#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgj n PRO 2 N 0.00 0.00 0.00 2.12 -0.04 -1.26 -1.47 135.00 134.35 2hgj n PRO 2 Ca 0.00 0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.81 2hgj n PRO 2 Cb 0.00 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.89 2hgj n PRO 2 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2hgj n LEU 3 N -1.33 0.00 0.28 1.53 0.00 -1.26 -0.98 117.00 115.24 2hgj n LEU 3 Ca 0.00 0.96 0.16 0.00 0.00 0.00 0.00 56.01 57.13 2hgj n LEU 3 Cb 0.07 -0.46 0.81 0.00 0.00 0.00 0.00 43.42 43.84 2hgj n LEU 3 CO 0.00 -0.46 1.02 0.44 0.00 0.00 0.00 177.39 178.39 2hgj h ASP 4 N 0.00 0.00 0.00 1.96 5.19 -1.69 -1.27 116.42 120.61 2hgj h ASP 4 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2hgj h ASP 4 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2hgj h ASP 4 CO 0.00 0.07 0.00 0.52 -3.12 0.00 0.00 179.24 176.71 2hgj n VAL 5 N -3.40 0.00 -0.25 -1.35 0.31 -0.54 -1.02 118.33 112.08 2hgj n VAL 5 Ca -0.01 1.48 0.02 0.00 -0.01 0.00 0.00 64.34 65.82 2hgj n VAL 5 Cb 0.22 -2.32 0.15 0.00 -0.91 0.00 0.00 33.84 30.99 2hgj n VAL 5 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2hgj h ALA 6 N -1.68 1.01 -2.91 3.52 0.00 -1.00 -1.37 119.26 116.83 2hgj h ALA 6 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2hgj h ALA 6 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2hgj h ALA 6 CO 0.00 -0.08 0.00 1.28 0.00 0.00 0.00 179.25 180.45 2hgj n LEU 7 N -4.89 0.00 -0.26 0.00 4.77 -0.49 -0.89 117.00 115.24 2hgj n LEU 7 Ca 0.12 0.51 0.04 0.00 -0.03 0.00 0.00 56.01 56.65 2hgj n LEU 7 Cb 0.31 -0.01 0.17 0.00 -2.33 0.00 0.00 43.42 41.56 2hgj n LEU 7 CO 0.23 -0.01 1.06 0.50 -1.33 0.00 0.00 177.39 177.84 2hgj h LYS 8 N 0.00 0.54 -0.72 3.23 3.11 -1.07 0.86 116.57 122.52 2hgj h LYS 8 Ca 0.00 -0.03 0.06 0.00 -2.81 0.00 0.00 60.65 57.87 2hgj h LYS 8 Cb 0.00 -0.12 -0.09 0.00 -1.00 0.00 0.00 32.23 31.02 2hgj h LYS 8 CO 0.00 0.36 -0.43 0.54 -2.81 0.00 0.00 179.45 177.11 2hgj n ARG 9 N -4.91 -0.32 0.18 1.90 1.74 -0.52 -1.23 116.66 113.50 2hgj n ARG 9 Ca 0.13 1.29 -0.14 0.00 -0.77 0.00 0.00 57.85 58.36 2hgj n ARG 9 Cb 0.35 -1.91 -0.08 0.00 -1.02 0.00 0.00 32.46 29.81 2hgj n ARG 9 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2hgj h LYS 10 N 0.00 -0.41 -0.62 5.56 1.79 0.11 -0.20 116.57 122.79 2hgj h LYS 10 Ca 0.12 0.03 0.07 0.00 -2.18 0.00 0.00 60.65 58.69 2hgj h LYS 10 Cb 0.30 0.09 -0.10 0.00 -1.58 0.00 0.00 32.23 30.94 2hgj h LYS 10 CO -0.68 -0.17 -0.52 1.88 -1.08 0.00 0.00 179.45 178.88 2hgj h TYR 11 N -0.60 -1.60 -0.11 -1.35 0.05 -0.12 -0.57 116.97 112.67 2hgj h TYR 11 Ca -0.04 0.09 -0.01 0.00 0.05 0.00 0.00 58.73 58.82 2hgj h TYR 11 Cb 0.44 0.78 -0.00 0.00 1.01 0.00 0.00 36.73 38.96 2hgj h TYR 11 CO -0.01 -0.44 0.01 0.10 -1.05 0.00 0.00 178.16 176.77 2hgj h TYR 12 N -0.24 0.20 -0.75 4.88 -0.00 -1.21 -0.83 116.97 119.02 2hgj h TYR 12 Ca 0.14 -0.03 0.13 0.00 0.00 0.00 0.00 58.73 58.97 2hgj h TYR 12 Cb 0.54 -0.05 -0.14 0.00 0.00 0.00 0.00 36.73 37.08 2hgj h TYR 12 CO -0.80 0.40 -0.30 0.93 -0.00 0.00 0.00 178.16 178.39 2hgj h GLU 13 N -0.06 -0.07 -0.00 0.10 5.08 0.14 0.72 114.58 120.49 2hgj h GLU 13 Ca 0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 2hgj h GLU 13 Cb 0.31 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2hgj h GLU 13 CO 0.00 -0.05 -0.12 1.49 -1.00 0.00 0.00 179.01 179.34 2hgj h GLU 14 N -0.07 0.08 -0.73 2.33 4.22 -1.02 -3.24 114.58 116.15 2hgj h GLU 14 Ca 0.31 -0.09 0.16 0.00 0.08 0.00 0.00 59.36 59.83 2hgj h GLU 14 Cb 0.57 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.73 2hgj h GLU 14 CO -0.79 0.85 0.13 -0.39 -2.18 0.00 0.00 179.01 176.63 2hgj h VAL 15 N -0.65 0.47 0.00 0.32 -1.51 -0.92 -1.19 116.25 112.77 2hgj h VAL 15 Ca -0.01 -0.08 0.00 0.00 -1.23 0.00 0.00 66.70 65.38 2hgj h VAL 15 Cb 0.89 0.24 0.00 0.00 -2.13 0.00 0.00 31.29 30.29 2hgj h VAL 15 CO 0.02 0.04 0.00 0.54 -1.23 0.00 0.00 177.57 176.94 2hgj n ARG 16 N -5.20 0.00 -0.18 5.19 5.12 0.23 -0.08 116.66 121.74 2hgj n ARG 16 Ca 0.14 0.32 -0.04 0.00 -1.93 0.00 0.00 57.85 56.34 2hgj n ARG 16 Cb 0.46 -0.63 0.06 0.00 -1.16 0.00 0.00 32.46 31.19 2hgj n ARG 16 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2hgj h PRO 17 N 0.00 0.50 0.00 5.56 0.13 -1.55 -0.54 132.00 136.10 2hgj h PRO 17 Ca 0.00 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2hgj h PRO 17 Cb 0.00 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.02 2hgj h PRO 17 CO 0.00 0.33 0.00 -1.91 -0.23 0.00 0.00 178.00 176.19 2hgj n GLU 18 N -4.88 0.00 -0.11 0.86 0.00 0.89 -0.87 120.64 116.52 2hgj n GLU 18 Ca 0.05 0.37 -0.13 0.00 0.00 0.00 0.00 57.16 57.46 2hgj n GLU 18 Cb 0.15 -0.69 -0.03 0.00 0.00 0.00 0.00 31.44 30.87 2hgj n GLU 18 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 2hgj h LEU 19 N 0.00 0.85 0.00 4.31 4.07 -1.26 -1.17 115.31 122.11 2hgj h LEU 19 Ca 0.00 -0.45 0.00 0.00 0.08 0.00 0.00 57.88 57.51 2hgj h LEU 19 Cb 0.00 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 41.50 2hgj h LEU 19 CO 0.00 1.12 0.00 -0.38 -1.08 0.00 0.00 178.44 178.10 2hgj n ILE 20 N -4.21 0.00 0.06 1.22 2.08 -0.05 -0.18 119.36 118.29 2hgj n ILE 20 Ca -0.03 0.30 -0.20 0.00 0.56 0.00 0.00 62.75 63.39 2hgj n ILE 20 Cb 0.47 -0.41 -0.15 0.00 -0.75 0.00 0.00 39.64 38.81 2hgj n ILE 20 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 2hgj h ARG 21 N 0.00 0.32 -1.63 0.38 9.65 -1.21 -0.47 114.38 121.42 2hgj h ARG 21 Ca 0.00 -0.54 0.47 0.00 -1.10 0.00 0.00 59.98 58.81 2hgj h ARG 21 Cb 0.00 0.20 -0.07 0.00 -1.39 0.00 0.00 29.97 28.72 2hgj h ARG 21 CO 0.00 1.20 1.33 -0.09 2.80 0.00 0.00 179.97 185.21 2hgj h ARG 22 N 0.09 0.00 0.00 0.20 1.12 0.75 -3.22 114.38 113.32 2hgj h ARG 22 Ca -0.31 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.56 2hgj h ARG 22 Cb 2.06 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 32.02 2hgj h ARG 22 CO 0.16 0.00 0.00 1.19 -3.11 0.00 0.00 179.97 178.21 2hgj n PHE 23 N -3.72 0.00 0.02 2.20 3.72 -0.39 -4.92 117.46 114.37 2hgj n PHE 23 Ca 0.37 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.75 2hgj n PHE 23 Cb 1.82 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 40.35 2hgj n PHE 23 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2hgj h GLY 24 N 0.00 -0.96 -0.31 1.37 0.00 -1.08 -3.45 103.07 98.64 2hgj h GLY 24 Ca 0.00 0.42 -0.09 0.00 0.00 0.00 0.00 47.33 47.66 2hgj h GLY 24 CO 0.00 -0.35 -0.09 2.98 0.00 0.00 0.00 176.54 179.08 2hgj n TYR 25 N -2.70 -0.05 0.00 5.60 4.19 -1.21 -4.97 117.16 118.03 2hgj n TYR 25 Ca -0.01 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.20 2hgj n TYR 25 Cb 0.05 -1.26 0.00 0.00 0.49 0.00 0.00 39.34 38.62 2hgj n TYR 25 CO 0.00 0.00 0.00 0.94 0.91 0.00 0.00 176.86 178.71 2hgj n GLN 26 N -2.56 0.00 0.00 2.98 7.27 -1.26 -4.97 117.38 118.83 2hgj n GLN 26 Ca -0.05 0.38 0.00 0.00 0.07 0.00 0.00 57.00 57.40 2hgj n GLN 26 Cb 0.23 -0.97 0.00 0.00 2.41 0.00 0.00 30.24 31.92 2hgj n GLN 26 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 2hgj n ASN 27 N -1.63 0.00 0.00 1.69 2.85 -1.26 -5.00 115.26 111.92 2hgj n ASN 27 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2hgj n ASN 27 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2hgj n ASN 27 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 2hgj n VAL 28 N 0.00 0.00 0.00 3.44 0.31 -1.26 -4.85 118.33 115.97 2hgj n VAL 28 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2hgj n VAL 28 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2hgj n VAL 28 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 2hgj n TRP 29 N -0.02 -1.18 -0.61 3.52 8.01 -1.26 -4.52 117.44 121.39 2hgj n TRP 29 Ca 0.00 0.00 -0.34 0.00 -1.31 0.00 0.00 57.50 55.85 2hgj n TRP 29 Cb 0.00 0.00 -0.09 0.00 -2.01 0.00 0.00 31.31 29.21 2hgj n TRP 29 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.69 177.07 2hgj n GLU 30 N -0.38 0.00 -2.27 -0.99 -0.58 -1.26 -4.49 120.64 110.68 2hgj n GLU 30 Ca 0.00 -0.76 -0.25 0.00 -0.42 0.00 0.00 57.16 55.73 2hgj n GLU 30 Cb 0.00 -2.14 0.01 0.00 -0.57 0.00 0.00 31.44 28.74 2hgj n GLU 30 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2hgj n VAL 31 N 6.14 2.43 0.00 2.62 0.31 -1.26 -4.57 118.33 124.00 2hgj n VAL 31 Ca 0.35 -4.59 0.00 0.00 -0.01 0.00 0.00 64.34 60.09 2hgj n VAL 31 Cb 0.37 -1.19 0.00 0.00 -0.91 0.00 0.00 33.84 32.11 2hgj n VAL 31 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2hgj n PRO 32 N -0.58 0.00 0.00 5.55 -0.04 -1.26 -4.61 135.00 134.05 2hgj n PRO 32 Ca 0.41 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.87 2hgj n PRO 32 Cb 0.80 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.26 2hgj n PRO 32 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2hgj n ARG 33 N 0.00 -0.56 -3.56 0.54 -4.01 -1.26 -4.89 116.66 102.92 2hgj n ARG 33 Ca 0.00 0.00 -0.37 0.00 -1.04 0.00 0.00 57.85 56.44 2hgj n ARG 33 Cb 0.00 0.00 -0.09 0.00 -3.04 0.00 0.00 32.46 29.33 2hgj n ARG 33 CO 0.00 0.00 0.00 -0.51 -3.04 0.00 0.00 177.63 174.08 2hgj s LEU 34 N 0.00 4.10 -0.03 2.89 1.02 -1.26 -1.33 118.68 124.06 2hgj s LEU 34 Ca 0.00 0.19 0.01 0.00 0.02 0.00 0.00 54.13 54.36 2hgj s LEU 34 Cb 0.00 -2.23 0.02 0.00 0.02 0.00 0.00 46.19 43.99 2hgj s LEU 34 CO 0.00 -0.02 -0.05 -0.70 0.02 0.00 0.00 176.35 175.61 2hgj s GLU 35 N 1.37 0.74 0.10 1.70 -6.30 -0.21 -4.98 118.70 111.11 2hgj s GLU 35 Ca 0.11 -0.13 0.00 0.00 -2.50 0.00 0.00 54.97 52.45 2hgj s GLU 35 Cb -0.14 -0.74 0.00 0.00 0.00 0.00 0.00 34.13 33.24 2hgj s GLU 35 CO 0.07 -0.03 0.00 0.36 0.02 0.00 0.00 175.26 175.68 2hgj n LYS 36 N 3.78 -0.53 -3.28 4.30 -0.00 -1.05 -1.27 118.16 120.12 2hgj n LYS 36 Ca -0.23 0.43 -0.07 0.00 -0.00 0.00 0.00 58.31 58.44 2hgj n LYS 36 Cb 0.52 -1.03 -0.04 0.00 -0.00 0.00 0.00 35.03 34.48 2hgj n LYS 36 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2hgj s VAL 37 N -4.81 -0.69 0.62 0.58 1.01 -1.19 -1.58 120.40 114.35 2hgj s VAL 37 Ca 0.00 -0.38 -0.15 0.00 0.00 0.00 0.00 61.98 61.46 2hgj s VAL 37 Cb 0.00 -0.65 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 2hgj s VAL 37 CO 0.00 -0.26 1.06 0.68 0.00 0.00 0.00 175.10 176.58 2hgj s VAL 38 N 2.10 3.77 0.03 2.92 -7.23 -0.91 -4.26 120.40 116.82 2hgj s VAL 38 Ca 0.13 0.79 0.01 0.00 -1.81 0.00 0.00 61.98 61.10 2hgj s VAL 38 Cb -0.11 -3.34 -0.02 0.00 0.56 0.00 0.00 36.38 33.47 2hgj s VAL 38 CO -0.17 -0.55 -0.05 -0.63 -0.31 0.00 0.00 175.10 173.39 2hgj s ILE 39 N -2.55 0.35 -0.00 -0.62 1.09 0.17 -0.92 121.20 118.72 2hgj s ILE 39 Ca 0.63 -0.87 -0.08 0.00 -1.10 0.00 0.00 60.65 59.23 2hgj s ILE 39 Cb -0.16 -0.43 0.01 0.00 -1.06 0.00 0.00 42.46 40.81 2hgj s ILE 39 CO 0.41 -0.34 0.17 0.21 -0.10 0.00 0.00 174.94 175.28 2hgj s ASN 40 N -1.29 -0.02 0.07 3.58 3.04 -0.30 -1.18 114.94 118.84 2hgj s ASN 40 Ca -0.10 -0.12 0.03 0.00 0.04 0.00 0.00 52.86 52.71 2hgj s ASN 40 Cb -0.09 0.23 -0.03 0.00 -1.54 0.00 0.00 41.25 39.83 2hgj s ASN 40 CO -0.00 -0.36 -0.10 -1.58 -3.04 0.00 0.00 177.10 172.02 2hgj s GLN 41 N -1.28 0.73 0.00 0.43 0.74 -1.25 -1.24 119.66 117.79 2hgj s GLN 41 Ca -0.14 -1.00 0.00 0.00 0.05 0.00 0.00 55.36 54.27 2hgj s GLN 41 Cb -0.07 -0.46 0.00 0.00 1.10 0.00 0.00 33.01 33.58 2hgj s GLN 41 CO 0.02 0.08 0.00 0.41 -0.55 0.00 0.00 175.29 175.25 2hgj n GLY 42 N 0.93 0.00 1.88 2.59 0.00 -0.32 -4.74 105.19 105.53 2hgj n GLY 42 Ca -0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 2hgj n GLY 42 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2hgj n LEU 43 N 0.61 -2.48 0.00 0.99 0.00 -1.26 -3.18 117.00 111.68 2hgj n LEU 43 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 56.01 56.33 2hgj n LEU 43 Cb 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 43.42 42.93 2hgj n LEU 43 CO 0.00 -2.99 0.00 0.61 0.00 0.00 0.00 177.39 175.01 2hgj n GLY 44 N 1.61 0.55 0.04 -3.96 0.00 -1.26 -3.54 105.19 98.63 2hgj n GLY 44 Ca 0.03 0.38 0.04 0.00 0.00 0.00 0.00 46.02 46.47 2hgj n GLY 44 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hgj n GLU 45 N 0.00 -0.01 -0.35 1.61 1.02 -1.15 0.32 120.64 122.08 2hgj n GLU 45 Ca 0.00 0.18 -0.01 0.00 -0.02 0.00 0.00 57.16 57.31 2hgj n GLU 45 Cb 0.00 -0.32 -0.02 0.00 -0.02 0.00 0.00 31.44 31.08 2hgj n GLU 45 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2hgj n ALA 46 N -3.04 3.22 -2.45 0.62 0.00 -1.19 -4.77 120.51 112.90 2hgj n ALA 46 Ca 0.05 -0.17 -0.36 0.00 0.00 0.00 0.00 53.44 52.96 2hgj n ALA 46 Cb 0.16 -1.52 -0.06 0.00 0.00 0.00 0.00 19.45 18.03 2hgj n ALA 46 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2hgj s LYS 47 N 0.92 3.91 0.00 0.00 2.47 0.94 -4.78 119.74 123.19 2hgj s LYS 