#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgu s LYS 2 N 0.00 0.73 0.50 0.54 1.02 -1.26 -5.19 119.74 116.08 2hgu s LYS 2 Ca 0.00 0.59 0.01 0.00 0.02 0.00 0.00 55.97 56.59 2hgu s LYS 2 Cb 0.00 0.35 -0.01 0.00 -0.52 0.00 0.00 37.83 37.65 2hgu s LYS 2 CO 0.00 -0.13 0.02 -1.01 -0.92 0.00 0.00 175.35 173.31 2hgu s HIS 3 N -0.14 1.81 -1.04 3.18 3.76 -1.26 -5.09 115.29 116.52 2hgu s HIS 3 Ca -0.03 -1.03 -0.15 0.00 -0.15 0.00 0.00 55.06 53.70 2hgu s HIS 3 Cb -0.03 -1.53 0.19 0.00 1.11 0.00 0.00 32.58 32.31 2hgu s HIS 3 CO 0.03 0.13 1.16 0.20 -0.85 0.00 0.00 174.74 175.40 2hgu s GLY 4 N -3.85 2.46 -0.30 -2.22 0.00 -1.26 -4.88 107.32 97.27 2hgu s GLY 4 Ca 0.06 -3.26 -0.09 0.00 0.00 0.00 0.00 44.72 41.44 2hgu s GLY 4 CO 0.04 1.76 0.86 0.54 0.00 0.00 0.00 173.10 176.30 2hgu s LYS 5 N 1.15 0.35 0.00 2.90 3.01 -1.26 -4.95 119.74 120.94 2hgu s LYS 5 Ca 0.33 0.66 0.03 0.00 -1.01 0.00 0.00 55.97 55.98 2hgu s LYS 5 Cb -0.06 0.37 0.12 0.00 -1.01 0.00 0.00 37.83 37.25 2hgu s LYS 5 CO -0.06 -0.35 0.99 2.89 0.51 0.00 0.00 175.35 179.32 2hgu n ARG 6 N 5.41 0.02 0.26 1.68 -4.01 -1.26 0.34 116.66 119.09 2hgu n ARG 6 Ca -0.05 0.36 0.09 0.00 -1.04 0.00 0.00 57.85 57.21 2hgu n ARG 6 Cb 0.52 -1.50 0.51 0.00 -3.04 0.00 0.00 32.46 28.95 2hgu n ARG 6 CO 0.00 0.00 0.00 -0.92 -3.04 0.00 0.00 177.63 173.67 2hgu h TYR 7 N 0.00 0.00 -0.65 2.89 3.20 -1.97 -2.97 116.97 117.47 2hgu h TYR 7 Ca 0.00 0.00 0.12 0.00 3.14 0.00 0.00 58.73 61.99 2hgu h TYR 7 Cb 0.03 0.00 -0.12 0.00 1.54 0.00 0.00 36.73 38.19 2hgu h TYR 7 CO 0.00 0.00 -0.20 -2.13 -1.64 0.00 0.00 178.16 174.19 2hgu n ARG 8 N -2.45 -0.09 0.34 1.82 3.00 0.15 -0.64 116.66 118.79 2hgu n ARG 8 Ca -0.01 1.00 -0.14 0.00 -0.00 0.00 0.00 57.85 58.70 2hgu n ARG 8 Cb 0.44 -1.49 -0.07 0.00 0.00 0.00 0.00 32.46 31.33 2hgu n ARG 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2hgu h ALA 9 N 1.14 -1.21 -0.70 5.13 0.00 -1.82 0.12 119.26 121.92 2hgu h ALA 9 Ca 0.28 -0.19 0.15 0.00 0.00 0.00 0.00 54.91 55.15 2hgu h ALA 9 Cb 0.44 0.43 -0.12 0.00 0.00 0.00 0.00 17.79 18.54 2hgu h ALA 9 CO -0.66 -1.16 -0.02 1.25 0.00 0.00 0.00 179.25 178.66 2hgu h LEU 10 N -0.91 -0.37 -1.38 0.00 5.85 -1.24 0.34 115.31 117.58 2hgu h LEU 10 Ca -0.09 0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 2hgu h LEU 10 Cb 0.72 0.34 -0.03 0.00 0.37 0.00 0.00 40.66 42.06 2hgu h LEU 10 CO 0.11 -0.17 0.35 0.25 -0.34 0.00 0.00 178.44 178.65 2hgu h LEU 11 N 0.09 0.68 -0.86 2.25 5.85 -0.76 0.41 115.31 122.96 2hgu h LEU 11 Ca 0.37 -0.03 0.07 0.00 0.84 0.00 0.00 57.88 59.13 2hgu h LEU 11 Cb 0.63 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.43 2hgu h LEU 11 CO -0.63 0.52 0.53 -0.33 -0.34 0.00 0.00 178.44 178.18 2hgu h GLU 12 N 0.79 0.93 -0.16 1.25 4.39 0.17 -0.40 114.58 121.54 2hgu h GLU 12 Ca 0.21 -0.06 0.05 0.00 0.34 0.00 0.00 59.36 59.90 2hgu h GLU 12 Cb -0.04 -0.21 -0.05 0.00 -0.10 0.00 0.00 28.75 28.35 2hgu h GLU 12 CO -0.04 0.61 -0.16 0.87 -1.16 0.00 0.00 179.01 179.13 2hgu h LYS 13 N 0.95 -0.18 -6.34 2.33 1.57 0.13 -3.42 116.57 111.61 2hgu h LYS 13 Ca 0.38 0.01 -0.27 0.00 -1.87 0.00 0.00 60.65 58.90 2hgu h LYS 13 Cb 0.21 0.04 0.16 0.00 0.08 0.00 0.00 32.23 32.71 2hgu h LYS 13 CO -0.19 -0.12 -0.26 0.28 -0.57 0.00 0.00 179.45 178.60 2hgu n VAL 14 N -5.31 0.00 0.00 0.50 0.31 -0.16 -5.04 118.33 108.64 2hgu n VAL 14 Ca -0.02 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 2hgu n VAL 14 Cb 0.22 -0.65 0.00 0.00 -0.91 0.00 0.00 33.84 32.50 2hgu n VAL 14 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2hgu n ASP 15 N -2.68 0.00 -4.53 4.52 2.03 -1.26 -4.98 116.55 109.65 2hgu n ASP 15 Ca 0.08 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.14 2hgu n ASP 15 Cb 0.43 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.72 2hgu n ASP 15 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2hgu n PRO 16 N 0.00 0.45 0.00 -0.67 -0.04 -1.26 -4.45 135.00 129.03 2hgu n PRO 16 Ca 0.00 -0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.12 2hgu n PRO 16 Cb 0.00 -2.68 0.00 0.00 -0.04 0.00 0.00 33.50 30.78 2hgu n PRO 16 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2hgu n ASN 17 N 13.76 0.00 -3.82 3.54 3.02 -1.26 -5.07 115.26 125.44 2hgu n ASN 17 Ca 0.53 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.79 2hgu n ASN 17 Cb 0.33 0.00 -0.16 0.00 -0.61 0.00 0.00 39.78 39.34 2hgu n ASN 17 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2hgu s LYS 18 N -0.66 1.04 0.00 3.52 2.20 -1.26 -5.01 119.74 119.57 2hgu s LYS 18 Ca 0.00 -0.61 0.00 0.00 -0.36 0.00 0.00 55.97 55.00 2hgu s LYS 18 Cb 0.00 -2.25 0.00 0.00 -1.51 0.00 0.00 37.83 34.07 2hgu s LYS 18 CO 0.00 -0.61 0.32 -0.89 -0.36 0.00 0.00 175.35 173.82 2hgu n ILE 19 N 4.91 0.00 0.00 5.43 2.08 -1.26 -4.89 119.36 125.63 2hgu n ILE 19 Ca -0.10 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.21 2hgu n ILE 19 Cb 0.46 -0.25 0.00 0.00 -0.75 0.00 0.00 39.64 39.11 2hgu n ILE 19 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2hgu n TYR 20 N -0.03 0.00 -3.94 1.39 0.18 -1.26 -1.65 117.16 111.84 2hgu n TYR 20 Ca 0.00 0.00 -0.08 0.00 1.88 0.00 0.00 57.90 59.70 2hgu n TYR 20 Cb 0.07 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 38.95 2hgu n TYR 20 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 2hgu s THR 21 N 0.00 0.16 0.00 -3.48 -4.23 -1.26 -2.19 115.64 104.64 2hgu s THR 21 Ca 0.00 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 2hgu s THR 21 Cb 0.00 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.40 2hgu s THR 21 CO 0.00 -0.74 0.18 -0.38 -0.54 0.00 0.00 174.62 173.14 2hgu n ILE 22 N -0.02 0.00 -0.30 2.99 5.41 -1.23 -1.13 119.36 125.08 2hgu n ILE 22 Ca -0.14 0.47 0.13 0.00 1.00 0.00 0.00 62.75 64.22 2hgu n ILE 22 Cb 0.62 -0.77 0.30 0.00 -0.71 0.00 0.00 39.64 39.09 2hgu n ILE 22 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 2hgu h ASP 23 N 0.00 0.23 -0.19 4.38 3.32 -1.91 0.88 116.42 123.13 2hgu h ASP 23 Ca 0.00 0.17 0.04 0.00 0.02 0.00 0.00 57.03 57.26 2hgu h ASP 23 Cb 0.00 0.18 -0.07 0.00 0.22 0.00 0.00 39.33 39.66 2hgu h ASP 23 CO 0.00 -0.06 -0.50 -0.33 -1.72 0.00 0.00 179.24 176.64 2hgu h GLU 24 N 0.33 -0.49 -0.70 3.56 5.08 -1.88 -0.67 114.58 119.80 2hgu h GLU 24 Ca 0.56 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 59.08 2hgu h GLU 24 Cb 1.09 0.11 -0.13 0.00 0.50 0.00 0.00 28.75 30.32 2hgu h GLU 24 CO -0.57 -0.33 -0.26 0.00 -1.00 0.00 0.00 179.01 176.85 2hgu h ALA 25 N -0.07 0.25 -0.30 3.43 0.00 0.23 0.40 119.26 123.20 2hgu h ALA 25 Ca 0.06 0.24 0.07 0.00 0.00 0.00 0.00 54.91 55.28 2hgu h ALA 25 Cb 0.65 0.69 -0.08 0.00 0.00 0.00 0.00 17.79 19.05 2hgu h ALA 25 CO -0.46 -0.54 -0.26 0.00 0.00 0.00 0.00 179.25 177.99 2hgu h ALA 26 N 1.41 -0.12 0.33 0.00 0.00 0.22 0.02 119.26 121.13 2hgu h ALA 26 Ca 0.31 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 2hgu h ALA 26 Cb 0.55 0.56 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2hgu h ALA 26 CO -0.75 -0.67 -0.16 0.45 0.00 0.00 0.00 179.25 178.12 2hgu h HIS 27 N -0.24 -0.41 -0.99 0.00 -0.00 0.32 -0.75 115.15 113.07 2hgu h HIS 27 Ca 0.15 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.52 2hgu h HIS 27 Cb 0.48 0.14 -0.05 0.00 -0.00 0.00 0.00 27.41 27.98 2hgu h HIS 27 CO -0.44 -0.21 0.65 -0.07 -0.00 0.00 0.00 177.93 177.87 2hgu h LEU 28 N -0.53 1.14 0.21 2.43 4.07 -0.88 -0.64 115.31 121.11 2hgu h LEU 28 Ca -0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 57.88 57.87 2hgu h LEU 28 Cb 0.40 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 41.85 2hgu h LEU 28 CO 0.08 0.83 -0.10 1.62 -1.08 0.00 0.00 178.44 179.78 2hgu h VAL 29 N 1.34 0.80 -0.73 1.22 3.04 -0.85 0.11 116.25 121.19 2hgu h VAL 29 Ca 0.36 -0.04 0.15 0.00 -1.01 0.00 0.00 66.70 66.16 2hgu h VAL 29 Cb -0.15 0.83 -0.10 0.00 -2.01 0.00 0.00 31.29 29.86 2hgu h VAL 29 CO -0.08 