#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xgu s ILE 2 N 0.00 3.38 -0.18 0.53 1.01 -1.26 -5.01 121.20 119.67 1xgu s ILE 2 Ca 0.00 1.10 -0.07 0.00 0.00 0.00 0.00 60.65 61.68 1xgu s ILE 2 Cb 0.00 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 1xgu s ILE 2 CO 0.00 0.15 0.05 -0.69 0.00 0.00 0.00 174.94 174.45 1xgu s VAL 3 N 0.34 4.71 -0.20 2.92 1.01 -1.26 -4.78 120.40 123.14 1xgu s VAL 3 Ca 0.57 -0.06 -0.03 0.00 0.00 0.00 0.00 61.98 62.46 1xgu s VAL 3 Cb -0.35 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.90 1xgu s VAL 3 CO 0.36 0.47 -0.05 -0.76 0.00 0.00 0.00 175.10 175.11 1xgu s LEU 4 N 0.35 2.91 -0.26 3.92 1.43 -1.26 -0.92 118.68 124.86 1xgu s LEU 4 Ca 0.02 -0.35 -0.05 0.00 -1.03 0.00 0.00 54.13 52.72 1xgu s LEU 4 Cb -0.12 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.37 1xgu s LEU 4 CO 0.00 0.03 0.01 -0.89 0.23 0.00 0.00 176.35 175.73 1xgu s THR 5 N 1.20 3.56 -0.08 5.49 2.01 0.61 -3.81 115.64 124.63 1xgu s THR 5 Ca 0.02 -0.65 -0.04 0.00 0.31 0.00 0.00 61.69 61.34 1xgu s THR 5 Cb -0.14 -2.75 -0.04 0.00 0.01 0.00 0.00 72.50 69.58 1xgu s THR 5 CO -0.01 0.24 0.09 -1.10 -0.69 0.00 0.00 174.62 173.15 1xgu s GLN 6 N 1.47 3.22 -0.01 4.92 -0.21 -1.26 -0.59 119.66 127.20 1xgu s GLN 6 Ca 0.03 -0.30 -0.11 0.00 0.02 0.00 0.00 55.36 55.00 1xgu s GLN 6 Cb -0.16 -3.00 0.01 0.00 1.00 0.00 0.00 33.01 30.87 1xgu s GLN 6 CO -0.01 0.72 0.23 -1.54 -2.12 0.00 0.00 175.29 172.57 1xgu s SER 7 N -1.19 -0.09 0.75 5.90 1.04 -0.92 -4.44 113.70 114.76 1xgu s SER 7 Ca 0.17 -0.05 -0.12 0.00 0.48 0.00 0.00 55.95 56.44 1xgu s SER 7 Cb -0.12 0.27 0.05 0.00 0.10 0.00 0.00 66.02 66.31 1xgu s SER 7 CO 0.06 -0.40 1.14 -2.16 0.98 0.00 0.00 173.24 172.85 1xgu s PRO 8 N -1.33 2.43 0.37 4.02 0.04 -1.26 -2.11 135.00 137.17 1xgu s PRO 8 Ca -0.14 0.29 0.05 0.00 0.04 0.00 0.00 61.00 61.24 1xgu s PRO 8 Cb -0.06 -1.99 0.71 0.00 0.04 0.00 0.00 34.50 33.20 1xgu s PRO 8 CO 0.03 -1.30 1.99 0.00 0.04 0.00 0.00 177.00 177.76 1xgu h ALA 9 N -0.84 1.56 -3.11 8.56 0.00 -1.85 -3.42 119.26 120.16 1xgu h ALA 9 Ca -0.45 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.20 1xgu h ALA 9 Cb 1.29 -0.19 -0.23 0.00 0.00 0.00 0.00 17.79 18.66 1xgu h ALA 9 CO 0.65 0.37 -0.60 -0.08 0.00 0.00 0.00 179.25 179.58 1xgu s THR 10 N -5.44 0.06 -0.04 0.00 -1.32 -1.26 -0.93 115.64 106.71 1xgu s THR 10 Ca -0.09 -0.50 -0.01 0.00 -1.21 0.00 0.00 61.69 59.88 1xgu s THR 10 Cb 0.17 -0.27 0.03 0.00 -1.51 0.00 0.00 72.50 70.92 1xgu s THR 10 CO 0.75 -0.27 0.03 -0.22 -2.21 0.00 0.00 174.62 172.69 1xgu s LEU 11 N -0.87 0.62 -0.26 9.08 0.20 0.52 -4.91 118.68 123.05 1xgu s LEU 11 Ca -0.10 0.01 -0.08 0.00 0.69 0.00 0.00 54.13 54.66 1xgu s LEU 11 Cb -0.06 -0.23 -0.02 0.00 -0.43 0.00 0.00 46.19 45.46 1xgu s LEU 11 CO 0.00 -0.18 0.08 -0.44 -0.29 0.00 0.00 176.35 175.52 1xgu s SER 12 N 1.70 5.18 0.16 3.68 0.01 -1.26 -0.31 113.70 122.86 1xgu s SER 12 Ca -0.00 -0.32 0.02 0.00 1.31 0.00 0.00 55.95 56.95 1xgu s SER 12 Cb -0.13 -1.93 -0.05 0.00 0.21 0.00 0.00 66.02 64.13 1xgu s SER 12 CO -0.03 -0.08 -0.00 0.68 0.41 0.00 0.00 173.24 174.22 1xgu s VAL 13 N 1.60 0.65 -0.14 3.43 -7.23 -0.39 -4.72 120.40 113.59 1xgu s VAL 13 Ca 0.06 -1.97 -0.12 0.00 -1.81 0.00 0.00 61.98 58.14 1xgu s VAL 13 Cb -0.16 -2.07 -0.05 0.00 0.56 0.00 0.00 36.38 34.67 1xgu s VAL 13 CO 0.04 -0.52 0.24 -0.89 -0.31 0.00 0.00 175.10 173.66 1xgu s THR 14 N -3.68 5.34 0.21 5.32 2.01 -1.26 -1.00 115.64 122.59 1xgu s THR 14 Ca 0.23 0.43 -0.31 0.00 0.31 0.00 0.00 61.69 62.34 1xgu s THR 14 Cb 0.06 -3.56 -0.15 0.00 0.01 0.00 0.00 72.50 68.87 1xgu s THR 14 CO 0.03 