47 Ca 0.06 0.38 0.00 0.00 -1.56 0.00 0.00 55.97 54.85 2hgj s LYS 47 Cb 0.03 -3.01 0.00 0.00 -1.46 0.00 0.00 37.83 33.39 2hgj s LYS 47 CO 0.00 0.55 0.00 -1.91 0.16 0.00 0.00 175.35 174.15 2hgj n GLU 48 N 1.03 0.00 0.00 4.03 2.13 -1.26 -5.00 120.64 121.57 2hgj n GLU 48 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 2hgj n GLU 48 Cb 0.52 -0.14 0.00 0.00 0.27 0.00 0.00 31.44 32.09 2hgj n GLU 48 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2hgj n ASP 49 N 0.00 0.00 0.00 4.31 10.43 -1.26 -4.25 116.55 125.77 2hgj n ASP 49 Ca 0.00 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.36 2hgj n ASP 49 Cb 0.18 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.14 2hgj n ASP 49 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2hgj n ALA 50 N 9.86 0.00 -1.00 2.24 0.00 -1.26 -1.22 120.51 129.14 2hgj n ALA 50 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgj n ALA 50 Cb 0.00 0.27 0.00 0.00 0.00 0.00 0.00 19.45 19.72 2hgj n ALA 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2hgj n ARG 51 N -2.14 0.00 -0.34 0.00 3.00 -1.26 -1.06 116.66 114.86 2hgj n ARG 51 Ca 0.00 0.00 0.35 0.00 -0.01 0.00 0.00 57.85 58.19 2hgj n ARG 51 Cb 0.00 -0.18 0.58 0.00 0.00 0.00 0.00 32.46 32.86 2hgj n ARG 51 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 2hgj h ILE 52 N 0.00 0.04 0.47 0.55 2.04 -1.86 0.84 117.51 119.58 2hgj h ILE 52 Ca 0.00 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 2hgj h ILE 52 Cb 0.00 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.15 2hgj h ILE 52 CO 0.00 0.00 -0.22 -0.07 0.00 0.00 0.00 178.15 177.86 2hgj h LEU 53 N 0.00 -0.53 -1.94 1.44 4.07 -1.18 0.30 115.31 117.46 2hgj h LEU 53 Ca 0.61 0.02 0.14 0.00 0.08 0.00 0.00 57.88 58.72 2hgj h LEU 53 Cb 3.04 0.14 -0.02 0.00 1.08 0.00 0.00 40.66 44.89 2hgj h LEU 53 CO -0.01 -0.17 0.37 -0.33 -1.08 0.00 0.00 178.44 177.22 2hgj h GLU 54 N -1.04 0.06 -0.27 1.13 3.07 0.80 0.86 114.58 119.19 2hgj h GLU 54 Ca -0.06 -0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.61 2hgj h GLU 54 Cb 0.48 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.38 2hgj h GLU 54 CO 0.11 0.04 -0.55 -0.22 -1.40 0.00 0.00 179.01 176.99 2hgj h LYS 55 N 0.06 0.81 -0.97 2.33 3.11 -1.15 -0.39 116.57 120.36 2hgj h LYS 55 Ca 0.25 -0.51 0.22 0.00 -2.81 0.00 0.00 60.65 57.79 2hgj h LYS 55 Cb 0.91 0.06 -0.08 0.00 -1.00 0.00 0.00 32.23 32.11 2hgj h LYS 55 CO -0.02 1.14 0.62 0.00 -2.81 0.00 0.00 179.45 178.39 2hgj h ALA 56 N 0.76 2.08 -0.61 5.00 0.00 0.13 0.04 119.26 126.65 2hgj h ALA 56 Ca 0.01 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2hgj h ALA 56 Cb 1.14 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2hgj h ALA 56 CO 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 178.95 2hgj n ALA 57 N -2.46 -0.33 -0.25 0.00 0.00 -0.20 -0.91 120.51 116.36 2hgj n ALA 57 Ca 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.64 2hgj n ALA 57 Cb 0.71 0.08 0.01 0.00 0.00 0.00 0.00 19.45 20.25 2hgj n ALA 57 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2hgj n GLN 58 N -1.85 -0.17 0.19 0.00 6.02 -0.30 -0.95 117.38 120.32 2hgj n GLN 58 Ca 0.00 0.97 -0.08 0.00 -0.01 0.00 0.00 57.00 57.89 2hgj n GLN 58 Cb 0.00 -1.44 -0.04 0.00 1.02 0.00 0.00 30.24 29.78 2hgj n GLN 58 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 2hgj h GLU 59 N 0.00 -0.47 -0.97 -1.09 4.11 -0.96 -0.74 114.58 114.45 2hgj h GLU 59 Ca 0.20 0.03 0.24 0.00 0.07 0.00 0.00 59.36 59.90 2hgj h GLU 59 Cb 0.36 0.11 -0.12 0.00 0.50 0.00 0.00 28.75 29.59 2hgj h GLU 59 CO -0.62 -0.32 0.54 -0.07 0.07 0.00 0.00 179.01 178.61 2hgj h LEU 60 N -0.57 0.59 0.00 3.06 -0.00 -0.88 -0.48 115.31 117.03 2hgj h LEU 60 Ca -0.05 0.14 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2hgj h LEU 60 Cb 0.38 0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.09 2hgj h LEU 60 CO 0.08 0.08 0.00 0.00 -0.00 0.00 0.00 178.44 178.60 2hgj n ALA 61 N -2.36 0.00 -0.01 1.53 0.00 0.41 -1.30 120.51 118.78 2hgj n ALA 61 Ca 0.25 0.00 0.23 0.00 0.00 0.00 0.00 53.44 53.92 2hgj n ALA 61 Cb 0.71 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.89 2hgj n ALA 61 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2hgj h LEU 62 N 0.00 0.00 0.24 0.00 4.07 -1.02 -0.11 115.31 118.49 2hgj h LEU 62 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 2hgj h LEU 62 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 2hgj h LEU 62 CO 0.00 0.00 -0.12 -0.29 -1.08 0.00 0.00 178.44 176.95 2hgj h ILE 63 N 0.00 0.80 0.00 1.22 6.09 -0.92 -3.43 117.51 121.27 2hgj h ILE 63 Ca 0.27 -0.26 0.00 0.00 -1.37 0.00 0.00 64.86 63.51 2hgj h ILE 63 Cb 1.27 0.95 0.00 0.00 0.47 0.00 0.00 36.82 39.51 2hgj h ILE 63 CO -0.00 0.06 0.00 1.07 -3.07 0.00 0.00 178.15 176.20 2hgj n THR 64 N -5.17 0.00 0.00 2.19 5.66 -0.42 -5.10 114.28 111.44 2hgj n THR 64 Ca -0.09 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 2hgj n THR 64 Cb 0.19 0.43 0.00 0.00 -1.55 0.00 0.00 70.33 69.40 2hgj n THR 64 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2hgj n GLY 65 N 0.00 0.78 0.00 1.09 0.00 -0.16 -5.05 105.19 101.85 2hgj n GLY 65 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2hgj n GLY 65 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2hgj n GLN 66 N 0.00 0.00 -3.78 1.61 7.27 -1.26 -4.92 117.38 116.30 2hgj n GLN 66 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.77 2hgj n GLN 66 Cb 0.00 0.00 -0.15 0.00 2.41 0.00 0.00 30.24 32.50 2hgj n GLN 66 CO 0.00 0.00 0.00 -1.59 0.07 0.00 0.00 177.06 175.54 2hgj s LYS 67 N -1.23 0.87 0.03 3.69 -2.85 -1.26 0.15 119.74 119.14 2hgj s LYS 67 Ca 0.00 -1.00 -0.01 0.00 -1.00 0.00 0.00 55.97 53.97 2hgj s LYS 67 Cb 0.00 -2.17 -0.01 0.00 -2.06 0.00 0.00 37.83 33.60 2hgj s LYS 67 CO 0.00 -0.87 -0.02 -2.30 0.10 0.00 0.00 175.35 172.26 2hgj n PRO 68 N 4.82 0.00 0.00 1.78 -0.02 -1.26 -4.51 135.00 135.81 2hgj n PRO 68 Ca -0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 2hgj n PRO 68 Cb 0.43 -0.03 0.00 0.00 -0.02 0.00 0.00 33.50 33.88 2hgj n PRO 68 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hgj n ALA 69 N -0.07 0.00 -3.18 3.55 0.00 -1.26 -4.19 120.51 115.36 2hgj n ALA 69 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2hgj n ALA 69 Cb 0.02 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.41 