0.01 0.24 0.11 -1.01 0.00 0.00 177.57 176.84 2hgu h LYS 30 N -0.30 0.34 -0.10 4.17 1.57 -0.84 0.42 116.57 121.83 2hgu h LYS 30 Ca -0.03 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.54 2hgu h LYS 30 Cb 0.23 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 2hgu h LYS 30 CO 0.05 0.23 -0.73 0.93 -0.57 0.00 0.00 179.45 179.36 2hgu h GLU 31 N 0.35 0.48 0.04 3.15 5.08 -0.82 -3.37 114.58 119.48 2hgu h GLU 31 Ca 0.41 -0.38 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 2hgu h GLU 31 Cb 0.65 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.93 2hgu h GLU 31 CO -0.45 1.01 -0.48 -0.07 -1.00 0.00 0.00 179.01 178.03 2hgu h LEU 32 N 0.33 -1.45 -6.28 1.33 3.38 0.14 -3.43 115.31 109.33 2hgu h LEU 32 Ca -0.03 0.16 -0.43 0.00 0.09 0.00 0.00 57.88 57.67 2hgu h LEU 32 Cb 1.31 0.55 -0.32 0.00 0.09 0.00 0.00 40.66 42.28 2hgu h LEU 32 CO 0.13 -0.50 -0.75 0.00 0.09 0.00 0.00 178.44 177.40 2hgu s ALA 33 N -5.83 0.00 -1.09 1.53 0.00 -0.78 -4.87 121.76 110.73 2hgu s ALA 33 Ca -0.16 -1.37 -0.05 0.00 0.00 0.00 0.00 51.96 50.38 2hgu s ALA 33 Cb 0.07 -1.95 0.30 0.00 0.00 0.00 0.00 23.12 21.55 2hgu s ALA 33 CO 0.62 -2.12 1.47 2.41 0.00 0.00 0.00 175.76 178.14 2hgu n THR 34 N 3.83 5.26 0.00 0.00 -1.04 -1.26 -3.28 114.28 117.78 2hgu n THR 34 Ca 0.15 -5.85 0.00 0.00 -2.04 0.00 0.00 64.05 56.31 2hgu n THR 34 Cb 0.45 -2.13 0.00 0.00 -1.82 0.00 0.00 70.33 66.83 2hgu n THR 34 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hgu n ALA 35 N 1.51 0.00 -1.76 2.41 0.00 -1.26 -4.56 120.51 116.84 2hgu n ALA 35 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.29 2hgu n ALA 35 Cb 0.34 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.77 2hgu n ALA 35 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2hgu n LYS 36 N 0.00 2.53 0.00 0.00 3.00 -1.26 -4.63 118.16 117.80 2hgu n LYS 36 Ca 0.00 -2.54 0.00 0.00 -0.00 0.00 0.00 58.31 55.77 2hgu n LYS 36 Cb 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 35.03 31.76 2hgu n LYS 36 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.40 179.37 2hgu n PHE 37 N 7.31 0.00 -4.24 5.64 1.16 -1.26 -5.05 117.46 121.02 2hgu n PHE 37 Ca 0.51 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.74 2hgu n PHE 37 Cb 0.41 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 38.15 2hgu n PHE 37 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2hgu s ASP 38 N -4.00 4.62 0.17 5.98 2.15 -1.26 -4.64 116.67 119.69 2hgu s ASP 38 Ca 0.00 -0.23 -0.11 0.00 0.43 0.00 0.00 52.55 52.64 2hgu s ASP 38 Cb 0.00 -1.77 -0.08 0.00 -0.30 0.00 0.00 42.92 40.77 2hgu s ASP 38 CO 0.00 0.10 0.09 1.21 -0.17 0.00 0.00 175.17 176.40 2hgu n GLU 39 N 4.03 0.00 -2.26 4.34 4.07 -1.21 -4.78 120.64 124.83 2hgu n GLU 39 Ca -0.17 0.00 -0.36 0.00 -0.06 0.00 0.00 57.16 56.57 2hgu n GLU 39 Cb 0.52 -0.48 0.02 0.00 -0.06 0.00 0.00 31.44 31.44 2hgu n GLU 39 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 2hgu n THR 40 N -0.37 3.60 -1.20 6.31 -1.04 -1.26 -3.05 114.28 117.27 2hgu n THR 40 Ca 0.06 -4.83 -0.37 0.00 -2.04 0.00 0.00 64.05 56.87 2hgu n THR 40 Cb 0.17 -1.31 0.04 0.00 -1.82 0.00 0.00 70.33 67.41 2hgu n THR 40 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2hgu n VAL 41 N -0.43 0.62 -3.95 12.58 0.31 -1.26 -3.83 118.33 122.37 2hgu n VAL 41 Ca 0.47 -0.47 -0.11 0.00 -0.01 0.00 0.00 64.34 64.23 2hgu n VAL 41 Cb 0.36 -0.26 -0.02 0.00 -0.91 0.00 0.00 33.84 33.02 2hgu n VAL 41 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2hgu s GLU 42 N -1.83 1.94 0.01 5.55 0.41 -0.03 -4.59 118.70 120.16 2hgu s GLU 42 Ca 0.56 -1.47 0.07 0.00 -0.41 0.00 0.00 54.97 53.72 2hgu s GLU 42 Cb -0.38 0.53 -0.02 0.00 -1.78 0.00 0.00 34.13 32.48 2hgu s GLU 42 CO 0.67 -0.85 -0.20 0.08 -0.49 0.00 0.00 175.26 174.47 2hgu s VAL 43 N -3.08 1.61 0.01 2.63 1.01 -0.25 -1.02 120.40 121.32 2hgu s VAL 43 Ca 0.22 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.21 2hgu s VAL 43 Cb -0.03 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 2hgu s VAL 43 CO 0.14 0.35 -0.02 -1.00 0.00 0.00 0.00 175.10 174.57 2hgu s HIS 44 N -0.60 0.18 0.29 5.22 3.76 -0.25 -1.35 115.29 122.55 2hgu s HIS 44 Ca 0.08 -0.28 -0.20 0.00 -0.15 0.00 0.00 55.06 54.50 2hgu s HIS 44 Cb -0.08 -0.13 0.02 0.00 1.11 0.00 0.00 32.58 33.51 2hgu s HIS 44 CO 0.00 -0.10 0.73 0.00 -0.85 0.00 0.00 174.74 174.52 2hgu s ALA 45 N -0.78 -1.16 0.08 -1.40 0.00 -0.50 -0.99 121.76 117.01 2hgu s ALA 45 Ca -0.08 -0.37 0.06 0.00 0.00 0.00 0.00 51.96 51.57 2hgu s ALA 45 Cb -0.05 0.83 -0.03 0.00 0.00 0.00 0.00 23.12 23.87 2hgu s ALA 45 CO -0.00 -1.03 -0.16 -1.59 0.00 0.00 0.00 175.76 172.97 2hgu s LYS 46 N -3.74 0.92 -0.05 0.00 0.00 -0.19 -0.79 119.74 115.89 2hgu s LYS 46 Ca 0.12 -1.00 0.06 0.00 0.00 0.00 0.00 55.97 55.15 2hgu s LYS 46 Cb -0.06 -1.00 -0.01 0.00 0.00 0.00 0.00 37.83 36.76 2hgu s LYS 46 CO 0.08 0.23 -0.24 -0.48 0.00 0.00 0.00 175.35 174.93 2hgu s LEU 47 N -1.74 2.05 -0.81 2.77 2.34 -0.24 -1.08 118.68 121.96 2hgu s LEU 47 Ca 0.01 -0.49 -0.12 0.00 0.06 0.00 0.00 54.13 53.59 2hgu s LEU 47 Cb -0.10 -1.32 -0.09 0.00 -0.56 0.00 0.00 46.19 44.12 2hgu s LEU 47 CO 0.03 0.24 1.98 0.61 -1.06 0.00 0.00 176.35 178.16 2hgu n GLY 48 N 2.89 2.82 0.00 -3.48 0.00 0.02 -4.68 105.19 102.77 2hgu n GLY 48 Ca -0.17 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.87 2hgu n GLY 48 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2hgu n ILE 49 N 4.95 0.00 0.00 -0.61 -5.35 -1.26 -4.79 119.36 112.30 2hgu n ILE 49 Ca 0.44 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.92 2hgu n ILE 49 Cb 0.23 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.13 2hgu n ILE 49 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2hgu n ASP 50 N 0.00 0.00 0.00 7.28 -0.08 -1.26 -5.05 116.55 117.44 2hgu n ASP 50 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2hgu n ASP 50 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2hgu n ASP 50 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2hgu n PRO 51 N 0.00 0.00 0.00 -0.67 -0.04 -1.26 -2.75 135.00 130.27 2hgu n PRO 51 Ca 0.00 0.33 0.03 0.00 -0.04 0.00 0.00 63.50 63.82 2hgu n PRO 51 Cb 0.00 -1.52 0.19 0.00 -0.04 0.00 0.00 33.50 32.13 2hgu n PRO 51 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2hgu n ARG 52 N -1.32 0.23 -2.91 0.54 1.74 -1.26 -2.63 116.66 111.05 2hgu n ARG 52 Ca 0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.98 2hgu n ARG 52 Cb 0.02 -1.43 -0.01 0.00 -1.02 0.00 0.00 32.46 30.02 2hgu n ARG 52 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2hgu n ARG 53 N -0.93 0.49 0.00 5.56 1.74 -1.11 -5.03 116.66 117.39 2hgu n ARG 53 Ca 0.05 -2.30 0.00 0.00 -0.77 0.00 0.00 57.85 54.83 2hgu n ARG 53 Cb 0.02 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 2hgu n ARG 53 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2hgu n SER 54 N 2.73 0.00 0.00 0.55 7.64 -1.08 -3.36 113.62 120.11 2hgu n SER 54 Ca 0.20 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.08 2hgu n SER 54 Cb 0.55 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.77 2hgu n SER 54 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2hgu n ASP 55 N -0.35 0.00 0.00 6.43 5.75 -1.26 -1.63 116.55 125.49 2hgu n ASP 55 Ca 0.00 -0.25 0.00 0.00 -0.01 0.00 0.00 54.79 54.53 2hgu n ASP 55 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 2hgu n ASP 55 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2hgu n GLN 56 N -0.57 0.00 -1.81 0.11 6.02 -1.21 -4.76 117.38 115.16 2hgu n GLN 56 Ca 0.00 -0.10 -0.34 0.00 -0.01 0.00 0.00 57.00 56.55 2hgu n GLN 56 Cb 0.00 -0.15 -0.03 0.00 1.02 0.00 0.00 30.24 31.07 2hgu n GLN 56 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2hgu s ASN 57 N 0.00 4.80 0.25 1.08 0.01 -0.65 -4.77 114.94 115.66 2hgu s ASN 57 Ca 0.00 0.53 -0.09 0.00 -0.71 0.00 0.00 52.86 52.58 2hgu s ASN 57 Cb 0.00 -2.52 -0.07 0.00 0.41 