0.47 1.21 -2.65 -0.69 0.00 0.00 174.62 172.99 1xgu n PRO 15 N 3.02 1.46 0.00 4.92 -0.02 -1.26 -1.09 135.00 142.04 1xgu n PRO 15 Ca -0.15 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 1xgu n PRO 15 Cb 0.53 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1xgu n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xgu n GLY 16 N 1.90 2.38 3.86 -1.23 0.00 0.90 -4.94 105.19 108.06 1xgu n GLY 16 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1xgu n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xgu s ASP 17 N -0.57 6.47 0.18 1.61 1.01 -0.25 -4.33 116.67 120.80 1xgu s ASP 17 Ca 0.00 1.37 0.04 0.00 0.71 0.00 0.00 52.55 54.67 1xgu s ASP 17 Cb 0.00 -2.43 -0.03 0.00 1.01 0.00 0.00 42.92 41.46 1xgu s ASP 17 CO 0.00 -0.61 0.29 -0.44 0.21 0.00 0.00 175.17 174.62 1xgu s SER 18 N -3.45 6.23 0.09 0.27 0.01 -1.26 0.40 113.70 115.98 1xgu s SER 18 Ca 0.55 0.10 -0.06 0.00 1.31 0.00 0.00 55.95 57.85 1xgu s SER 18 Cb -0.10 -1.84 -0.01 0.00 0.21 0.00 0.00 66.02 64.28 1xgu s SER 18 CO 0.38 0.01 0.13 0.54 0.41 0.00 0.00 173.24 174.72 1xgu s VAL 19 N -1.83 0.16 -0.07 3.43 0.11 -0.57 -4.89 120.40 116.74 1xgu s VAL 19 Ca 0.34 -1.39 0.00 0.00 -2.93 0.00 0.00 61.98 58.00 1xgu s VAL 19 Cb -0.10 -1.46 0.02 0.00 -1.53 0.00 0.00 36.38 33.32 1xgu s VAL 19 CO 0.28 -0.71 -0.04 -0.44 -3.33 0.00 0.00 175.10 170.86 1xgu s SER 20 N -2.89 1.44 -0.09 3.54 0.01 -1.26 -1.52 113.70 112.93 1xgu s SER 20 Ca 0.07 -0.16 -0.01 0.00 1.31 0.00 0.00 55.95 57.16 1xgu s SER 20 Cb 0.06 -0.56 -0.03 0.00 0.21 0.00 0.00 66.02 65.70 1xgu s SER 20 CO -0.09 -0.10 -0.04 -0.76 0.41 0.00 0.00 173.24 172.66 1xgu s LEU 21 N 1.34 3.35 0.05 2.44 1.43 0.58 -4.90 118.68 122.97 1xgu s LEU 21 Ca -0.04 0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.11 1xgu s LEU 21 Cb -0.14 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.29 1xgu s LEU 21 CO -0.03 0.34 0.07 -0.55 0.23 0.00 0.00 176.35 176.42 1xgu s SER 22 N -0.68 5.53 -0.12 2.29 0.15 -0.89 -0.86 113.70 119.11 1xgu s SER 22 Ca 0.10 0.03 -0.05 0.00 0.70 0.00 0.00 55.95 56.74 1xgu s SER 22 Cb -0.12 -1.51 0.06 0.00 -1.71 0.00 0.00 66.02 62.75 1xgu s SER 22 CO 0.02 0.21 0.25 0.00 1.20 0.00 0.00 173.24 174.92 1xgu s ARG 24 N 2.36 2.70 -0.10 0.00 3.00 0.24 -1.49 118.95 125.66 1xgu s ARG 24 Ca 0.01 -0.76 -0.07 0.00 0.00 0.00 0.00 55.73 54.92 1xgu s ARG 24 Cb -0.12 -2.36 -0.04 0.00 0.00 0.00 0.00 34.95 32.43 1xgu s ARG 24 CO -0.08 0.47 0.15 0.00 0.00 0.00 0.00 175.30 175.83 1xgu s ALA 25 N -0.33 3.89 -0.16 2.13 0.00 -0.46 -0.28 121.76 126.54 1xgu s ALA 25 Ca 0.02 -0.65 0.29 0.00 0.00 0.00 0.00 51.96 51.63 1xgu s ALA 25 Cb -0.13 -1.97 1.22 0.00 0.00 0.00 0.00 23.12 22.25 1xgu s ALA 25 CO 0.02 0.63 1.86 0.66 0.00 0.00 0.00 175.76 178.94 1xgu h SER 26 N 4.84 0.00 -5.06 0.00 4.64 -1.37 -3.44 113.55 113.15 1xgu h SER 26 Ca -0.54 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.62 1xgu h SER 26 Cb 1.22 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.14 1xgu h SER 26 CO 0.59 0.00 -0.69 -1.10 -0.87 0.00 0.00 176.83 174.76 1xgu s GLN 27 N -3.52 0.52 0.26 4.77 -0.21 -1.26 -4.97 119.66 115.25 1xgu s GLN 27 Ca 0.02 -0.98 -0.30 0.00 0.02 0.00 0.00 55.36 54.12 1xgu s GLN 27 Cb 0.09 0.11 -0.10 0.00 1.00 0.00 0.00 33.01 34.11 1xgu s GLN 27 CO 0.46 -0.07 1.41 0.45 -2.12 0.00 0.00 175.29 175.42 1xgu s SER 28 N -2.32 6.68 -0.05 5.90 0.15 -1.26 -4.64 113.70 118.15 1xgu s SER 28 Ca -0.02 2.66 0.08 0.00 0.70 0.00 0.00 55.95 59.37 1xgu s SER 28 Cb 0.00 -2.63 0.12 0.00 -1.71 0.00 0.00 66.02 61.81 1xgu s SER 28 CO -0.06 -0.67 1.06 2.30 1.20 0.00 0.00 173.24 177.07 1xgu n