#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgj s LYS 2 N 0.00 0.01 0.01 3.17 0.00 -1.26 -1.38 119.74 120.30 2hgj s LYS 2 Ca 0.00 0.32 0.04 0.00 0.00 0.00 0.00 55.97 56.33 2hgj s LYS 2 Cb 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 37.83 37.56 2hgj s LYS 2 CO 0.00 -0.20 -0.12 0.20 0.00 0.00 0.00 175.35 175.23 2hgj s GLY 3 N 1.36 0.62 -0.16 0.59 0.00 -0.02 -4.98 107.32 104.73 2hgj s GLY 3 Ca -0.06 -0.61 -0.04 0.00 0.00 0.00 0.00 44.72 44.01 2hgj s GLY 3 CO -0.04 -0.55 -0.03 -0.26 0.00 0.00 0.00 173.10 172.22 2hgj s ILE 4 N -0.50 3.99 0.23 0.90 -5.25 -1.26 -0.92 121.20 118.39 2hgj s ILE 4 Ca 0.03 -0.32 -0.15 0.00 -0.99 0.00 0.00 60.65 59.21 2hgj s ILE 4 Cb -0.06 -2.75 0.06 0.00 2.95 0.00 0.00 42.46 42.66 2hgj s ILE 4 CO 0.00 0.49 0.77 0.00 -1.79 0.00 0.00 174.94 174.42 2hgj n LEU 5 N 3.49 0.00 -4.20 0.37 -0.00 -0.34 -4.39 117.00 111.93 2hgj n LEU 5 Ca -0.17 -1.63 -0.31 0.00 -0.00 0.00 0.00 56.01 53.90 2hgj n LEU 5 Cb 0.52 2.72 -0.17 0.00 -0.00 0.00 0.00 43.42 46.49 2hgj n LEU 5 CO 0.33 -0.54 -0.55 -0.83 -0.00 0.00 0.00 177.39 175.80 2hgj s GLY 6 N -2.98 1.27 0.24 1.47 0.00 -0.45 -1.05 107.32 105.82 2hgj s GLY 6 Ca 0.17 -0.91 0.07 0.00 0.00 0.00 0.00 44.72 44.05 2hgj s GLY 6 CO 0.07 -0.27 0.18 0.54 0.00 0.00 0.00 173.10 173.62 2hgj s VAL 7 N 0.38 4.43 0.00 1.40 0.11 -0.06 -1.14 120.40 125.53 2hgj s VAL 7 Ca -0.18 -1.37 0.00 0.00 -2.93 0.00 0.00 61.98 57.50 2hgj s VAL 7 Cb -0.18 -3.38 0.00 0.00 -1.53 0.00 0.00 36.38 31.30 2hgj s VAL 7 CO 0.08 -0.32 0.00 1.17 -3.33 0.00 0.00 175.10 172.71 2hgj n LYS 8 N -1.06 2.10 -3.75 1.54 0.00 0.62 0.29 118.16 117.90 2hgj n LYS 8 Ca -0.08 0.00 -0.21 0.00 0.00 0.00 0.00 58.31 58.02 2hgj n LYS 8 Cb 0.57 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.57 2hgj n LYS 8 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2hgj s VAL 9 N 4.66 3.48 0.04 3.15 -7.23 -1.26 -2.88 120.40 120.37 2hgj s VAL 9 Ca 0.00 -1.33 -0.19 0.00 -1.81 0.00 0.00 61.98 58.64 2hgj s VAL 9 Cb 0.00 -3.18 -0.06 0.00 0.56 0.00 0.00 36.38 33.70 2hgj s VAL 9 CO 0.00 -0.15 0.55 -0.83 -0.31 0.00 0.00 175.10 174.36 2hgj s GLY 10 N -4.03 2.63 0.01 2.32 0.00 -1.26 -0.86 107.32 106.13 2hgj s GLY 10 Ca 0.42 -0.00 -0.19 0.00 0.00 0.00 0.00 44.72 44.95 2hgj s GLY 10 CO 0.27 0.51 0.42 -0.29 0.00 0.00 0.00 173.10 174.01 2hgj s MET 11 N -0.81 0.85 0.55 2.90 0.00 0.05 -4.95 119.30 117.88 2hgj s MET 11 Ca 0.29 -0.21 -0.18 0.00 0.00 0.00 0.00 55.69 55.59 2hgj s MET 11 Cb -0.19 0.38 -0.06 0.00 0.00 0.00 0.00 34.83 34.97 2hgj s MET 11 CO 0.18 -0.27 1.07 0.95 0.00 0.00 0.00 175.02 176.95 2hgj s THR 12 N -1.87 3.60 0.01 10.11 -4.23 -1.26 -1.85 115.64 120.14 2hgj s THR 12 Ca -0.09 0.89 -0.06 0.00 -1.18 0.00 0.00 61.69 61.26 2hgj s THR 12 Cb -0.02 -3.36 -0.00 0.00 1.34 0.00 0.00 72.50 70.46 2hgj s THR 12 CO 0.02 -0.31 0.10 0.00 -0.54 0.00 0.00 174.62 173.89 2hgj s ARG 13 N -3.59 0.47 0.36 3.99 1.04 -0.12 -4.87 118.95 116.23 2hgj s ARG 13 Ca 0.67 -0.48 0.05 0.00 -1.04 0.00 0.00 55.73 54.93 2hgj s ARG 13 Cb -0.18 0.19 -0.01 0.00 -2.04 0.00 0.00 34.95 32.91 2hgj s ARG 13 CO 0.29 -0.11 0.51 0.96 -0.04 0.00 0.00 175.30 176.91 2hgj s ILE 14 N -1.54 4.13 0.00 4.99 -5.25 -1.26 -1.47 121.20 120.80 2hgj s ILE 14 Ca -0.14 -0.87 0.00 0.00 -0.99 0.00 0.00 60.65 58.65 2hgj s ILE 14 Cb -0.07 -3.46 0.00 0.00 2.95 0.00 0.00 42.46 41.88 2hgj s ILE 14 CO 0.00 -0.21 0.00 0.33 -1.79 0.00 0.00 174.94 173.27 2hgj n PHE 15 N -1.73 0.00 0.21 1.37 7.35 -0.33 -4.91 117.46 119.42 2hgj n PHE 15 Ca -0.00 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.83 2hgj n PHE 15 Cb 0.58 0.00 0.74 0.00 0.35 0.00 0.00 39.48 41.15 2hgj n PHE 15 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2hgj h ARG 16 N 0.00 0.00 0.00 -4.13 3.08 -2.01 -3.44 114.38 107.88 2hgj h ARG 16 Ca 0.00 0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.17 2hgj h ARG 16 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2hgj h ARG 16 CO 0.00 0.00 0.31 -0.40 -1.07 0.00 0.00 179.97 178.81 2hgj n ASP 17 N -2.46 -0.37 0.00 7.04 3.85 -1.26 -5.13 116.55 118.22 2hgj n ASP 17 Ca -0.02 -1.05 0.00 0.00 -0.71 0.00 0.00 54.79 53.01 2hgj n ASP 17 Cb 0.05 0.56 0.00 0.00 -1.35 0.00 0.00 41.12 40.38 2hgj n ASP 17 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 2hgj n ASP 18 N -0.41 0.00 -1.16 -1.12 3.85 -1.26 -4.91 116.55 111.54 2hgj n ASP 18 Ca 0.02 0.00 -0.00 0.00 -0.71 0.00 0.00 54.79 54.10 2hgj n ASP 18 Cb 0.19 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.96 2hgj n ASP 18 CO 0.00 0.00 0.00 -2.11 -1.01 0.00 0.00 177.20 174.08 2hgj n ARG 19 N 0.11 0.03 0.00 0.11 0.00 -1.26 -1.18 116.66 114.46 2hgj n ARG 19 Ca 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 57.85 57.78 2hgj n ARG 19 Cb 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 32.46 32.56 2hgj n ARG 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2hgj n ALA 20 N -2.87 0.00 -3.08 2.89 0.00 -0.54 -4.92 120.51 112.00 2hgj n ALA 20 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.33 2hgj n ALA 20 Cb 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.44 2hgj n ALA 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2hgj s VAL 21 N -0.77 0.05 0.00 0.00 -7.23 -1.26 -0.95 120.40 110.25 2hgj s VAL 21 Ca 0.00 -0.81 0.00 0.00 -1.81 0.00 0.00 61.98 59.36 2hgj s VAL 21 Cb 0.00 -1.46 0.00 0.00 0.56 0.00 0.00 36.38 35.48 2hgj s VAL 21 CO 0.00 -0.23 0.00 -0.81 -0.31 0.00 0.00 175.10 173.75 2hgj n PRO 22 N -0.27 3.31 -3.87 4.82 -0.04 -0.77 -3.68 135.00 134.49 2hgj n PRO 22 Ca -0.12 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.23 2hgj n PRO 22 Cb 0.63 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.97 2hgj n PRO 22 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2hgj s VAL 23 N 0.94 0.04 -0.44 0.52 -7.23 -1.26 -0.77 120.40 112.20 2hgj s VAL 23 Ca 0.00 -0.37 -0.28 0.00 -1.81 0.00 0.00 61.98 59.52 2hgj s VAL 23 Cb 0.00 -0.26 0.00 0.00 0.56 0.00 0.00 36.38 36.68 2hgj s VAL 23 CO 0.00 -0.20 1.51 -0.89 -0.31 0.00 0.00 175.10 175.21 2hgj s THR 24 N -0.65 3.77 -0.08 5.32 2.01 -0.04 -1.49 115.64 124.49 2hgj s THR 24 Ca -0.07 0.74 0.05 0.00 0.31 0.00 0.00 61.69 62.72 2hgj s THR 24 Cb -0.04 -4.14 -0.01 0.00 0.01 0.00 0.00 72.50 68.32 2hgj s THR 24 CO 0.00 -0.79 -0.22 0.68 -0.69 0.00 0.00 174.62 173.60 2hgj s VAL 25 N 6.05 2.32 -0.06 3.82 -7.23 0.07 -0.28 120.40 125.09 2hgj s VAL 25 Ca 0.63 -0.96 0.02 0.00 -1.81 0.00 0.00 61.98 59.86 2hgj s VAL 25 Cb -0.15 -1.88 0.01 0.00 0.56 0.00 0.00 36.38 34.93 2hgj s VAL 25 CO 0.31 0.56 -0.12 -0.51 -0.31 0.00 0.00 175.10 175.03 2hgj s ILE 26 N -0.06 1.08 -0.55 -0.62 2.07 -0.29 -0.67 121.20 122.16 2hgj s ILE 26 Ca -0.06 -0.45 0.04 0.00 -1.41 0.00 0.00 60.65 58.77 2hgj s ILE 26 Cb -0.14 -0.99 0.16 0.00 0.13 0.00 0.00 42.46 41.61 2hgj s ILE 26 CO 0.05 0.34 0.37 -0.22 -1.91 0.00 0.00 174.94 173.57 2hgj s LEU 27 N 0.68 3.40 0.00 8.50 2.96 -0.35 -1.34 118.68 132.53 2hgj s LEU 27 Ca -0.14 -3.26 0.00 