#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgu n ARG 2 N 0.00 0.00 -0.24 0.03 0.00 -1.24 -4.86 116.66 110.35 2hgu n ARG 2 Ca 0.00 0.00 0.30 0.00 -0.00 0.00 0.00 57.85 58.15 2hgu n ARG 2 Cb 0.00 0.00 0.51 0.00 0.00 0.00 0.00 32.46 32.97 2hgu n ARG 2 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2hgu h VAL 3 N 0.59 0.04 -3.34 5.15 2.07 -1.81 -3.31 116.25 115.63 2hgu h VAL 3 Ca 0.00 0.00 -0.58 0.00 0.82 0.00 0.00 66.70 66.94 2hgu h VAL 3 Cb 0.00 0.07 -0.09 0.00 -1.52 0.00 0.00 31.29 29.75 2hgu h VAL 3 CO 0.00 0.00 -0.18 -0.54 0.02 0.00 0.00 177.57 176.87 2hgu s LYS 4 N -4.51 4.30 0.51 1.57 3.01 -1.23 -4.62 119.74 118.76 2hgu s LYS 4 Ca -0.03 0.34 0.02 0.00 -1.01 0.00 0.00 55.97 55.29 2hgu s LYS 4 Cb 0.16 -3.45 -0.01 0.00 -1.01 0.00 0.00 37.83 33.52 2hgu s LYS 4 CO 0.53 0.13 0.09 -1.64 0.51 0.00 0.00 175.35 174.97 2hgu s MET 5 N 0.73 2.20 0.00 1.68 -1.94 -1.26 -3.56 119.30 117.15 2hgu s MET 5 Ca 0.23 -2.30 0.00 0.00 -1.71 0.00 0.00 55.69 51.91 2hgu s MET 5 Cb -0.15 -1.66 0.00 0.00 2.01 0.00 0.00 34.83 35.04 2hgu s MET 5 CO 0.08 -0.39 0.00 0.72 -0.01 0.00 0.00 175.02 175.42 2hgu n HIS 6 N -1.35 0.00 -0.96 -0.03 8.25 -1.26 -5.04 115.22 114.83 2hgu n HIS 6 Ca -0.15 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 56.98 2hgu n HIS 6 Cb 0.66 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.75 2hgu n HIS 6 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2hgu n VAL 7 N 0.00 1.19 0.00 1.59 0.24 -1.26 -5.00 118.33 115.10 2hgu n VAL 7 Ca 0.00 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 2hgu n VAL 7 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2hgu n VAL 7 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2hgu n LYS 8 N 0.72 1.21 -0.15 7.34 4.76 -1.26 -4.86 118.16 125.92 2hgu n LYS 8 Ca 0.12 0.00 -0.06 0.00 -2.87 0.00 0.00 58.31 55.50 2hgu n LYS 8 Cb 0.16 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.34 2hgu n LYS 8 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2hgu h LYS 9 N 0.00 -0.20 0.00 1.97 1.57 -1.90 -3.43 116.57 114.58 2hgu h LYS 9 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2hgu h LYS 9 Cb 0.00 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2hgu h LYS 9 CO 0.00 -0.13 0.00 0.41 -0.57 0.00 0.00 179.45 179.16 2hgu n GLY 10 N -1.42 0.09 3.64 3.86 0.00 -1.26 -3.54 105.19 106.56 2hgu n GLY 10 Ca 0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 46.02 45.94 2hgu n GLY 10 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2hgu s ASP 11 N -0.47 -0.52 0.00 1.61 1.01 -1.26 -3.66 116.67 113.39 2hgu s ASP 11 Ca 0.00 0.83 0.00 0.00 0.71 0.00 0.00 52.55 54.09 2hgu s ASP 11 Cb 0.00 1.20 0.00 0.00 1.01 0.00 0.00 42.92 45.13 2hgu s ASP 11 CO 0.00 -0.13 0.00 0.41 0.21 0.00 0.00 175.17 175.66 2hgu n THR 12 N 3.66 0.00 -4.02 -1.27 -1.04 -1.16 -4.11 114.28 106.35 2hgu n THR 12 Ca -0.18 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.60 2hgu n THR 12 Cb 0.58 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.04 2hgu n THR 12 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2hgu s VAL 13 N -2.01 3.49 -0.38 12.58 0.11 -1.25 -1.70 120.40 131.26 2hgu s VAL 13 Ca 0.00 -1.55 -0.01 0.00 -2.93 0.00 0.00 61.98 57.49 2hgu s VAL 13 Cb 0.00 -3.11 0.10 0.00 -1.53 0.00 0.00 36.38 31.84 2hgu s VAL 13 CO 0.00 -0.23 0.14 -0.76 -3.33 0.00 0.00 175.10 170.92 2hgu s LEU 14 N -3.88 4.96 0.00 2.54 1.02 -1.14 0.27 118.68 122.45 2hgu s LEU 14 Ca 0.37 -1.99 0.00 0.00 0.02 0.00 0.00 54.13 52.54 2hgu s LEU 14 Cb -0.05 -1.76 0.00 0.00 0.02 0.00 0.00 46.19 44.40 2hgu s LEU 14 CO 