ILE 29 N 2.06 0.80 0.00 6.45 -5.35 0.10 -4.98 119.36 118.44 1xgu n ILE 29 Ca 0.05 -0.96 0.00 0.00 -0.27 0.00 0.00 62.75 61.58 1xgu n ILE 29 Cb 0.41 0.20 0.00 0.00 -1.74 0.00 0.00 39.64 38.50 1xgu n ILE 29 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1xgu n SER 30 N -0.61 0.00 -0.23 7.28 7.64 -1.24 -0.88 113.62 125.58 1xgu n SER 30 Ca 0.07 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.99 1xgu n SER 30 Cb 0.67 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.96 1xgu n SER 30 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1xgu n ASN 31 N 8.40 2.45 -2.78 6.43 2.04 -1.26 -0.34 115.26 130.19 1xgu n ASN 31 Ca 0.00 -2.34 -0.29 0.00 -0.44 0.00 0.00 54.58 51.51 1xgu n ASN 31 Cb 0.00 -0.19 -0.07 0.00 -2.53 0.00 0.00 39.78 36.98 1xgu n ASN 31 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1xgu n ASN 32 N -0.51 7.08 -4.07 0.53 4.13 -0.06 -2.30 115.26 120.06 1xgu n ASN 32 Ca 0.08 -2.80 -0.26 0.00 1.68 0.00 0.00 54.58 53.28 1xgu n ASN 32 Cb 0.43 -1.41 -0.16 0.00 -1.54 0.00 0.00 39.78 37.10 1xgu n ASN 32 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1xgu s LEU 33 N -0.88 1.76 0.17 3.41 1.98 -1.26 -1.76 118.68 122.11 1xgu s LEU 33 Ca 0.63 -0.33 0.11 0.00 -2.89 0.00 0.00 54.13 51.65 1xgu s LEU 33 Cb 0.27 -0.91 -0.04 0.00 0.66 0.00 0.00 46.19 46.16 1xgu s LEU 33 CO -0.09 0.08 -0.24 -1.00 -1.89 0.00 0.00 176.35 173.21 1xgu s HIS 34 N 0.47 2.26 -0.10 5.38 3.76 0.12 0.47 115.29 127.65 1xgu s HIS 34 Ca -0.12 -0.37 0.02 0.00 -0.15 0.00 0.00 55.06 54.44 1xgu s HIS 34 Cb -0.15 -1.15 -0.01 0.00 1.11 0.00 0.00 32.58 32.38 1xgu s HIS 34 CO 0.04 0.44 -0.18 -1.58 -0.85 0.00 0.00 174.74 172.61 1xgu s TRP 35 N -1.53 2.67 0.07 1.40 0.52 -0.20 -0.48 118.94 121.39 1xgu s TRP 35 Ca 0.18 -0.75 0.08 0.00 0.02 0.00 0.00 56.10 55.64 1xgu s TRP 35 Cb -0.08 -1.75 -0.03 0.00 -1.15 0.00 0.00 33.47 30.46 1xgu s TRP 35 CO 0.09 -0.25 -0.23 0.71 0.02 0.00 0.00 176.95 177.29 1xgu s TYR 36 N 0.18 1.97 -0.02 -1.98 2.02 0.13 -0.76 117.35 118.88 1xgu s TYR 36 Ca -0.11 -0.39 0.06 0.00 -0.37 0.00 0.00 57.07 56.26 1xgu s TYR 36 Cb -0.16 -1.13 -0.02 0.00 -0.40 0.00 0.00 41.96 40.25 1xgu s TYR 36 CO 0.06 0.17 -0.20 -1.14 -1.57 0.00 0.00 175.55 172.87 1xgu s GLN 37 N -1.53 2.24 -0.16 -0.62 0.74 -0.11 -0.58 119.66 119.65 1xgu s GLN 37 Ca 0.09 -0.85 -0.04 0.00 0.05 0.00 0.00 55.36 54.60 1xgu s GLN 37 Cb -0.10 -2.19 0.07 0.00 1.10 0.00 0.00 33.01 31.89 1xgu s GLN 37 CO 0.03 0.58 0.15 -1.14 -0.55 0.00 0.00 175.29 174.36 1xgu s GLN 38 N -0.82 0.10 0.60 1.67 0.74 0.17 0.41 119.66 122.53 1xgu s GLN 38 Ca 0.11 0.16 -0.07 0.00 0.05 0.00 0.00 55.36 55.61 1xgu s GLN 38 Cb -0.10 -1.27 0.00 0.00 1.10 0.00 0.00 33.01 32.74 1xgu s GLN 38 CO 0.01 -0.59 0.93 0.15 -0.55 0.00 0.00 175.29 175.23 1xgu s LYS 39 N 2.24 2.98 0.40 1.67 -0.14 -1.26 -1.62 119.74 124.01 1xgu s LYS 39 Ca 0.04 0.11 -0.27 0.00 -1.36 0.00 0.00 55.97 54.50 1xgu s LYS 39 Cb -0.15 -2.23 -0.09 0.00 -1.68 0.00 0.00 37.83 33.67 1xgu s LYS 39 CO -0.09 -0.71 1.39 -1.54 -0.76 0.00 0.00 175.35 173.63 1xgu s SER 40 N -4.29 6.26 -1.90 2.83 1.04 -1.26 -2.05 113.70 114.33 1xgu s SER 40 Ca 0.54 2.84 0.00 0.00 0.48 0.00 0.00 55.95 59.81 1xgu s SER 40 Cb -0.11 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.36 1xgu s SER 40 CO 0.46 -0.91 0.00 1.41 0.98 0.00 0.00 173.24 175.19 1xgu n HIS 41 N 0.22 -0.15 -4.16 5.02 8.25 -1.26 -4.97 115.22 118.17 1xgu n HIS 41 Ca 0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.39 1xgu n HIS 41 Cb 0.42 -3.23 -0.10 0.00 1.12 0.00 0.00 29.99 28.20 1xgu n HIS 41 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1xgu