0.00 0.00 41.25 39.07 2hgu s ASN 57 CO 0.00 -2.74 0.57 -0.69 -1.51 0.00 0.00 177.10 172.72 2hgu s VAL 58 N 10.92 4.93 -0.13 1.60 1.01 -1.26 -4.96 120.40 132.51 2hgu s VAL 58 Ca 0.82 0.43 -0.34 0.00 0.00 0.00 0.00 61.98 62.89 2hgu s VAL 58 Cb -0.14 -3.64 0.15 0.00 0.00 0.00 0.00 36.38 32.75 2hgu s VAL 58 CO 0.20 -0.13 1.40 -0.60 0.00 0.00 0.00 175.10 175.97 2hgu s ARG 59 N -2.98 0.08 0.00 2.72 3.52 -1.26 -1.99 118.95 119.04 2hgu s ARG 59 Ca 0.47 -0.04 0.00 0.00 -0.13 0.00 0.00 55.73 56.03 2hgu s ARG 59 Cb -0.11 0.03 0.00 0.00 -1.56 0.00 0.00 34.95 33.31 2hgu s ARG 59 CO 0.23 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 175.09 2hgu n GLY 60 N -0.38 -1.38 0.00 8.12 0.00 -1.26 -4.87 105.19 105.42 2hgu n GLY 60 Ca -0.06 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.51 2hgu n GLY 60 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2hgu n THR 61 N 0.00 0.00 -4.23 2.61 5.66 -1.26 -3.49 114.28 113.57 2hgu n THR 61 Ca 0.00 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.68 2hgu n THR 61 Cb 0.00 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 68.62 2hgu n THR 61 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2hgu s VAL 62 N -1.04 1.88 -0.62 1.08 0.11 -1.26 -4.92 120.40 115.63 2hgu s VAL 62 Ca 0.00 -0.84 -0.27 0.00 -2.93 0.00 0.00 61.98 57.94 2hgu s VAL 62 Cb 0.00 -1.71 0.00 0.00 -1.53 0.00 0.00 36.38 33.15 2hgu s VAL 62 CO 0.00 0.51 1.57 -0.44 -3.33 0.00 0.00 175.10 173.41 2hgu s SER 63 N 1.22 5.79 -0.37 3.54 0.01 -1.26 -4.41 113.70 118.22 2hgu s SER 63 Ca 0.02 0.15 -0.32 0.00 1.31 0.00 0.00 55.95 57.11 2hgu s SER 63 Cb -0.14 -2.54 -0.10 0.00 0.21 0.00 0.00 66.02 63.46 2hgu s SER 63 CO -0.09 -2.00 2.27 0.18 0.41 0.00 0.00 173.24 174.00 2hgu n LEU 64 N 10.78 2.35 -1.92 2.44 4.77 -1.23 -4.70 117.00 129.49 2hgu n LEU 64 Ca 0.13 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 2hgu n LEU 64 Cb 0.50 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 2hgu n LEU 64 CO 0.71 -0.85 0.09 -0.81 -1.33 0.00 0.00 177.39 175.19 2hgu n PRO 65 N 8.50 0.09 -4.47 3.23 -0.04 -1.26 -4.69 135.00 136.35 2hgu n PRO 65 Ca 0.39 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.65 2hgu n PRO 65 Cb 0.32 -1.46 -0.15 0.00 -0.04 0.00 0.00 33.50 32.18 2hgu n PRO 65 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2hgu s HIS 66 N 1.78 1.02 0.27 0.54 2.46 -1.26 -5.08 115.29 115.02 2hgu s HIS 66 Ca 0.00 -0.22 -0.07 0.00 0.47 0.00 0.00 55.06 55.23 2hgu s HIS 66 Cb 0.00 -0.69 -0.06 0.00 -0.13 0.00 0.00 32.58 31.70 2hgu s HIS 66 CO 0.00 -0.06 -0.13 0.41 -2.47 0.00 0.00 174.74 172.49 2hgu n GLY 67 N 3.02 -1.51 0.00 1.59 0.00 -1.22 -4.30 105.19 102.77 2hgu n GLY 67 Ca -0.16 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2hgu n GLY 67 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2hgu n LEU 68 N 1.16 0.00 0.00 0.99 7.94 -1.02 -4.70 117.00 121.37 2hgu n LEU 68 Ca 0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 2hgu n LEU 68 Cb 0.21 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.16 2hgu n LEU 68 CO 0.22 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.11 2hgu n GLY 69 N 0.00 0.00 3.45 -3.96 0.00 -1.01 -4.43 105.19 99.24 2hgu n GLY 69 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 2hgu n GLY 69 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2hgu n LYS 70 N 0.00 0.66 0.00 1.61 2.85 -1.26 -5.00 118.16 117.02 2hgu n LYS 70 Ca 0.00 -3.04 0.00 0.00 -1.05 0.00 0.00 58.31 54.22 2hgu n LYS 70 Cb 0.00 2.81 0.00 0.00 -0.65 0.00 0.00 35.03 37.19 2hgu n LYS 70 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 2hgu n GLN 71 N -0.61 0.00 -0.06 -1.58 -0.06 -1.26 -4.88 117.38 108.93 2hgu n GLN 71 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.02 2hgu n GLN 71 Cb 0.61 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.79 2hgu n GLN 71 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 2hgu n VAL 72 N -1.44 0.00 -1.07 1.69 0.31 -1.26 -4.77 118.33 111.79 2hgu n VAL 72 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.98 2hgu n VAL 72 Cb 0.00 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 32.95 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 0.01 0.00 -3.89 5.55 1.74 -1.26 -4.51 116.66 114.29 2hgu n ARG 73 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 2hgu n ARG 73 Cb 0.00 -0.93 -0.12 0.00 -1.02 0.00 0.00 32.46 30.38 2hgu n ARG 73 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2hgu s VAL 74 N -1.87 0.04 -0.22 1.55 1.01 -1.26 -1.26 120.40 118.39 2hgu s VAL 74 Ca 0.47 -0.34 -0.06 0.00 0.00 0.00 0.00 61.98 62.05 2hgu s VAL 74 Cb -0.34 -0.18 -0.02 0.00 0.00 0.00 0.00 36.38 35.83 2hgu s VAL 74 CO 0.68 -0.19 0.01 -0.22 0.00 0.00 0.00 175.10 175.39 2hgu s LEU 75 N -0.57 3.24 -0.50 3.92 2.96 -0.37 -1.15 118.68 126.22 2hgu s LEU 75 Ca -0.06 -0.24 -0.20 0.00 -0.22 0.00 0.00 54.13 53.40 2hgu s LEU 75 Cb -0.04 -1.84 0.05 0.00 0.50 0.00 0.00 46.19 44.86 2hgu s LEU 75 CO 0.00 0.01 0.66 0.00 -1.32 0.00 0.00 176.35 175.70 2hgu s ALA 76 N 1.30 3.35 -0.27 5.97 0.00 -0.09 -1.05 121.76 130.97 2hgu s ALA 76 Ca 0.04 -1.60 -0.09 0.00 0.00 0.00 0.00 51.96 50.32 2hgu s ALA 76 Cb -0.15 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 2hgu s ALA 76 CO 0.01 -2.01 0.12 0.42 0.00 0.00 0.00 175.76 174.31 2hgu s ILE 77 N 2.80 4.60 0.00 0.00 1.01 -0.15 -1.25 121.20 128.20 2hgu s ILE 77 Ca 0.18 -0.18 0.00 0.00 0.00 0.00 0.00 60.65 60.64 2hgu s ILE 77 Cb -0.18 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.08 2hgu s ILE 77 CO 0.14 0.24 0.00 0.00 0.00 0.00 0.00 174.94 175.31 2hgu n ALA 78 N 4.97 0.00 -3.27 9.38 0.00 -0.19 -1.00 120.51 130.40 2hgu n ALA 78 Ca -0.15 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.17 2hgu n ALA 78 Cb 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.94 2hgu n ALA 78 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2hgu s LYS 79 N 3.67 2.04 0.00 0.00 1.02 -1.26 -4.22 119.74 120.99 2hgu s LYS 79 Ca 0.00 -1.62 0.00 0.00 0.02 0.00 0.00 55.97 54.37 2hgu s LYS 79 Cb 0.00 0.52 0.00 0.00 -0.52 0.00 0.00 37.83 37.83 2hgu s LYS 79 CO 0.00 -0.90 0.00 0.41 -0.92 0.00 0.00 175.35 173.94 2hgu n GLY 80 N -0.55 0.00 0.34 -3.33 0.00 -1.26 -0.81 105.19 99.58 2hgu n GLY 80 Ca -0.03 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.16 2hgu n GLY 80 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2hgu h GLU 81 N 0.00 0.00 -0.26 1.61 -0.00 -2.01 0.14 114.58 114.06 2hgu h GLU 81 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 59.36 59.28 2hgu h GLU 81 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.74 2hgu h GLU 81 CO 0.00 0.00 -0.17 0.87 -0.00 0.00 0.00 179.01 179.71 2hgu h LYS 82 N 0.00 0.57 -0.42 1.06 1.79 -1.63 0.50 116.57 118.43 2hgu h LYS 82 Ca 0.08 -0.27 0.02 0.00 -2.18 0.00 0.00 60.65 58.31 2hgu h LYS 82 Cb 0.49 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.11 2hgu h LYS 82 CO -0.00 0.84 0.24 0.82 -1.08 0.00 0.00 179.45 180.27 2hgu h ILE 83 N 0.30 1.02 -0.03 1.86 2.04 0.93 -0.23 117.51 123.41 2hgu h ILE 83 Ca 0.05 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 65.75 2hgu h ILE 83 Cb 0.69 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2hgu h ILE 83 CO 0.05 0.09 -0.09 0.11 0.00 0.00 0.00 178.15 178.30 2hgu h LYS 84 N 0.48 -0.09 -0.73 2.37 1.79 -0.82 -0.55 116.57 119.02 2hgu h LYS 84 Ca 0.17 0.01 0.10 0.00 -2.18 0.00 0.00 60.65 58.75 2hgu h LYS 84 Cb 0.04 0.02 -0.12 0.00 -1.58 0.00 0.00 32.23 30.59 2hgu h LYS 84 CO -0.09 -0.06 -0.45 1.49 -1.08 0.00 0.00 179.45 179.25 2hgu h GLU 85 N -0.10 -0.14 0.74 3.15 4.81 -0.85 -1.03 114.58 121.16 2hgu h GLU 85 Ca 0.01 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 2hgu h GLU 85 Cb 0.11 0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.53 2hgu h GLU 85 CO -0.07 -0.10 -0.36 0.00 -0.73 0.00 0.00 179.01 177.75 2hgu h ALA 86 N 