0.00 -0.22 0.00 0.00 54.13 50.51 2hgj s LEU 27 Cb -0.16 -1.19 0.00 0.00 0.50 0.00 0.00 46.19 45.34 2hgj s LEU 27 CO 0.03 -0.17 0.26 0.00 -1.32 0.00 0.00 176.35 175.16 2hgj n ALA 28 N 2.71 0.00 -3.46 5.97 0.00 -1.25 -4.55 120.51 119.92 2hgj n ALA 28 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.37 2hgj n ALA 28 Cb 0.38 0.12 -0.12 0.00 0.00 0.00 0.00 19.45 19.83 2hgj n ALA 28 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2hgj s GLY 29 N 0.00 0.40 0.18 0.00 0.00 -1.14 -4.81 107.32 101.94 2hgj s GLY 29 Ca 0.00 -1.16 -0.31 0.00 0.00 0.00 0.00 44.72 43.25 2hgj s GLY 29 CO 0.00 2.30 1.42 2.56 0.00 0.00 0.00 173.10 179.37 2hgj s PRO 30 N 1.73 4.30 -0.01 2.90 0.04 -0.94 -4.17 135.00 138.85 2hgj s PRO 30 Ca 0.13 2.18 0.01 0.00 0.04 0.00 0.00 61.00 63.37 2hgj s PRO 30 Cb -0.18 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.18 2hgj s PRO 30 CO -0.19 -0.43 -0.04 0.00 0.04 0.00 0.00 177.00 176.38 2hgj n PRO 32 N 3.13 0.16 -0.01 0.00 -0.04 -1.26 -3.64 135.00 133.34 2hgj n PRO 32 Ca -0.15 -1.36 -0.13 0.00 -0.04 0.00 0.00 63.50 61.83 2hgj n PRO 32 Cb 0.57 -3.56 -0.09 0.00 -0.04 0.00 0.00 33.50 30.38 2hgj n PRO 32 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 2hgj h VAL 33 N 6.91 1.31 -3.18 0.52 -1.51 -0.97 -3.46 116.25 115.85 2hgj h VAL 33 Ca 0.00 -0.92 -0.10 0.00 -1.23 0.00 0.00 66.70 64.45 2hgj h VAL 33 Cb 1.00 1.89 -0.18 0.00 -2.13 0.00 0.00 31.29 31.87 2hgj h VAL 33 CO 1.01 0.24 -0.25 -0.69 -1.23 0.00 0.00 177.57 176.66 2hgj s VAL 34 N -4.67 0.07 -0.03 7.19 1.01 -0.41 -4.81 120.40 118.74 2hgj s VAL 34 Ca -0.15 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.30 2hgj s VAL 34 Cb 0.03 -0.82 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 2hgj s VAL 34 CO 0.68 -0.33 -0.21 -1.10 0.00 0.00 0.00 175.10 174.14 2hgj s GLN 35 N -2.08 1.99 -0.50 2.72 1.11 -1.26 -0.95 119.66 120.69 2hgj s GLN 35 Ca -0.08 -0.77 -0.06 0.00 0.01 0.00 0.00 55.36 54.46 2hgj s GLN 35 Cb -0.02 -1.79 0.13 0.00 -1.01 0.00 0.00 33.01 30.31 2hgj s GLN 35 CO -0.00 0.39 0.34 1.03 0.01 0.00 0.00 175.29 177.05 2hgj s ARG 36 N -0.27 2.39 -0.00 2.91 1.81 -0.48 -4.87 118.95 120.45 2hgj s ARG 36 Ca 0.02 -1.95 0.00 0.00 -1.72 0.00 0.00 55.73 52.08 2hgj s ARG 36 Cb -0.11 -3.81 0.00 0.00 -0.45 0.00 0.00 34.95 30.58 2hgj s ARG 36 CO 0.01 -1.16 0.86 2.89 -0.68 0.00 0.00 175.30 177.22 2hgj n ARG 37 N 4.52 1.00 0.00 3.54 1.85 -1.26 -1.01 116.66 125.31 2hgj n ARG 37 Ca -0.02 -0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.83 2hgj n ARG 37 Cb 0.41 -1.14 0.00 0.00 -1.05 0.00 0.00 32.46 30.67 2hgj n ARG 37 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2hgj n THR 38 N -0.35 0.00 0.20 8.89 -1.04 0.08 -4.43 114.28 117.63 2hgj n THR 38 Ca 0.00 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.08 2hgj n THR 38 Cb 0.07 0.00 0.58 0.00 -1.82 0.00 0.00 70.33 69.17 2hgj n THR 38 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 2hgj h PRO 39 N 0.00 0.11 0.00 -2.82 0.11 -1.93 -3.02 132.00 124.46 2hgj h PRO 39 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2hgj h PRO 39 Cb 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.09 2hgj h PRO 39 CO 0.00 0.09 0.00 0.39 -0.21 0.00 0.00 178.00 178.27 2hgj n GLU 40 N -4.51 0.00 -4.02 1.05 -0.58 -1.26 -4.85 120.64 106.46 2hgj n GLU 40 Ca -0.02 0.02 -0.31 0.00 -0.42 0.00 0.00 57.16 56.44 2hgj n GLU 40 Cb 0.10 -0.51 -0.16 0.00 -0.57 0.00 0.00 31.44 30.30 2hgj n GLU 40 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2hgj s LYS 41 N -0.05 2.23 0.28 3.49 3.01 -1.23 -4.90 119.74 122.58 2hgj s LYS 41 Ca 0.00 -0.84 -0.04 0.00 -1.01 0.00 0.00 55.97 54.08 2hgj s LYS 41 Cb 0.00 -2.43 0.56 0.00 -1.01 0.00 0.00 37.83 34.95 2hgj s LYS 41 CO 0.00 -0.38 1.59 0.22 0.51 0.00 0.00 175.35 177.30 2hgj h ASP 42 N 7.96 -0.54 0.00 2.83 -0.00 -1.83 0.70 116.42 125.53 2hgj h ASP 42 Ca -0.31 0.25 -0.06 0.00 -0.00 0.00 0.00 57.03 56.91 2hgj h ASP 42 Cb 1.10 0.47 -0.02 0.00 -0.00 0.00 0.00 39.33 40.88 2hgj h ASP 42 CO 0.51 -0.28 0.06 0.61 -0.00 0.00 0.00 179.24 180.13 2hgj n GLY 43 N -1.50 1.74 1.47 -0.78 0.00 -1.26 -4.39 105.19 100.47 2hgj n GLY 43 Ca 0.18 -0.36 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 2hgj n GLY 43 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2hgj n TYR 44 N 2.42 -0.02 -3.83 1.61 -0.00 -0.30 -4.48 117.16 112.56 2hgj n TYR 44 Ca 0.13 0.43 -0.01 0.00 -0.00 0.00 0.00 57.90 58.44 2hgj n TYR 44 Cb 0.35 -0.86 0.01 0.00 -0.00 0.00 0.00 39.34 38.84 2hgj n TYR 44 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.86 176.78 2hgj s THR 45 N -0.26 0.00 -0.23 2.97 -1.32 -0.18 -0.70 115.64 115.92 2hgj s THR 45 Ca 0.32 -0.47 -0.06 0.00 -1.21 0.00 0.00 61.69 60.27 2hgj s THR 45 Cb -0.45 -2.55 -0.02 0.00 -1.51 0.00 0.00 72.50 67.97 2hgj s THR 45 CO 0.24 0.00 0.02 0.00 -2.21 0.00 0.00 174.62 172.67 2hgj s ALA 46 N -2.43 3.03 -0.17 11.08 0.00 -0.56 -1.38 121.76 131.33 2hgj s ALA 46 Ca 0.20 -1.12 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 2hgj s ALA 46 Cb -0.01 -1.91 -0.03 0.00 0.00 0.00 0.00 23.12 21.18 2hgj s ALA 46 CO 0.02 -0.42 -0.02 0.08 0.00 0.00 0.00 175.76 175.42 2hgj s VAL 47 N 1.48 3.98 0.05 0.00 1.01 -0.12 -1.19 120.40 125.61 2hgj s VAL 47 Ca 0.06 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 61.72 2hgj s VAL 47 Cb -0.15 -2.76 -0.00 0.00 0.00 0.00 0.00 36.38 33.47 2hgj s VAL 47 CO 0.01 0.48 0.04 0.00 0.00 0.00 0.00 175.10 175.63 2hgj n GLN 48 N 3.67 0.07 -4.16 2.72 0.00 -0.20 -0.28 117.38 119.20 2hgj n GLN 48 Ca -0.17 -0.46 -0.16 0.00 0.00 0.00 0.00 57.00 56.22 2hgj n GLN 48 Cb 0.52 0.37 -0.06 0.00 0.00 0.00 0.00 30.24 31.07 2hgj n GLN 48 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 2hgj s LEU 49 N 0.00 1.24 0.00 2.61 1.98 -1.24 -1.21 118.68 122.07 2hgj s LEU 49 Ca 0.05 -1.54 0.00 0.00 -2.89 0.00 0.00 54.13 49.76 2hgj s LEU 49 Cb 0.00 1.05 0.00 0.00 0.66 0.00 0.00 46.19 47.91 2hgj s LEU 49 CO 0.04 -1.16 0.48 0.61 -1.89 0.00 0.00 176.35 174.43 2hgj n GLY 50 N -0.54 -0.36 0.00 7.98 0.00 -0.51 -2.69 105.19 109.07 2hgj n GLY 50 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2hgj n GLY 50 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2hgj n PHE 51 N 0.00 0.00 0.00 1.61 -1.74 -1.26 -2.90 117.46 113.17 2hgj n PHE 51 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 2hgj n PHE 51 Cb 0.54 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.54 2hgj n PHE 51 CO 0.00 0.00 0.00 1.47 -0.56 0.00 0.00 176.76 177.67 2hgj n LEU 52 N 0.00 0.00 -4.33 5.98 -0.00 -1.26 -3.57 117.00 113.82 2hgj n LEU 52 Ca 0.00 0.00 -0.45 0.00 -0.00 0.00 0.00 56.01 55.56 2hgj n LEU 52 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.36 2hgj n LEU 52 CO 0.00 0.00 0.08 -2.16 -0.00 0.00 0.00 177.39 175.31 2hgj s PRO 53 N 0.00 2.94 0.03 1.47 0.04 0.23 -4.73 135.00 135.00 2hgj s PRO 53 Ca 0.00 -1.58 0.00 0.00 0.04 0.00 0.00 61.00 59.46 2hgj s PRO 53 Cb 0.00 -4.20 0.00 0.00 0.04 0.00 0.00 34.50 30.34 2hgj s PRO 