2hgj n ALA 69 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2hgj n VAL 70 N 0.00 -0.76 -2.01 0.00 0.31 -1.26 -2.57 118.33 112.04 2hgj n VAL 70 Ca 0.00 -3.30 -0.00 0.00 -0.01 0.00 0.00 64.34 61.03 2hgj n VAL 70 Cb 0.00 -1.25 -0.00 0.00 -0.91 0.00 0.00 33.84 31.67 2hgj n VAL 70 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2hgj n THR 71 N 2.07 0.00 0.09 2.52 5.66 -1.26 -4.78 114.28 118.57 2hgj n THR 71 Ca 0.23 -0.03 0.00 0.00 -3.05 0.00 0.00 64.05 61.20 2hgj n THR 71 Cb 0.52 0.27 0.00 0.00 -1.55 0.00 0.00 70.33 69.58 2hgj n THR 71 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2hgj n ARG 72 N 0.01 0.04 -3.09 1.09 3.00 -1.26 -3.23 116.66 113.23 2hgj n ARG 72 Ca -0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 57.85 57.74 2hgj n ARG 72 Cb 0.61 -1.04 -0.03 0.00 0.00 0.00 0.00 32.46 32.00 2hgj n ARG 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2hgj s ALA 73 N -2.00 -1.27 -0.27 7.54 0.00 -1.26 -2.91 121.76 121.58 2hgj s ALA 73 Ca 0.00 -0.71 -0.00 0.00 0.00 0.00 0.00 51.96 51.25 2hgj s ALA 73 Cb 0.00 -2.41 0.08 0.00 0.00 0.00 0.00 23.12 20.79 2hgj s ALA 73 CO 0.00 -2.18 0.04 0.21 0.00 0.00 0.00 175.76 173.84 2hgj s LYS 74 N 1.09 1.05 0.00 0.00 2.20 -1.20 -4.70 119.74 118.18 2hgj s LYS 74 Ca 0.24 -1.05 0.00 0.00 -0.36 0.00 0.00 55.97 54.80 2hgj s LYS 74 Cb -0.04 -2.33 0.00 0.00 -1.51 0.00 0.00 37.83 33.95 2hgj s LYS 74 CO -0.07 -0.82 0.00 1.63 -0.36 0.00 0.00 175.35 175.73 2hgj n LYS 75 N 4.75 0.00 -0.02 4.03 5.02 -1.26 -3.86 118.16 126.82 2hgj n LYS 75 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 2hgj n LYS 75 Cb 0.43 -0.64 0.00 0.00 -0.02 0.00 0.00 35.03 34.80 2hgj n LYS 75 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2hgj n SER 76 N 0.31 0.00 0.00 4.39 2.88 -1.26 0.93 113.62 120.86 2hgj n SER 76 Ca 0.00 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.63 2hgj n SER 76 Cb 0.13 -0.03 0.43 0.00 -0.75 0.00 0.00 64.21 63.99 2hgj n SER 76 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hgj n ILE 77 N -0.05 0.62 0.00 2.46 0.13 -1.26 -3.98 119.36 117.27 2hgj n ILE 77 Ca 0.00 0.15 0.00 0.00 -1.10 0.00 0.00 62.75 61.80 2hgj n ILE 77 Cb 0.00 -0.82 0.00 0.00 -0.84 0.00 0.00 39.64 37.98 2hgj n ILE 77 CO 0.00 0.00 0.00 -1.20 2.80 0.00 0.00 176.55 178.15 2hgj n SER 78 N -1.45 0.00 -3.79 9.51 7.64 -1.26 -4.47 113.62 119.79 2hgj n SER 78 Ca 0.06 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.64 2hgj n SER 78 Cb 0.21 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.27 2hgj n SER 78 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2hgj s ASN 79 N -2.88 4.04 0.00 6.43 4.22 -1.26 -4.90 114.94 120.60 2hgj s ASN 79 Ca 0.00 -2.20 0.00 0.00 -2.14 0.00 0.00 52.86 48.52 2hgj s ASN 79 Cb 0.00 -1.12 0.00 0.00 1.28 0.00 0.00 41.25 41.41 2hgj s ASN 79 CO 0.00 -0.34 0.00 0.33 -2.04 0.00 0.00 177.10 175.05 2hgj n PHE 80 N 4.12 0.00 -2.72 1.54 -0.00 -1.26 -4.12 117.46 115.02 2hgj n PHE 80 Ca 0.04 0.00 0.01 0.00 -0.00 0.00 0.00 57.45 57.50 2hgj n PHE 80 Cb 0.38 0.00 0.04 0.00 -0.00 0.00 0.00 39.48 39.91 2hgj n PHE 80 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.76 177.93 2hgj n LYS 81 N 0.00 1.22 0.00 -4.13 4.81 -1.26 -4.95 118.16 113.85 2hgj n LYS 81 Ca 0.00 -3.06 0.00 0.00 -0.87 0.00 0.00 58.31 54.38 2hgj n LYS 81 Cb 0.00 -1.13 0.00 0.00 0.02 0.00 0.00 35.03 33.92 2hgj n LYS 81 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 2hgj n LEU 82 N -0.27 0.21 -4.58 3.14 -0.00 -1.26 -5.10 117.00 109.14 2hgj n LEU 82 Ca 0.07 -0.21 -0.31 0.00 -0.00 0.00 0.00 56.01 55.56 2hgj n LEU 82 Cb 0.91 0.00 0.18 0.00 -0.00 0.00 0.00 43.42 44.51 2hgj n LEU 82 CO 0.04 0.05 0.50 0.54 -0.00 0.00 0.00 177.39 178.52 2hgj n ARG 83 N -0.02 -0.90 0.00 1.47 3.00 -1.26 -4.81 116.66 114.15 2hgj n ARG 83 Ca 0.00 -0.21 0.00 0.00 -0.01 0.00 0.00 57.85 57.63 2hgj n ARG 83 Cb 0.26 -2.24 0.00 0.00 0.00 0.00 0.00 32.46 30.47 2hgj n ARG 83 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2hgj n LYS 84 N -4.00 0.00 -0.02 5.56 5.02 0.26 -4.98 118.16 120.00 2hgj n LYS 84 Ca 0.09 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.34 2hgj n LYS 84 Cb 0.53 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.51 2hgj n LYS 84 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2hgj h GLY 85 N 0.00 -0.07 0.00 0.72 0.00 -1.87 -3.50 103.07 98.35 2hgj h GLY 85 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2hgj h GLY 85 CO 0.00 -0.02 0.00 1.03 0.00 0.00 0.00 176.54 177.55 2hgj n MET 86 N -4.79 0.00 -0.49 4.80 2.81 -1.26 -5.10 117.12 113.08 2hgj n MET 86 Ca -0.03 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.77 2hgj n MET 86 Cb 0.11 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 32.56 2hgj n MET 86 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2hgj n PRO 87 N 0.00 1.12 -3.19 0.03 -0.04 -1.25 -4.56 135.00 127.11 2hgj n PRO 87 Ca 0.00 -0.68 0.02 0.00 -0.04 0.00 0.00 63.50 62.80 2hgj n PRO 87 Cb 0.00 -1.90 -0.01 0.00 -0.04 0.00 0.00 33.50 31.55 2hgj n PRO 87 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2hgj s ILE 88 N 2.55 -0.98 -0.64 0.52 1.01 -1.26 -4.57 121.20 117.82 2hgj s ILE 88 Ca 0.31 -0.02 0.04 0.00 0.00 0.00 0.00 60.65 60.98 2hgj s ILE 88 Cb 0.13 -0.49 0.16 0.00 0.01 0.00 0.00 42.46 42.26 2hgj s ILE 88 CO -0.01 -0.02 0.42 -0.83 0.00 0.00 0.00 174.94 174.50 2hgj s GLY 89 N 2.31 2.77 -0.84 6.18 0.00 -1.26 -4.63 107.32 111.85 2hgj s GLY 89 Ca 0.13 -3.64 -0.16 0.00 0.00 0.00 0.00 44.72 41.05 2hgj s GLY 89 CO -0.16 1.06 0.90 -2.27 0.00 0.00 0.00 173.10 172.63 2hgj s LEU 90 N -1.02 5.92 0.15 0.66 1.98 -1.26 -4.98 118.68 120.13 2hgj s LEU 90 Ca 0.22 -2.29 -0.14 0.00 -2.89 0.00 0.00 54.13 49.03 2hgj s LEU 90 Cb -0.12 -2.30 0.02 0.00 0.66 0.00 0.00 46.19 44.45 2hgj s LEU 90 CO -0.10 -0.83 0.39 0.00 -1.89 0.00 0.00 176.35 173.92 2hgj s ARG 91 N 1.46 1.16 -0.25 1.98 1.04 -1.26 -3.88 118.95 119.21 2hgj s ARG 91 Ca 0.23 -0.89 -0.01 0.00 -1.04 0.00 0.00 55.73 54.02 2hgj s ARG 91 Cb -0.10 0.45 0.08 0.00 -2.04 0.00 0.00 34.95 33.34 2hgj s ARG 91 CO -0.07 -0.46 0.05 0.08 -0.04 0.00 0.00 175.30 174.86 2hgj s VAL 92 N -3.87 0.82 -0.20 4.99 1.01 -0.32 -5.01 120.40 117.82 2hgj s VAL 92 Ca 0.08 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.06 