0.24 -0.46 0.00 0.52 0.02 0.00 0.00 176.35 176.67 2hgu n VAL 15 N 4.49 0.00 -1.54 -1.59 0.31 -0.04 -3.81 118.33 116.15 2hgu n VAL 15 Ca -0.02 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 63.99 2hgu n VAL 15 Cb 0.42 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.27 2hgu n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2hgu n ALA 16 N -3.00 0.62 -2.78 3.52 0.00 -1.26 -4.65 120.51 112.96 2hgu n ALA 16 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 53.44 52.59 2hgu n ALA 16 Cb 0.00 -2.95 0.00 0.00 0.00 0.00 0.00 19.45 16.50 2hgu n ALA 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2hgu n SER 17 N 14.42 1.12 -2.78 0.00 3.41 -1.26 -4.72 113.62 123.81 2hgu n SER 17 Ca 0.48 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 59.07 2hgu n SER 17 Cb 0.38 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.39 2hgu n SER 17 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2hgu n GLY 18 N 0.00 1.78 1.21 5.00 0.00 -1.26 -4.92 105.19 107.00 2hgu n GLY 18 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 2hgu n GLY 18 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hgu n LYS 19 N -0.70 0.00 0.00 1.61 4.01 -1.26 -5.05 118.16 116.77 2hgu n LYS 19 Ca 0.03 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.83 2hgu n LYS 19 Cb 0.82 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.34 2hgu n LYS 19 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 2hgu n TYR 20 N -2.41 0.00 -0.01 2.13 4.02 -1.25 -4.76 117.16 114.89 2hgu n TYR 20 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2hgu n TYR 20 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 2hgu n TYR 20 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 2hgu n LYS 21 N 0.00 0.00 -1.08 -0.72 2.85 -1.26 -2.86 118.16 115.09 2hgu n LYS 21 Ca 0.00 -0.11 -0.37 0.00 -1.05 0.00 0.00 58.31 56.78 2hgu n LYS 21 Cb 0.00 -1.54 0.03 0.00 -0.65 0.00 0.00 35.03 32.87 2hgu n LYS 21 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2hgu n GLY 22 N 3.12 -4.20 0.00 2.58 0.00 -1.24 -4.99 105.19 100.46 2hgu n GLY 22 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2hgu n GLY 22 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2hgu n ARG 23 N 2.14 0.00 -1.77 1.61 1.85 -0.69 -4.84 116.66 114.97 2hgu n ARG 23 Ca 0.01 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.44 2hgu n ARG 23 Cb 0.53 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 31.91 2hgu n ARG 23 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 2hgu s VAL 24 N -2.33 2.29 -0.19 8.89 -7.23 -1.26 -2.97 120.40 117.60 2hgu s VAL 24 Ca 0.00 0.12 -0.05 0.00 -1.81 0.00 0.00 61.98 60.24 2hgu s VAL 24 Cb 0.00 -3.08 -0.03 0.00 0.56 0.00 0.00 36.38 33.84 2hgu s VAL 24 CO 0.00 0.01 0.00 -0.83 -0.31 0.00 0.00 175.10 173.97 2hgu s GLY 25 N 1.60 1.74 0.00 2.32 0.00 -1.23 -4.12 107.32 107.63 2hgu s GLY 25 Ca 0.75 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 44.54 2hgu s GLY 25 CO 0.33 0.16 0.68 1.17 0.00 0.00 0.00 173.10 175.44 2hgu n LYS 26 N 4.05 0.00 -4.03 2.90 4.81 1.18 -4.69 118.16 122.38 2hgu n LYS 26 Ca -0.17 0.64 -0.10 0.00 -0.87 0.00 0.00 58.31 57.82 2hgu n LYS 26 Cb 0.52 -1.18 -0.07 0.00 0.02 0.00 0.00 35.03 34.32 2hgu n LYS 26 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2hgu s VAL 27 N -1.72 0.01 -0.04 3.15 0.11 -1.25 -4.88 120.40 115.78 2hgu s VAL 27 Ca 0.00 -1.51 -0.01 0.00 -2.93 0.00 0.00 61.98 57.52 2hgu s VAL 27 Cb 0.00 -2.19 0.03 0.00 -1.53 0.00 0.00 36.38 32.69 2hgu s VAL 27 CO 0.00 -0.05 0.07 -1.59 -3.33 0.00 0.00 175.10 170.20 2hgu s LYS 