0.74 -1.07 -0.15 2.92 0.00 -0.98 -0.34 119.26 120.38 2hgu h ALA 86 Ca 0.21 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2hgu h ALA 86 Cb 0.55 0.39 -0.06 0.00 0.00 0.00 0.00 17.79 18.66 2hgu h ALA 86 CO -0.79 -1.00 -0.25 0.93 0.00 0.00 0.00 179.25 178.14 2hgu h GLU 87 N -1.18 -0.30 0.00 0.00 5.08 -1.11 -1.35 114.58 115.73 2hgu h GLU 87 Ca -0.10 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2hgu h GLU 87 Cb 0.76 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2hgu h GLU 87 CO 0.17 -0.20 0.00 -1.91 -1.00 0.00 0.00 179.01 176.07 2hgu n GLU 88 N -5.38 0.00 -0.34 2.33 4.07 -0.39 -0.82 120.64 120.12 2hgu n GLU 88 Ca -0.02 0.88 0.02 0.00 -0.06 0.00 0.00 57.16 57.97 2hgu n GLU 88 Cb 0.29 -1.43 0.08 0.00 -0.06 0.00 0.00 31.44 30.32 2hgu n GLU 88 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2hgu n ALA 89 N -2.62 0.06 0.00 4.31 0.00 -0.14 -4.68 120.51 117.44 2hgu n ALA 89 Ca 0.00 0.95 0.00 0.00 0.00 0.00 0.00 53.44 54.39 2hgu n ALA 89 Cb 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 18.95 2hgu n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hgu n GLY 90 N -1.50 -1.10 3.53 0.00 0.00 0.00 -4.31 105.19 101.82 2hgu n GLY 90 Ca 0.12 0.29 -0.37 0.00 0.00 0.00 0.00 46.02 46.05 2hgu n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hgu s ALA 91 N 0.00 3.37 0.06 4.61 0.00 -0.27 -4.12 121.76 125.42 2hgu s ALA 91 Ca 0.00 -1.09 -0.26 0.00 0.00 0.00 0.00 51.96 50.61 2hgu s ALA 91 Cb 0.00 -2.30 -0.12 0.00 0.00 0.00 0.00 23.12 20.70 2hgu s ALA 91 CO 0.00 -0.50 1.40 -0.44 0.00 0.00 0.00 175.76 176.22 2hgu h ASP 92 N 8.26 -1.00 -3.35 0.00 5.19 -1.91 -3.41 116.42 120.19 2hgu h ASP 92 Ca -0.37 0.08 -0.65 0.00 -0.62 0.00 0.00 57.03 55.48 2hgu h ASP 92 Cb 1.18 0.33 -0.23 0.00 0.18 0.00 0.00 39.33 40.79 2hgu h ASP 92 CO 0.57 -0.48 -0.71 -0.31 -3.12 0.00 0.00 179.24 175.19 2hgu s TYR 93 N -5.02 2.93 -0.01 4.55 2.02 -0.30 -5.01 117.35 116.51 2hgu s TYR 93 Ca -0.13 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.20 2hgu s TYR 93 Cb 0.03 -1.89 -0.00 0.00 -0.40 0.00 0.00 41.96 39.70 2hgu s TYR 93 CO 0.43 -0.06 -0.06 0.08 -1.57 0.00 0.00 175.55 174.36 2hgu s VAL 94 N 0.23 0.53 -2.19 0.71 1.01 -1.26 -0.91 120.40 118.52 2hgu s VAL 94 Ca -0.05 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.66 2hgu s VAL 94 Cb -0.14 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.77 2hgu s VAL 94 CO 0.04 0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.91 2hgu n GLY 95 N 3.06 -0.57 0.00 4.51 0.00 -0.38 -4.93 105.19 106.88 2hgu n GLY 95 Ca -0.15 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.15 2hgu n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hgu n GLY 96 N 0.00 4.63 0.16 -0.02 0.00 -1.26 -1.02 105.19 107.68 2hgu n GLY 96 Ca 0.00 -0.64 0.13 0.00 0.00 0.00 0.00 46.02 45.51 2hgu n GLY 96 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2hgu h GLU 97 N 0.00 0.00 0.16 1.61 3.07 -1.97 -0.99 114.58 116.46 2hgu h GLU 97 Ca 0.00 0.00 -0.30 0.00 -0.50 0.00 0.00 59.36 58.56 2hgu h GLU 97 Cb 0.00 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 27.93 2hgu h GLU 97 CO 0.00 0.00 -1.30 0.93 -1.40 0.00 0.00 179.01 177.24 2hgu h GLU 98 N 0.00 0.43 -0.29 2.33 5.08 -1.95 0.08 114.58 120.26 2hgu h GLU 98 Ca 0.00 -0.68 -0.12 0.00 -1.00 0.00 0.00 59.36 57.56 2hgu h GLU 98 Cb 0.37 0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2hgu h GLU 98 CO 0.00 1.31 -0.27 0.97 -1.00 0.00 0.00 179.01 180.02 2hgu h ILE 99 N 0.14 1.30 -0.42 3.13 2.10 -1.82 -0.49 117.51 121.46 2hgu h ILE 99 Ca -0.18 -1.44 0.06 0.00 1.08 0.00 0.00 64.86 64.38 2hgu h ILE 99 Cb 2.00 1.58 -0.05 0.00 -1.09 0.00 0.00 36.82 39.26 2hgu h ILE 99 CO 0.23 0.46 0.13 0.40 -1.08 0.00 0.00 178.15 178.29 2hgu h ILE 100 N 0.43 0.84 -0.38 2.19 2.04 -1.21 -0.72 117.51 120.71 2hgu h ILE 100 Ca 0.05 -0.10 0.08 0.00 1.00 0.00 0.00 64.86 65.89 2hgu h ILE 100 Cb 0.84 0.54 -0.07 0.00 -0.74 0.00 0.00 36.82 37.38 2hgu h ILE 100 CO 0.07 0.05 -0.11 1.56 0.00 0.00 0.00 178.15 179.72 2hgu h GLN 101 N 0.28 -0.02 -0.72 2.37 1.08 -0.75 0.10 115.11 117.46 2hgu h GLN 101 Ca 0.20 0.00 0.15 0.00 -1.45 0.00 0.00 58.65 57.55 2hgu h GLN 101 Cb 0.21 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 27.53 2hgu h GLN 101 CO -0.22 -0.01 0.15 0.87 -0.95 0.00 0.00 178.83 178.67 2hgu h LYS 102 N -0.02 0.24 0.04 1.46 1.79 -0.13 -0.01 116.57 119.94 2hgu h LYS 102 Ca 0.18 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.66 2hgu h LYS 102 Cb 0.30 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 2hgu h LYS 102 CO -0.40 0.16 -0.12 0.82 -1.08 0.00 0.00 179.45 178.82 2hgu h ILE 103 N 0.24 0.70 -0.82 1.86 2.04 0.54 0.18 117.51 122.26 2hgu h ILE 103 Ca 0.40 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.44 2hgu h ILE 103 Cb 0.68 0.70 -0.11 0.00 -0.74 0.00 0.00 36.82 37.35 2hgu h ILE 103 CO -0.51 0.00 0.32 -0.07 0.00 0.00 0.00 178.15 177.88 2hgu h LEU 104 N -0.23 0.26 0.43 1.44 -0.00 0.21 -1.72 115.31 115.70 2hgu h LEU 104 Ca 0.03 0.13 -0.02 0.00 -0.00 0.00 0.00 57.88 58.02 2hgu h LEU 104 Cb 0.26 0.12 0.00 0.00 -0.00 0.00 0.00 40.66 41.05 2hgu h LEU 104 CO -0.10 0.04 -0.21 0.44 -0.00 0.00 0.00 178.44 178.62 2hgu h ASP 105 N 0.41 -0.49 0.00 -0.43 3.32 -0.61 -3.46 116.42 115.16 2hgu h ASP 105 Ca 0.47 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.45 2hgu h ASP 105 Cb 0.81 0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.49 2hgu h ASP 105 CO -0.47 -0.21 0.00 0.61 -1.72 0.00 0.00 179.24 177.44 2hgu n GLY 106 N -0.83 0.00 2.61 2.75 0.00 -0.03 -5.11 105.19 104.58 2hgu n GLY 106 Ca -0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 2hgu n GLY 106 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2hgu s TRP 107 N 0.00 0.17 -0.33 1.61 -0.00 -0.73 -4.93 118.94 114.73 2hgu s TRP 107 Ca 0.00 -0.36 0.16 0.00 -0.00 0.00 0.00 56.10 55.90 2hgu s TRP 107 Cb 0.00 -0.70 0.46 0.00 -0.00 0.00 0.00 33.47 33.23 2hgu s TRP 107 CO 0.00 -0.57 1.02 -0.12 -0.00 0.00 0.00 176.95 177.28 2hgu n MET 108 N 5.28 1.83 0.00 5.86 0.00 -1.26 -2.66 117.12 126.16 2hgu n MET 108 Ca -0.07 -3.59 0.00 0.00 -0.00 0.00 0.00 57.70 54.04 2hgu n MET 108 Cb 0.48 -1.56 0.00 0.00 0.00 0.00 0.00 33.22 32.14 2hgu n MET 108 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 2hgu n ASP 109 N -0.28 0.00 -4.29 6.12 8.00 -1.26 -4.35 116.55 120.50 2hgu n ASP 109 Ca 0.16 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.29 2hgu n ASP 109 Cb 0.80 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.77 2hgu n ASP 109 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2hgu s PHE 110 N -1.81 3.22 0.07 1.24 -0.12 -1.26 -4.84 117.98 114.49 2hgu s PHE 110 Ca 0.00 -1.30 -0.37 0.00 -0.05 0.00 0.00 56.93 55.21 2hgu s PHE 110 Cb 0.00 -2.26 -0.19 0.00 -0.63 0.00 0.00 43.02 39.94 2hgu s PHE 110 CO 0.00 -0.69 1.57 -0.44 -0.05 0.00 0.00 175.22 175.61 2hgu h ASP 111 N 8.22 -1.26 -3.06 1.98 3.32 -1.70 -3.43 116.42 120.48 2hgu h ASP 111 Ca -0.26 0.08 -0.58 0.00 0.02 0.00 0.00 57.03 56.29 2hgu h ASP 111 Cb 1.09 0.38 -0.03 0.00 0.22 0.00 0.00 39.33 40.99 2hgu h ASP 111 CO 0.60 -0.73 -0.35 0.00 -1.72 0.00 0.00 179.24 177.04 2hgu s ALA 112 N -5.93 3.84 -0.16 3.45 0.00 -0.39 -4.47 121.76 118.10 2hgu s ALA 112 Ca -0.19 -0.66 0.01 0.00 0.00 0.00 0.00 51.96 51.12 2hgu s ALA 112 Cb 0.03 -2.05 0.02 0.00 0.00 0.00 0.00 23.12 21.13 2hgu s ALA 112 CO 0.60 0.66 -0.15 0.08 0.00 0.00 0.00 175.76 176.96 2hgu s VAL 113 N -1.67 1.68 -0.30 0.00 1.01 -1.26 -1.23 120.40 118.62 2hgu s VAL 113 Ca 0.39 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.66 2hgu s VAL 113 Cb -0.12 -1.58 0.07 0.00 0.00 0.00 0.00 36.38 34.75 2hgu s VAL 113 CO 0.26 0.44 -0.02 0.68 0.00 0.00 0.00 175.10 176.46 2hgu s VAL 114 N 1.44 2.51 0.05 2.92 -7.23 -0.22 -3.92 120.40 115.96 2hgu s VAL 114 Ca 0.04 -1.75 0.07 0.00 -1.81 0.00 0.00 