53 CO 0.00 -1.20 0.00 0.94 0.04 0.00 0.00 177.00 176.78 2hgj n GLN 54 N 5.20 -0.95 0.11 4.56 -0.06 -1.26 -4.89 117.38 120.09 2hgj n GLN 54 Ca -0.13 0.67 -0.23 0.00 -2.00 0.00 0.00 57.00 55.31 2hgj n GLN 54 Cb 0.41 -1.15 -0.15 0.00 -4.06 0.00 0.00 30.24 25.29 2hgj n GLN 54 CO 0.00 0.00 0.00 -0.97 -0.20 0.00 0.00 177.06 175.89 2hgj h ASN 55 N 3.29 0.72 -0.23 1.69 -0.00 -1.92 -3.35 115.58 115.78 2hgj h ASN 55 Ca 0.00 -0.92 0.02 0.00 -0.00 0.00 0.00 56.30 55.40 2hgj h ASN 55 Cb 0.00 -0.23 -0.03 0.00 -0.00 0.00 0.00 38.32 38.06 2hgj h ASN 55 CO 0.00 1.59 -0.14 -2.65 -0.00 0.00 0.00 177.43 176.24 2hgj n PRO 56 N -3.87 -0.10 -2.22 6.67 -0.02 -1.26 -3.63 135.00 130.57 2hgj n PRO 56 Ca -0.16 0.57 -0.43 0.00 -2.02 0.00 0.00 63.50 61.46 2hgj n PRO 56 Cb 1.00 -0.84 -0.02 0.00 -0.02 0.00 0.00 33.50 33.61 2hgj n PRO 56 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2hgj s LYS 57 N -4.15 3.77 -0.32 -0.52 -2.85 -1.26 -4.97 119.74 109.44 2hgj s LYS 57 Ca -0.03 1.45 0.01 0.00 -1.00 0.00 0.00 55.97 56.40 2hgj s LYS 57 Cb 0.03 -4.00 0.19 0.00 -2.06 0.00 0.00 37.83 31.98 2hgj s LYS 57 CO 0.14 -1.32 0.74 0.50 0.10 0.00 0.00 175.35 175.52 2hgj s ARG 58 N 4.63 0.48 0.39 1.78 6.06 -1.24 -4.90 118.95 126.16 2hgj s ARG 58 Ca 0.67 0.24 -0.23 0.00 -2.50 0.00 0.00 55.73 53.91 2hgj s ARG 58 Cb -0.21 0.16 -0.14 0.00 0.06 0.00 0.00 34.95 34.81 2hgj s ARG 58 CO 0.28 -0.82 0.38 0.28 -2.50 0.00 0.00 175.30 172.92 2hgj n VAL 59 N 5.00 1.38 0.00 7.11 0.31 -1.26 -4.66 118.33 126.21 2hgj n VAL 59 Ca 0.07 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2hgj n VAL 59 Cb 0.56 -0.30 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 2hgj n VAL 59 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2hgj n ASN 60 N 1.73 0.00 -0.31 4.52 0.23 -1.26 -0.96 115.26 119.21 2hgj n ASN 60 Ca 0.12 0.81 -0.05 0.00 -0.53 0.00 0.00 54.58 54.93 2hgj n ASN 60 Cb 0.38 -0.31 -0.03 0.00 -2.08 0.00 0.00 39.78 37.74 2hgj n ASN 60 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2hgj n ARG 61 N -1.51 -0.27 -0.20 -3.83 3.00 -1.26 0.21 116.66 112.80 2hgj n ARG 61 Ca 0.00 1.15 -0.13 0.00 -0.01 0.00 0.00 57.85 58.86 2hgj n ARG 61 Cb 0.00 -1.70 -0.10 0.00 0.00 0.00 0.00 32.46 30.66 2hgj n ARG 61 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 2hgj h PRO 62 N 0.00 -0.28 -0.68 5.56 0.11 -1.89 0.81 132.00 135.63 2hgj h PRO 62 Ca 0.18 0.02 0.20 0.00 0.11 0.00 0.00 66.00 66.51 2hgj h PRO 62 Cb 0.37 0.06 -0.13 0.00 0.11 0.00 0.00 31.00 31.42 2hgj h PRO 62 CO -0.73 -0.19 0.05 1.28 -0.21 0.00 0.00 178.00 178.20 2hgj n LEU 63 N -5.28 -0.04 -0.08 2.35 4.77 0.58 -1.20 117.00 118.10 2hgj n LEU 63 Ca -0.02 1.15 -0.11 0.00 -0.03 0.00 0.00 56.01 57.00 2hgj n LEU 63 Cb 0.31 -0.43 -0.15 0.00 -2.33 0.00 0.00 43.42 40.82 2hgj n LEU 63 CO -0.03 -1.18 -1.00 0.29 -1.33 0.00 0.00 177.39 174.14 2hgj n LYS 64 N -4.87 0.67 -0.24 3.23 5.02 0.25 -1.10 118.16 121.13 2hgj n LYS 64 Ca 0.17 0.10 0.32 0.00 -2.02 0.00 0.00 58.31 56.88 2hgj n LYS 64 Cb 0.56 -1.60 0.73 0.00 -0.02 0.00 0.00 35.03 34.70 2hgj n LYS 64 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2hgj h GLY 65 N 3.48 0.00 0.15 0.72 0.00 0.19 0.92 103.07 108.53 2hgj h GLY 65 Ca -0.48 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 2hgj h GLY 65 CO 0.03 0.00 -0.07 0.84 0.00 0.00 0.00 176.54 177.34 2hgj h HIS 66 N 0.00 -0.19 -0.03 5.60 -0.00 -1.23 -3.32 115.15 115.99 2hgj h HIS 66 Ca 0.49 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.86 2hgj h HIS 66 Cb 2.09 0.06 -0.00 0.00 -0.00 0.00 0.00 27.41 29.55 2hgj h HIS 66 CO 0.00 -0.12 -0.01 0.34 -0.00 0.00 0.00 177.93 178.14 2hgj n PHE 67 N -3.27 0.00 0.00 5.26 -0.00 0.30 -0.70 117.46 119.06 2hgj n PHE 67 Ca -0.02 0.03 0.00 0.00 -0.00 0.00 0.00 57.45 57.46 2hgj n PHE 67 Cb 0.08 -0.51 0.00 0.00 -0.00 0.00 0.00 39.48 39.05 2hgj n PHE 67 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2hgj n ALA 68 N -3.99 0.00 -1.34 3.13 0.00 -0.20 0.26 120.51 118.38 2hgj n ALA 68 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 2hgj n ALA 68 Cb 0.01 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.52 2hgj n ALA 68 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2hgj n LYS 69 N -3.33 0.79 -0.70 0.00 4.81 -0.78 -5.11 118.16 113.85 2hgj n LYS 69 Ca 0.00 -1.61 0.00 0.00 -0.87 0.00 0.00 58.31 55.83 2hgj n LYS 69 Cb 0.00 -0.94 0.00 0.00 0.02 0.00 0.00 35.03 34.11 2hgj n LYS 69 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2hgj n ALA 70 N -0.61 -1.00 -0.34 3.14 0.00 0.74 -5.05 120.51 117.40 2hgj n ALA 70 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2hgj n ALA 70 Cb 0.61 -0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.81 2hgj n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hgj n GLY 71 N 0.05 -0.03 0.00 0.00 0.00 -1.26 -4.97 105.19 98.98 2hgj n GLY 71 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hgj n GLY 71 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2hgj n VAL 72 N -1.99 0.00 -0.15 1.61 0.24 -1.26 -5.07 118.33 111.70 2hgj n VAL 72 Ca 0.00 0.00 0.07 0.00 -2.04 0.00 0.00 64.34 62.37 2hgj n VAL 72 Cb 0.00 0.00 0.28 0.00 -1.47 0.00 0.00 33.84 32.65 2hgj n VAL 72 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2hgj n GLU 73 N 0.00 3.24 -0.39 7.34 -0.58 -1.26 -5.04 120.64 123.95 2hgj n GLU 73 Ca 0.00 -2.23 0.00 0.00 -0.42 0.00 0.00 57.16 54.51 2hgj n GLU 73 Cb 0.00 -1.80 0.00 0.00 -0.57 0.00 0.00 31.44 29.07 2hgj n GLU 73 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 2hgj n PRO 74 N 0.77 0.58 0.00 3.49 -0.04 -1.23 -0.60 135.00 137.96 2hgj n PRO 74 Ca 0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 2hgj n PRO 74 Cb 0.75 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.21 2hgj n PRO 74 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2hgj n VAL 75 N -1.41 0.00 -2.77 0.52 0.24 -1.26 -4.56 118.33 109.10 2hgj n VAL 75 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.88 2hgj n VAL 75 Cb 0.00 0.43 -0.04 0.00 -1.47 0.00 0.00 33.84 32.76 2hgj n VAL 75 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2hgj s ARG 76 N 0.00 3.19 0.00 7.34 1.70 -1.26 -4.98 118.95 124.95 2hgj s ARG 76 Ca 0.00 -0.52 -0.01 0.00 -0.47 0.00 0.00 55.73 54.73 2hgj s ARG 76 Cb 0.00 -4.17 -0.01 0.00 -0.57 0.00 0.00 34.95 30.20 2hgj s ARG 76 CO 0.00 -1.82 0.02 -1.50 -1.08 0.00 0.00 175.30 170.92 2hgj s ILE 77 N 4.49 0.06 0.00 4.99 2.07 -1.26 -1.42 121.20 130.13 2hgj s ILE 77 Ca 0.28 -0.51 0.00 0.00 -1.41 0.00 0.00 60.65 59.01 2hgj s ILE 77 Cb -0.13 -0.20 0.00 0.00 0.13 0.00 0.00 42.46 42.26 2hgj s ILE 77 CO 0.14 -0.28 0.00 0.18 -1.91 0.00 0.00 174.94 173.07 2hgj n LEU 78 N 2.18 0.00 -3.59 8.50 4.32 -0.35 -4.99 117.00 123.08 2hgj n LEU 78 Ca -0.19 0.00 -0.07 0.00 -0.02 0.00 0.00 56.01 55.73 2hgj n LEU 78 Cb 0.57 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.35 2hgj n LEU 78 CO 0.22 0.00 0.70 0.00 -1.22 0.00 0.00 177.39 177.09 2hgj s ARG 79 N 0.99 0.94 -0.01 3.23 1.70 -1.26 -1.03 118.95 123.51 2hgj s ARG 79 Ca 0.00 -0.42 0.00 0.00 -0.47 0.00 0.00 55.73 54.84 2hgj s ARG 79 Cb 0.00 0.39 0.01 0.00 -0.57 0.00 0.00 34.95 34.77 2hgj s ARG 79 CO 0.00 -0.42 0.00 -1.83 -1.08 0.00 0.00 175.30 171.97 2hgj s GLU 80 N -3.17 0.04 0.21 3.89 1.03 -0.33 -4.98 118.70 115.40 2hgj s GLU 80 Ca 0.08 0.04 -0.30 0.00 0.03 0.00 0.00 54.97 54.81 2hgj s GLU 80 Cb -0.01 -0.12 -0.08 0.00 -0.80 0.00 0.00 34.13 33.11 2hgj s GLU 80 CO -0.05 -0.04 1.16 0.42 -1.33 0.00 0.00 175.26 175.42 2hgj s ILE 81 N 0.31 3.57 -1.08 1.83 1.01 -1.26 -1.49 121.20 124.09 2hgj s ILE 81 Ca -0.03 1.40 -0.07 0.00 0.00 0.00 0.00 60.65 61.95 2hgj s ILE 81 Cb -0.04 -3.89 -0.06 0.00 0.01 0.00 0.00 42.46 38.48 2hgj s ILE 81 CO -0.01 0.26 0.91 0.54 0.00 0.00 0.00 174.94 176.64 2hgj n ARG 82 N 2.06 -2.59 -3.33 2.79 5.12 0.12 -4.96 116.66 115.88 2hgj n ARG 82 Ca 0.02 0.83 -0.22 0.00 -1.93 0.00 0.00 57.85 56.55 2hgj n ARG 82 Cb 0.45 -5.67 -0.09 0.00 -1.16 0.00 0.00 32.46 25.99 2hgj n ARG 82 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2hgj s ASP 83 N -3.50 1.36 0.97 0.55 1.11 -1.26 -4.98 116.67 110.93 2hgj s ASP 83 Ca 0.41 -2.35 -0.14 0.00 0.18 0.00 0.00 52.55 50.65 2hgj s ASP 83 Cb -0.06 0.09 0.01 0.00 1.07 0.00 0.00 42.92 44.03 2hgj s ASP 83 CO 0.75 -0.21 0.20 0.33 1.18 0.00 0.00 175.17 177.42 2hgj n PHE 84 N 3.47 -1.95 -3.91 4.23 7.35 -1.26 -4.06 117.46 121.32 2hgj n PHE 84 Ca 0.20 0.19 -0.30 0.00 -0.76 0.00 0.00 57.45 56.79 2hgj n PHE 84 Cb 0.46 -1.72 -0.14 0.00 0.35 0.00 0.00 39.48 38.43 2hgj n PHE 84 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 2hgj s ASN 85 N -1.86 4.20 0.00 -2.13 0.02 -1.26 -4.93 114.94 108.97 2hgj s ASN 85 Ca 0.54 -2.96 0.00 0.00 -1.02 0.00 0.00 52.86 49.43 2hgj s ASN 85 Cb -0.20 -1.53 0.00 0.00 0.02 0.00 0.00 41.25 39.54 2hgj s ASN 85 CO 0.69 -0.24 0.74 -0.81 0.02 0.00 0.00 177.10 177.51 2hgj n PRO 86 N 3.17 0.69 -3.87 -0.60 -0.04 -1.26 -4.71 135.00 128.38 2hgj n PRO 86 Ca 0.06 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.51 2hgj n PRO 86 Cb 0.32 -1.15 0.01 0.00 -0.04 0.00 0.00 33.50 32.64 2hgj n PRO 86 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2hgj s GLU 87 N 0.33 0.93 -0.17 0.54 0.41 -1.26 -4.97 118.70 114.52 2hgj s GLU 87 Ca 0.00 -0.59 0.14 0.00 -0.41 0.00 0.00 54.97 54.11 2hgj s GLU 87 Cb 0.00 0.27 0.39 0.00 -1.78 0.00 0.00 34.13 33.01 2hgj s GLU 87 CO 0.00 -0.44 1.20 0.41 -0.49 0.00 0.00 175.26 175.94 2hgj n GLY 88 N -0.71 4.46 0.00 -1.39 0.00 -1.26 -4.85 105.19 101.43 2hgj n GLY 88 Ca -0.02 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.81 2hgj n GLY 88 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2hgj n ASP 89 N -0.93 0.00 -4.34 1.61 4.64 -1.26 -4.25 116.55 112.02 2hgj n ASP 89 Ca 0.16 0.00 -0.18 0.00 -1.38 0.00 0.00 54.79 53.40 2hgj n ASP 89 Cb 0.74 0.00 -0.10 0.00 -1.04 0.00 0.00 41.12 40.72 2hgj n ASP 89 CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 2hgj s THR 90 N 0.00 1.18 -0.00 5.18 -1.32 -0.06 -4.97 115.64 115.66 2hgj s THR 90 Ca 0.00 -2.06 -0.04 0.00 -1.21 0.00 0.00 61.69 58.38 2hgj s THR 90 Cb 0.00 -2.30 -0.01 0.00 -1.51 0.00 0.00 72.50 68.67 2hgj s THR 90 CO 0.00 -0.37 -0.08 0.55 -2.21 0.00 0.00 174.62 172.51 2hgj n VAL 91 N -0.43 0.84 0.00 5.08 3.14 -1.26 -2.21 118.33 123.50 2hgj n VAL 91 Ca -0.06 0.26 0.00 0.00 -2.96 0.00 0.00 64.34 61.59 2hgj n VAL 91 Cb 0.63 -1.62 0.00 0.00 -1.06 0.00 0.00 33.84 31.80 2hgj n VAL 91 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 2hgj n THR 92 N -3.35 0.00 -1.52 1.55 -1.04 -1.26 -4.35 114.28 104.31 2hgj n THR 92 Ca -0.03 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.54 2hgj n THR 92 Cb 0.12 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.62 2hgj n THR 92 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2hgj n VAL 93 N 0.00 1.98 0.00 12.58 0.24 -1.26 0.19 118.33 132.06 2hgj n VAL 93 Ca 0.00 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 2hgj n VAL 93 Cb 0.00 -0.72 0.00 0.00 -1.47 0.00 0.00 33.84 31.65 2hgj n VAL 93 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2hgj n GLU 94 N 0.68 0.00 -0.25 7.34 -0.58 -1.26 -4.07 120.64 122.50 2hgj n GLU 94 Ca 0.11 0.00 0.09 0.00 -0.42 0.00 0.00 57.16 56.95 2hgj n GLU 94 Cb 0.33 -0.29 0.19 0.00 -0.57 0.00 0.00 31.44 31.10 2hgj n GLU 94 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2hgj n ILE 95 N 0.00 -0.30 -4.21 -3.67 -0.00 0.83 -3.73 119.36 108.29 2hgj n ILE 95 Ca 0.00 1.60 -0.16 0.00 -0.00 0.00 0.00 62.75 64.18 2hgj n ILE 95 Cb 0.00 -2.30 -0.14 0.00 -0.00 0.00 0.00 39.64 37.20 2hgj n ILE 95 CO 0.00 0.00 0.00 -0.36 -0.00 0.00 0.00 176.55 176.19 2hgj s PHE 96 N -5.69 0.64 0.14 1.39 2.99 0.13 -4.97 117.98 112.61 2hgj s PHE 96 Ca -0.10 -0.20 0.07 0.00 0.00 0.00 0.00 56.93 56.71 2hgj s PHE 96 Cb 0.21 -0.40 -0.04 0.00 0.00 0.00 0.00 43.02 42.78 2hgj s PHE 96 CO 0.56 -0.02 -0.17 -1.59 -0.00 0.00 0.00 175.22 174.00 2hgj s LYS 97 N -0.49 1.16 1.11 0.44 -2.85 -1.24 -4.61 119.74 113.27 2hgj s LYS 97 Ca 0.00 -1.32 -0.17 0.00 -1.00 0.00 0.00 55.97 53.48 2hgj s LYS 97 Cb -0.04 -1.18 0.25 0.00 -2.06 0.00 0.00 37.83 34.80 2hgj s LYS 97 CO -0.00 0.24 1.14 -1.25 0.10 0.00 0.00 175.35 175.58 2hgj s PRO 98 N -2.66 -0.52 0.00 1.78 0.04 -1.26 -3.44 135.00 128.94 2hgj s PRO 98 Ca 0.12 -0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.14 2hgj s PRO 98 Cb -0.06 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.81 2hgj s PRO 98 CO 0.05 -3.26 0.00 0.41 0.04 0.00 0.00 177.00 174.24 2hgj n GLY 99 N -1.53 0.53 3.81 0.56 0.00 -1.25 -4.94 105.19 102.36 2hgj n GLY 99 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 2hgj n GLY 99 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hgj s GLU 100 N -0.37 2.90 -0.07 1.61 2.02 -1.22 -5.01 118.70 118.55 2hgj s GLU 100 Ca 0.00 -0.97 -0.04 0.00 0.02 0.00 0.00 54.97 53.97 2hgj s GLU 100 Cb 0.00 -2.60 -0.04 0.00 0.10 0.00 0.00 34.13 31.60 2hgj s GLU 100 CO 0.00 0.44 0.12 0.50 0.02 0.00 0.00 175.26 176.34 2hgj s ARG 101 N -3.48 3.32 0.12 1.61 3.00 -1.26 -1.24 118.95 121.01 2hgj s ARG 101 Ca 0.32 -0.26 0.02 0.00 -1.00 0.00 0.00 55.73 54.81 2hgj s ARG 101 Cb -0.09 -3.06 -0.04 0.00 0.00 0.00 0.00 34.95 31.75 2hgj s ARG 101 CO 0.24 0.73 -0.06 0.54 0.00 0.00 0.00 175.30 176.74 2hgj s VAL 102 N -1.10 0.80 0.08 7.11 0.11 -0.28 -4.84 120.40 122.28 2hgj s VAL 102 Ca 0.18 -1.97 0.07 0.00 -2.93 0.00 0.00 61.98 57.33 2hgj s VAL 102 Cb -0.12 -1.79 -0.03 0.00 -1.53 0.00 0.00 36.38 32.91 2hgj s VAL 102 CO 0.08 -0.78 -0.18 -1.81 -3.33 0.00 0.00 175.10 169.08 2hgj s ASP 103 N -3.09 2.20 0.14 3.54 1.01 -0.40 -0.72 116.67 119.35 2hgj s ASP 103 Ca 0.15 -0.62 -0.25 0.00 0.71 0.00 0.00 52.55 52.55 2hgj s ASP 103 Cb 0.05 -0.12 0.07 0.00 1.01 0.00 0.00 42.92 43.92 2hgj s ASP 103 CO -0.02 0.04 0.79 -0.69 0.21 0.00 0.00 175.17 175.50 2hgj s VAL 104 N -1.10 0.00 -0.10 -1.27 1.01 -0.36 -1.15 120.40 117.43 2hgj s VAL 104 Ca 0.04 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.62 