28 N -4.04 -0.00 0.11 1.54 0.00 -1.26 -0.90 119.74 115.19 2hgu s LYS 28 Ca 0.25 0.28 -0.21 0.00 0.00 0.00 0.00 55.97 56.29 2hgu s LYS 28 Cb 0.02 -0.26 -0.10 0.00 0.00 0.00 0.00 37.83 37.49 2hgu s LYS 28 CO 0.08 -0.19 1.74 0.93 0.00 0.00 0.00 175.35 177.90 2hgu h GLU 29 N 7.45 0.19 0.00 1.78 5.08 -1.07 -3.49 114.58 124.52 2hgu h GLU 29 Ca -0.40 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2hgu h GLU 29 Cb 1.13 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.34 2hgu h GLU 29 CO 0.41 0.15 0.00 0.28 -1.00 0.00 0.00 179.01 178.86 2hgu n VAL 30 N -4.97 0.00 -0.05 3.13 0.31 -1.26 -4.77 118.33 110.71 2hgu n VAL 30 Ca -0.04 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.22 2hgu n VAL 30 Cb 0.04 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.95 2hgu n VAL 30 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2hgu n LEU 31 N 0.00 1.62 -4.55 7.52 0.00 -1.25 -2.98 117.00 117.36 2hgu n LEU 31 Ca 0.00 0.26 -0.43 0.00 0.00 0.00 0.00 56.01 55.84 2hgu n LEU 31 Cb 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 43.42 42.80 2hgu n LEU 31 CO 0.00 -0.41 1.94 -0.81 0.00 0.00 0.00 177.39 178.11 2hgu n PRO 32 N -4.10 3.21 -0.11 1.96 -0.04 -1.26 -3.64 135.00 131.02 2hgu n PRO 32 Ca -0.10 -3.32 0.08 0.00 -0.04 0.00 0.00 63.50 60.13 2hgu n PRO 32 Cb 0.36 -3.45 0.13 0.00 -0.04 0.00 0.00 33.50 30.50 2hgu n PRO 32 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2hgu n LYS 33 N 8.08 -0.00 0.00 0.54 5.02 -1.26 -4.18 118.16 126.36 2hgu n LYS 33 Ca 0.48 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.95 2hgu n LYS 33 Cb 0.46 -0.41 0.00 0.00 -0.02 0.00 0.00 35.03 35.05 2hgu n LYS 33 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2hgu n LYS 34 N -2.43 0.00 -3.77 1.97 5.02 -1.26 -3.22 118.16 114.46 2hgu n LYS 34 Ca 0.07 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.25 2hgu n LYS 34 Cb 0.32 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.25 2hgu n LYS 34 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2hgu s TYR 35 N 0.00 -0.08 -0.18 2.13 -0.85 -0.48 -1.07 117.35 116.81 2hgu s TYR 35 Ca 0.00 -0.06 -0.00 0.00 -0.52 0.00 0.00 57.07 56.49 2hgu s TYR 35 Cb 0.00 0.08 0.00 0.00 0.38 0.00 0.00 41.96 42.42 2hgu s TYR 35 CO 0.00 -0.49 -0.14 0.00 -1.52 0.00 0.00 175.55 173.40 2hgu s ALA 36 N -2.51 2.51 -1.58 9.51 0.00 -0.08 -0.55 121.76 129.06 2hgu s ALA 36 Ca -0.05 -1.13 0.28 0.00 0.00 0.00 0.00 51.96 51.06 2hgu s ALA 36 Cb -0.01 -1.32 1.15 0.00 0.00 0.00 0.00 23.12 22.94 2hgu s ALA 36 CO -0.03 -0.22 1.81 1.55 0.00 0.00 0.00 175.76 178.87 2hgu n VAL 37 N 4.41 0.00 -3.78 0.00 3.14 -1.26 0.37 118.33 121.21 2hgu n VAL 37 Ca -0.19 -0.06 -0.28 0.00 -2.96 0.00 0.00 64.34 60.85 2hgu n VAL 37 Cb 0.51 -0.06 0.02 0.00 -1.06 0.00 0.00 33.84 33.25 2hgu n VAL 37 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 2hgu n ILE 38 N -0.99 -4.68 -0.56 1.55 5.41 -1.26 -4.43 119.36 114.40 2hgu n ILE 38 Ca 0.13 -0.73 0.00 0.00 1.00 0.00 0.00 62.75 63.15 2hgu n ILE 38 Cb 0.29 -3.68 0.00 0.00 -0.71 0.00 0.00 39.64 35.54 2hgu n ILE 38 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2hgu n VAL 39 N -4.27 0.00 0.00 1.39 0.31 -1.26 -4.96 118.33 109.54 2hgu n VAL 39 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 2hgu n VAL 39 Cb 0.64 1.28 0.00 0.00 -0.91 0.00 0.00 33.84 34.85 2hgu n VAL 39 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2hgu n GLU 40 N 0.00 0.00 0.00 5.55 2.13 -1.26 -5.02 120.64 122.04 2hgu n GLU 40 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2hgu n GLU 40 Cb 0.11 