 61.69 59.42 1ob1 s THR 171 Cb -0.22 -2.78 -0.02 0.00 1.34 0.00 0.00 72.50 70.82 1ob1 s THR 171 CO 0.58 0.00 0.19 -0.31 -0.54 0.00 0.00 174.62 174.54 1ob1 s TYR 172 N -2.63 2.10 -0.24 3.99 2.02 -0.94 -1.49 117.35 120.15 1ob1 s TYR 172 Ca 0.39 -0.77 -0.23 0.00 -0.37 0.00 0.00 57.07 56.08 1ob1 s TYR 172 Cb 0.01 -1.84 0.06 0.00 -0.40 0.00 0.00 41.96 39.80 1ob1 s TYR 172 CO 0.22 0.01 0.66 -1.12 -1.57 0.00 0.00 175.55 173.76 1ob1 s SER 173 N -4.00 -0.69 0.10 2.29 0.01 -1.26 -0.79 113.70 109.36 1ob1 s SER 173 Ca 0.29 1.30 0.05 0.00 1.31 0.00 0.00 55.95 58.90 1ob1 s SER 173 Cb 0.02 1.31 -0.03 0.00 0.21 0.00 0.00 66.02 67.53 1ob1 s SER 173 CO 0.16 -0.25 -0.13 0.00 0.41 0.00 0.00 173.24 173.44 1ob1 s MET 174 N 0.28 0.91 -0.10 12.44 0.23 -0.16 -1.53 119.30 131.36 1ob1 s MET 174 Ca -0.01 -1.13 0.03 0.00 -1.03 0.00 0.00 55.69 53.55 1ob1 s MET 174 Cb -0.04 -0.76 -0.01 0.00 -1.53 0.00 0.00 34.83 32.48 1ob1 s MET 174 CO 0.01 0.15 -0.19 0.45 -2.03 0.00 0.00 175.02 173.41 1ob1 s SER 175 N -2.24 3.53 -0.02 -1.18 0.15 0.22 -1.76 113.70 112.39 1ob1 s SER 175 Ca 0.05 -0.43 0.07 0.00 0.70 0.00 0.00 55.95 56.33 1ob1 s SER 175 Cb -0.06 -1.37 -0.02 0.00 -1.71 0.00 0.00 66.02 62.86 1ob1 s SER 175 CO 0.02 0.19 -0.24 -0.55 1.20 0.00 0.00 173.24 173.86 1ob1 s SER 176 N 0.20 2.77 -0.20 5.45 0.15 -0.14 -0.86 113.70 121.06 1ob1 s SER 176 Ca -0.11 -0.43 -0.05 0.00 0.70 0.00 0.00 55.95 56.06 1ob1 s SER 176 Cb -0.16 -0.37 0.07 0.00 -1.71 0.00 0.00 66.02 63.85 1ob1 s SER 176 CO 0.06 0.28 0.10 -0.89 1.20 0.00 0.00 173.24 173.99 1ob1 s THR 177 N -0.49 -0.06 -0.19 6.45 2.01 0.61 -0.22 115.64 123.75 1ob1 s THR 177 Ca 0.07 -0.34 -0.19 0.00 0.31 0.00 0.00 61.69 61.54 1ob1 s THR 177 Cb -0.10 -0.70 -0.03 0.00 0.01 0.00 0.00 72.50 71.68 1ob1 s THR 177 CO -0.00 -0.40 0.55 -0.22 -0.69 0.00 0.00 174.62 173.85 1ob1 s LEU 178 N 2.12 4.16 -0.11 4.42 2.96 -0.26 -0.55 118.68 131.42 1ob1 s LEU 178 Ca 0.04 0.75 -0.01 0.00 -0.22 0.00 0.00 54.13 54.69 1ob1 s LEU 178 Cb -0.16 -2.77 0.03 0.00 0.50 0.00 0.00 46.19 43.79 1ob1 s LEU 178 CO -0.17 -0.19 -0.05 -0.89 -1.32 0.00 0.00 176.35 173.73 1ob1 s THR 179 N 1.59 0.89 0.43 3.68 2.01 -1.04 0.88 115.64 124.08 1ob1 s THR 179 Ca 0.26 -0.25 0.04 0.00 0.31 0.00 0.00 61.69 62.05 1ob1 s THR 179 Cb -0.16 -0.97 -0.02 0.00 0.01 0.00 0.00 72.50 71.37 1ob1 s THR 179 CO 0.10 0.31 0.13 -0.76 -0.69 0.00 0.00 174.62 173.71 1ob1 s LEU 180 N 1.76 2.01 0.77 4.42 1.43 0.26 -4.93 118.68 124.39 1ob1 s LEU 180 Ca 0.04 -1.71 -0.11 0.00 -1.03 0.00 0.00 54.13 51.33 1ob1 s LEU 180 Cb -0.13 -0.13 0.05 0.00 0.03 0.00 0.00 46.19 46.02 1ob1 s LEU 180 CO -0.08 -0.96 1.08 0.42 0.23 0.00 0.00 176.35 177.05 1ob1 s THR 181 N -3.16 3.40 -0.11 5.49 -4.23 -1.26 0.12 115.64 115.89 1ob1 s THR 181 Ca 0.21 0.45 -0.03 0.00 -1.18 0.00 0.00 61.69 61.14 1ob1 s THR 181 Cb 0.02 -3.03 -0.03 0.00 1.34 0.00 0.00 72.50 70.80 