61.98 58.54 2hgu s VAL 114 Cb -0.13 -2.57 -0.03 0.00 0.56 0.00 0.00 36.38 34.21 2hgu s VAL 114 CO -0.11 -0.22 -0.18 0.00 -0.31 0.00 0.00 175.10 174.28 2hgu s ALA 115 N 1.11 2.62 0.56 1.32 0.00 -0.24 -0.98 121.76 126.14 2hgu s ALA 115 Ca -0.02 -1.22 -0.03 0.00 0.00 0.00 0.00 51.96 50.69 2hgu s ALA 115 Cb -0.20 -0.73 0.02 0.00 0.00 0.00 0.00 23.12 22.21 2hgu s ALA 115 CO -0.04 0.58 0.83 0.95 0.00 0.00 0.00 175.76 178.08 2hgu s THR 116 N -0.96 3.42 -1.48 0.00 -4.23 -0.17 -0.95 115.64 111.28 2hgu s THR 116 Ca 0.15 -0.27 0.00 0.00 -1.18 0.00 0.00 61.69 60.39 2hgu s THR 116 Cb -0.11 -3.33 0.00 0.00 1.34 0.00 0.00 72.50 70.40 2hgu s THR 116 CO 0.06 -0.30 0.34 -2.65 -0.54 0.00 0.00 174.62 171.53 2hgu n PRO 117 N -2.45 0.46 -0.23 3.99 -0.02 -1.26 -2.36 135.00 133.12 2hgu n PRO 117 Ca 0.05 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.60 2hgu n PRO 117 Cb 0.58 -1.12 0.21 0.00 -0.02 0.00 0.00 33.50 33.15 2hgu n PRO 117 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2hgu n ASP 118 N -0.10 3.25 -0.52 2.55 5.68 -1.26 -4.40 116.55 121.76 2hgu n ASP 118 Ca 0.00 -1.98 -0.00 0.00 -0.50 0.00 0.00 54.79 52.30 2hgu n ASP 118 Cb 0.06 -0.31 -0.00 0.00 -1.14 0.00 0.00 41.12 39.73 2hgu n ASP 118 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 2hgu n VAL 119 N 0.92 0.00 -0.05 2.12 0.24 -0.99 -4.72 118.33 115.85 2hgu n VAL 119 Ca 0.16 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.37 2hgu n VAL 119 Cb 0.49 0.03 0.07 0.00 -1.47 0.00 0.00 33.84 32.95 2hgu n VAL 119 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 2hgu h MET 120 N 0.00 0.69 -0.05 7.34 2.86 -1.71 0.05 114.93 124.11 2hgu h MET 120 Ca -0.03 -0.35 -0.00 0.00 -2.06 0.00 0.00 59.70 57.26 2hgu h MET 120 Cb 1.00 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.66 2hgu h MET 120 CO -0.01 0.96 0.02 0.78 1.06 0.00 0.00 176.91 179.71 2hgu h GLY 121 N 0.97 0.09 0.96 8.32 0.00 -1.90 -0.14 103.07 111.36 2hgu h GLY 121 Ca 0.05 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2hgu h GLY 121 CO 0.08 0.05 0.09 0.00 0.00 0.00 0.00 176.54 176.76 2hgu h ALA 122 N 0.85 0.20 0.77 3.60 0.00 -1.94 -0.70 119.26 122.03 2hgu h ALA 122 Ca 0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2hgu h ALA 122 Cb 0.18 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2hgu h ALA 122 CO -0.00 -0.29 -0.47 0.28 0.00 0.00 0.00 179.25 178.78 2hgu h VAL 123 N 0.17 0.06 -0.25 0.00 2.07 -0.90 0.04 116.25 117.45 2hgu h VAL 123 Ca 0.06 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.53 2hgu h VAL 123 Cb 0.04 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 2hgu h VAL 123 CO -0.01 0.00 -0.06 1.23 0.02 0.00 0.00 177.57 178.75 2hgu h GLY 124 N -1.16 0.42 0.51 2.17 0.00 -1.04 -0.54 103.07 103.43 2hgu h GLY 124 Ca -0.10 -0.25 -0.34 0.00 0.00 0.00 0.00 47.33 46.64 2hgu h GLY 124 CO 0.11 0.23 -2.05 -1.26 0.00 0.00 0.00 176.54 173.57 2hgu n SER 125 N -4.28 0.88 -0.01 0.19 2.88 -0.27 -1.38 113.62 111.64 2hgu n SER 125 Ca 0.00 0.20 -0.17 0.00 -1.33 0.00 0.00 58.87 57.57 2hgu n SER 125 Cb 0.25 0.13 -0.12 0.00 -0.75 0.00 0.00 64.21 63.72 2hgu n SER 125 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2hgu h LYS 126 N 0.01 0.26 -0.63 -1.46 1.57 -1.05 -3.26 116.57 112.01 2hgu h LYS 126 Ca -0.42 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.05 2hgu h LYS 126 Cb 2.08 0.09 0.00 0.00 0.08 0.00 0.00 32.23 34.49 2hgu h LYS 126 CO 0.05 1.04 0.00 1.28 -0.57 0.00 0.00 179.45 181.24 2hgu n LEU 127 N -4.36 4.11 0.11 2.94 4.77 -0.22 -4.20 117.00 120.15 2hgu n LEU 127 Ca -0.11 -2.20 -0.13 0.00 -0.03 0.00 0.00 56.01 53.54 2hgu n LEU 127 Cb 0.61 -0.49 -0.08 0.00 -2.33 0.00 0.00 43.42 41.13 2hgu n LEU 127 CO 0.43 0.88 0.77 1.23 -1.33 0.00 0.00 177.39 179.36 2hgu h GLY 128 N 3.80 -0.22 -0.23 -0.72 0.00 -1.18 0.22 103.07 104.74 2hgu h GLY 128 Ca 0.00 0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.46 2hgu h GLY 128 CO 0.09 -0.08 -0.53 3.21 0.00 0.00 0.00 176.54 179.23 2hgu h ARG 129 N -0.31 -0.47 -0.19 4.80 2.47 -1.75 -0.68 114.38 118.25 2hgu h ARG 129 Ca -0.02 0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.70 2hgu h ARG 129 Cb 0.24 0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.66 2hgu h ARG 129 CO 0.04 -0.32 -0.00 0.82 0.56 0.00 0.00 179.97 181.07 2hgu h ILE 130 N -0.49 1.26 0.00 2.04 5.03 -1.75 -3.37 117.51 120.22 2hgu h ILE 130 Ca 0.06 -0.88 0.00 0.00 -0.12 0.00 0.00 64.86 63.92 2hgu h ILE 130 Cb 0.64 1.46 0.00 0.00 -3.03 0.00 0.00 36.82 35.89 2hgu h ILE 130 CO -0.50 0.27 -1.21 0.18 -0.68 0.00 0.00 178.15 176.20 2hgu n LEU 131 N -4.70 0.63 0.44 1.44 4.77 0.05 -4.71 117.00 114.92 2hgu n LEU 131 Ca -0.05 -0.21 -0.17 0.00 -0.03 0.00 0.00 56.01 55.55 2hgu n LEU 131 Cb 0.23 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.19 2hgu n LEU 131 CO 0.37 0.12 0.53 1.23 -1.33 0.00 0.00 177.39 178.31 2hgu h GLY 132 N 4.63 -1.19 0.80 -0.72 0.00 -1.22 -2.08 103.07 103.28 2hgu h GLY 132 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.78 2hgu h GLY 132 CO 0.00 -0.43 0.00 -1.55 0.00 0.00 0.00 176.54 174.56 2hgu n PRO 133 N -5.07 0.32 -0.06 4.80 -0.04 -1.26 -3.36 135.00 130.32 2hgu n PRO 133 Ca -0.14 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.19 2hgu n PRO 133 Cb 0.45 -1.40 -0.04 0.00 -0.04 0.00 0.00 33.50 32.47 2hgu n PRO 133 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2hgu n ARG 134 N -0.90 0.26 0.00 0.54 1.74 -1.23 -5.04 116.66 112.03 2hgu n ARG 134 Ca 0.06 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 2hgu n ARG 134 Cb 0.03 -0.94 0.00 0.00 -1.02 0.00 0.00 32.46 30.53 2hgu n ARG 134 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2hgu n GLY 135 N 2.25 0.34 2.26 -0.13 0.00 -0.86 -5.05 105.19 104.00 2hgu n GLY 135 Ca -0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.51 2hgu n GLY 135 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hgu n LEU 136 N 0.00 7.08 -4.13 0.99 4.32 -0.84 -4.86 117.00 119.56 2hgu n LEU 136 Ca 0.00 -3.96 -0.27 0.00 -0.02 0.00 0.00 56.01 51.76 2hgu n LEU 136 Cb 0.00 -1.05 -0.16 0.00 -1.62 0.00 0.00 43.42 40.58 2hgu n LEU 136 CO 0.00 1.45 -0.51 -0.22 -1.22 0.00 0.00 177.39 176.89 2hgu s LEU 137 N -2.90 1.89 0.16 2.23 0.20 -1.22 -4.55 118.68 114.49 2hgu s LEU 137 Ca 0.50 -0.38 -0.32 0.00 0.69 0.00 0.00 54.13 54.62 2hgu s LEU 137 Cb 0.39 -1.02 -0.12 0.00 -0.43 0.00 0.00 46.19 45.01 2hgu s LEU 137 CO -0.08 0.13 1.75 -2.65 -0.29 0.00 0.00 176.35 175.21 2hgu n PRO 138 N 3.33 2.68 -3.85 0.98 -0.02 -1.25 -4.87 135.00 132.00 2hgu n PRO 138 Ca -0.19 0.97 -0.27 0.00 -2.02 0.00 0.00 63.50 61.99 2hgu n PRO 138 Cb 0.53 -2.82 -0.17 0.00 -0.02 0.00 0.00 33.50 31.02 2hgu n PRO 138 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2hgu s ASN 139 N 1.77 2.49 0.00 2.55 3.84 -1.26 -4.76 114.94 119.57 2hgu s ASN 139 Ca 0.79 -0.51 0.00 0.00 0.21 0.00 0.00 52.86 53.35 2hgu s ASN 139 Cb -0.53 -0.78 0.00 0.00 -0.55 0.00 0.00 41.25 39.40 2hgu s ASN 139 CO 0.35 -0.19 0.00 -0.81 -2.79 0.00 0.00 177.10 173.67 2hgu n PRO 140 N 4.96 0.00 -2.20 0.43 -0.04 -1.26 -0.04 135.00 136.84 2hgu n PRO 140 Ca -0.11 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.33 2hgu n PRO 140 Cb 0.49 -1.29 0.01 0.00 -0.04 0.00 0.00 33.50 32.67 2hgu n PRO 140 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2hgu n LYS 141 N 1.07 0.25 -2.69 0.54 4.81 -1.26 -5.01 118.16 115.88 2hgu n LYS 141 Ca 0.00 -0.50 -0.06 0.00 -0.87 0.00 0.00 58.31 56.88 2hgu n LYS 141 Cb 0.00 0.04 0.07 0.00 0.02 0.00 0.00 35.03 35.16 2hgu n LYS 141 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2hgu n ALA 142 N -0.42 -0.09 -3.63 3.14 0.00 0.94 -5.02 120.51 115.44 2hgu n ALA 142 Ca -0.15 -0.99 -0.09 0.00 0.00 0.00 0.00 53.44 52.22 2hgu n ALA 142 Cb 0.62 -1.03 -0.00 0.00 0.00 0.00 0.00 19.45 19.04 2hgu n ALA 142 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hgu