2hgj s VAL 92 Cb 0.02 -1.41 0.15 0.00 0.00 0.00 0.00 36.38 35.14 2hgj s VAL 92 CO -0.06 -0.38 1.93 0.41 0.00 0.00 0.00 175.10 176.99 2hgj n THR 93 N 4.91 2.42 -1.67 3.92 -1.04 -1.26 -0.65 114.28 120.90 2hgj n THR 93 Ca -0.07 -1.19 -0.38 0.00 -2.04 0.00 0.00 64.05 60.37 2hgj n THR 93 Cb 0.45 -1.32 0.05 0.00 -1.82 0.00 0.00 70.33 67.68 2hgj n THR 93 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2hgj n LEU 94 N 0.64 4.56 0.00 -4.42 4.32 -1.26 -4.79 117.00 116.05 2hgj n LEU 94 Ca 0.20 0.88 0.00 0.00 -0.02 0.00 0.00 56.01 57.06 2hgj n LEU 94 Cb 0.59 -1.47 0.00 0.00 -1.62 0.00 0.00 43.42 40.92 2hgj n LEU 94 CO 0.25 -1.31 0.20 -1.14 -1.22 0.00 0.00 177.39 174.17 2hgj n ARG 95 N -1.09 0.32 0.00 3.23 3.00 -1.26 -2.99 116.66 117.87 2hgj n ARG 95 Ca 0.13 -0.49 0.00 0.00 -0.00 0.00 0.00 57.85 57.49 2hgj n ARG 95 Cb 0.46 -0.66 0.00 0.00 0.00 0.00 0.00 32.46 32.26 2hgj n ARG 95 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2hgj n ARG 96 N -0.08 0.00 0.09 -0.14 1.85 -1.26 -2.52 116.66 114.60 2hgj n ARG 96 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.73 2hgj n ARG 96 Cb 0.29 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.63 2hgj n ARG 96 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 2hgj h ASP 97 N 0.00 -1.13 -0.91 2.89 5.19 -2.01 0.24 116.42 120.69 2hgj h ASP 97 Ca 0.00 0.12 0.27 0.00 -0.62 0.00 0.00 57.03 56.80 2hgj h ASP 97 Cb 0.00 0.41 -0.17 0.00 0.18 0.00 0.00 39.33 39.75 2hgj h ASP 97 CO 0.00 -0.41 0.09 0.54 -3.12 0.00 0.00 179.24 176.34 2hgj n ARG 98 N -4.61 -0.07 0.00 3.56 1.74 -1.26 0.27 116.66 116.29 2hgj n ARG 98 Ca -0.06 1.35 -0.04 0.00 -0.77 0.00 0.00 57.85 58.32 2hgj n ARG 98 Cb 0.30 -2.18 -0.03 0.00 -1.02 0.00 0.00 32.46 29.53 2hgj n ARG 98 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 2hgj h MET 99 N 0.00 -0.17 -0.97 5.56 2.86 -1.02 0.25 114.93 121.44 2hgj h MET 99 Ca 0.59 0.01 0.28 0.00 -2.06 0.00 0.00 59.70 58.52 2hgj h MET 99 Cb 1.28 0.04 -0.18 0.00 0.06 0.00 0.00 31.60 32.80 2hgj h MET 99 CO -0.83 -0.11 0.13 -1.49 1.06 0.00 0.00 176.91 175.66 2hgj h TRP 100 N -0.18 0.13 -0.87 -0.22 6.55 0.56 2.93 115.95 124.85 2hgj h TRP 100 Ca 0.01 0.06 0.06 0.00 0.95 0.00 0.00 58.89 59.97 2hgj h TRP 100 Cb 0.20 0.10 -0.05 0.00 -0.86 0.00 0.00 29.16 28.55 2hgj h TRP 100 CO -0.47 -0.41 0.57 0.97 -1.05 0.00 0.00 178.44 178.05 2hgj h ILE 101 N 0.04 1.08 -0.62 1.49 -0.00 0.08 0.94 117.51 120.51 2hgj h ILE 101 Ca 0.62 -0.34 -0.02 0.00 -0.00 0.00 0.00 64.86 65.12 2hgj h ILE 101 Cb 1.35 -0.01 -0.03 0.00 -0.00 0.00 0.00 36.82 38.13 2hgj h ILE 101 CO -0.86 0.18 0.32 -0.26 -0.00 0.00 0.00 178.15 177.53 2hgj h PHE 102 N 1.00 0.87 -1.02 2.19 -1.00 0.64 0.16 116.94 119.78 2hgj h PHE 102 Ca 0.37 -0.03 0.25 0.00 2.81 0.00 0.00 57.97 61.37 2hgj h PHE 102 Cb 0.16 -0.27 -0.11 0.00 3.61 0.00 0.00 35.95 39.34 2hgj h PHE 102 CO -0.00 0.64 0.63 1.25 -1.61 0.00 0.00 178.31 179.22 2hgj h LEU 103 N 0.84 0.58 0.00 1.54 5.85 0.17 0.74 115.31 125.03 2hgj h LEU 103 Ca 0.22 0.11 0.00 0.00 0.84 0.00 0.00 57.88 59.04 2hgj h LEU 103 Cb 0.08 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.13 2hgj h LEU 103 CO -0.03 0.11 0.00 1.21 -0.34 0.00 0.00 178.44 179.38 2hgj n GLU 104 N -4.76 0.00 -0.38 1.25 4.07 -0.19 -0.57 120.64 120.06 2hgj n GLU 104 Ca 0.26 0.42 -0.09 0.00 -0.06 0.00 0.00 57.16 57.69 2hgj n GLU 104 Cb 0.80 -1.23 -0.08 0.00 -0.06 0.00 0.00 31.44 30.87 2hgj n GLU 104 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2hgj n LYS 105 N -1.77 -0.38 0.00 5.31 0.00 0.40 -1.06 118.16 120.65 2hgj n LYS 105 Ca 0.00 1.39 0.00 0.00 0.00 0.00 0.00 58.31 59.70 2hgj n LYS 105 Cb 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 35.03 32.98 2hgj n LYS 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2hgj n LEU 106 N -5.18 0.00 0.00 3.14 4.77 0.22 -0.80 117.00 119.15 2hgj n LEU 106 Ca 0.03 0.97 0.00 0.00 -0.03 0.00 0.00 56.01 56.98 2hgj n LEU 106 Cb 0.26 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 2hgj n LEU 106 CO -0.14 -0.49 0.45 -0.11 -1.33 0.00 0.00 177.39 175.76 2hgj n LEU 107 N -1.97 0.00 -0.56 2.23 -0.00 0.26 -0.76 117.00 116.20 2hgj n LEU 107 Ca 0.00 0.90 0.08 0.00 -0.00 0.00 0.00 56.01 56.99 2hgj n LEU 107 Cb 0.00 -0.43 0.20 0.00 -0.00 0.00 0.00 43.42 43.19 2hgj n LEU 107 CO 0.00 -0.43 0.62 0.59 -0.00 0.00 0.00 177.39 178.18 2hgj n ASN 108 N -2.74 2.93 0.00 1.96 3.02 -0.23 -1.11 115.26 119.09 2hgj n ASN 108 Ca 0.00 -3.19 0.00 0.00 -0.03 0.00 0.00 54.58 51.36 2hgj n ASN 108 Cb 0.00 -0.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.66 2hgj n ASN 108 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2hgj n VAL 109 N -1.01 0.00 0.00 2.41 0.24 0.02 -4.79 118.33 115.20 2hgj n VAL 109 Ca 0.20 -0.39 0.00 0.00 -2.04 0.00 0.00 64.34 62.11 2hgj n VAL 109 Cb 0.79 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 34.28 2hgj n VAL 109 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2hgj n ALA 110 N -0.32 2.19 0.00 2.33 0.00 0.06 -4.89 120.51 119.88 2hgj n ALA 110 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgj n ALA 110 Cb 0.03 0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.85 2hgj n ALA 110 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2hgj n LEU 111 N -2.36 0.00 -4.52 0.00 7.94 -0.27 -0.24 117.00 117.55 2hgj n LEU 111 Ca 0.00 0.00 -0.42 0.00 -1.11 0.00 0.00 56.01 54.48 2hgj n LEU 111 Cb 0.37 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.29 2hgj n LEU 111 CO 0.00 0.00 1.19 -2.16 -1.11 0.00 0.00 177.39 175.31 2hgj s PRO 112 N 0.00 3.37 0.00 1.96 0.04 -1.26 -4.84 135.00 134.27 2hgj s PRO 112 Ca 0.00 -0.84 0.00 0.00 0.04 0.00 0.00 61.00 60.20 2hgj s PRO 112 Cb 0.00 -4.69 0.00 0.00 0.04 0.00 0.00 34.50 29.85 2hgj s PRO 112 CO 0.00 -2.07 0.00 -2.13 0.04 0.00 0.00 177.00 172.84 2hgj n ARG 113 N 8.58 0.00 -4.21 4.56 3.00 0.67 -4.96 116.66 124.30 2hgj n ARG 113 Ca 0.15 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.67 2hgj n ARG 113 Cb 0.49 -0.06 -0.08 0.00 0.00 0.00 0.00 32.46 32.81 2hgj n ARG 113 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2hgj s ILE 114 N 0.00 4.46 0.27 5.15 1.10 -1.26 -4.91 121.20 126.01 2hgj s ILE 114 Ca 0.00 -0.44 0.00 0.00 -0.51 0.00 0.00 60.65 59.70 2hgj s ILE 114 Cb 0.00 -2.99 0.00 0.00 0.15 0.00 