1ob1 s THR 181 CO 0.14 -0.59 0.08 0.50 -0.54 0.00 0.00 174.62 174.21 1ob1 h LYS 182 N -1.08 0.00 -1.15 3.99 3.64 -1.77 -2.66 116.57 117.54 1ob1 h LYS 182 Ca -0.45 0.00 0.33 0.00 -1.27 0.00 0.00 60.65 59.26 1ob1 h LYS 182 Cb 1.24 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 33.00 1ob1 h LYS 182 CO 0.54 0.11 0.81 -0.44 -2.27 0.00 0.00 179.45 178.20 1ob1 h ASP 183 N -1.00 0.08 0.00 4.20 3.32 -1.95 -2.45 116.42 118.62 1ob1 h ASP 183 Ca -0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ob1 h ASP 183 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1ob1 h ASP 183 CO -0.00 0.01 0.00 1.21 -1.72 0.00 0.00 179.24 178.74 1ob1 n GLU 184 N -4.27 0.00 0.00 3.56 2.13 -1.25 -4.45 120.64 116.35 1ob1 n GLU 184 Ca 0.25 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.07 1ob1 n GLU 184 Cb 1.17 -0.37 0.00 0.00 0.27 0.00 0.00 31.44 32.51 1ob1 n GLU 184 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 1ob1 n TYR 185 N -0.22 0.00 -0.09 4.31 9.36 -0.96 -1.49 117.16 128.08 1ob1 n TYR 185 Ca 0.00 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.19 1ob1 n TYR 185 Cb 0.00 0.00 -0.00 0.00 -0.63 0.00 0.00 39.34 38.71 1ob1 n TYR 185 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1ob1 n GLU 186 N -0.24 0.25 0.00 2.98 1.02 -1.00 -1.98 120.64 121.67 1ob1 n GLU 186 Ca 0.00 -0.59 0.00 0.00 -0.02 0.00 0.00 57.16 56.55 1ob1 n GLU 186 Cb 0.00 -2.02 0.00 0.00 -0.02 0.00 0.00 31.44 29.40 1ob1 n GLU 186 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1ob1 n ARG 187 N 4.78 0.00 -2.29 3.49 0.63 -0.55 -5.00 116.66 117.72 1ob1 n ARG 187 Ca 0.05 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.65 1ob1 n ARG 187 Cb 0.02 -0.05 -0.01 0.00 0.45 0.00 0.00 32.46 32.87 1ob1 n ARG 187 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 1ob1 s HIS 188 N -1.76 3.03 0.00 -0.14 3.76 -0.84 -5.05 115.29 114.29 1ob1 s HIS 188 Ca 0.00 1.54 0.00 0.00 -0.15 0.00 0.00 55.06 56.45 1ob1 s HIS 188 Cb 0.00 -3.01 0.00 0.00 1.11 0.00 0.00 32.58 30.68 1ob1 s HIS 188 CO 0.00 -0.93 0.00 -1.71 -0.85 0.00 0.00 174.74 171.25 1ob1 n ASN 189 N -1.54 0.00 -4.77 1.40 5.15 -1.26 -4.90 115.26 109.34 1ob1 n ASN 189 Ca 0.09 0.00 -0.39 0.00 -0.60 0.00 0.00 54.58 53.68 1ob1 n ASN 189 Cb 0.53 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.75 1ob1 n ASN 189 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1ob1 s SER 190 N -1.00 6.76 -0.30 1.20 0.01 -1.26 -4.17 113.70 114.93 1ob1 s SER 190 Ca 0.00 2.34 0.03 0.00 1.31 0.00 0.00 55.95 59.63 1ob1 s SER 190 Cb 0.00 -2.62 0.08 0.00 0.21 0.00 0.00 66.02 63.70 1ob1 s SER 190 CO 0.00 -0.51 -0.00 -0.31 0.41 0.00 0.00 173.24 172.83 1ob1 s TYR 191 N -1.35 3.31 -0.21 2.43 1.51 -0.85 0.98 117.35 123.17 1ob1 s TYR 191 Ca 0.53 -2.58 -0.07 0.00 -1.01 0.00 0.00 57.07 53.94 1ob1 s TYR 191 Cb -0.31 -2.41 -0.03 0.00 -0.11 0.00 0.00 41.96 39.10 1ob1 s TYR 191 CO 