2hgj s VAL 104 Cb -0.10 -1.48 0.00 0.00 0.00 0.00 0.00 36.38 34.80 2hgj s VAL 104 CO 0.03 0.00 0.00 1.07 0.00 0.00 0.00 175.10 176.20 2hgj n THR 105 N -0.39 0.00 0.00 3.92 5.66 -0.22 -0.80 114.28 122.45 2hgj n THR 105 Ca -0.09 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 2hgj n THR 105 Cb 0.62 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.40 2hgj n THR 105 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2hgj n GLY 106 N 0.00 -0.34 3.76 1.09 0.00 -0.53 -0.48 105.19 108.70 2hgj n GLY 106 Ca 0.00 -0.71 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 2hgj n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hgj s THR 107 N -4.00 2.86 -0.38 2.61 2.01 -0.75 -1.30 115.64 116.69 2hgj s THR 107 Ca 0.00 0.49 -0.11 0.00 0.31 0.00 0.00 61.69 62.38 2hgj s THR 107 Cb 0.00 -3.13 0.03 0.00 0.01 0.00 0.00 72.50 69.41 2hgj s THR 107 CO 0.00 -0.15 0.21 -0.44 -0.69 0.00 0.00 174.62 173.55 2hgj s SER 108 N -1.88 5.74 0.17 3.53 0.01 0.38 -3.46 113.70 118.20 2hgj s SER 108 Ca 0.74 -1.02 -0.13 0.00 1.31 0.00 0.00 55.95 56.85 2hgj s SER 108 Cb -0.26 -2.03 -0.09 0.00 0.21 0.00 0.00 66.02 63.85 2hgj s SER 108 CO 0.34 -0.40 0.15 0.29 0.41 0.00 0.00 173.24 174.04 2hgj n LYS 109 N 5.00 0.00 -2.92 12.44 5.02 -1.26 -3.61 118.16 132.83 2hgj n LYS 109 Ca -0.12 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.73 2hgj n LYS 109 Cb 0.46 -0.55 -0.00 0.00 -0.02 0.00 0.00 35.03 34.91 2hgj n LYS 109 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2hgj s GLY 110 N -0.55 2.32 0.00 0.72 0.00 -0.98 -4.54 107.32 104.29 2hgj s GLY 110 Ca 0.34 -3.29 0.00 0.00 0.00 0.00 0.00 44.72 41.77 2hgj s GLY 110 CO 0.33 2.10 0.29 0.54 0.00 0.00 0.00 173.10 176.37 2hgj n ARG 111 N 5.93 0.00 0.00 2.90 3.00 -1.12 -4.63 116.66 122.74 2hgj n ARG 111 Ca 0.37 0.20 0.00 0.00 -0.01 0.00 0.00 57.85 58.41 2hgj n ARG 111 Cb 0.43 -0.79 0.00 0.00 0.00 0.00 0.00 32.46 32.10 2hgj n ARG 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2hgj n GLY 112 N -0.49 -0.61 2.36 -0.13 0.00 -1.20 -4.83 105.19 100.29 2hgj n GLY 112 Ca 0.00 -0.25 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 2hgj n GLY 112 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2hgj n PHE 113 N 0.00 1.16 -4.10 1.61 3.01 -1.20 -0.87 117.46 117.07 2hgj n PHE 113 Ca 0.00 -3.83 -0.35 0.00 1.01 0.00 0.00 57.45 54.28 2hgj n PHE 113 Cb 0.00 -0.43 -0.11 0.00 -0.01 0.00 0.00 39.48 38.93 2hgj n PHE 113 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2hgj s ALA 114 N -2.39 3.20 0.66 4.37 0.00 -1.08 -3.69 121.76 122.82 2hgj s ALA 114 Ca 0.41 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.51 2hgj s ALA 114 Cb 0.28 -1.82 0.00 0.00 0.00 0.00 0.00 23.12 21.58 2hgj s ALA 114 CO -0.09 0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.12 2hgj n GLY 115 N 3.85 -2.33 0.30 0.00 0.00 -1.26 -0.81 105.19 104.93 2hgj n GLY 115 Ca -0.17 -0.79 0.01 0.00 0.00 0.00 0.00 46.02 45.07 2hgj n GLY 115 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2hgj h VAL 116 N -0.92 0.21 0.00 1.61 -1.51 -1.91 1.51 116.25 115.24 2hgj h VAL 116 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2hgj h VAL 116 Cb 0.00 0.21 0.00 0.00 -2.13 0.00 0.00 31.29 29.37 2hgj h VAL 116 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 177.57 177.14 2hgj n MET 117 N -5.49 0.00 0.00 5.19 0.00 -1.26 -4.01 117.12 111.55 2hgj n MET 117 Ca 0.10 0.36 0.00 0.00 0.00 0.00 0.00 57.70 58.16 2hgj n MET 117 Cb 0.39 -0.57 0.00 0.00 0.00 0.00 0.00 33.22 33.03 2hgj n MET 117 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2hgj n LYS 118 N -1.97 0.00 0.00 2.12 4.76 0.50 -4.54 118.16 119.03 2hgj n LYS 118 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2hgj n LYS 118 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2hgj n LYS 118 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 2hgj n ARG 119 N 0.00 0.00 -0.12 1.97 0.00 0.01 -4.13 116.66 114.39 2hgj n ARG 119 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2hgj n ARG 119 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2hgj n ARG 119 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.63 174.96 2hgj n TRP 120 N 0.00 -0.37 0.00 -0.14 4.27 -1.26 -5.07 117.44 114.88 2hgj n TRP 120 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 2hgj n TRP 120 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 2hgj n TRP 120 CO 0.00 0.00 0.00 -1.71 -2.29 0.00 0.00 177.69 173.69 2hgj n ASN 121 N -0.37 0.00 -2.02 -0.67 4.05 -1.26 -4.77 115.26 110.22 2hgj n ASN 121 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 2hgj n ASN 121 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 2hgj n ASN 121 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 2hgj n PHE 122 N 0.00 0.00 -1.12 1.20 3.01 -1.26 -4.37 117.46 114.93 2hgj n PHE 122 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.41 2hgj n PHE 122 Cb 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.42 2hgj n PHE 122 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2hgj n ALA 123 N -0.48 0.60 0.00 4.37 0.00 -1.26 -4.78 120.51 118.96 2hgj n ALA 123 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.42 2hgj n ALA 123 Cb 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2hgj n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hgj n GLY 124 N 4.76 0.35 0.00 0.00 0.00 -1.26 -4.84 105.19 104.20 2hgj n GLY 124 Ca 0.14 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2hgj n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hgj n GLY 125 N 0.00 -2.86 3.64 -0.02 0.00 -1.20 -4.78 105.19 99.97 2hgj n GLY 125 Ca 0.00 -1.05 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 2hgj n GLY 125 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hgj s PRO 126 N 0.00 2.03 -0.20 1.61 0.04 0.33 -4.26 135.00 134.56 2hgj s PRO 126 Ca 0.00 -2.24 -0.04 0.00 0.04 0.00 0.00 61.00 58.75 2hgj s PRO 126 Cb 0.00 -1.24 0.10 0.00 0.04 0.00 0.00 34.50 33.40 2hgj s PRO 126 CO 0.00 -0.32 0.31 0.34 0.04 0.00 0.00 177.00 177.37 2hgj s ASP 127 N -3.74 0.47 0.00 6.66 3.68 -1.23 -1.72 116.67 120.79 2hgj s ASP 127 Ca 0.19 0.33 0.00 0.00 2.13 0.00 0.00 52.55 55.20 2hgj s ASP 127 Cb 0.04 0.86 0.00 0.00 -1.45 0.00 0.00 42.92 42.37 2hgj s ASP 127 CO 0.10 -0.28 0.00 -1.54 0.13 0.00 0.00 175.17 173.58 2hgj n SER 128 N 5.35 0.00 -0.00 -0.34 3.41 -1.26 -4.91 113.62 115.87 2hgj n SER 128 Ca -0.05 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.60 2hgj n SER 128 Cb 0.50 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.38 2hgj n SER 128 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2hgj n HIS 129 N 0.00 0.00 -3.81 7.33 8.25 -1.26 -4.87 115.22 120.86 2hgj n HIS 129 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.18 2hgj n HIS 129 Cb 0.00 -0.14 -0.16 0.00 1.12 0.00 0.00 29.99 30.81 2hgj n HIS 129 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2hgj s GLY 130 N -2.64 0.89 0.00 -1.41 0.00 -1.26 -4.96 107.32 97.94 2hgj s GLY 130 