s GLU 42 N -3.80 0.79 0.51 -0.41 2.02 -0.87 -5.16 118.70 111.79 1xgu s GLU 42 Ca 0.00 -1.30 -0.06 0.00 0.02 0.00 0.00 54.97 53.63 1xgu s GLU 42 Cb 0.00 -0.15 -0.03 0.00 0.10 0.00 0.00 34.13 34.05 1xgu s GLU 42 CO 0.00 -0.03 0.83 -1.54 0.02 0.00 0.00 175.26 174.54 1xgu s SER 43 N -2.98 6.14 0.61 -0.19 1.04 -1.26 -4.51 113.70 112.56 1xgu s SER 43 Ca 0.10 0.93 -0.19 0.00 0.48 0.00 0.00 55.95 57.28 1xgu s SER 43 Cb 0.05 -2.17 -0.03 0.00 0.10 0.00 0.00 66.02 63.97 1xgu s SER 43 CO -0.05 -0.69 1.22 -2.65 0.98 0.00 0.00 173.24 172.05 1xgu n PRO 44 N -2.36 1.19 -4.34 4.02 -0.02 -1.26 -4.60 135.00 127.62 1xgu n PRO 44 Ca 0.02 0.46 -0.24 0.00 -2.02 0.00 0.00 63.50 61.71 1xgu n PRO 44 Cb 0.55 -2.45 -0.17 0.00 -0.02 0.00 0.00 33.50 31.42 1xgu n PRO 44 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1xgu s ARG 45 N -3.10 1.43 -0.00 -0.52 3.52 0.17 -4.94 118.95 115.50 1xgu s ARG 45 Ca 0.79 -0.30 -0.30 0.00 -0.13 0.00 0.00 55.73 55.79 1xgu s ARG 45 Cb -0.40 -1.29 -0.05 0.00 -1.56 0.00 0.00 34.95 31.65 1xgu s ARG 45 CO 0.44 -0.06 1.31 -1.17 -0.81 0.00 0.00 175.30 175.01 1xgu s LEU 46 N 0.96 4.31 -0.18 -0.88 2.96 -1.26 -0.93 118.68 123.66 1xgu s LEU 46 Ca -0.10 2.02 -0.04 0.00 -0.22 0.00 0.00 54.13 55.79 1xgu s LEU 46 Cb -0.15 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 42.89 1xgu s LEU 46 CO 0.00 -0.65 -0.20 0.18 -1.32 0.00 0.00 176.35 174.37 1xgu n LEU 47 N 5.08 2.08 -3.93 -0.68 4.77 0.06 -4.96 117.00 119.42 1xgu n LEU 47 Ca 0.12 0.08 -0.15 0.00 -0.03 0.00 0.00 56.01 56.02 1xgu n LEU 47 Cb 0.45 -0.57 -0.15 0.00 -2.33 0.00 0.00 43.42 40.82 1xgu n LEU 47 CO 0.57 0.57 -0.39 -0.63 -1.33 0.00 0.00 177.39 176.18 1xgu s ILE 48 N -2.34 0.32 0.19 -0.08 -1.09 -1.19 -4.06 121.20 112.95 1xgu s ILE 48 Ca -0.24 -0.16 0.11 0.00 -2.23 0.00 0.00 60.65 58.13 1xgu s ILE 48 Cb 0.08 -0.29 -0.04 0.00 -1.58 0.00 0.00 42.46 40.63 1xgu s ILE 48 CO 0.36 0.10 -0.24 -1.59 -1.23 0.00 0.00 174.94 172.34 1xgu s LYS 49 N 0.02 1.48 -1.40 2.79 -2.85 -0.90 -1.04 119.74 117.84 1xgu s LYS 49 Ca 0.00 -1.50 -0.03 0.00 -1.00 0.00 0.00 55.97 53.44 1xgu s LYS 49 Cb -0.03 -1.79 0.00 0.00 -2.06 0.00 0.00 37.83 33.95 1xgu s LYS 49 CO -0.00 0.39 0.39 0.66 0.10 0.00 0.00 175.35 176.88 1xgu n TYR 50 N 0.31 -1.59 0.00 1.78 4.01 -1.16 -1.13 117.16 119.39 1xgu n TYR 50 Ca -0.13 0.67 0.00 0.00 -0.16 0.00 0.00 57.90 58.28 1xgu n TYR 50 Cb 0.56 -3.53 0.00 0.00 -0.31 0.00 0.00 39.34 36.06 1xgu n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xgu n ALA 51 N -4.44 0.00 -1.08 -0.72 0.00 0.18 -3.93 120.51 110.51 1xgu n ALA 51 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1xgu n ALA 51 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.13 1xgu n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1xgu n SER 52 N 1.03 0.00 -4.69 0.00 3.41 -1.19 -2.87 113.62 109.32 1xgu n SER 52 Ca 0.00 -1.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.19 1xgu n SER 52 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1xgu n SER 52 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1xgu s GLN 53 N 0.00 4.39 0.51 4.33 -0.21 -0.28 -4.64 119.66 123.77 1xgu s GLN 53 Ca 0.00 1.52 -0.20 0.00 0.02 0.00 0.00 55.36 56.70 1xgu s GLN 53 Cb 0.00 -3.54 -0.07 0.00 1.00 0.00 0.00 33.01 30.39 1xgu s GLN 53 CO 0.00 -0.37 1.06 -1.54 -2.12 0.00 0.00 175.29 172.32 1xgu s SER 54 N 1.25 6.15 -0.22 5.90 1.04 -1.26 -2.12 113.70 124.44 1xgu s SER 54 Ca 0.52 1.96 -0.06 0.00 0.48 0.00 0.00 55.95 58.85 1xgu s SER 54 Cb -0.21 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.32 1xgu s SER 54 CO 0.20 -0.91 0.03 -0.63 0.98 