0.40 -0.91 0.05 0.99 -1.11 0.00 0.00 175.55 174.97 1ob1 s THR 192 N 1.07 4.34 -0.31 -0.71 2.01 1.09 -2.83 115.64 120.30 1ob1 s THR 192 Ca 0.04 -0.18 -0.15 0.00 0.31 0.00 0.00 61.69 61.71 1ob1 s THR 192 Cb -0.19 -2.99 -0.02 0.00 0.01 0.00 0.00 72.50 69.31 1ob1 s THR 192 CO -0.08 0.40 0.38 0.00 -0.69 0.00 0.00 174.62 174.63 1ob1 s GLU 194 N 2.09 2.56 -0.30 0.00 2.02 0.16 -1.56 118.70 123.68 1ob1 s GLU 194 Ca 0.14 -1.45 -0.01 0.00 0.02 0.00 0.00 54.97 53.66 1ob1 s GLU 194 Cb -0.16 -2.36 0.19 0.00 0.10 0.00 0.00 34.13 31.90 1ob1 s GLU 194 CO 0.11 -0.01 0.66 0.00 0.02 0.00 0.00 175.26 176.04 1ob1 s ALA 195 N -2.40 -2.46 -0.36 5.21 0.00 -1.26 -2.85 121.76 117.64 1ob1 s ALA 195 Ca 0.43 1.64 -0.25 0.00 0.00 0.00 0.00 51.96 53.78 1ob1 s ALA 195 Cb -0.04 -2.29 0.01 0.00 0.00 0.00 0.00 23.12 20.80 1ob1 s ALA 195 CO 0.26 -1.46 0.85 0.99 0.00 0.00 0.00 175.76 176.41 1ob1 s THR 196 N 2.87 4.66 0.06 0.00 2.01 0.14 -1.52 115.64 123.87 1ob1 s THR 196 Ca 0.17 1.06 0.06 0.00 0.31 0.00 0.00 61.69 63.28 1ob1 s THR 196 Cb -0.13 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.08 1ob1 s THR 196 CO -0.21 -0.47 -0.15 -2.28 -0.69 0.00 0.00 174.62 170.81 1ob1 s HIS 197 N 3.28 1.34 0.41 4.92 2.46 -1.26 -2.08 115.29 124.35 1ob1 s HIS 197 Ca 0.35 -0.41 0.22 0.00 0.47 0.00 0.00 55.06 55.68 1ob1 s HIS 197 Cb -0.13 -0.76 1.20 0.00 -0.13 0.00 0.00 32.58 32.76 1ob1 s HIS 197 CO 0.17 0.07 1.73 -0.22 -2.47 0.00 0.00 174.74 174.03 1ob1 h LYS 198 N 4.50 0.29 -0.01 2.88 3.64 -1.91 -2.36 116.57 123.60 1ob1 h LYS 198 Ca -0.41 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 58.87 1ob1 h LYS 198 Cb 1.18 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 1ob1 h LYS 198 CO 0.41 0.19 -0.40 1.79 -2.27 0.00 0.00 179.45 179.17 1ob1 h THR 199 N 0.30 1.29 -2.44 1.00 1.35 -1.92 -3.45 112.91 109.03 1ob1 h THR 199 Ca 0.66 -1.38 -0.53 0.00 -0.55 0.00 0.00 66.41 64.61 1ob1 h THR 199 Cb 1.82 1.74 -0.14 0.00 -1.73 0.00 0.00 68.15 69.84 1ob1 h THR 199 CO -0.33 0.40 -0.66 -0.55 -0.25 0.00 0.00 175.52 174.12 1ob1 s SER 200 N -6.92 3.01 -0.99 5.36 0.15 -0.89 -5.08 113.70 108.34 1ob1 s SER 200 Ca -0.03 -1.23 -0.06 0.00 0.70 0.00 0.00 55.95 55.34 1ob1 s SER 200 Cb 0.14 -0.21 0.25 0.00 -1.71 0.00 0.00 66.02 64.48 1ob1 s SER 200 CO 0.73 -0.35 0.94 -0.89 1.20 0.00 0.00 173.24 174.87 1ob1 s THR 201 N -2.94 5.23 0.00 6.45 2.01 -1.26 -4.61 115.64 120.52 1ob1 s THR 201 Ca 0.31 -3.55 0.00 0.00 0.31 0.00 0.00 61.69 58.76 1ob1 s THR 201 Cb 0.04 -4.19 0.00 0.00 0.01 0.00 0.00 72.50 68.37 1ob1 s THR 201 CO 0.14 -1.13 0.00 -1.54 -0.69 0.00 0.00 174.62 171.40 1ob1 n SER 202 N 2.63 0.00 -3.49 3.53 3.41 -1.26 -5.14 113.62 113.30 1ob1 n SER 202 Ca 0.22 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.59 1ob1 n SER 202 Cb 0.39 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.51 1ob1 n SER 202 