0.00 42.46 39.62 2hgj s ILE 114 CO 0.00 0.41 0.00 0.54 -2.11 0.00 0.00 174.94 173.78 2hgj n ARG 115 N 1.45 -2.34 0.00 3.50 1.74 -1.26 -3.27 116.66 116.48 2hgj n ARG 115 Ca -0.15 1.54 0.00 0.00 -0.77 0.00 0.00 57.85 58.47 2hgj n ARG 115 Cb 0.53 -2.85 0.00 0.00 -1.02 0.00 0.00 32.46 29.12 2hgj n ARG 115 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2hgj n ASP 116 N -4.34 0.00 -3.84 0.55 10.43 -1.26 -4.69 116.55 113.39 2hgj n ASP 116 Ca 0.01 0.00 -0.21 0.00 2.57 0.00 0.00 54.79 57.16 2hgj n ASP 116 Cb 0.63 0.00 -0.19 0.00 1.84 0.00 0.00 41.12 43.41 2hgj n ASP 116 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 2hgj n PHE 117 N -0.07 0.05 0.01 1.24 3.01 -1.20 -4.61 117.46 115.88 2hgj n PHE 117 Ca 0.00 0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.50 2hgj n PHE 117 Cb 0.00 -0.61 0.00 0.00 -0.01 0.00 0.00 39.48 38.86 2hgj n PHE 117 CO 0.00 0.00 0.00 2.89 1.01 0.00 0.00 176.76 180.66 2hgj n ARG 118 N 4.98 0.98 -0.52 -1.08 -4.01 -1.26 -4.33 116.66 111.42 2hgj n ARG 118 Ca 0.58 -0.38 0.00 0.00 -1.04 0.00 0.00 57.85 57.00 2hgj n ARG 118 Cb 0.11 -0.88 0.00 0.00 -3.04 0.00 0.00 32.46 28.65 2hgj n ARG 118 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2hgj n GLY 119 N 0.26 0.00 0.00 2.89 0.00 -1.26 -4.79 105.19 102.28 2hgj n GLY 119 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hgj n GLY 119 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hgj n LEU 120 N 0.27 0.00 -0.62 0.99 4.77 -1.26 -3.47 117.00 117.67 2hgj n LEU 120 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2hgj n LEU 120 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2hgj n LEU 120 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.39 175.60 2hgj n ASN 121 N -0.83 0.00 -4.38 -1.43 6.94 -1.26 -4.28 115.26 110.02 2hgj n ASN 121 Ca 0.00 0.00 -0.35 0.00 -0.02 0.00 0.00 54.58 54.21 2hgj n ASN 121 Cb 0.00 0.00 0.08 0.00 -2.36 0.00 0.00 39.78 37.50 2hgj n ASN 121 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 2hgj n PRO 122 N -0.07 0.04 -3.88 -0.53 -0.04 -1.24 -2.40 135.00 126.88 2hgj n PRO 122 Ca 0.00 0.05 -0.32 0.00 -0.04 0.00 0.00 63.50 63.19 2hgj n PRO 122 Cb 0.00 -1.69 0.01 0.00 -0.04 0.00 0.00 33.50 31.78 2hgj n PRO 122 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2hgj n ASN 123 N -0.02 -4.38 0.00 3.54 6.94 -1.26 -4.87 115.26 115.22 2hgj n ASN 123 Ca 0.07 -1.07 0.00 0.00 -0.02 0.00 0.00 54.58 53.56 2hgj n ASN 123 Cb 0.52 -1.53 0.00 0.00 -2.36 0.00 0.00 39.78 36.41 2hgj n ASN 123 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 2hgj n SER 124 N -2.35 0.00 0.00 0.53 2.88 -1.01 -4.27 113.62 109.40 2hgj n SER 124 Ca -0.24 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 2hgj n SER 124 Cb 0.63 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.09 2hgj n SER 124 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 2hgj n PHE 125 N -0.53 0.00 0.00 0.66 7.35 0.40 -4.40 117.46 120.93 2hgj n PHE 125 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2hgj n PHE 125 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 2hgj n PHE 125 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2hgj n ASP 126 N 0.00 0.00 -3.51 -2.13 2.03 -1.26 -4.86 116.55 106.81 2hgj n ASP 126 Ca 0.00 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.02 2hgj n ASP 126 Cb 0.00 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.28 2hgj n ASP 126 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2hgj s GLY 127 N -0.24 1.16 0.00 0.27 0.00 -1.26 -4.77 107.32 102.49 2hgj s GLY 127 Ca 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 44.72 42.51 2hgj s GLY 127 CO 0.00 1.95 0.00 -2.13 0.00 0.00 0.00 173.10 172.92 2hgj n ARG 128 N 3.61 0.00 -0.85 2.90 0.00 -1.26 -4.77 116.66 116.29 2hgj n ARG 128 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.00 2hgj n ARG 128 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 32.46 32.84 2hgj n ARG 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2hgj n GLY 129 N -0.50 0.00 0.00 5.14 0.00 -1.24 -4.73 105.19 103.87 2hgj n GLY 129 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hgj n GLY 129 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2hgj n ASN 130 N 0.20 3.74 0.00 1.61 5.03 -1.26 -4.25 115.26 120.32 2hgj n ASN 130 Ca 0.00 -0.12 0.00 0.00 0.87 0.00 0.00 54.58 55.33 2hgj n ASN 130 Cb 0.00 1.02 0.00 0.00 -1.02 0.00 0.00 39.78 39.78 2hgj n ASN 130 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2hgj n TYR 131 N -1.40 0.00 -0.65 3.10 9.36 -1.25 -3.69 117.16 122.62 2hgj n TYR 131 Ca -0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2hgj n TYR 131 Cb 0.01 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.72 2hgj n TYR 131 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 2hgj n ASN 132 N 0.00 -3.13 0.00 2.98 5.15 -1.26 0.15 115.26 119.15 2hgj n ASN 132 Ca 0.00 0.22 0.00 0.00 -0.60 0.00 0.00 54.58 54.20 2hgj n ASN 132 Cb 0.00 -1.26 0.00 0.00 -0.53 0.00 0.00 39.78 37.99 2hgj n ASN 132 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2hgj n LEU 133 N 0.16 0.00 0.00 1.20 7.99 -1.26 -4.24 117.00 120.84 2hgj n LEU 133 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.00 2hgj n LEU 133 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 2hgj n LEU 133 CO 0.00 0.00 0.00 0.61 -1.51 0.00 0.00 177.39 176.49 2hgj n GLY 134 N -1.00 0.00 0.61 -0.72 0.00 -1.26 -4.46 105.19 98.35 2hgj n GLY 134 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hgj n GLY 134 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2hgj n LEU 135 N 0.00 0.00 -0.08 0.99 -0.00 -1.26 -4.53 117.00 112.12 2hgj n LEU 135 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 56.01 55.93 2hgj n LEU 135 Cb 0.00 -0.39 -0.03 0.00 -0.00 0.00 0.00 43.42 43.00 2hgj n LEU 135 CO 0.00 0.00 -0.43 0.54 -0.00 0.00 0.00 177.39 177.50 2hgj n ARG 136 N -0.39 0.48 -0.58 1.96 1.74 -1.26 -4.22 116.66 114.38 2hgj n ARG 136 Ca 0.00 0.50 -0.30 0.00 -0.77 0.00 0.00 57.85 57.28 2hgj n ARG 136 Cb 0.00 -1.67 0.21 0.00 -1.02 0.00 0.00 32.46 29.98 2hgj n ARG 136 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2hgj n GLU 137 N -4.57 -1.60 -2.31 5.56 2.13 -1.26 -3.00 120.64 115.58 2hgj n GLU 137 Ca -0.12 -0.43 -0.26 0.00 0.66 0.00 0.00 57.16 57.01 2hgj n GLU 137 Cb 0.36 -2.17 0.14 