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.82 2hgu n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2hgu n GLY 41 N 0.00 4.25 0.00 8.31 0.00 -0.36 -4.58 105.19 112.81 2hgu n GLY 41 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2hgu n GLY 41 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2hgu n VAL 42 N 0.00 0.00 0.00 1.61 0.24 -1.25 -4.96 118.33 113.97 2hgu n VAL 42 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2hgu n VAL 42 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2hgu n VAL 42 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2hgu n ASN 43 N 0.00 1.70 0.00 -1.34 5.15 -1.26 -4.05 115.26 115.46 2hgu n ASN 43 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2hgu n ASN 43 Cb 0.00 0.12 0.00 0.00 -0.53 0.00 0.00 39.78 39.37 2hgu n ASN 43 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 2hgu n ILE 44 N -1.31 0.00 -0.42 -1.44 5.41 -1.26 -0.73 119.36 119.61 2hgu n ILE 44 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.74 2hgu n ILE 44 Cb 0.18 -0.42 -0.00 0.00 -0.71 0.00 0.00 39.64 38.69 2hgu n ILE 44 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2hgu n VAL 45 N -2.26 0.00 -0.03 1.39 0.24 -1.26 -4.68 118.33 111.73 2hgu n VAL 45 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2hgu n VAL 45 Cb 0.15 -0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.19 2hgu n VAL 45 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2hgu n LYS 46 N 0.03 0.00 0.00 7.34 5.02 -1.25 -4.40 118.16 124.91 2hgu n LYS 46 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2hgu n LYS 46 Cb 0.15 -0.02 0.00 0.00 -0.02 0.00 0.00 35.03 35.14 2hgu n LYS 46 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2hgu n LYS 47 N -0.07 0.00 -0.38 1.97 5.02 -1.26 -4.49 118.16 118.95 2hgu n LYS 47 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2hgu n LYS 47 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2hgu n LYS 47 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2hgu n ALA 48 N -3.27 0.00 -2.53 7.82 0.00 -1.26 -5.05 120.51 116.22 2hgu n ALA 48 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 2hgu n ALA 48 Cb 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 19.45 19.25 2hgu n ALA 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2hgu s VAL 49 N -2.00 5.03 -2.00 0.00 -7.23 -1.26 -4.53 120.40 108.41 2hgu s VAL 49 Ca 0.00 0.05 0.00 0.00 -1.81 0.00 0.00 61.98 60.23 2hgu s VAL 49 Cb 0.00 -3.73 0.01 0.00 0.56 0.00 0.00 36.38 33.23 2hgu s VAL 49 CO 0.00 -0.30 0.69 -1.14 -0.31 0.00 0.00 175.10 174.04 2hgu n ARG 50 N -0.86 0.66 -0.10 4.82 0.63 -1.25 -1.58 116.66 118.98 2hgu n ARG 50 Ca -0.02 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 56.82 2hgu n ARG 50 Cb 0.54 -1.01 -0.02 0.00 0.45 0.00 0.00 32.46 32.42 2hgu n ARG 50 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2hgu h VAL 51 N 0.00 1.17 -6.35 5.15 2.07 -1.92 -3.39 116.25 112.98 2hgu h VAL 51 Ca 0.00 -0.48 -0.47 0.00 0.82 0.00 0.00 66.70 66.56 2hgu h VAL 51 Cb 0.00 0.90 0.02 0.00 -1.52 0.00 0.00 31.29 30.69 2hgu h VAL 51 CO 0.00 0.17 -0.09 -0.24 0.02 0.00 0.00 177.57 177.43 2hgu n SER 52 N -4.75 2.10 -4.60 0.57 2.88 -0.61 -4.95 113.62 104.26 2hgu n SER 52 Ca -0.02 -2.51 -0.56 0.00 -1.33 0.00 0.00 58.87 54.45 2hgu n SER 52 Cb 0.11 -0.35 -0.07 0.00 -0.75 0.00 0.00 64.21 63.16 2hgu n SER 52 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2hgu n PRO 53 N -2.13 0.72 -0.10 -1.46 -0.04 -1.26 -4.54 135.00 126.19 2hgu n PRO 53 Ca 0.13 0.26 0.09 0.00 -0.04 0.00 0.00 63.50 63.94 2hgu n PRO 53 Cb 0.57 -1.86 0.17 0.00 -0.04 