n GLY 143 N -0.55 -0.13 0.00 0.00 0.00 -1.26 -4.52 105.19 98.73 2hgu n GLY 143 Ca -0.12 0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2hgu n GLY 143 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2hgu n THR 144 N -1.72 0.00 -3.87 2.61 -2.24 -1.25 -4.91 114.28 102.90 2hgu n THR 144 Ca -0.03 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.50 2hgu n THR 144 Cb 0.11 0.90 -0.17 0.00 -2.10 0.00 0.00 70.33 69.07 2hgu n THR 144 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2hgu s VAL 145 N 0.00 0.75 -0.30 2.28 1.01 -1.26 -1.07 120.40 121.81 2hgu s VAL 145 Ca 0.00 -0.12 -0.21 0.00 0.00 0.00 0.00 61.98 61.64 2hgu s VAL 145 Cb 0.00 -0.83 0.21 0.00 0.00 0.00 0.00 36.38 35.76 2hgu s VAL 145 CO 0.00 0.32 1.41 -0.83 0.00 0.00 0.00 175.10 176.00 2hgu s GLY 146 N 1.78 0.53 0.65 4.51 0.00 -0.12 -4.78 107.32 109.89 2hgu s GLY 146 Ca 0.04 3.75 0.36 0.00 0.00 0.00 0.00 44.72 48.87 2hgu s GLY 146 CO -0.07 2.30 2.16 0.74 0.00 0.00 0.00 173.10 178.23 2hgu h PHE 147 N 3.85 0.00 0.00 1.90 0.04 -1.89 -3.15 116.94 117.69 2hgu h PHE 147 Ca -0.27 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.36 2hgu h PHE 147 Cb 1.18 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.28 2hgu h PHE 147 CO 0.20 0.00 -0.21 0.27 -0.60 0.00 0.00 178.31 177.97 2hgu n ASN 148 N -3.17 4.22 -0.12 2.17 6.94 -1.26 -4.62 115.26 119.42 2hgu n ASN 148 Ca -0.02 -2.28 -0.08 0.00 -0.02 0.00 0.00 54.58 52.17 2hgu n ASN 148 Cb 0.23 -1.14 -0.00 0.00 -2.36 0.00 0.00 39.78 36.51 2hgu n ASN 148 CO 0.00 0.00 0.00 -0.29 -1.03 0.00 0.00 177.26 175.94 2hgu h ILE 149 N 2.17 1.11 -0.31 1.53 2.10 -1.89 -0.10 117.51 122.12 2hgu h ILE 149 Ca 0.15 -0.23 -0.03 0.00 1.08 0.00 0.00 64.86 65.82 2hgu h ILE 149 Cb 1.21 0.59 -0.01 0.00 -1.09 0.00 0.00 36.82 37.52 2hgu h ILE 149 CO 0.27 0.11 0.08 1.23 -1.08 0.00 0.00 178.15 178.76 2hgu h GLY 150 N 0.50 0.54 0.60 8.18 0.00 -1.81 -0.52 103.07 110.57 2hgu h GLY 150 Ca 0.14 -0.34 0.05 0.00 0.00 0.00 0.00 47.33 47.18 2hgu h GLY 150 CO -0.03 0.31 0.05 0.83 0.00 0.00 0.00 176.54 177.70 2hgu h GLU 151 N 0.35 0.15 0.04 4.80 5.08 -1.82 0.19 114.58 123.36 2hgu h GLU 151 Ca 0.10 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2hgu h GLU 151 Cb 0.29 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2hgu h GLU 151 CO 0.00 0.10 -0.06 0.82 -1.00 0.00 0.00 179.01 178.87 2hgu h ILE 152 N 0.15 0.00 0.00 3.13 2.04 -0.68 -0.67 117.51 121.48 2hgu h ILE 152 Ca 0.15 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.97 2hgu h ILE 152 Cb 0.17 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.24 2hgu h ILE 152 CO -0.21 0.00 -0.16 0.40 0.00 0.00 0.00 178.15 178.19 2hgu h ILE 153 N -0.11 0.74 -0.08 -0.67 5.03 -1.13 -0.80 117.51 120.50 2hgu h ILE 153 Ca -0.01 -0.62 0.01 0.00 -0.12 0.00 0.00 64.86 64.12 2hgu h ILE 153 Cb 0.10 1.38 -0.02 0.00 -3.03 0.00 0.00 36.82 35.24 2hgu h ILE 153 CO -0.02 0.15 -0.17 0.03 -0.68 0.00 0.00 178.15 177.47 2hgu h ARG 154 N 0.00 -0.14 -0.61 2.37 3.08 -0.74 0.62 114.38 118.96 2hgu h ARG 154 Ca -0.00 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.18 2hgu h ARG 154 Cb 0.37 0.03 -0.10 0.00 0.08 0.00 0.00 29.97 30.35 2hgu h ARG 154 CO 0.02 -0.10 0.04 1.49 -1.07 0.00 0.00 179.97 180.36 2hgu h GLU 155 N -0.15 0.15 -1.00 0.04 4.57 -0.36 0.07 114.58 117.91 2hgu h GLU 155 Ca 0.02 -0.01 0.35 0.00 -1.18 0.00 0.00 59.36 58.54 2hgu h GLU 155 Cb 0.19 -0.03 -0.16 0.00 -0.16 0.00 0.00 28.75 28.59 2hgu h GLU 155 CO -0.16 0.10 0.52 0.82 -1.18 0.00 0.00 179.01 179.12 2hgu h ILE 156 N 0.16 0.18 0.00 2.32 2.04 0.48 -0.41 117.51 122.27 2hgu h ILE 156 Ca 0.32 -0.06 -0.05 0.00 1.00 0.00 0.00 64.86 66.06 2hgu h ILE 156 Cb 0.51 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 2hgu h ILE 156 CO -0.49 0.03 -2.04 2.29 0.00 0.00 0.00 178.15 177.95 2hgu n LYS 157 N -5.15 0.66 0.06 2.37 2.85 -0.29 -3.93 118.16 114.74 2hgu n LYS 157 Ca 0.33 -0.17 -0.05 0.00 -1.05 0.00 0.00 58.31 57.38 2hgu n LYS 157 Cb 1.08 -1.51 -0.09 0.00 -0.65 0.00 0.00 35.03 33.86 2hgu n LYS 157 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2hgu h ALA 158 N 1.82 0.50 0.00 0.58 0.00 -0.39 -2.69 119.26 119.08 2hgu h ALA 158 Ca -0.08 -0.89 0.00 0.00 0.00 0.00 0.00 54.91 53.94 2hgu h ALA 158 Cb 1.16 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2hgu h ALA 158 CO 0.00 1.15 0.00 0.41 0.00 0.00 0.00 179.25 180.81 2hgu n GLY 159 N 1.35 -1.82 3.94 0.00 0.00 -0.23 -2.43 105.19 105.99 2hgu n GLY 159 Ca -0.02 0.81 -0.20 0.00 0.00 0.00 0.00 46.02 46.60 2hgu n GLY 159 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hgu s ARG 160 N 0.00 3.09 0.00 1.61 1.81 -0.80 -3.56 118.95 121.09 2hgu s ARG 160 Ca 0.00 -1.02 0.00 0.00 -1.72 0.00 0.00 55.73 52.99 2hgu s ARG 160 Cb 0.00 -2.73 0.00 0.00 -0.45 0.00 0.00 34.95 31.77 2hgu s ARG 160 CO 0.00 0.20 0.00 0.44 -0.68 0.00 0.00 175.30 175.26 2hgu n ILE 161 N -1.48 0.00 0.00 1.52 -0.00 -1.26 -4.87 119.36 113.27 2hgu n ILE 161 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.72 2hgu n ILE 161 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.22 2hgu n ILE 161 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 2hgu n GLU 162 N -0.79 0.00 -1.06 6.28 2.13 -1.26 -4.98 120.64 120.96 2hgu n GLU 162 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2hgu n GLU 162 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2hgu n GLU 162 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2hgu n PHE 163 N -0.29 0.00 0.00 4.31 0.99 -1.23 -4.78 117.46 116.46 2hgu n PHE 163 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2hgu n PHE 163 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.48 2hgu n PHE 163 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63 2hgu n ARG 164 N 0.00 0.00 -4.36 -1.08 0.00 -1.23 -4.39 116.66 105.59 2hgu n ARG 164 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.50 2hgu n ARG 164 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.36 2hgu n ARG 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2hgu s ASN 165 N 0.00 5.23 0.23 6.15 4.22 -0.84 -4.23 114.94 125.69 2hgu s ASN 165 Ca 0.00 0.13 -0.04 0.00 -2.14 0.00 0.00 52.86 50.81 2hgu s ASN 165 Cb 0.00 -1.50 -0.05 0.00 1.28 0.00 0.00 41.25 40.98 2hgu s ASN 165 CO 0.00 0.36 0.47 1.51 -2.04 0.00 0.00 177.10 177.40 2hgu s ASP 166 N -0.80 6.45 0.00 3.54 -4.77 -0.03 -4.86 116.67 116.20 2hgu s ASP 166 Ca 0.12 0.61 0.00 0.00 -3.30 0.00 0.00 52.55 49.98 2hgu s ASP 166 Cb -0.11 -2.10 0.00 0.00 -1.09 0.00 0.00 42.92 39.62 2hgu s ASP 166 CO 0.02 -0.09 0.00 2.29 0.70 0.00 0.00 175.17 178.10 2hgu n LYS 167 N -0.56 0.00 0.27 2.11 2.85 -1.26 -0.72 118.16 120.84 2hgu n LYS 167 Ca -0.03 0.00 0.08 0.00 -1.05 0.00 0.00 58.31 57.31 2hgu n LYS 167 Cb 0.53 0.00 0.42 0.00 -0.65 0.00 0.00 35.03 35.33 2hgu n LYS 167 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 2hgu h THR 168 N 0.00 0.00 0.00 0.58 1.35 -2.02 -3.42 112.91 109.40 2hgu h THR 168 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2hgu h THR 168 Cb 0.00 0.34 0.00 0.00 -1.73 0.00 0.00 68.15 66.76 2hgu h THR 168 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2hgu n GLY 169 N -1.30 0.87 3.23 5.82 0.00 0.10 -4.86 105.19 109.05 2hgu n GLY 169 Ca -0.01 -0.09 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2hgu n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hgu s ALA 170 N 0.00 1.28 0.06 4.61 0.00 -1.17 -1.08 121.76 125.46 2hgu s ALA 170 Ca 0.00 -1.60 0.06 0.00 0.00 0.00 0.00 51.96 50.42 2hgu s ALA 170 Cb 0.00 0.69 -0.03 0.00 0.00 0.00 0.00 23.12 23.78 2hgu s ALA 170 CO 0.00 -0.38 -0.17 -1.50 0.00 0.00 0.00 175.76 173.71 2hgu s ILE 171 N -3.76 1.35 -0.10 0.00 2.07 0.03 -0.85 121.20 119.93 2hgu s ILE 171 Ca 0.26 -1.24 0.00 0.00 -1.41 0.00 0.00 60.65 58.26 2hgu s ILE 171 Cb 0.07 -1.23 0.02 0.00 0.13 0.00 0.00 42.46 41.45 