0.00 0.27 0.00 0.00 31.44 30.04 2hgj n GLU 137 CO 0.00 0.00 0.00 -1.14 -0.41 0.00 0.00 177.13 175.58 2hgj s GLN 138 N -4.33 1.21 -0.13 5.31 0.74 -1.26 -4.74 119.66 116.45 2hgj s GLN 138 Ca 0.66 -0.83 0.11 0.00 0.05 0.00 0.00 55.36 55.35 2hgj s GLN 138 Cb -0.23 -2.12 0.56 0.00 1.10 0.00 0.00 33.01 32.32 2hgj s GLN 138 CO 0.63 -1.88 1.40 -0.11 -0.55 0.00 0.00 175.29 174.78 2hgj n LEU 139 N -3.24 4.05 0.00 3.68 0.00 -1.26 -4.28 117.00 115.94 2hgj n LEU 139 Ca 0.15 -2.05 0.00 0.00 0.00 0.00 0.00 56.01 54.12 2hgj n LEU 139 Cb 0.60 -0.57 0.00 0.00 0.00 0.00 0.00 43.42 43.45 2hgj n LEU 139 CO 0.44 0.57 0.00 -0.38 0.00 0.00 0.00 177.39 178.01 2hgj n ILE 140 N 0.59 0.00 -1.82 1.96 2.08 -1.26 0.03 119.36 120.94 2hgj n ILE 140 Ca 0.19 0.00 -0.39 0.00 0.56 0.00 0.00 62.75 63.12 2hgj n ILE 140 Cb 0.82 0.00 0.05 0.00 -0.75 0.00 0.00 39.64 39.76 2hgj n ILE 140 CO 0.00 0.00 0.00 0.49 0.56 0.00 0.00 176.55 177.60 2hgj n PHE 141 N 0.00 3.04 0.34 1.39 3.01 -1.26 -4.39 117.46 119.58 2hgj n PHE 141 Ca 0.00 -2.47 0.22 0.00 1.01 0.00 0.00 57.45 56.21 2hgj n PHE 141 Cb 0.00 -1.22 1.19 0.00 -0.01 0.00 0.00 39.48 39.45 2hgj n PHE 141 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2hgj h PRO 142 N 2.80 0.00 0.00 -1.08 0.13 -0.80 -3.43 132.00 129.62 2hgj h PRO 142 Ca 0.57 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.70 2hgj h PRO 142 Cb 0.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.33 2hgj h PRO 142 CO 1.46 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 179.62 2hgj n GLU 143 N -3.14 0.00 -0.77 0.86 -0.58 -1.26 -5.06 120.64 110.70 2hgj n GLU 143 Ca -0.03 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.42 2hgj n GLU 143 Cb 0.08 0.00 0.02 0.00 -0.57 0.00 0.00 31.44 30.97 2hgj n GLU 143 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2hgj n ILE 144 N 0.00 0.00 0.00 -3.67 2.08 -1.26 -5.06 119.36 111.45 2hgj n ILE 144 Ca 0.00 -0.07 0.00 0.00 0.56 0.00 0.00 62.75 63.24 2hgj n ILE 144 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 2hgj n ILE 144 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 2hgj n THR 145 N -2.55 0.00 -3.41 1.39 -2.24 -1.26 -4.13 114.28 102.08 2hgj n THR 145 Ca -0.02 0.00 -0.45 0.00 -2.27 0.00 0.00 64.05 61.32 2hgj n THR 145 Cb 0.56 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.75 2hgj n THR 145 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2hgj s TYR 146 N 0.20 3.68 -0.37 4.78 2.02 -1.26 -4.89 117.35 121.51 2hgj s TYR 146 Ca 0.00 -2.14 0.01 0.00 -0.37 0.00 0.00 57.07 54.57 2hgj s TYR 146 Cb 0.00 -3.69 0.15 0.00 -0.40 0.00 0.00 41.96 38.02 2hgj s TYR 146 CO 0.00 -0.96 0.24 -0.51 -1.57 0.00 0.00 175.55 172.75 2hgj s ASP 147 N 1.87 2.62 -0.03 2.29 -0.00 -1.26 -4.97 116.67 117.19 2hgj s ASP 147 Ca 0.17 -2.39 -0.01 0.00 -0.00 0.00 0.00 52.55 50.33 2hgj s ASP 147 Cb -0.13 -0.41 0.00 0.00 -0.00 0.00 0.00 42.92 42.39 2hgj s ASP 147 CO -0.08 -0.28 0.02 0.80 -0.00 0.00 0.00 175.17 175.64 2hgj n MET 148 N 3.77 -0.49 -0.15 8.23 0.00 -1.26 -4.78 117.12 122.44 2hgj n MET 148 Ca 0.16 0.81 0.20 0.00 0.00 0.00 0.00 57.70 58.87 2hgj n MET 148 Cb 0.39 -1.48 0.30 0.00 0.00 0.00 0.00 33.22 32.44 2hgj n MET 148 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 175.97 177.52 2hgj n VAL 149 N 0.16 0.00 -3.64 1.12 3.14 -1.26 -3.91 118.33 113.93 2hgj n VAL 149 Ca -0.03 0.88 -0.10 0.00 -2.96 0.00 0.00 64.34 62.12 2hgj n VAL 149 Cb 0.05 -1.57 -0.07 0.00 -1.06 0.00 0.00 33.84 31.19 2hgj n VAL 149 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2hgj s ASP 150 N -3.32 -0.84 0.00 6.55 -1.08 -1.26 -4.99 116.67 111.73 2hgj s ASP 150 Ca -0.02 1.44 0.00 0.00 -0.52 0.00 0.00 52.55 53.45 2hgj s ASP 150 Cb 0.10 1.36 0.00 0.00 -1.46 0.00 0.00 42.92 42.92 2hgj s ASP 150 CO 0.33 -0.24 0.00 0.00 0.52 0.00 0.00 175.17 175.78 2hgj n ALA 151 N 3.69 0.00 -3.61 3.66 0.00 -1.25 -4.93 120.51 118.08 2hgj n ALA 151 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.98 2hgj n ALA 151 Cb 0.57 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.86 2hgj n ALA 151 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2hgj s LEU 152 N 0.00 0.71 0.00 0.00 1.43 -1.26 -4.20 118.68 115.36 2hgj s LEU 152 Ca 0.00 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 52.06 2hgj s LEU 152 Cb 0.00 -0.39 0.00 0.00 0.03 0.00 0.00 46.19 45.83 2hgj s LEU 152 CO 0.00 -0.39 0.00 -1.14 0.23 0.00 0.00 176.35 175.05 2hgj n ARG 153 N 5.20 0.00 -2.66 1.70 0.63 -1.26 -4.76 116.66 115.50 2hgj n ARG 153 Ca -0.06 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.45 2hgj n ARG 153 Cb 0.45 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 33.33 2hgj n ARG 153 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2hgj s GLY 154 N -1.66 1.32 0.07 5.14 0.00 -1.25 -4.16 107.32 106.77 2hgj s GLY 154 Ca 0.00 -2.11 0.08 0.00 0.00 0.00 0.00 44.72 42.68 2hgj s GLY 154 CO 0.00 2.47 -0.18 1.06 0.00 0.00 0.00 173.10 176.46 2hgj s MET 155 N 4.59 1.96 -0.27 2.90 -1.94 -1.16 -1.18 119.30 124.20 2hgj s MET 155 Ca 0.38 -1.06 -0.23 0.00 -1.71 0.00 0.00 55.69 53.07 2hgj s MET 155 Cb -0.05 -2.17 0.07 0.00 2.01 0.00 0.00 34.83 34.70 2hgj s MET 155 CO -0.02 0.52 0.71 0.34 -0.01 0.00 0.00 175.02 176.55 2hgj s ASP 156 N -1.74 -0.77 0.43 3.03 3.68 -0.37 -4.37 116.67 116.55 2hgj s ASP 156 Ca 0.16 1.44 0.07 0.00 2.13 0.00 0.00 52.55 56.35 2hgj s ASP 156 Cb -0.11 1.44 -0.04 0.00 -1.45 0.00 0.00 42.92 42.77 2hgj s ASP 156 CO 0.07 -0.25 0.25 -0.51 0.13 0.00 0.00 175.17 174.87 2hgj s ILE 157 N 0.57 2.34 0.01 4.11 2.07 -1.26 -1.15 121.20 127.89 2hgj s ILE 157 Ca -0.02 -1.58 -0.05 0.00 -1.41 0.00 0.00 60.65 57.59 2hgj s ILE 157 Cb -0.05 -2.92 -0.01 0.00 0.13 0.00 0.00 42.46 39.61 2hgj s ILE 157 CO -0.02 0.00 0.09 0.00 -1.91 0.00 0.00 174.94 173.09 2hgj s ALA 158 N -2.58 -0.17 0.12 1.50 0.00 -0.10 -4.67 121.76 115.86 2hgj s ALA 158 Ca 0.42 -0.32 0.08 0.00 0.00 0.00 0.00 51.96 52.14 2hgj s ALA 158 Cb 0.01 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 2hgj s ALA 158 CO 0.24 -0.21 -0.19 0.14 0.00 0.00 0.00 175.76 175.74 2hgj s VAL 159 N -1.58 1.66 -0.32 0.00 -7.23 -1.25 -2.13 120.40 109.53 2hgj s VAL 159 Ca -0.14 -1.68 -0.06 0.00 -1.81 0.00 0.00 61.98 58.29 2hgj s VAL 159 Cb -0.07 -1.62 0.03 0.00 0.56 0.00 0.00 36.38 35.28 2hgj s