0.00 0.00 33.50 32.34 2hgu n PRO 53 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2hgu n LYS 54 N 2.88 -0.02 -3.21 0.54 3.00 -1.26 -0.59 118.16 119.50 2hgu n LYS 54 Ca 0.21 0.41 -0.44 0.00 -0.00 0.00 0.00 58.31 58.50 2hgu n LYS 54 Cb 0.13 -0.73 -0.06 0.00 0.00 0.00 0.00 35.03 34.36 2hgu n LYS 54 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 2hgu s TYR 55 N -4.50 3.09 0.00 5.64 1.51 -1.26 -3.81 117.35 118.02 2hgu s TYR 55 Ca -0.03 -0.71 0.00 0.00 -1.01 0.00 0.00 57.07 55.32 2hgu s TYR 55 Cb 0.10 -3.53 0.00 0.00 -0.11 0.00 0.00 41.96 38.42 2hgu s TYR 55 CO 0.23 -1.02 0.00 -0.35 -1.11 0.00 0.00 175.55 173.31 2hgu n PRO 56 N 5.94 0.13 -3.82 -1.71 -0.04 0.24 -5.01 135.00 130.73 2hgu n PRO 56 Ca -0.09 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.36 2hgu n PRO 56 Cb 0.44 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.91 2hgu n PRO 56 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2hgu s GLN 57 N 1.09 0.94 0.20 0.54 -0.21 -1.26 -4.56 119.66 116.39 2hgu s GLN 57 Ca 0.00 -0.58 -0.02 0.00 0.02 0.00 0.00 55.36 54.78 2hgu s GLN 57 Cb 0.00 0.28 -0.05 0.00 1.00 0.00 0.00 33.01 34.24 2hgu s GLN 57 CO 0.00 -0.44 0.41 0.20 -2.12 0.00 0.00 175.29 173.34 2hgu s GLY 58 N -3.30 1.93 0.00 3.09 0.00 0.09 -4.62 107.32 104.51 2hgu s GLY 58 Ca 0.20 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 44.20 2hgu s GLY 58 CO 0.02 -0.66 0.00 0.61 0.00 0.00 0.00 173.10 173.07 2hgu n GLY 59 N -0.48 0.13 3.60 0.20 0.00 -1.26 -4.39 105.19 102.99 2hgu n GLY 59 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 2hgu n GLY 59 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2hgu s PHE 60 N 0.00 2.09 -0.17 1.61 5.99 -1.26 -4.52 117.98 121.72 2hgu s PHE 60 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 56.93 57.57 2hgu s PHE 60 Cb 0.00 -4.20 0.01 0.00 0.00 0.00 0.00 43.02 38.83 2hgu s PHE 60 CO 0.00 -2.52 -0.17 0.42 -0.00 0.00 0.00 175.22 172.95 2hgu s ILE 61 N 6.12 2.39 -0.39 3.12 1.09 -1.26 -4.95 121.20 127.33 2hgu s ILE 61 Ca 0.71 -0.84 -0.02 0.00 -1.10 0.00 0.00 60.65 59.39 2hgu s ILE 61 Cb -0.19 -2.01 0.22 0.00 -1.06 0.00 0.00 42.46 39.42 2hgu s ILE 61 CO 0.33 0.52 1.03 -0.62 -0.10 0.00 0.00 174.94 176.10 2hgu n GLU 62 N 4.40 0.25 -3.34 2.79 -0.58 -1.26 -1.23 120.64 121.67 2hgu n GLU 62 Ca -0.20 -1.11 -0.46 0.00 -0.42 0.00 0.00 57.16 54.98 2hgu n GLU 62 Cb 0.51 -0.39 -0.05 0.00 -0.57 0.00 0.00 31.44 30.94 2hgu n GLU 62 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2hgu s LYS 63 N 0.79 3.00 -0.56 3.49 1.02 -1.26 -4.56 119.74 121.66 2hgu s LYS 63 Ca 0.26 -1.80 -0.26 0.00 0.02 0.00 0.00 55.97 54.19 2hgu s LYS 63 Cb 0.12 -4.27 0.04 0.00 -0.52 0.00 0.00 37.83 33.20 2hgu s LYS 63 CO -0.10 -1.31 1.05 -2.00 -0.92 0.00 0.00 175.35 172.06 2hgu s GLU 64 N 1.42 3.41 0.00 1.68 2.56 0.29 -4.97 118.70 123.09 2hgu s GLU 64 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.97 54.98 2hgu s GLU 64 Cb -0.27 -4.03 0.00 0.00 2.00 0.00 0.00 34.13 31.82 2hgu s GLU 64 CO 0.01 -1.56 0.00 0.00 -0.56 0.00 0.00 175.26 173.15 2hgu n ALA 65 N 7.86 0.00 0.00 6.30 0.00 -1.26 -1.39 120.51 132.03 2hgu n ALA 65 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2hgu n ALA 65 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2hgu n ALA 65 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2hgu n PRO 66 N 0.00 0.00 -2.75 0.00 -0.02 -1.26 -4.72 135.00 126.25 2hgu n PRO 66 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 61.13 2hgu n PRO 66 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2hgu n PRO 66 