Ca -0.01 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 43.83 2hgj s GLY 130 CO 0.38 1.22 0.69 0.00 0.00 0.00 0.00 173.10 175.39 2hgj n ALA 131 N 4.92 1.81 -2.45 3.20 0.00 -1.26 -3.88 120.51 122.85 2hgj n ALA 131 Ca -0.10 -0.69 -0.43 0.00 0.00 0.00 0.00 53.44 52.22 2hgj n ALA 131 Cb 0.46 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.92 2hgj n ALA 131 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2hgj n HIS 132 N -0.24 2.78 0.00 0.00 -0.00 -1.26 -2.52 115.22 113.98 2hgj n HIS 132 Ca 0.00 -2.74 0.00 0.00 0.46 0.00 0.00 57.72 55.44 2hgj n HIS 132 Cb 0.22 -1.81 0.00 0.00 -0.12 0.00 0.00 29.99 28.27 2hgj n HIS 132 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 2hgj n LYS 133 N 3.37 0.00 0.00 1.57 4.76 -1.26 -5.09 118.16 121.50 2hgj n LYS 133 Ca 0.37 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.81 2hgj n LYS 133 Cb 0.36 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.55 2hgj n LYS 133 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2hgj n ILE 134 N 0.00 0.00 0.00 -0.18 5.41 -1.05 -3.86 119.36 119.68 2hgj n ILE 134 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2hgj n ILE 134 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2hgj n ILE 134 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 2hgj n HIS 135 N 0.00 0.00 -4.56 1.39 -0.00 -0.70 -4.75 115.22 106.60 2hgj n HIS 135 Ca 0.00 0.00 -0.27 0.00 0.46 0.00 0.00 57.72 57.91 2hgj n HIS 135 Cb 0.00 0.00 -0.08 0.00 -0.12 0.00 0.00 29.99 29.79 2hgj n HIS 135 CO 0.00 0.00 0.00 -0.98 0.46 0.00 0.00 176.34 175.82 2hgj s ARG 136 N 0.00 1.98 0.00 1.57 1.04 -1.25 0.12 118.95 122.41 2hgj s ARG 136 Ca 0.00 -2.22 0.00 0.00 -1.04 0.00 0.00 55.73 52.47 2hgj s ARG 136 Cb 0.00 -0.81 0.00 0.00 -2.04 0.00 0.00 34.95 32.10 2hgj s ARG 136 CO 0.00 -0.45 0.00 -2.39 -0.04 0.00 0.00 175.30 172.42 2hgj n HIS 137 N -0.98 0.00 -2.86 5.89 1.44 -1.26 -4.73 115.22 112.71 2hgj n HIS 137 Ca -0.08 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.21 2hgj n HIS 137 Cb 0.65 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.73 2hgj n HIS 137 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 2hgj s PRO 138 N 1.04 4.42 0.00 -1.40 0.04 -1.26 -3.26 135.00 134.58 2hgj s PRO 138 Ca 0.00 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.16 2hgj s PRO 138 Cb 0.00 -3.51 0.00 0.00 0.04 0.00 0.00 34.50 31.03 2hgj s PRO 138 CO 0.00 -0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.30 2hgj n GLY 139 N 3.18 -1.28 3.18 0.56 0.00 -1.26 -4.98 105.19 104.58 2hgj n GLY 139 Ca 0.04 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 2hgj n GLY 139 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2hgj s SER 140 N -2.58 2.78 0.00 1.61 0.15 -1.26 -5.08 113.70 109.32 2hgj s SER 140 Ca 0.00 -0.50 0.17 0.00 0.70 0.00 0.00 55.95 56.33 2hgj s SER 140 Cb 0.00 -1.23 0.59 0.00 -1.71 0.00 0.00 66.02 63.66 2hgj s SER 140 CO 0.00 0.14 1.44 2.30 1.20 0.00 0.00 173.24 178.32 2hgj n ILE 141 N 3.55 0.32 0.00 6.45 -5.35 -1.26 -5.05 119.36 118.02 2hgj n ILE 141 Ca -0.20 -0.40 0.00 0.00 -0.27 0.00 0.00 62.75 61.88 2hgj n ILE 141 Cb 0.53 0.33 0.00 0.00 -1.74 0.00 0.00 39.64 38.75 2hgj n ILE 141 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2hgj n GLY 142 N 1.11 0.53 3.60 3.28 0.00 -1.26 -2.06 105.19 110.40 2hgj n GLY 142 Ca 0.15 -0.87 -0.03 0.00 0.00 0.00 0.00 46.02 45.27 2hgj n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hgj s ASN 143 N -4.00 -0.12 0.37 1.61 6.03 -0.38 -5.04 114.94 113.40 2hgj s ASN 143 Ca 0.00 -0.05 -0.26 0.00 -1.03 0.00 0.00 52.86 51.52 2hgj s ASN 143 Cb 0.00 0.17 -0.09 0.00 -3.03 0.00 0.00 41.25 38.30 2hgj s ASN 143 CO 0.00 -0.28 1.12 0.00 -2.03 0.00 0.00 177.10 175.91 2hgj s ARG 144 N -2.47 4.23 0.00 3.55 1.70 -1.26 -1.13 118.95 123.57 2hgj s ARG 144 Ca 0.11 1.73 0.00 0.00 -0.47 0.00 0.00 55.73 57.10 2hgj s ARG 144 Cb 0.01 -2.76 0.00 0.00 -0.57 0.00 0.00 34.95 31.63 2hgj s ARG 144 CO -0.04 -0.14 0.00 1.63 -1.08 0.00 0.00 175.30 175.67 2hgj n LYS 145 N 0.30 -0.38 0.10 3.89 4.76 -1.26 -4.52 118.16 121.05 2hgj n LYS 145 Ca 0.03 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.42 2hgj n LYS 145 Cb 0.47 -1.16 -0.03 0.00 -1.84 0.00 0.00 35.03 32.48 2hgj n LYS 145 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 2hgj h THR 146 N 0.00 0.02 0.00 -0.18 2.02 -1.93 -3.37 112.91 109.47 2hgj h THR 146 Ca 0.00 -0.76 0.00 0.00 0.77 0.00 0.00 66.41 66.42 2hgj h THR 146 Cb 0.00 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.44 2hgj h THR 146 CO 0.00 0.01 -0.66 -0.81 0.37 0.00 0.00 175.52 174.42 2hgj n PRO 147 N -5.00 2.97 -1.40 6.66 -0.04 -1.26 -5.00 135.00 131.93 2hgj n PRO 147 Ca -0.04 -0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 2hgj n PRO 147 Cb 0.14 -0.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 2hgj n PRO 147 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2hgj n GLY 148 N 1.69 0.71 0.00 0.55 0.00 -1.25 -5.01 105.19 101.89 2hgj n GLY 148 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2hgj n GLY 148 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2hgj n ARG 149 N -1.31 0.00 -3.67 1.61 -4.01 -0.29 -4.82 116.66 104.17 2hgj n ARG 149 Ca 0.00 0.00 -0.36 0.00 -1.04 0.00 0.00 57.85 56.45 2hgj n ARG 149 Cb 0.47 0.00 -0.06 0.00 -3.04 0.00 0.00 32.46 29.83 2hgj n ARG 149 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 2hgj s VAL 150 N -3.31 5.22 0.00 8.89 1.01 -1.26 -1.25 120.40 129.69 2hgj s VAL 150 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.39 2hgj s VAL 150 Cb 0.00 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.79 2hgj s VAL 150 CO 0.00 0.45 0.00 0.00 0.00 0.00 0.00 175.10 175.55 2hgj n TYR 151 N 1.40 0.00 -1.75 5.22 -0.00 -0.87 -5.02 117.16 116.14 2hgj n TYR 151 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.77 2hgj n TYR 151 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.87 2hgj n TYR 151 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.86 177.22 2hgj n LYS 152 N 0.00 0.00 -0.92 2.98 -0.00 -1.26 -5.06 118.16 113.90 2hgj n LYS 152 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.30 2hgj n LYS 152 Cb 0.00 -0.03 -0.00 0.00 -0.00 0.00 0.00 35.03 35.00 2hgj n LYS 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2hgj n GLY 153 N 0.00 -0.33 3.93 2.58 0.00 -1.26 -5.14 105.19 104.97 2hgj n GLY 153 Ca 0.00 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 2hgj n GLY 153 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hgj s LYS 154 N 0.01 3.53 0.49 1.61 0.00 -1.26 -5.04 119.74 119.08 2hgj s LYS 154 Ca 0.01 -0.28 -0.14 0.00 0.00 0.00 0.00 55.97 55.56 2hgj s LYS 154 Cb 0.03 -2.75 -0.12 0.00 0.00 0.00 0.00 37.83 34.99 2hgj s LYS 154 CO -0.01 0.29 -0.23 1.63 0.00 0.00 0.00 175.35 177.03 2hgj n LYS 155 N -1.07 0.00 -3.53 1.78 4.76 -1.26 -4.98 118.16 113.85 2hgj n LYS 155 Ca -0.04 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.23 2hgj n LYS 155 Cb 0.55 -0.77 -0.06 0.00 -1.84 0.00 