0.00 0.00 173.24 172.91 1xgu s ILE 55 N -2.00 4.13 0.13 -1.02 -1.09 -1.26 -4.89 121.20 115.21 1xgu s ILE 55 Ca 0.68 -0.24 -0.33 0.00 -2.23 0.00 0.00 60.65 58.53 1xgu s ILE 55 Cb -0.18 -2.90 -0.12 0.00 -1.58 0.00 0.00 42.46 37.68 1xgu s ILE 55 CO 0.23 0.39 1.73 -0.24 -1.23 0.00 0.00 174.94 175.82 1xgu n SER 56 N 4.54 3.64 0.00 3.58 2.88 -1.26 -1.20 113.62 125.79 1xgu n SER 56 Ca -0.17 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.41 1xgu n SER 56 Cb 0.52 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 1xgu n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xgu n GLY 57 N 3.90 0.39 3.75 0.46 0.00 -1.26 -5.07 105.19 107.36 1xgu n GLY 57 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1xgu n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xgu s ILE 58 N -2.00 5.21 0.28 -0.61 -1.09 -0.34 -5.06 121.20 117.59 1xgu s ILE 58 Ca 0.00 0.11 -0.28 0.00 -2.23 0.00 0.00 60.65 58.25 1xgu s ILE 58 Cb 0.00 -3.33 -0.14 0.00 -1.58 0.00 0.00 42.46 37.41 1xgu s ILE 58 CO 0.00 0.51 1.01 -2.65 -1.23 0.00 0.00 174.94 172.59 1xgu n PRO 59 N 2.95 1.32 0.29 2.79 -0.02 -1.26 -4.87 135.00 136.19 1xgu n PRO 59 Ca -0.18 0.46 0.19 0.00 -2.02 0.00 0.00 63.50 61.96 1xgu n PRO 59 Cb 0.53 -1.84 0.96 0.00 -0.02 0.00 0.00 33.50 33.13 1xgu n PRO 59 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1xgu h SER 60 N 2.09 0.00 0.42 2.55 4.64 -1.97 -2.77 113.55 118.51 1xgu h SER 60 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1xgu h SER 60 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1xgu h SER 60 CO 0.61 0.00 0.00 0.08 -0.87 0.00 0.00 176.83 176.65 1xgu h ARG 61 N 0.00 0.00 -5.56 4.77 0.11 -1.89 -3.41 114.38 108.40 1xgu h ARG 61 Ca 0.00 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.49 1xgu h ARG 61 Cb 0.19 0.00 -0.10 0.00 1.11 0.00 0.00 29.97 31.17 1xgu h ARG 61 CO 0.00 0.00 -0.16 -0.06 0.10 0.00 0.00 179.97 179.85 1xgu s PHE 62 N -3.49 3.43 0.05 4.08 0.08 -1.05 -0.91 117.98 120.17 1xgu s PHE 62 Ca 0.01 0.73 -0.12 0.00 0.12 0.00 0.00 56.93 57.67 1xgu s PHE 62 Cb 0.08 -2.54 0.01 0.00 -0.57 0.00 0.00 43.02 40.00 1xgu s PHE 62 CO 0.33 0.06 0.27 -1.54 -0.10 0.00 0.00 175.22 174.23 1xgu s SER 63 N 0.87 -0.06 0.08 1.36 1.04 -0.44 -4.99 113.70 111.55 1xgu s SER 63 Ca 0.22 -0.31 0.04 0.00 0.48 0.00 0.00 55.95 56.39 1xgu s SER 63 Cb -0.15 0.35 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 1xgu s SER 63 CO 0.09 -0.63 -0.12 -0.83 0.98 0.00 0.00 173.24 172.72 1xgu s GLY 64 N -2.23 0.85 0.25 7.32 0.00 -1.26 0.10 107.32 112.35 1xgu s GLY 64 Ca -0.03 -1.07 -0.07 0.00 0.00 0.00 0.00 44.72 43.55 1xgu s GLY 64 CO -0.05 -1.12 0.37 -1.35 0.00 0.00 0.00 173.10 170.95 1xgu s SER 65 N -2.04 0.23 0.00 1.64 1.04 -0.37 -4.18 113.70 110.02 1xgu s SER 65 Ca 0.01 -1.20 0.00 0.00 0.48 0.00 0.00 55.95 55.24 1xgu s SER 65 Cb -0.07 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.59 1xgu s SER 65 CO 0.01 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 173.76 1xgu n GLY 66 N -0.39 1.78 3.55 7.32 0.00 -1.26 -1.29 105.19 114.89 1xgu n GLY 66 Ca 0.00 -2.13 -0.08 0.00 0.00 0.00 0.00 46.02 43.81 1xgu n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xgu s SER 67 N 0.00 -0.31 0.08 1.61 0.15 -0.86 -4.90 113.70 109.47 1xgu s SER 67 Ca 0.00 0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.77 1xgu s SER 67 Cb 0.00 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 1xgu s SER 67 CO 0.00 -0.45 0.00 0.61 1.20 0.00 0.00 173.24 174.60 1xgu n GLY 68 N 0.09 1.86 0.00 9.45 0.00 0.53 -3.00 105.19 114.12 1xgu n GLY 68 Ca -0.07 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1xgu