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1ob1 n PRO 203 N -1.86 -1.32 -3.07 4.33 -0.02 -1.26 -4.24 135.00 127.57 1ob1 n PRO 203 Ca 0.00 -1.60 -0.26 0.00 -2.02 0.00 0.00 63.50 59.61 1ob1 n PRO 203 Cb 0.00 -1.13 -0.05 0.00 -0.02 0.00 0.00 33.50 32.30 1ob1 n PRO 203 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1ob1 n ILE 204 N -3.62 2.67 -1.63 4.25 5.41 -0.57 -4.87 119.36 120.99 1ob1 n ILE 204 Ca 0.13 -5.42 -0.47 0.00 1.00 0.00 0.00 62.75 57.99 1ob1 n ILE 204 Cb 0.46 -1.50 -0.04 0.00 -0.71 0.00 0.00 39.64 37.85 1ob1 n ILE 204 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1ob1 n VAL 205 N 0.06 0.56 -3.50 1.39 0.31 -1.26 -4.45 118.33 111.44 1ob1 n VAL 205 Ca 0.30 -0.14 -0.10 0.00 -0.01 0.00 0.00 64.34 64.40 1ob1 n VAL 205 Cb 0.41 -1.19 -0.09 0.00 -0.91 0.00 0.00 33.84 32.06 1ob1 n VAL 205 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1ob1 s LYS 206 N 0.04 0.31 0.00 5.55 2.20 -0.60 -5.03 119.74 122.21 1ob1 s LYS 206 Ca 0.75 0.73 0.00 0.00 -0.36 0.00 0.00 55.97 57.08 1ob1 s LYS 206 Cb -0.77 -0.16 0.00 0.00 -1.51 0.00 0.00 37.83 35.39 1ob1 s LYS 206 CO 0.47 -0.46 0.00 -1.13 -0.36 0.00 0.00 175.35 173.87 1ob1 n SER 207 N 5.37 0.21 -3.61 1.43 3.41 -1.26 -1.07 113.62 118.09 1ob1 n SER 207 Ca -0.06 -0.89 -0.06 0.00 -0.26 0.00 0.00 58.87 57.61 1ob1 n SER 207 Cb 0.50 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.43 1ob1 n SER 207 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1ob1 s PHE 208 N -1.77 -0.24 -0.12 7.33 -0.12 -1.13 -5.01 117.98 116.93 1ob1 s PHE 208 Ca 0.00 0.04 0.02 0.00 -0.05 0.00 0.00 56.93 56.93 1ob1 s PHE 208 Cb 0.00 0.58 -0.01 0.00 -0.63 0.00 0.00 43.02 42.96 1ob1 s PHE 208 CO 0.00 -0.64 -0.18 -0.80 -0.05 0.00 0.00 175.22 173.55 1ob1 s ASN 209 N -2.68 3.59 0.16 1.98 -0.87 -1.24 -2.01 114.94 113.87 1ob1 s ASN 209 Ca 0.08 -0.43 -0.29 0.00 -1.57 0.00 0.00 52.86 50.65 1ob1 s ASN 209 Cb -0.01 -1.52 -0.02 0.00 -0.02 0.00 0.00 41.25 39.68 1ob1 s ASN 209 CO -0.04 0.16 1.55 0.08 -2.57 0.00 0.00 177.10 176.28 1ob1 h ARG 210 N 6.73 -0.21 0.00 -0.60 0.11 -1.64 -3.33 114.38 115.43 1ob1 h ARG 210 Ca -0.23 0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.87 1ob1 h ARG 210 Cb 1.22 0.05 0.00 0.00 1.11 0.00 0.00 29.97 32.35 1ob1 h ARG 210 CO 0.52 -0.14 0.00 0.09 0.10 0.00 0.00 179.97 180.54 1ob1 n ASN 211 N -5.37 0.00 0.00 0.08 5.03 -1.26 0.23 115.26 113.97 1ob1 n ASN 211 Ca 0.01 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.46 1ob1 n ASN 211 Cb 0.33 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.09 1ob1 n ASN 211 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 1ob1 n GLU 212 N 0.00 0.00 0.00 3.52 0.28 -1.26 -5.31 120.64 117.87 1ob1 n GLU 212 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1ob1 n GLU 212 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1ob1 n GLU 212 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97