0.00 35.03 32.90 2hgj n LYS 155 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 2hgj s MET 156 N -0.97 0.98 0.30 1.97 1.75 -1.26 -5.05 119.30 117.01 2hgj s MET 156 Ca 0.41 0.28 -0.03 0.00 -1.25 0.00 0.00 55.69 55.10 2hgj s MET 156 Cb -0.32 0.46 0.04 0.00 2.84 0.00 0.00 34.83 37.85 2hgj s MET 156 CO 0.54 -0.30 0.09 0.00 -0.65 0.00 0.00 175.02 174.71 2hgj n ALA 157 N 0.97 -0.54 0.00 4.11 0.00 -1.26 -4.90 120.51 118.88 2hgj n ALA 157 Ca -0.17 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2hgj n ALA 157 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2hgj n ALA 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hgj n GLY 158 N 0.30 -1.09 3.58 0.00 0.00 -1.24 -4.87 105.19 101.87 2hgj n GLY 158 Ca 0.01 -1.69 -0.40 0.00 0.00 0.00 0.00 46.02 43.94 2hgj n GLY 158 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2hgj s HIS 159 N 0.00 1.17 -0.43 1.61 5.65 -1.24 -2.63 115.29 119.41 2hgj s HIS 159 Ca 0.00 0.92 0.08 0.00 0.25 0.00 0.00 55.06 56.31 2hgj s HIS 159 Cb 0.00 -3.81 0.31 0.00 -1.18 0.00 0.00 32.58 27.90 2hgj s HIS 159 CO 0.00 -3.44 0.91 0.66 -0.65 0.00 0.00 174.74 172.22 2hgj n TYR 160 N 13.20 -1.81 0.06 3.88 4.02 -0.05 -4.90 117.16 131.55 2hgj n TYR 160 Ca 0.32 -2.71 0.00 0.00 -0.01 0.00 0.00 57.90 55.50 2hgj n TYR 160 Cb 0.49 0.83 0.00 0.00 -0.02 0.00 0.00 39.34 40.63 2hgj n TYR 160 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2hgj n GLY 161 N 0.65 -0.35 3.44 2.72 0.00 -1.24 -3.26 105.19 107.14 2hgj n GLY 161 Ca 0.14 0.04 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 2hgj n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hgj n ALA 162 N -2.83 3.95 -2.47 4.61 0.00 -1.26 -2.32 120.51 120.20 2hgj n ALA 162 Ca 0.00 -4.25 -0.18 0.00 0.00 0.00 0.00 53.44 49.01 2hgj n ALA 162 Cb 0.00 -3.05 -0.07 0.00 0.00 0.00 0.00 19.45 16.33 2hgj n ALA 162 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2hgj s GLU 163 N 1.49 1.81 -0.04 0.00 1.03 -1.24 -5.06 118.70 116.69 2hgj s GLU 163 Ca 0.43 -1.95 0.06 0.00 0.03 0.00 0.00 54.97 53.54 2hgj s GLU 163 Cb -0.02 0.36 -0.02 0.00 -0.80 0.00 0.00 34.13 33.65 2hgj s GLU 163 CO 0.00 -0.70 -0.23 0.50 -1.33 0.00 0.00 175.26 173.50 2hgj s ARG 164 N -3.31 2.36 0.25 -4.83 3.00 -1.26 -0.47 118.95 114.69 2hgj s ARG 164 Ca 0.38 -0.87 -0.16 0.00 -1.00 0.00 0.00 55.73 54.07 2hgj s ARG 164 Cb 0.02 -2.16 0.06 0.00 0.00 0.00 0.00 34.95 32.87 2hgj s ARG 164 CO 0.26 0.50 0.80 0.28 0.00 0.00 0.00 175.30 177.13 2hgj n VAL 165 N 2.62 0.00 -4.16 7.11 0.31 -0.42 -4.84 118.33 118.95 2hgj n VAL 165 Ca -0.17 -0.67 -0.13 0.00 -0.01 0.00 0.00 64.34 63.37 2hgj n VAL 165 Cb 0.52 0.76 -0.11 0.00 -0.91 0.00 0.00 33.84 34.10 2hgj n VAL 165 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2hgj s THR 166 N -2.17 0.80 -0.41 2.52 -1.32 -1.26 -1.45 115.64 112.34 2hgj s THR 166 Ca 0.17 -1.66 -0.14 0.00 -1.21 0.00 0.00 61.69 58.85 2hgj s THR 166 Cb -0.03 -1.36 0.04 0.00 -1.51 0.00 0.00 72.50 69.64 2hgj s THR 166 CO 0.07 -0.64 0.30 -0.69 -2.21 0.00 0.00 174.62 171.45 2hgj s VAL 167 N -2.68 5.04 0.00 5.08 1.01 0.02 -5.01 120.40 123.85 2hgj s VAL 167 Ca 0.05 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.21 2hgj s VAL 167 Cb -0.01 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.50 2hgj s VAL 167 CO -0.01 -0.36 0.00 0.23 0.00 0.00 0.00 175.10 174.96 2hgj n MET 168 N 5.12 0.00 -4.40 2.72 0.00 -1.26 -1.22 117.12 118.08 2hgj n MET 168 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 57.70 57.28 2hgj n MET 168 Cb 0.46 -0.17 -0.11 0.00 0.00 0.00 0.00 33.22 33.39 2hgj n MET 168 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 2hgj s ASN 169 N -2.70 4.16 0.35 7.83 3.04 -1.26 -3.38 114.94 122.98 2hgj s ASN 169 Ca 0.00 -0.39 -0.17 0.00 0.04 0.00 0.00 52.86 52.34 2hgj s ASN 169 Cb 0.00 -0.75 0.04 0.00 -1.54 0.00 0.00 41.25 39.00 2hgj s ASN 169 CO 0.00 0.22 0.76 -1.48 -3.04 0.00 0.00 177.10 173.55 2hgj s LEU 170 N -1.85 -0.05 0.09 3.21 2.34 0.10 -4.98 118.68 117.54 2hgj s LEU 170 Ca 0.18 -0.99 -0.12 0.00 0.06 0.00 0.00 54.13 53.26 2hgj s LEU 170 Cb -0.11 2.76 -0.06 0.00 -0.56 0.00 0.00 46.19 48.22 2hgj s LEU 170 CO 0.10 -1.57 0.46 -0.70 -1.06 0.00 0.00 176.35 173.58 2hgj s GLU 171 N -2.85 3.87 0.27 1.48 -6.30 -1.24 -1.13 118.70 112.80 2hgj s GLU 171 Ca 0.15 0.34 0.11 0.00 -2.50 0.00 0.00 54.97 53.06 2hgj s GLU 171 Cb -0.05 -3.01 0.33 0.00 0.00 0.00 0.00 34.13 31.40 2hgj s GLU 171 CO 0.10 0.55 1.59 -0.39 0.02 0.00 0.00 175.26 177.13 2hgj h VAL 172 N 2.96 1.40 0.00 3.70 -1.51 -1.33 -3.37 116.25 118.10 2hgj h VAL 172 Ca -0.49 -2.18 0.00 0.00 -1.23 0.00 0.00 66.70 62.80 2hgj h VAL 172 Cb 1.20 2.19 0.00 0.00 -2.13 0.00 0.00 31.29 32.55 2hgj h VAL 172 CO 0.65 0.61 0.00 0.55 -1.23 0.00 0.00 177.57 178.16 2hgj n VAL 173 N -3.73 0.00 -3.52 7.19 3.14 -1.25 -4.22 118.33 115.95 2hgj n VAL 173 Ca -0.01 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.23 2hgj n VAL 173 Cb 0.64 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 33.37 2hgj n VAL 173 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2hgj s ASP 174 N -1.12 -0.52 -0.08 6.55 2.15 -0.29 -3.96 116.67 119.40 2hgj s ASP 174 Ca 0.00 0.23 0.04 0.00 0.43 0.00 0.00 52.55 53.25 2hgj s ASP 174 Cb 0.00 0.53 0.00 0.00 -0.30 0.00 0.00 42.92 43.16 2hgj s ASP 174 CO 0.00 -0.77 -0.21 0.68 -0.17 0.00 0.00 175.17 174.70 2hgj s VAL 175 N -2.60 1.80 -0.64 1.11 -7.23 -1.26 -0.94 120.40 110.64 2hgj s VAL 175 Ca -0.04 -0.88 -0.09 0.00 -1.81 0.00 0.00 61.98 59.15 2hgj s VAL 175 Cb -0.01 -1.56 0.17 0.00 0.56 0.00 0.00 36.38 35.54 2hgj s VAL 175 CO -0.03 0.50 0.52 -0.51 -0.31 0.00 0.00 175.10 175.28 2hgj s ILE 176 N 0.30 4.57 -0.56 -0.62 -1.16 0.01 -4.96 121.20 118.78 2hgj s ILE 176 Ca -0.14 -2.35 0.01 0.00 -0.51 0.00 0.00 60.65 57.66 2hgj s ILE 176 Cb -0.16 -3.93 0.01 0.00 0.61 0.00 0.00 42.46 39.00 2hgj s ILE 176 CO 0.06 -0.89 0.87 -0.81 -2.81 0.00 0.00 174.94 171.36 2hgj n PRO 177 N 4.19 0.01 0.00 3.50 -0.04 -1.26 -1.61 135.00 139.79 2hgj n PRO 177 Ca 0.04 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.84 2hgj n PRO 177 Cb 0.42 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 2hgj n PRO 177 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2hgj n GLU 178 N -1.40 0.00 -1.30 0.54 4.71 -1.26 -4.56 120.64 117.37 2hgj n GLU 178 Ca -0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.16 56.96 2hgj n GLU 178 Cb 0.20 0.00 -0.11 0.00 -1.01 0.00 0.00 31.44 30.52 2hgj n GLU 178 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 2hgj n GLU 179 N 0.00 0.06 0.00 3.49 0.00 -1.26 -4.50 120.64 118.44 2hgj n GLU 179 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 57.16 55.77 2hgj n GLU 179 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 31.44 28.08 2hgj n GLU 179 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2hgj n ASN 180 N 16.24 0.00 -4.35 -1.84 5.03 -1.25 -4.79 115.26 124.31 2hgj n ASN 180 Ca 0.38 0.00 -0.31 0.00 0.87 0.00 0.00 54.58 55.52 2hgj n ASN 