n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xgu n THR 69 N 0.00 0.00 -4.01 2.61 -2.24 -1.26 0.02 114.28 109.39 1xgu n THR 69 Ca 0.00 -0.30 -0.31 0.00 -2.27 0.00 0.00 64.05 61.17 1xgu n THR 69 Cb 0.00 1.36 -0.16 0.00 -2.10 0.00 0.00 70.33 69.43 1xgu n THR 69 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xgu s ASP 70 N -0.05 3.46 0.18 3.42 2.15 -1.16 -1.36 116.67 123.30 1xgu s ASP 70 Ca 0.00 -0.91 0.07 0.00 0.43 0.00 0.00 52.55 52.14 1xgu s ASP 70 Cb 0.00 -1.28 -0.04 0.00 -0.30 0.00 0.00 42.92 41.29 1xgu s ASP 70 CO 0.00 -0.14 -0.14 -0.36 -0.17 0.00 0.00 175.17 174.37 1xgu s PHE 71 N 1.36 1.58 -0.08 -5.34 0.40 -0.56 -2.03 117.98 113.32 1xgu s PHE 71 Ca -0.01 -0.60 -0.05 0.00 -0.60 0.00 0.00 56.93 55.67 1xgu s PHE 71 Cb -0.16 -0.76 0.04 0.00 0.51 0.00 0.00 43.02 42.64 1xgu s PHE 71 CO -0.08 0.27 0.19 0.99 0.70 0.00 0.00 175.22 177.28 1xgu s THR 72 N -2.83 -0.03 -0.22 0.64 2.01 -0.41 -2.10 115.64 112.70 1xgu s THR 72 Ca 0.18 0.12 -0.08 0.00 0.31 0.00 0.00 61.69 62.23 1xgu s THR 72 Cb -0.01 -0.30 -0.04 0.00 0.01 0.00 0.00 72.50 72.17 1xgu s THR 72 CO 0.05 0.05 0.08 -0.22 -0.69 0.00 0.00 174.62 173.89 1xgu s LEU 73 N 0.94 3.66 -0.01 4.42 2.96 -0.04 -1.24 118.68 129.37 1xgu s LEU 73 Ca -0.07 -0.06 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 1xgu s LEU 73 Cb -0.09 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.61 1xgu s LEU 73 CO -0.05 0.06 -0.10 -0.44 -1.32 0.00 0.00 176.35 174.50 1xgu s SER 74 N 1.05 4.38 -0.26 3.68 0.01 0.11 -0.31 113.70 122.37 1xgu s SER 74 Ca 0.04 -0.18 -0.01 0.00 1.31 0.00 0.00 55.95 57.11 1xgu s SER 74 Cb -0.14 -0.97 0.08 0.00 0.21 0.00 0.00 66.02 65.20 1xgu s SER 74 CO 0.03 0.30 0.04 -0.63 0.41 0.00 0.00 173.24 173.39 1xgu s ILE 75 N -0.91 1.04 -0.51 1.44 1.01 -0.58 -1.33 121.20 121.35 1xgu s ILE 75 Ca 0.15 -1.16 -0.29 0.00 0.00 0.00 0.00 60.65 59.35 1xgu s ILE 75 Cb -0.11 -1.58 0.03 0.00 0.01 0.00 0.00 42.46 40.81 1xgu s ILE 75 CO 0.05 -0.38 1.15 0.21 0.00 0.00 0.00 174.94 175.97 1xgu s ASN 76 N 1.58 6.57 -0.27 3.58 3.84 -0.09 -1.52 114.94 128.63 1xgu s ASN 76 Ca 0.02 0.34 -0.06 0.00 0.21 0.00 0.00 52.86 53.37 1xgu s ASN 76 Cb -0.18 -2.55 0.01 0.00 -0.55 0.00 0.00 41.25 37.98 1xgu s ASN 76 CO -0.14 -1.33 0.21 -1.20 -2.79 0.00 0.00 177.10 171.85 1xgu n SER 77 N 8.04 -6.52 -4.74 -4.21 7.64 -1.21 -4.77 113.62 107.84 1xgu n SER 77 Ca 0.11 0.77 -0.42 0.00 1.01 0.00 0.00 58.87 60.34 1xgu n SER 77 Cb 0.49 -4.30 -0.02 0.00 -1.01 0.00 0.00 64.21 59.37 1xgu n SER 77 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1xgu s VAL 78 N -1.68 2.26 0.24 0.44 1.01 0.16 -4.66 120.40 118.17 1xgu s VAL 78 Ca 0.09 0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.34 1xgu s VAL 78 Cb -0.02 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 1xgu s VAL 78 CO 0.59 0.03 0.26 -1.61 0.00 0.00 0.00 175.10 174.36 1xgu s GLU 79 N -0.09 3.13 0.48 2.72 0.41 -1.26 -0.07 118.70 124.03 1xgu s GLU 79 Ca 0.64 -0.92 0.26 0.00 -0.41 0.00 0.00 54.97 54.55 1xgu s GLU 79 Cb -0.46 -2.70 1.33 0.00 -1.78 0.00 0.00 34.13 30.51 1xgu s GLU 79 CO 0.43 0.42 1.85 0.00 -0.49 0.00 0.00 175.26 177.47 1xgu h THR 80 N 1.41 0.56 -0.08 3.63 1.03 -1.96 0.13 112.91 117.64 1xgu h THR 80 Ca -0.50 -0.06 0.00 0.00 -0.01 0.00 0.00 66.41 65.84 1xgu h THR 80 Cb 1.23 0.38 0.00 0.00 -1.07 0.00 0.00 68.15 68.69 1xgu h THR 80 CO 0.61 0.03 0.00 -1.84 -0.01 0.00 0.00 175.52 174.31 1xgu n GLU 81 N -4.38 1.40 0.00 0.00 0.00 -1.26 -3.93 120.64 112.48 1xgu n GLU 81 Ca 0.21 -0.60 0.14 0.00 0.00 0.00 0.00 57.16 56.90 1xgu n GLU 81 Cb 0.91 -1.37 0.47 0.00 0.00 0.00 