2hgu s ILE 171 CO 0.05 -0.04 -0.09 -1.38 -1.91 0.00 0.00 174.94 171.57 2hgu s HIS 172 N -1.03 1.52 -0.11 3.50 -3.43 -1.26 -1.41 115.29 113.08 2hgu s HIS 172 Ca 0.03 -0.72 -0.30 0.00 -0.80 0.00 0.00 55.06 53.27 2hgu s HIS 172 Cb -0.09 -1.21 0.11 0.00 -1.43 0.00 0.00 32.58 29.96 2hgu s HIS 172 CO 0.02 -0.46 0.92 0.00 -2.00 0.00 0.00 174.74 173.23 2hgu s ALA 173 N 1.38 -1.88 -0.19 -1.38 0.00 -0.46 -4.90 121.76 114.33 2hgu s ALA 173 Ca -0.01 1.42 -0.29 0.00 0.00 0.00 0.00 51.96 53.09 2hgu s ALA 173 Cb -0.14 -0.36 -0.00 0.00 0.00 0.00 0.00 23.12 22.62 2hgu s ALA 173 CO -0.05 -0.40 1.17 -1.25 0.00 0.00 0.00 175.76 175.24 2hgu s PRO 174 N -1.54 4.24 -0.22 0.00 0.04 -1.26 -1.09 135.00 135.17 2hgu s PRO 174 Ca -0.02 1.53 0.13 0.00 0.04 0.00 0.00 61.00 62.69 2hgu s PRO 174 Cb -0.00 -3.72 0.48 0.00 0.04 0.00 0.00 34.50 31.30 2hgu s PRO 174 CO 0.01 -0.68 1.39 1.33 0.04 0.00 0.00 177.00 179.09 2hgu n VAL 175 N 5.36 2.34 0.00 -0.36 0.24 -1.26 -4.91 118.33 119.74 2hgu n VAL 175 Ca 0.13 -2.40 0.00 0.00 -2.04 0.00 0.00 64.34 60.04 2hgu n VAL 175 Cb 0.45 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.54 2hgu n VAL 175 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2hgu n GLY 176 N -0.95 1.55 3.70 7.63 0.00 -1.26 -3.40 105.19 112.46 2hgu n GLY 176 Ca 0.26 -1.38 -0.31 0.00 0.00 0.00 0.00 46.02 44.59 2hgu n GLY 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hgu s LYS 177 N -1.90 2.72 0.00 1.61 1.02 -1.26 -4.59 119.74 117.33 2hgu s LYS 177 Ca 0.00 -0.71 0.00 0.00 0.02 0.00 0.00 55.97 55.28 2hgu s LYS 177 Cb 0.00 -2.63 0.00 0.00 -0.52 0.00 0.00 37.83 34.68 2hgu s LYS 177 CO 0.00 0.58 0.10 0.00 -0.92 0.00 0.00 175.35 175.11 2hgu n ALA 178 N 0.90 0.00 0.19 5.17 0.00 -1.17 -2.24 120.51 123.35 2hgu n ALA 178 Ca -0.12 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.43 2hgu n ALA 178 Cb 0.52 0.04 0.59 0.00 0.00 0.00 0.00 19.45 20.60 2hgu n ALA 178 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2hgu h SER 179 N 0.00 0.00 -3.00 0.00 4.64 -1.85 -3.40 113.55 109.94 2hgu h SER 179 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 2hgu h SER 179 Cb 0.00 0.00 0.20 0.00 -0.31 0.00 0.00 62.40 62.29 2hgu h SER 179 CO 0.00 0.00 -0.68 0.33 -0.87 0.00 0.00 176.83 175.61 2hgu n PHE 180 N -2.30 -1.66 -1.67 4.77 7.35 -0.95 -4.74 117.46 118.26 2hgu n PHE 180 Ca -0.01 0.29 -0.51 0.00 -0.76 0.00 0.00 57.45 56.46 2hgu n PHE 180 Cb 0.15 -1.81 -0.05 0.00 0.35 0.00 0.00 39.48 38.11 2hgu n PHE 180 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2hgu n PRO 181 N -0.34 1.72 0.03 -7.13 -0.02 -1.26 -4.81 135.00 123.18 2hgu n PRO 181 Ca 0.08 0.63 -0.08 0.00 -2.02 0.00 0.00 63.50 62.10 2hgu n PRO 181 Cb 0.51 -2.38 -0.05 0.00 -0.02 0.00 0.00 33.50 31.56 2hgu n PRO 181 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2hgu h PRO 182 N 7.08 -0.34 -0.88 0.52 0.13 -1.90 -0.09 132.00 136.52 2hgu h PRO 182 Ca -0.47 0.02 0.16 0.00 -0.87 0.00 0.00 66.00 64.84 2hgu h PRO 182 Cb 1.29 0.08 -0.16 0.00 0.13 0.00 0.00 31.00 32.34 2hgu h PRO 182 CO 0.91 -0.23 -0.26 0.39 -0.23 0.00 0.00 178.00 178.57 2hgu n GLU 183 N -4.06 -0.13 0.05 0.86 4.71 -1.26 0.90 120.64 121.72 2hgu n GLU 183 Ca -0.04 1.36 -0.13 0.00 -0.01 0.00 0.00 57.16 58.34 2hgu n GLU 183 Cb 0.21 -2.03 -0.08 0.00 -1.01 0.00 0.00 31.44 28.53 2hgu n GLU 183 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 2hgu h LYS 184 N 0.00 -0.54 -1.02 3.49 1.57 -1.57 0.30 116.57 118.78 2hgu h LYS 184 Ca 0.38 0.04 0.37 0.00 -1.87 0.00 0.00 60.65 59.57 2hgu h LYS 184 Cb 0.60 0.12 -0.16 0.00 0.08 0.00 0.00 32.23 32.87 2hgu h LYS 184 CO -0.89 -0.36 0.58 -0.07 -0.57 0.00 0.00 179.45 178.14 2hgu h LEU 185 N -0.56 0.42 -0.02 2.94 3.38 0.23 1.68 115.31 123.38 2hgu h LEU 185 Ca 0.01 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2hgu h LEU 185 Cb 0.60 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 2hgu h LEU 185 CO -0.29 -0.27 0.00 0.00 0.09 0.00 0.00 178.44 177.98 2hgu h ALA 186 N 1.89 0.01 -0.76 1.53 0.00 0.12 -0.07 119.26 121.98 2hgu h ALA 186 Ca 0.79 0.00 0.18 0.00 0.00 0.00 0.00 54.91 55.88 2hgu h ALA 186 Cb 1.98 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 19.65 2hgu h ALA 186 CO -0.66 -0.49 0.09 0.22 0.00 0.00 0.00 179.25 178.41 2hgu h ASP 187 N 0.01 -0.18 -0.09 0.00 -0.00 0.42 -0.43 116.42 116.14 2hgu h ASP 187 Ca 0.01 0.18 -0.19 0.00 -0.00 0.00 0.00 57.03 57.03 2hgu h ASP 187 Cb 0.01 0.28 0.01 0.00 -0.00 0.00 0.00 39.33 39.63 2hgu h ASP 187 CO -0.01 -0.13 -0.67 -1.13 -0.00 0.00 0.00 179.24 177.30 2hgu h ASN 188 N 0.17 0.75 -0.59 2.28 -1.24 -0.60 -0.61 115.58 115.73 2hgu h ASN 188 Ca 0.43 -0.66 0.11 0.00 0.71 0.00 0.00 56.30 56.89 2hgu h ASN 188 Cb 0.77 -0.22 -0.12 0.00 0.73 0.00 0.00 38.32 39.48 2hgu h ASN 188 CO -0.61 1.30 -0.25 0.40 -1.29 0.00 0.00 177.43 176.98 2hgu h ILE 189 N 0.26 0.27 0.37 2.57 2.04 -0.39 0.98 117.51 123.61 2hgu h ILE 189 Ca -0.06 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 2hgu h ILE 189 Cb 1.32 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 2hgu h ILE 189 CO 0.14 0.00 -0.33 0.03 0.00 0.00 0.00 178.15 177.99 2hgu h ARG 190 N -0.10 -0.68 -0.65 2.37 3.08 -0.98 -0.19 114.38 117.24 2hgu h ARG 190 Ca 0.26 0.05 0.15 0.00 0.07 0.00 0.00 59.98 60.51 2hgu h ARG 190 Cb 0.51 0.16 -0.12 0.00 0.08 0.00 0.00 29.97 30.60 2hgu h ARG 190 CO -0.66 -0.46 -0.08 0.00 -1.07 0.00 0.00 179.97 177.71 2hgu n ALA 191 N -2.60 0.24 -0.02 0.04 0.00 0.19 0.32 120.51 118.67 2hgu n ALA 191 Ca -0.10 0.70 -0.12 0.00 0.00 0.00 0.00 53.44 53.92 2hgu n ALA 191 Cb 0.34 -0.47 -0.07 0.00 0.00 0.00 0.00 19.45 19.26 2hgu n ALA 191 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2hgu h PHE 192 N 0.00 0.17 -0.75 0.00 3.04 -0.38 -1.27 116.94 117.74 2hgu h PHE 192 Ca 0.35 -0.03 0.11 0.00 3.98 0.00 0.00 57.97 62.39 2hgu h PHE 192 Cb 0.64 -0.04 -0.13 0.00 2.56 0.00 0.00 35.95 38.97 2hgu h PHE 192 CO -0.42 0.38 -0.40 0.82 -2.02 0.00 0.00 178.31 176.67 2hgu h ILE 193 N -0.10 0.08 0.00 1.41 2.04 0.69 -0.06 117.51 121.57 2hgu h ILE 193 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 2hgu h ILE 193 Cb 0.31 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 2hgu h ILE 193 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 178.15 178.69 2hgu n ARG 194 N -5.42 0.00 -0.34 2.37 5.12 -0.08 -1.03 116.66 117.28 2hgu n ARG 194 Ca 0.05 0.37 0.17 0.00 -1.93 0.00 0.00 57.85 56.51 2hgu n ARG 194 Cb 0.36 -1.30 0.33 0.00 -1.16 0.00 0.00 32.46 30.69 2hgu n ARG 194 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2hgu h ALA 195 N -2.00 1.32 0.25 7.54 0.00 -1.12 0.16 119.26 125.40 2hgu h ALA 195 Ca 0.00 0.34 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 2hgu h ALA 195 Cb 0.00 0.57 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2hgu h ALA 195 CO 0.00 -0.63 -0.12 1.25 0.00 0.00 0.00 179.25 179.75 2hgu h LEU 196 N 0.00 -0.30 -0.94 0.00 5.85 -1.03 -0.41 115.31 118.49 2hgu h LEU 196 Ca 0.64 0.01 0.37 0.00 0.84 0.00 0.00 57.88 59.74 2hgu h LEU 196 Cb 1.39 0.08 -0.15 0.00 0.37 0.00 0.00 40.66 42.35 2hgu h LEU 196 CO -0.91 -0.21 0.54 -0.62 -0.34 0.00 0.00 178.44 176.90 2hgu n GLU 197 N -2.94 -0.05 0.00 1.25 1.02 0.38 -0.24 120.64 120.06 2hgu n GLU 197 Ca -0.04 1.16 0.00 0.00 -0.02 0.00 0.00 57.16 58.25 2hgu n GLU 197 Cb 0.14 -2.12 0.00 0.00 -0.02 0.00 0.00 31.44 29.43 2hgu n GLU 197 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2hgu n ALA 198 N -2.41 -0.25 -0.46 0.62 0.00 -0.19 -3.38 120.51 114.44 2hgu n ALA 198 Ca 0.33 0.00 0.39 0.00 0.00 0.00 0.00 53.44 54.16 2hgu n ALA 198 Cb 1.17 0.00 0.67 0.00 0.00 0.00 0.00 19.45 21.29 2hgu n ALA 198 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2hgu h HIS 199 N 0.00 0.52 0.00 0.00 3.86 0.11 -3.41 115.15 116.22 2hgu h HIS 199 Ca 0.00 0.02 -0.27 0.00 -1.16 0.00 0.00 60.37 58.97 2hgu h HIS 199 Cb 0.00 -0.12 -0.08 0.00 1.06 0.00 0.00 27.41 28.26 2hgu h HIS 199 CO 0.11 -0.26 1.45 1.17 0.86 0.00 0.00 177.93 181.26 2hgu n LYS 200 N -4.73 0.00 -0.95 2.45 0.00 -0.29 -4.86 118.16 109.78 2hgu n LYS 200 Ca 0.39 0.00 -0.35 0.00 0.00 0.00 0.00 58.31 58.35 2hgu n LYS 200 Cb 1.52 -0.75 0.07 0.00 0.00 0.00 0.00 35.03 35.86 2hgu n LYS 200 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2hgu n PRO 201 N 4.17 -0.09 -0.03 1.64 -0.04 -1.26 -4.86 135.00 134.53 2hgu n PRO 201 Ca 0.49 -0.01 0.05 0.00 -0.04 0.00 0.00 63.50 63.99 2hgu n PRO 201 Cb 0.09 -1.32 0.23 0.00 -0.04 0.00 0.00 33.50 32.46 2hgu n PRO 201 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2hgu n GLU 202 N 0.91 1.19 -1.95 0.54 -0.00 -1.26 -4.08 120.64 115.98 2hgu n GLU 202 Ca 0.02 -0.29 -0.39 0.00 -0.00 0.00 0.00 57.16 56.50 2hgu n GLU 202 Cb 0.55 -1.17 0.02 0.00 -0.00 0.00 0.00 31.44 30.84 2hgu n GLU 202 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2hgu n GLY 203 N 0.73 5.44 3.82 -1.84 0.00 -1.26 -4.95 105.19 107.14 2hgu n GLY 203 Ca 0.08 -2.41 -0.22 0.00 0.00 0.00 0.00 46.02 43.47 2hgu n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hgu s ALA 204 N -3.76 3.83 -0.35 4.61 0.00 -1.26 -4.92 121.76 119.91 2hgu s ALA 204 Ca 0.51 -1.85 -0.06 0.00 0.00 0.00 0.00 51.96 50.57 2hgu s ALA 204 Cb 0.40 -0.91 0.21 0.00 0.00 0.00 0.00 23.12 22.82 2hgu s ALA 204 CO -0.36 -0.11 1.09 1.17 0.00 0.00 0.00 175.76 177.56 2hgu n LYS 205 N -1.38 0.12 0.00 0.00 3.00 -1.26 -5.13 118.16 113.51 2hgu n LYS 205 Ca 0.00 -0.84 0.00 0.00 -0.00 0.00 0.00 58.31 57.47 2hgu n LYS 205 Cb 0.62 0.06 0.00 0.00 0.00 0.00 0.00 35.03 35.70 2hgu n LYS 205 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2hgu n GLY 206 N 2.58 0.24 3.44 3.14 0.00 -1.26 -4.96 105.19 108.37 2hgu n GLY 206 Ca 0.12 -1.27 -0.44 0.00 0.00 0.00 0.00 46.02 44.43 2hgu n GLY 206 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hgu s THR 207 N 0.00 4.54 -0.05 2.61 2.01 -1.26 -4.92 115.64 118.57 2hgu s THR 207 Ca 0.00 -0.94 -0.00 0.00 0.31 0.00 0.00 61.69 61.06 2hgu s THR 207 Cb 0.00 -4.71 -0.00 0.00 0.01 0.00 0.00 72.50 67.80 2hgu s THR 207 CO 0.00 -1.45 -0.01 0.15 -0.69 0.00 0.00 174.62 172.62 2hgu h PHE 208 N 9.23 0.00 -1.28 4.92 3.57 -1.93 -3.34 116.94 128.11 2hgu h PHE 208 Ca -0.10 0.00 -0.47 0.00 3.53 0.00 0.00 57.97 60.93 2hgu h PHE 208 Cb 1.05 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.72 2hgu h PHE 208 CO 1.04 0.00 1.15 -1.17 -2.23 0.00 0.00 178.31 177.10 2hgu s LEU 209 N -6.22 3.30 -0.03 0.59 0.20 -1.26 -0.80 118.68 114.46 2hgu s LEU 209 Ca -0.01 -0.78 -0.03 0.00 0.69 0.00 0.00 54.13 54.00 2hgu s LEU 209 Cb 0.00 -2.56 -0.02 0.00 -0.43 0.00 0.00 46.19 43.18 2hgu s LEU 209 CO 0.01 -2.11 0.23 0.03 -0.29 0.00 0.00 176.35 174.22 2hgu h ARG 210 N 11.09 -0.12 -4.67 1.98 3.08 -1.30 -3.45 114.38 121.00 2hgu h ARG 210 Ca 0.03 0.01 -0.62 0.00 0.07 0.00 0.00 59.98 59.46 2hgu h ARG 210 Cb 1.04 0.03 -0.37 0.00 0.08 0.00 0.00 29.97 30.75 2hgu h ARG 210 CO 1.30 -0.08 -0.82 -1.54 -1.07 0.00 0.00 179.97 177.76 2hgu s SER 211 N -4.02 3.30 -0.25 7.04 1.04 -1.20 -4.98 113.70 114.62 2hgu s SER 211 Ca -0.02 -0.82 -0.02 0.00 0.48 0.00 0.00 55.95 55.57 2hgu s SER 211 Cb 0.00 -1.27 0.02 0.00 0.10 0.00 0.00 66.02 64.87 2hgu s SER 211 CO 0.05 -0.11 -0.04 -0.69 0.98 0.00 0.00 173.24 173.43 2hgu s VAL 212 N 1.38 3.06 0.10 5.02 1.01 -1.26 -1.02 120.40 128.68 2hgu s VAL 212 Ca 0.00 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.09 2hgu s VAL 212 Cb -0.15 -2.54 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 2hgu s VAL 212 CO -0.09 0.20 -0.12 -0.31 0.00 0.00 0.00 175.10 174.79 2hgu s TYR 213 N 1.36 1.18 -0.19 5.22 1.51 -0.17 -0.85 117.35 125.41 2hgu s TYR 213 Ca 0.01 -0.58 -0.07 0.00 -1.01 0.00 0.00 57.07 55.42 2hgu s TYR 213 Cb -0.16 -0.64 -0.04 0.00 -0.11 0.00 0.00 41.96 41.01 2hgu s TYR 213 CO -0.03 0.05 0.05 0.08 -1.11 0.00 0.00 175.55 174.59 2hgu s VAL 214 N -2.09 4.57 0.22 0.71 1.01 -0.10 -1.09 120.40 123.62 2hgu s VAL 214 Ca 0.04 -0.11 -0.12 0.00 0.00 0.00 0.00 61.98 61.80 2hgu s VAL 214 Cb -0.05 -3.07 -0.00 0.00 0.00 0.00 0.00 36.38 33.26 2hgu s VAL 214 CO 0.01 0.44 0.41 0.28 0.00 0.00 0.00 175.10 176.24 2hgu s THR 215 N 0.63 0.02 0.37 3.92 -1.32 -0.19 -1.04 115.64 118.03 2hgu s THR 215 Ca 0.02 -1.35 0.08 0.00 -1.21 0.00 0.00 61.69 59.24 2hgu s THR 215 Cb -0.13 -2.04 -0.06 0.00 -1.51 0.00 0.00 72.50 68.76 2hgu s THR 215 CO 0.02 -0.10 0.06 0.42 -2.21 0.00 0.00 174.62 172.81 2hgu s THR 216 N -3.99 2.49 0.00 5.08 -4.23 -0.16 -0.85 115.64 113.98 2hgu s THR 216 Ca 0.20 -1.89 0.00 0.00 -1.18 0.00 0.00 61.69 58.82 2hgu s THR 216 Cb 0.01 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 70.96 2hgu s THR 216 CO 0.05 -0.12 0.00 0.41 -0.54 0.00 0.00 174.62 174.42 2hgu n THR 217 N -1.04 0.00 -3.35 3.99 -1.04 -1.25 -3.83 114.28 107.76 2hgu n THR 217 Ca -0.03 0.16 -0.45 0.00 -2.04 0.00 0.00 64.05 61.69 2hgu n THR 217 Cb 0.63 -0.80 -0.01 0.00 -1.82 0.00 0.00 70.33 68.33 2hgu n THR 217 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 2hgu s MET 218 N 0.00 4.05 0.00 -2.82 1.75 -1.26 -4.91 119.30 116.11 2hgu s MET 218 Ca 0.00 -3.07 0.00 0.00 -1.25 0.00 0.00 55.69 51.37 2hgu s MET 218 Cb 0.00 -4.51 0.00 0.00 2.84 0.00 0.00 34.83 33.16 2hgu s MET 218 CO 0.00 -1.25 0.00 0.41 -0.65 0.00 0.00 175.02 173.53 2hgu n GLY 219 N 2.94 2.13 3.94 2.11 0.00 -1.25 -4.96 105.19 110.10 2hgu n GLY 219 Ca 0.22 0.11 -0.25 0.00 0.00 0.00 0.00 46.02 46.10 2hgu n GLY 219 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2hgu s PRO 220 N 4.22 2.22 -0.29 1.61 0.02 -1.26 -4.78 135.00 136.74 2hgu s PRO 220 Ca 0.00 -0.32 0.01 0.00 0.02 0.00 0.00 61.00 60.70 2hgu s PRO 220 Cb 0.00 -2.20 0.09 0.00 0.02 0.00 0.00 34.50 32.40 2hgu s PRO 220 CO 0.00 -1.19 0.04 0.45 -0.33 0.00 0.00 177.00 175.97 2hgu s SER 221 N -4.51 4.08 -0.23 2.53 0.15 -1.26 -0.99 113.70 113.47 2hgu s SER 221 Ca 0.60 -1.58 0.01 0.00 0.70 0.00 0.00 55.95 55.67 2hgu s SER 221 Cb -0.11 -1.11 0.06 0.00 -1.71 0.00 0.00 66.02 63.15 2hgu s SER 221 CO 0.44 -0.35 -0.05 -0.69 1.20 0.00 0.00 173.24 173.79 2hgu s VAL 222 N 1.40 1.51 0.60 4.45 1.01 -0.21 -4.89 120.40 124.27 2hgu s VAL 222 Ca 0.05 -1.20 -0.19 0.00 0.00 0.00 0.00 61.98 60.65 2hgu s VAL 222 Cb -0.18 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2hgu s VAL 222 CO -0.15 -0.09 1.21 -0.60 0.00 0.00 0.00 175.10 175.47 2hgu s ARG 223 N 1.40 2.94 0.09 2.72 3.52 -1.26 -0.92 118.95 127.44 2hgu s ARG 223 Ca -0.06 1.84 0.01 0.00 -0.13 0.00 0.00 55.73 57.40 2hgu s ARG 223 Cb -0.19 -1.92 -0.04 0.00 -1.56 0.00 0.00 34.95 31.24 2hgu s ARG 223 CO -0.06 -1.24 -0.06 0.96 -0.81 0.00 0.00 175.30 174.09 2hgu s ILE 224 N -1.58 0.59 -0.85 4.11 -4.36 -0.03 -4.27 121.20 114.80 2hgu s ILE 224 Ca 0.78 -1.91 0.00 0.00 -0.26 0.00 0.00 60.65 59.26 2hgu s ILE 224 Cb -0.31 -1.64 0.23 0.00 1.25 0.00 0.00 42.46 41.98 2hgu s ILE 224 CO 0.34 -0.90 0.81 -3.20 0.24 0.00 0.00 174.94 172.22 2hgu n ASN 225 N -0.00 4.18 -0.69 4.36 5.15 -0.66 -4.50 115.26 123.09 2hgu n ASN 225 Ca -0.13 -3.22 0.00 0.00 -0.60 0.00 0.00 54.58 50.64 2hgu n ASN 225 Cb 0.61 -0.98 0.00 0.00 -0.53 0.00 0.00 39.78 38.88 2hgu n ASN 225 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2hgu n PRO 226 N 1.95 0.19 -0.02 1.20 -0.04 -1.26 -2.35 135.00 134.67 2hgu n PRO 226 Ca 0.23 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.47 2hgu n PRO 226 Cb 0.37 -1.21 -0.13 0.00 -0.04 0.00 0.00 33.50 32.48 2hgu n PRO 226 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2hgu h HIS 227 N 1.12 0.38 0.00 0.54 3.86 -1.95 -3.49 115.15 115.61 2hgu h HIS 227 Ca 0.00 -0.28 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 2hgu h HIS 227 Cb 0.13 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.59 2hgu h HIS 227 CO 0.00 1.67 0.00 0.45 0.86 0.00 0.00 177.93 180.91