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2hgu n LEU 67 N 0.00 6.21 -0.81 2.45 7.94 -1.26 -4.46 117.00 127.07 2hgu n LEU 67 Ca 0.00 -5.50 0.06 0.00 -1.11 0.00 0.00 56.01 49.45 2hgu n LEU 67 Cb 0.00 -0.92 0.16 0.00 0.53 0.00 0.00 43.42 43.19 2hgu n LEU 67 CO 0.00 2.17 0.29 1.41 -1.11 0.00 0.00 177.39 180.15 2hgu n HIS 68 N -0.14 0.00 -3.16 1.96 8.25 -1.26 -4.96 115.22 115.90 2hgu n HIS 68 Ca 0.41 -1.24 -0.40 0.00 -0.26 0.00 0.00 57.72 56.23 2hgu n HIS 68 Cb 0.31 -0.22 -0.07 0.00 1.12 0.00 0.00 29.99 31.14 2hgu n HIS 68 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2hgu s ALA 69 N -2.43 3.59 -1.40 -1.41 0.00 -1.25 -0.86 121.76 117.99 2hgu s ALA 69 Ca 0.37 -0.45 -0.15 0.00 0.00 0.00 0.00 51.96 51.72 2hgu s ALA 69 Cb 0.37 -2.95 0.05 0.00 0.00 0.00 0.00 23.12 20.59 2hgu s ALA 69 CO -0.09 -0.70 2.04 0.45 0.00 0.00 0.00 175.76 177.46 2hgu n SER 70 N 5.43 4.29 -0.39 0.00 2.88 0.77 -4.87 113.62 121.74 2hgu n SER 70 Ca -0.02 -2.87 -0.04 0.00 -1.33 0.00 0.00 58.87 54.61 2hgu n SER 70 Cb 0.49 -1.69 0.00 0.00 -0.75 0.00 0.00 64.21 62.26 2hgu n SER 70 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2hgu n LYS 71 N 6.93 0.00 -1.26 -1.46 4.01 -1.26 -3.76 118.16 121.35 2hgu n LYS 71 Ca 0.51 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.31 2hgu n LYS 71 Cb 0.42 -0.09 0.00 0.00 -0.51 0.00 0.00 35.03 34.84 2hgu n LYS 71 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 2hgu n VAL 72 N -0.15 -0.16 -3.21 -0.18 0.31 -1.26 -3.88 118.33 109.80 2hgu n VAL 72 Ca 0.01 0.07 -0.23 0.00 -0.01 0.00 0.00 64.34 64.18 2hgu n VAL 72 Cb 0.04 -0.10 -0.06 0.00 -0.91 0.00 0.00 33.84 32.81 2hgu n VAL 72 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2hgu n ARG 73 N -0.26 1.25 0.00 5.55 1.74 -1.25 -4.06 116.66 119.63 2hgu n ARG 73 Ca 0.00 -3.61 0.00 0.00 -0.77 0.00 0.00 57.85 53.47 2hgu n ARG 73 Cb 0.00 -1.57 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 2hgu n ARG 73 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2hgu n PRO 74 N 0.95 1.56 -0.03 5.56 -0.04 -1.26 -4.37 135.00 137.38 2hgu n PRO 74 Ca 0.24 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 2hgu n PRO 74 Cb 0.53 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 2hgu n PRO 74 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2hgu n ILE 75 N -0.44 0.63 -3.17 0.52 0.00 -1.26 -3.99 119.36 111.66 2hgu n ILE 75 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 62.75 62.76 2hgu n ILE 75 Cb 0.00 -0.84 -0.01 0.00 0.00 0.00 0.00 39.64 38.79 2hgu n ILE 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2hgu n PRO 77 N 5.43 0.00 -1.85 0.00 -0.04 -1.26 -4.23 135.00 133.06 2hgu n PRO 77 Ca -0.01 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.22 2hgu n PRO 77 Cb 0.51 -0.77 -0.06 0.00 -0.04 0.00 0.00 33.50 33.14 2hgu n PRO 77 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hgu s ALA 78 N -2.08 1.32 0.15 0.55 0.00 -1.26 -3.80 121.76 116.63 2hgu s ALA 78 Ca 0.00 -1.13 0.01 0.00 0.00 0.00 0.00 51.96 50.85 2hgu s ALA 78 Cb 0.00 -4.54 -0.04 0.00 0.00 0.00 0.00 23.12 18.53 2hgu s ALA 78 CO 0.00 -5.18 -0.00 0.00 0.00 0.00 0.00 175.76 170.58 2hgu n GLY 80 N -0.19 0.94 2.84 0.00 0.00 -1.26 -4.72 105.19 102.80 2hgu n GLY 80 Ca -0.07 -1.85 -0.22 0.00 0.00 0.00 0.00 46.02 43.88 2hgu n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hgu s LYS 81 N 1.87 0.81 0.00 1.61 -0.14 -1.26 -4.75 119.74 117.88 2hgu s LYS 81 Ca 0.00 -0.03 0.00 0.00 -1.36 0.00 0.00 55.97 54.58 2hgu s LYS 81 Cb 0.00 -0.98 0.00 0.00 -1.68 0.00 0.00 37.83 35.17 2hgu s LYS 81 CO 0.00 -0.19 0.00 -0.35 -0.76 0.00 0.00 175.35 174.05 2hgu n PRO 82 N 4.60 3.19 0.00 -1.68 -0.04 -1.26 -4.99 135.00 134.83 2hgu n PRO 82 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 2hgu n PRO 82 Cb 0.50 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 2hgu n PRO 82 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2hgu n THR 83 N 0.00 0.00 -3.46 0.52 -1.04 -1.26 -4.96 114.28 104.08 2hgu n THR 83 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 2hgu n THR 83 Cb 0.00 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.49 2hgu n THR 83 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hgu s ARG 84 N 3.04 1.13 -0.04 -2.82 3.03 -1.26 -4.00 118.95 118.02 2hgu s ARG 84 Ca 0.00 -0.42 0.06 0.00 2.03 0.00 0.00 55.73 57.40 2hgu s ARG 84 Cb 0.00 0.51 0.09 0.00 -1.03 0.00 0.00 34.95 34.52 2hgu s ARG 84 CO 0.00 -0.49 0.95 0.28 -1.13 0.00 0.00 175.30 174.91 2hgu n VAL 85 N -0.33 0.89 0.00 4.99 0.31 -1.26 -5.02 118.33 117.90 2hgu n VAL 85 Ca -0.14 -1.01 0.00 0.00 -0.01 0.00 0.00 64.34 63.18 2hgu n VAL 85 Cb 0.64 0.36 0.00 0.00 -0.91 0.00 0.00 33.84 33.93 2hgu n VAL 85 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2hgu n ARG 86 N -0.60 0.00 0.00 5.55 0.63 -1.26 -4.73 116.66 116.25 2hgu n ARG 86 Ca 0.05 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.98 2hgu n ARG 86 Cb 0.51 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.42 2hgu n ARG 86 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 2hgu n LYS 87 N 0.00 0.00 -4.18 -0.14 3.00 -1.26 -4.58 118.16 111.00 2hgu n LYS 87 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 2hgu n LYS 87 Cb 0.00 -1.51 -0.10 0.00 0.00 0.00 0.00 35.03 33.42 2hgu n LYS 87 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2hgu s LYS 88 N 0.00 0.85 -0.39 1.64 2.36 -1.26 -5.09 119.74 117.84 2hgu s LYS 88 Ca 0.00 -1.24 -0.42 0.00 -2.55 0.00 0.00 55.97 51.76 2hgu s LYS 88 Cb 0.00 -0.40 -0.17 0.00 -1.05 0.00 0.00 37.83 36.21 2hgu s LYS 88 CO 0.00 0.04 1.81 1.19 1.55 0.00 0.00 175.35 179.94 2hgu n PHE 89 N 0.29 1.79 -3.25 4.03 3.01 -1.26 -2.49 117.46 119.57 2hgu n PHE 89 Ca -0.14 0.73 -0.25 0.00 1.01 0.00 0.00 57.45 58.81 2hgu n PHE 89 Cb 0.59 -2.37 0.03 0.00 -0.01 0.00 0.00 39.48 37.71 2hgu n PHE 89 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2hgu n LEU 90 N 5.75 -4.46 -4.09 4.37 4.32 -1.26 -4.93 117.00 116.71 2hgu n LEU 90 Ca 0.34 0.18 -0.35 0.00 -0.02 0.00 0.00 56.01 56.15 2hgu n LEU 90 Cb 0.06 -2.21 -0.08 0.00 -1.62 0.00 0.00 43.42 39.57 2hgu n LEU 90 CO 0.84 -1.00 0.24 -0.70 -1.22 0.00 0.00 177.39 175.56 2hgu s GLU 91 N -2.30 3.04 0.00 3.23 2.56 -1.04 -4.92 118.70 119.26 2hgu s GLU 91 Ca 0.29 -3.11 0.00 0.00 0.00 0.00 0.00 54.97 52.15 2hgu s GLU 91 Cb -0.04 -3.86 0.00 0.00 2.00 0.00 0.00 34.13 32.23 2hgu s GLU 91 CO 0.75 -1.25 0.00 0.09 -0.56 0.00 0.00 175.26 174.30 2hgu n ASN 92 N 2.57 0.00 -4.07 -1.70 3.02 -1.26 -4.03 115.26 109.79 2hgu n ASN 92 Ca 0.18 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.41 2hgu n ASN 92 Cb 0.37 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.51 2hgu n ASN 92 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2hgu n GLY 93 N 2.28 -0.39 0.27 7.41 0.00 -1.26 -4.56 105.19 108.93 2hgu n GLY 93 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2hgu n GLY 93 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hgu n LYS 94 N -4.57 0.00 -0.16 1.61 5.02 -1.26 -4.78 118.16 114.03 2hgu n LYS 94 Ca -0.26 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 55.98 2hgu n LYS 94 Cb 0.66 -0.92 0.01 0.00 -0.02 0.00 0.00 35.03 34.75 