180 Cb 0.46 0.00 -0.15 0.00 -1.02 0.00 0.00 39.78 39.07 2hgj n ASN 180 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2hgj s LEU 181 N 0.00 2.20 -0.01 3.41 1.43 -0.63 -1.21 118.68 123.87 2hgj s LEU 181 Ca 0.00 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 52.64 2hgj s LEU 181 Cb 0.00 -1.34 -0.01 0.00 0.03 0.00 0.00 46.19 44.86 2hgj s LEU 181 CO 0.00 0.29 -0.14 -0.22 0.23 0.00 0.00 176.35 176.50 2hgj s LEU 182 N -0.98 2.04 -0.31 1.79 2.96 0.15 -0.81 118.68 123.51 2hgj s LEU 182 Ca 0.11 -0.28 -0.08 0.00 -0.22 0.00 0.00 54.13 53.67 2hgj s LEU 182 Cb -0.10 -0.73 0.01 0.00 0.50 0.00 0.00 46.19 45.87 2hgj s LEU 182 CO 0.01 0.16 0.11 -0.76 -1.32 0.00 0.00 176.35 174.56 2hgj s LEU 183 N -0.41 4.06 -0.11 -0.68 2.01 -0.11 -0.75 118.68 122.69 2hgj s LEU 183 Ca 0.05 -0.75 0.17 0.00 0.01 0.00 0.00 54.13 53.61 2hgj s LEU 183 Cb -0.06 -1.92 -0.25 0.00 0.01 0.00 0.00 46.19 43.97 2hgj s LEU 183 CO -0.00 -0.23 0.21 1.33 1.01 0.00 0.00 176.35 178.66 2hgj n VAL 184 N 4.90 0.70 -1.00 -1.59 0.24 -0.56 -1.13 118.33 119.89 2hgj n VAL 184 Ca -0.14 -0.61 0.00 0.00 -2.04 0.00 0.00 64.34 61.55 2hgj n VAL 184 Cb 0.48 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.56 2hgj n VAL 184 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2hgj n LYS 185 N -2.44 -0.06 -2.47 7.34 0.00 -1.24 -3.60 118.16 115.68 2hgj n LYS 185 Ca -0.18 0.02 -0.23 0.00 0.00 0.00 0.00 58.31 57.91 2hgj n LYS 185 Cb 0.83 -3.05 0.06 0.00 0.00 0.00 0.00 35.03 32.87 2hgj n LYS 185 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2hgj s GLY 186 N -2.00 1.77 0.00 3.14 0.00 -1.26 -4.69 107.32 104.28 2hgj s GLY 186 Ca 0.00 -1.28 -0.00 0.00 0.00 0.00 0.00 44.72 43.44 2hgj s GLY 186 CO 0.00 -0.89 0.46 0.00 0.00 0.00 0.00 173.10 172.67 2hgj n ALA 187 N -2.65 2.07 -1.59 3.20 0.00 -1.26 -4.60 120.51 115.67 2hgj n ALA 187 Ca 0.10 -0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.48 2hgj n ALA 187 Cb 0.60 -1.78 -0.01 0.00 0.00 0.00 0.00 19.45 18.26 2hgj n ALA 187 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2hgj n VAL 188 N 1.90 0.00 -0.05 0.00 0.31 -1.26 -4.41 118.33 114.82 2hgj n VAL 188 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2hgj n VAL 188 Cb 0.11 -0.06 0.00 0.00 -0.91 0.00 0.00 33.84 32.99 2hgj n VAL 188 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2hgj n PRO 189 N -0.92 0.00 0.00 5.55 -0.04 -1.26 -4.44 135.00 133.89 2hgj n PRO 189 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2hgj n PRO 189 Cb 0.10 -0.25 0.00 0.00 -0.04 0.00 0.00 33.50 33.31 2hgj n PRO 189 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2hgj n GLY 190 N 0.70 3.57 2.88 0.55 0.00 -1.22 -3.99 105.19 107.67 2hgj n GLY 190 Ca 0.00 -1.75 -0.36 0.00 0.00 0.00 0.00 46.02 43.91 2hgj n GLY 190 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2hgj n PRO 191 N -1.67 0.00 -3.30 1.61 -0.02 -1.26 -4.84 135.00 125.51 2hgj n PRO 191 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.30 2hgj n PRO 191 Cb 0.00 -0.96 -0.00 0.00 -0.02 0.00 0.00 33.50 32.52 2hgj n PRO 191 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2hgj s ASN 192 N -0.96 5.73 -1.12 2.55 4.22 -1.26 -4.46 114.94 119.64 2hgj s ASN 192 Ca 0.36 -0.34 -0.12 0.00 -2.14 0.00 0.00 52.86 50.61 2hgj s ASN 192 Cb -0.00 -0.93 -0.03 0.00 1.28 0.00 0.00 41.25 41.57 2hgj s ASN 192 CO 0.70 -0.58 0.84 0.61 -2.04 0.00 0.00 177.10 176.63 2hgj n GLY 193 N -1.71 -0.98 0.00 0.45 0.00 0.83 -4.91 105.19 98.87 2hgj n GLY 193 Ca 0.03 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.53 2hgj n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hgj n GLY 194 N -1.48 1.53 3.63 -0.02 0.00 -0.31 -4.89 105.19 103.65 2hgj n GLY 194 Ca -0.11 -0.93 -0.43 0.00 0.00 0.00 0.00 46.02 44.55 2hgj n GLY 194 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2hgj s LEU 195 N 0.00 3.88 0.07 0.99 1.98 -1.26 -0.88 118.68 123.46 2hgj s LEU 195 Ca 0.00 1.30 -0.09 0.00 -2.89 0.00 0.00 54.13 52.45 2hgj s LEU 195 Cb 0.00 -3.54 -0.00 0.00 0.66 0.00 0.00 46.19 43.31 2hgj s LEU 195 CO 0.00 -1.13 0.18 0.68 -1.89 0.00 0.00 176.35 174.19 2hgj s VAL 196 N 4.59 0.14 0.28 1.68 -7.23 -0.21 -1.81 120.40 117.84 2hgj s VAL 196 Ca 0.60 -1.13 -0.15 0.00 -1.81 0.00 0.00 61.98 59.49 2hgj s VAL 196 Cb -0.19 -1.23 0.01 0.00 0.56 0.00 0.00 36.38 35.53 2hgj s VAL 196 CO 0.25 -0.62 0.60 -0.63 -0.31 0.00 0.00 175.10 174.39 2hgj s ILE 197 N -3.52 0.00 -0.02 -0.62 1.09 0.37 -1.20 121.20 117.30 2hgj s ILE 197 Ca 0.02 -1.22 0.04 0.00 -1.10 0.00 0.00 60.65 58.39 2hgj s ILE 197 Cb 0.03 -2.24 -0.01 0.00 -1.06 0.00 0.00 42.46 39.19 2hgj s ILE 197 CO -0.09 0.00 -0.14 -0.69 -0.10 0.00 0.00 174.94 173.92 2hgj s VAL 198 N -3.71 1.16 -0.07 2.92 1.01 -0.09 -1.06 120.40 120.56 2hgj s VAL 198 Ca 0.18 -0.60 -0.14 0.00 0.00 0.00 0.00 61.98 61.42 2hgj s VAL 198 Cb -0.03 -0.99 0.03 0.00 0.00 0.00 0.00 36.38 35.39 2hgj s VAL 198 CO 0.09 0.34 0.33 -0.13 0.00 0.00 0.00 175.10 175.73 2hgj s ARG 199 N -0.13 0.54 -0.31 2.72 3.00 -0.30 -0.84 118.95 123.62 2hgj s ARG 199 Ca 0.01 0.16 -0.02 0.00 0.00 0.00 0.00 55.73 55.88 2hgj s ARG 199 Cb -0.08 0.25 0.11 0.00 0.00 0.00 0.00 34.95 35.23 2hgj s ARG 199 CO 0.00 -0.11 0.14 -1.21 0.00 0.00 0.00 175.30 174.12 2hgj s GLU 200 N -0.55 0.44 -0.05 3.54 0.41 -0.48 -1.27 118.70 120.75 2hgj s GLU 200 Ca -0.07 -0.89 -0.01 0.00 -0.41 0.00 0.00 54.97 53.59 2hgj s GLU 200 Cb -0.04 -1.45 -0.04 0.00 -1.78 0.00 0.00 34.13 30.83 2hgj s GLU 200 CO 0.02 -1.06 0.04 0.99 -0.49 0.00 0.00 175.26 174.77 2hgj s THR 201 N 1.69 4.55 0.00 3.63 2.01 -1.26 -4.91 115.64 121.35 2hgj s THR 201 Ca 0.11 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 61.81 2hgj s THR 201 Cb -0.18 -2.99 0.00 0.00 0.01 0.00 0.00 72.50 69.34 2hgj s THR 201 CO -0.25 0.49 0.00 2.29 -0.69 0.00 0.00 174.62 176.46 2hgj n LYS 202 N 1.70 0.00 0.00 4.92 0.00 -1.26 -4.92 118.16 118.60 2hgj n LYS 202 Ca -0.16 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.16 2hgj n LYS 202 Cb 0.53 0.00 0.07 0.00 -0.00 0.00 0.00 35.03 35.63 2hgj n LYS 202 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2hgj n LYS 203 N 0.00 0.88 -3.96 -1.58 0.00 -1.26 -4.91 118.16 107.33 2hgj n LYS 203 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 58.31 58.03 2hgj n LYS 203 Cb 0.00 -1.04 -0.04 0.00 0.00 0.00 0.00 35.03 33.95 2hgj n LYS 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2hgj s ALA 204 N -2.00 3.90 1.12 3.14 0.00 -1.26 -5.12 121.76 121.54 2hgj s ALA 204 Ca 0.04 -0.98 -0.12 0.00 0.00 0.00 0.00 51.96 50.89 2hgj s ALA 204 Cb 0.02 -1.71 0.26 0.00 0.00 0.00 0.00 23.12 21.68 2hgj s ALA 204 CO 0.03 0.66 1.05 0.00 0.00 0.00 0.00 175.76 177.49 2hgj s ALA 205 N -1.63 -0.16 0.00 0.00 0.00 -1.26 -5.29 121.76 113.42 2hgj s ALA 205 Ca 0.34 0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.32 2hgj s ALA 205 Cb -0.12 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.71 2hgj s ALA 205 CO 0.27 -3.68 0.41 1.17 0.00 0.00 0.00 175.76 173.93