VAL 159 CO 0.00 -0.20 0.09 -0.69 -0.31 0.00 0.00 175.10 173.99 2hgj s VAL 160 N -1.60 3.81 0.50 1.32 1.01 -0.39 -3.94 120.40 121.11 2hgj s VAL 160 Ca 0.09 -1.01 0.09 0.00 0.00 0.00 0.00 61.98 61.15 2hgj s VAL 160 Cb -0.08 -3.10 0.04 0.00 0.00 0.00 0.00 36.38 33.25 2hgj s VAL 160 CO 0.05 -0.10 0.65 0.42 0.00 0.00 0.00 175.10 176.12 2hgj s THR 161 N 1.43 2.50 -1.19 3.92 -4.23 -1.24 -1.04 115.64 115.79 2hgj s THR 161 Ca -0.00 -1.05 0.12 0.00 -1.18 0.00 0.00 61.69 59.57 2hgj s THR 161 Cb -0.19 -2.56 0.03 0.00 1.34 0.00 0.00 72.50 71.12 2hgj s THR 161 CO 0.03 0.00 0.75 0.41 -0.54 0.00 0.00 174.62 175.26 2hgj n THR 162 N -2.00 0.00 -0.20 3.99 -1.04 -0.44 -4.74 114.28 109.84 2hgj n THR 162 Ca 0.11 -0.42 -0.04 0.00 -2.04 0.00 0.00 64.05 61.65 2hgj n THR 162 Cb 0.61 1.17 -0.02 0.00 -1.82 0.00 0.00 70.33 70.27 2hgj n THR 162 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hgj n ALA 163 N 0.05 2.04 0.00 2.41 0.00 -1.25 -4.69 120.51 119.07 2hgj n ALA 163 Ca 0.05 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2hgj n ALA 163 Cb 0.26 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.25 2hgj n ALA 163 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2hgj n GLU 164 N 3.83 0.00 -3.66 0.00 -0.58 -1.26 -3.81 120.64 115.15 2hgj n GLU 164 Ca 0.11 0.00 -0.33 0.00 -0.42 0.00 0.00 57.16 56.52 2hgj n GLU 164 Cb 0.10 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.92 2hgj n GLU 164 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2hgj s THR 165 N -4.43 5.17 0.00 2.62 2.01 -1.26 -3.64 115.64 116.11 2hgj s THR 165 Ca 0.00 0.15 0.00 0.00 0.31 0.00 0.00 61.69 62.15 2hgj s THR 165 Cb 0.00 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 68.89 2hgj s THR 165 CO 0.00 0.14 0.87 0.47 -0.69 0.00 0.00 174.62 175.41 2hgj n ASP 166 N 0.41 0.00 -0.34 3.53 8.00 -1.25 -1.37 116.55 125.53 2hgj n ASP 166 Ca -0.05 0.87 0.29 0.00 0.71 0.00 0.00 54.79 56.60 2hgj n ASP 166 Cb 0.52 -0.37 0.47 0.00 -0.02 0.00 0.00 41.12 41.72 2hgj n ASP 166 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2hgj n GLU 167 N -1.84 -0.02 0.15 -1.24 4.71 -1.26 0.58 120.64 121.72 2hgj n GLU 167 Ca 0.00 0.83 -0.06 0.00 -0.01 0.00 0.00 57.16 57.92 2hgj n GLU 167 Cb 0.00 -1.67 -0.03 0.00 -1.01 0.00 0.00 31.44 28.73 2hgj n GLU 167 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 2hgj h GLU 168 N 0.00 -0.38 -1.31 3.49 3.07 -1.73 -0.60 114.58 117.12 2hgj h GLU 168 Ca 0.60 0.03 0.39 0.00 -0.50 0.00 0.00 59.36 59.87 2hgj h GLU 168 Cb 2.01 0.09 -0.09 0.00 -0.84 0.00 0.00 28.75 29.92 2hgj h GLU 168 CO -0.27 -0.26 0.89 0.00 -1.40 0.00 0.00 179.01 177.98 2hgj h ALA 169 N -1.73 2.90 -3.00 3.43 0.00 0.14 -1.10 119.26 119.90 2hgj h ALA 169 Ca -0.04 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2hgj h ALA 169 Cb 0.30 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2hgj h ALA 169 CO 0.07 -1.38 0.00 -2.13 0.00 0.00 0.00 179.25 175.81 2hgj n ARG 170 N -4.41 0.00 -0.19 0.00 3.00 0.55 -0.93 116.66 114.68 2hgj n ARG 170 Ca 0.32 0.03 0.09 0.00 -0.00 0.00 0.00 57.85 58.29 2hgj n ARG 170 Cb 1.33 -0.63 0.18 0.00 0.00 0.00 0.00 32.46 33.34 2hgj n ARG 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2hgj n ALA 171 N -2.39 0.32 -1.00 5.13 0.00 -0.27 -0.35 120.51 121.94 2hgj n ALA 171 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 53.44 54.02 2hgj n ALA 171 Cb 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.00 2hgj n ALA 171 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2hgj n LEU 172 N -4.60 0.00 0.00 0.00 7.94 -0.46 -1.50 117.00 118.38 2hgj n LEU 172 Ca 0.14 0.02 0.08 0.00 -1.11 0.00 0.00 56.01 55.14 2hgj n LEU 172 Cb 0.46 0.00 0.38 0.00 0.53 0.00 0.00 43.42 44.79 2hgj n LEU 172 CO -0.03 0.00 0.72 -0.11 -1.11 0.00 0.00 177.39 176.85 2hgj n LEU 173 N -0.04 0.00 0.00 -1.96 7.94 -0.10 -1.04 117.00 121.79 2hgj n LEU 173 Ca 0.00 0.31 0.00 0.00 -1.11 0.00 0.00 56.01 55.21 2hgj n LEU 173 Cb 0.00 -0.31 0.00 0.00 0.53 0.00 0.00 43.42 43.64 2hgj n LEU 173 CO 0.00 -0.15 0.49 1.21 -1.11 0.00 0.00 177.39 177.83 2hgj n GLU 174 N -1.31 0.00 0.13 1.96 0.00 0.52 -0.30 120.64 121.65 2hgj n GLU 174 Ca 0.07 0.61 0.03 0.00 0.00 0.00 0.00 57.16 57.87 2hgj n GLU 174 Cb 0.13 -1.47 0.02 0.00 0.00 0.00 0.00 31.44 30.11 2hgj n GLU 174 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 2hgj h LEU 175 N 0.00 0.00 -0.46 4.31 3.38 -1.19 -0.19 115.31 121.16 2hgj h LEU 175 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 2hgj h LEU 175 Cb 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.67 2hgj h LEU 175 CO 0.00 0.46 -0.04 0.25 0.09 0.00 0.00 178.44 179.20 2hgj h LEU 176 N 0.00 -0.28 -2.39 1.67 7.12 -0.95 -3.36 115.31 117.11 2hgj h LEU 176 Ca -0.03 0.12 -0.15 0.00 0.13 0.00 0.00 57.88 57.96 2hgj h LEU 176 Cb 1.37 0.23 -0.23 0.00 -0.53 0.00 0.00 40.66 41.50 2hgj h LEU 176 CO 0.05 -0.10 -0.59 0.61 -0.13 0.00 0.00 178.44 178.28 2hgj n GLY 177 N -1.31 0.71 0.06 3.75 0.00 0.59 -4.88 105.19 104.12 2hgj n GLY 177 Ca 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2hgj n GLY 177 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2hgj n PHE 178 N 0.20 0.00 0.12 1.61 7.35 -0.10 -4.89 117.46 121.75 2hgj n PHE 178 Ca -0.13 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.68 2hgj n PHE 178 Cb 0.88 -0.74 0.26 0.00 0.35 0.00 0.00 39.48 40.23 2hgj n PHE 178 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2hgj n PRO 179 N 1.49 2.56 -1.34 -7.13 -0.04 -1.07 -4.44 135.00 125.03 2hgj n PRO 179 Ca 0.00 -2.38 0.00 0.00 -0.04 0.00 0.00 63.50 61.08 2hgj n PRO 179 Cb 0.00 -1.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.93 2hgj n PRO 179 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2hgj n PHE 180 N 1.52 0.00 0.00 0.54 0.99 -1.26 -4.88 117.46 114.37 2hgj n PHE 180 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.66 2hgj n PHE 180 Cb 0.60 -0.60 0.00 0.00 -1.00 0.00 0.00 39.48 38.48 2hgj n PHE 180 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 2hgj n ARG 181 N 1.64 0.00 0.00 -1.08 3.00 -1.23 -4.39 116.66 114.60 2hgj n ARG 181 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.85 57.88 2hgj n ARG 181 Cb 0.00 0.00 0.19 0.00 0.00 0.00 0.00 32.46 32.65 2hgj n ARG 181 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80