2hgu n LYS 94 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2hgu n LYS 95 N 0.02 0.00 -3.03 1.97 4.81 -1.26 -4.02 118.16 116.65 2hgu n LYS 95 Ca 0.00 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.03 2hgu n LYS 95 Cb 0.00 -0.16 -0.06 0.00 0.02 0.00 0.00 35.03 34.84 2hgu n LYS 95 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2hgu s ILE 96 N -0.31 4.88 -0.25 3.15 1.09 0.06 -4.19 121.20 125.63 2hgu s ILE 96 Ca 0.07 1.08 0.01 0.00 -1.10 0.00 0.00 60.65 60.71 2hgu s ILE 96 Cb -0.04 -4.06 0.06 0.00 -1.06 0.00 0.00 42.46 37.37 2hgu s ILE 96 CO 0.13 -0.15 -0.05 -0.13 -0.10 0.00 0.00 174.94 174.63 2hgu s ARG 97 N 2.75 1.67 -0.30 2.79 0.52 -1.26 -1.20 118.95 123.92 2hgu s ARG 97 Ca 0.29 -1.11 -0.03 0.00 -0.52 0.00 0.00 55.73 54.35 2hgu s ARG 97 Cb -0.15 -2.66 0.19 0.00 0.52 0.00 0.00 34.95 32.85 2hgu s ARG 97 CO 0.11 -0.63 0.69 0.08 0.02 0.00 0.00 175.30 175.57 2hgu s VAL 98 N 1.32 -0.86 0.00 3.52 1.01 -1.26 -4.45 120.40 119.68 2hgu s VAL 98 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.93 2hgu s VAL 98 Cb -0.19 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.19 2hgu s VAL 98 CO -0.07 0.00 0.00 0.00 0.00 0.00 0.00 175.10 175.03 2hgu n ALA 100 N 9.78 -4.53 -2.90 0.00 0.00 -1.26 -4.98 120.51 116.61 2hgu n ALA 100 Ca 0.00 -1.73 -0.10 0.00 0.00 0.00 0.00 53.44 51.62 2hgu n ALA 100 Cb 0.00 -1.72 -0.06 0.00 0.00 0.00 0.00 19.45 17.66 2hgu n ALA 100 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2hgu s LYS 101 N -4.83 1.36 -0.27 0.00 3.01 -1.26 -4.73 119.74 113.02 2hgu s LYS 101 Ca 0.68 -1.25 -0.26 0.00 -1.01 0.00 0.00 55.97 54.12 2hgu s LYS 101 Cb -0.17 0.42 0.17 0.00 -1.01 0.00 0.00 37.83 37.24 2hgu s LYS 101 CO 0.60 -0.53 1.28 0.00 0.51 0.00 0.00 175.35 177.20 2hgu n GLY 103 N 1.41 0.46 0.03 0.00 0.00 -1.26 -0.76 105.19 105.07 2hgu n GLY 103 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2hgu n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hgu n GLY 104 N 0.33 0.60 0.00 -0.02 0.00 -1.26 -4.72 105.19 100.13 2hgu n GLY 104 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hgu n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hgu n ALA 105 N -1.97 0.00 0.25 4.61 0.00 -1.26 -4.53 120.51 117.61 2hgu n ALA 105 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgu n ALA 105 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hgu n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2hgu n LEU 106 N 0.00 0.00 -5.01 0.00 4.77 -1.26 -4.55 117.00 110.94 2hgu n LEU 106 Ca 0.00 0.38 -0.19 0.00 -0.03 0.00 0.00 56.01 56.16 2hgu n LEU 106 Cb 0.00 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 2hgu n LEU 106 CO 0.00 -0.38 0.32 -1.81 -1.33 0.00 0.00 177.39 174.19 2hgu s ASP 107 N -2.74 5.19 0.00 -1.43 1.01 -1.26 -4.65 116.67 112.79 2hgu s ASP 107 Ca 0.00 -0.55 0.00 0.00 0.71 0.00 0.00 52.55 52.71 2hgu s ASP 107 Cb 0.00 -0.18 0.00 0.00 1.01 0.00 0.00 42.92 43.75 2hgu s ASP 107 CO 0.00 -1.21 0.00 0.41 0.21 0.00 0.00 175.17 174.58 2hgu n THR 108 N -2.21 0.00 -3.65 -1.27 -1.04 -1.26 -4.46 114.28 100.38 2hgu n THR 108 Ca 0.12 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.15 2hgu n THR 108 Cb 0.60 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 69.05 2hgu n THR 108 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2hgu s GLU 109 N 0.00 0.06 0.00 -2.82 2.02 -1.26 -5.23 118.70 111.46 2hgu s GLU 109 Ca 0.00 0.09 0.00 0.00 0.02 0.00 0.00 54.97 55.08 2hgu s GLU 109 Cb 0.00 0.01 0.00 0.00 0.10 0.00 0.00 34.13 34.24 2hgu s GLU 109 CO 0.00 -0.01 0.00 -1.91 0.02 0.00 0.00 175.26 173.36