0.00 31.44 31.44 1xgu n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1xgu n ASP 82 N -0.20 1.67 -4.74 -1.84 8.00 0.46 -4.94 116.55 114.95 1xgu n ASP 82 Ca 0.16 -1.54 -0.40 0.00 0.71 0.00 0.00 54.79 53.72 1xgu n ASP 82 Cb 0.22 0.01 -0.05 0.00 -0.02 0.00 0.00 41.12 41.27 1xgu n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1xgu s PHE 83 N -2.02 3.85 -5.00 1.24 0.40 -1.25 -4.91 117.98 110.29 1xgu s PHE 83 Ca 0.36 1.83 0.00 0.00 -0.60 0.00 0.00 56.93 58.52 1xgu s PHE 83 Cb 0.21 -3.07 0.00 0.00 0.51 0.00 0.00 43.02 40.67 1xgu s PHE 83 CO 0.34 0.16 0.00 0.41 0.70 0.00 0.00 175.22 176.83 1xgu n GLY 84 N 1.71 -0.08 3.88 4.36 0.00 -0.76 -4.80 105.19 109.50 1xgu n GLY 84 Ca -0.00 -1.18 -0.33 0.00 0.00 0.00 0.00 46.02 44.50 1xgu n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xgu s MET 85 N -2.00 3.70 -0.08 1.61 -1.94 -0.64 -0.08 119.30 119.87 1xgu s MET 85 Ca 0.00 0.07 0.00 0.00 -1.71 0.00 0.00 55.69 54.05 1xgu s MET 85 Cb 0.00 -2.94 0.02 0.00 2.01 0.00 0.00 34.83 33.92 1xgu s MET 85 CO 0.00 0.53 -0.07 0.71 -0.01 0.00 0.00 175.02 176.17 1xgu s TYR 86 N -1.50 1.22 0.07 -0.03 1.51 -0.14 -0.66 117.35 117.83 1xgu s TYR 86 Ca 0.36 -0.51 0.08 0.00 -1.01 0.00 0.00 57.07 56.00 1xgu s TYR 86 Cb -0.13 -1.02 -0.03 0.00 -0.11 0.00 0.00 41.96 40.66 1xgu s TYR 86 CO 0.20 -0.37 -0.23 -0.06 -1.11 0.00 0.00 175.55 173.99 1xgu s PHE 87 N 1.33 1.96 0.15 2.71 0.40 0.26 -0.76 117.98 124.04 1xgu s PHE 87 Ca -0.03 -0.39 0.06 0.00 -0.60 0.00 0.00 56.93 55.97 1xgu s PHE 87 Cb -0.14 -1.13 -0.04 0.00 0.51 0.00 0.00 43.02 42.23 1xgu s PHE 87 CO -0.03 0.17 0.04 0.00 0.70 0.00 0.00 175.22 176.10 1xgu s GLN 89 N -2.86 0.22 -0.05 0.00 0.74 0.37 -0.88 119.66 117.19 1xgu s GLN 89 Ca 0.28 0.38 -0.02 0.00 0.05 0.00 0.00 55.36 56.05 1xgu s GLN 89 Cb -0.10 0.01 -0.04 0.00 1.10 0.00 0.00 33.01 33.99 1xgu s GLN 89 CO 0.20 -0.08 0.07 1.14 -0.55 0.00 0.00 175.29 176.07 1xgu s GLN 90 N 0.58 3.14 -0.09 1.67 1.03 -0.75 0.15 119.66 125.39 1xgu s GLN 90 Ca -0.04 -0.38 0.14 0.00 0.04 0.00 0.00 55.36 55.12 1xgu s GLN 90 Cb -0.05 -2.92 0.21 0.00 0.03 0.00 0.00 33.01 30.28 1xgu s GLN 90 CO -0.03 0.69 1.10 -1.13 -2.54 0.00 0.00 175.29 173.38 1xgu n SER 91 N 1.64 1.87 0.06 12.60 3.41 -0.72 -3.32 113.62 129.16 1xgu n SER 91 Ca -0.16 -2.78 -0.10 0.00 -0.26 0.00 0.00 58.87 55.57 1xgu n SER 91 Cb 0.53 -0.35 0.01 0.00 -0.26 0.00 0.00 64.21 64.14 1xgu n SER 91 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1xgu h ASN 92 N 0.00 0.44 -4.75 4.04 -0.73 -1.89 -3.46 115.58 109.23 1xgu h ASN 92 Ca 0.00 -0.32 -0.18 0.00 1.87 0.00 0.00 56.30 57.68 1xgu h ASN 92 Cb 1.03 -0.13 -0.22 0.00 0.27 0.00 0.00 38.32 39.27 1xgu h ASN 92 CO 0.00 1.08 -0.67 -0.44 -0.37 0.00 0.00 177.43 177.02 1xgu s SER 93 N -6.99 0.17 0.02 1.15 0.01 -1.26 -5.14 113.70 101.65 1xgu s SER 93 Ca -0.05 -0.37 -0.18 0.00 1.31 0.00 0.00 55.95 56.66 1xgu s SER 93 Cb 0.10 0.10 -0.06 0.00 0.21 0.00 0.00 66.02 66.37 1xgu s SER 93 CO 0.84 -0.25 0.51 0.86 0.41 0.00 0.00 173.24 175.60 1xgu s TRP 94 N -1.18 3.73 0.38 2.43 -0.11 -1.26 -3.26 118.94 119.67 1xgu s TRP 94 Ca -0.13 1.12 -0.24 0.00 1.22 0.00 0.00 56.10 58.08 1xgu s TRP 94 Cb -0.08 -2.45 -0.10 0.00 -1.50 0.00 0.00 33.47 29.34 1xgu s TRP 94 CO -0.01 0.53 0.98 -1.25 -4.62 0.00 0.00 176.95 172.58 1xgu s PRO 95 N -0.77 4.35 0.43 5.86 0.04 -1.26 -5.00 135.00 138.65 1xgu s PRO 95 Ca 0.27 1.31 -0.25 0.00 0.04 0.00 0.00 61.00 62.37 1xgu s PRO 95 Cb -0.18 -2.53 -0.08 0.00 0.04 0.00 0.00 34.50 31.75 1xgu s PRO 95 CO 0.16 0.06 1.34 0.71 0.04 0.00 0.00 177.00 179.31 1xgu s TYR 96 N -1.81 2.66 0.08 0.56 4.12 -1.20 -4.72 117.35 117.04 1xgu s TYR 96 Ca 0.56 1.36 0.03 0.00 0.02 0.00 0.00 57.07 59.05 1xgu s TYR 96 Cb -0.17 -3.75 -0.03 0.00 -1.52 0.00 0.00 41.96 36.49 1xgu s TYR 96 CO 0.21 -2.40 -0.10 0.95 0.02 0.00 0.00 175.55 174.23 1xgu s THR 97 N -1.26 0.84 0.14 -0.71 -4.23 -1.21 -4.99 115.64 104.22 1xgu s THR 97 Ca 0.60 -1.51 0.07 0.00 -1.18 0.00 0.00 61.69 59.66 1xgu s THR 97 Cb -0.40 -1.20 -0.04 0.00 1.34 0.00 0.00 72.50 72.20 1xgu s THR 97 CO 0.51 -0.52 -0.02 -0.36 -0.54 0.00 0.00 174.62 173.69 1xgu s PHE 98 N -2.22 2.87 0.84 3.99 0.40 -1.26 -1.81 117.98 120.80 1xgu s PHE 98 Ca 0.02 -0.11 -0.12 0.00 -0.60 0.00 0.00 56.93 56.12 1xgu s PHE 98 Cb -0.04 -1.44 0.10 0.00 0.51 0.00 0.00 43.02 42.15 1xgu s PHE 98 CO -0.00 0.49 1.18 0.20 0.70 0.00 0.00 175.22 177.79 1xgu s GLY 99 N -2.62 1.60 0.02 4.36 0.00 -0.06 -4.56 107.32 106.06 1xgu s GLY 99 Ca 0.26 -0.66 0.20 0.00 0.00 0.00 0.00 44.72 44.52 1xgu s GLY 99 CO 0.18 -0.14 1.64 0.61 0.00 0.00 0.00 173.10 175.39 1xgu n GLY 100 N -3.09 -1.21 0.00 0.20 0.00 -1.25 -4.73 105.19 95.12 1xgu n GLY 100 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1xgu n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xgu n GLY 101 N 0.54 -0.88 3.07 -0.02 0.00 -1.26 -5.02 105.19 101.62 1xgu n GLY 101 Ca 0.05 -1.54 -0.26 0.00 0.00 0.00 0.00 46.02 44.27 1xgu n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xgu s THR 102 N -3.14 1.34 -0.24 2.61 2.01 0.06 -4.73 115.64 113.56 1xgu s THR 102 Ca 0.00 -0.61 -0.15 0.00 0.31 0.00 0.00 61.69 61.24 1xgu s THR 102 Cb 0.00 -1.20 -0.04 0.00 0.01 0.00 0.00 72.50 71.27 1xgu s THR 102 CO 0.00 0.40 0.38 -0.75 -0.69 0.00 0.00 174.62 173.96 1xgu s LYS 103 N 0.52 4.08 -0.33 4.92 2.47 -0.10 -0.96 119.74 130.33 1xgu s LYS 103 Ca -0.14 0.10 -0.16 0.00 -1.56 0.00 0.00 55.97 54.21 1xgu s LYS 103 Cb -0.16 -3.61 -0.01 0.00 -1.46 0.00 0.00 37.83 32.59 1xgu s LYS 103 CO 0.05 -0.18 0.43 -1.17 0.16 0.00 0.00 175.35 174.63 1xgu s LEU 104 N 1.78 4.32 0.27 5.43 0.20 0.89 -0.36 118.68 131.21 1xgu s LEU 104 Ca 0.16 -0.04 0.10 0.00 0.69 0.00 0.00 54.13 55.05 1xgu s LEU 104 Cb -0.15 -2.46 -0.05 0.00 -0.43 0.00 0.00 46.19 43.10 1xgu s LEU 104 CO 0.09 -0.36 -0.15 -1.61 -0.29 0.00 0.00 176.35 174.02 1xgu s GLU 105 N 2.18 1.60 0.08 1.98 2.02 0.57 -1.84 118.70 125.28 1xgu s GLU 105 Ca 0.15 -1.75 -0.30 0.00 0.02 0.00 0.00 54.97 53.09 1xgu s GLU 105 Cb -0.16 -1.52 -0.05 0.00 0.10 0.00 0.00 34.13 32.50 1xgu s GLU 105 CO 0.12 0.23 1.00 0.42 0.02 0.00 0.00 175.26 177.05 1xgu s ILE 106 N -2.71 4.53 0.06 -1.63 1.01 -1.26 -1.26 121.20 119.94 1xgu s ILE 106 Ca 0.28 1.98 -0.23 0.00 0.00 0.00 0.00 60.65 62.68 1xgu s ILE 106 Cb -0.02 -4.27 -0.06 0.00 0.01 0.00 0.00 42.46 38.13 1xgu s ILE 106 CO 0.13 0.25 0.69 -0.75 0.00 0.00 0.00 174.94 175.26 1xgu s LYS 107 N 0.38 4.42 0.37 2.79 2.47 -0.17 -4.75 119.74 125.25 1xgu s LYS 107 Ca 0.50 0.95 -0.09 0.00 -1.56 0.00 0.00 55.97 55.77 1xgu s LYS 107 Cb -0.24 -3.32 0.03 0.00 -1.46 0.00 0.00 37.83 32.84 1xgu s LYS 107 CO 0.30 0.42 0.63 -0.98 0.16 0.00 0.00 175.35 175.87 1xgu s ARG 108 N -0.47 2.08 0.30 4.03 1.70 -1.26 -4.76 118.95 120.57 1xgu s ARG 108 Ca 0.35 -1.61 -0.29 0.00 -0.47 0.00 0.00 55.73 53.71 1xgu s ARG 108 Cb -0.20 0.53 -0.10 0.00 -0.57 0.00 0.00 34.95 34.61 1xgu s ARG 108 CO 0.21 -0.92 1.17 0.00 -1.08 0.00 0.00 175.30 174.68 1xgu s ALA 109 N -2.68 3.42 0.49 7.88 0.00 -1.26 -4.97 121.76 124.65 1xgu s ALA 109 Ca 0.23 1.02 -0.23 0.00 0.00 0.00 0.00 51.96 52.98 1xgu s ALA 109 Cb -0.03 -3.38 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 1xgu s ALA 109 CO 0.16 -0.33 1.13 -0.25 0.00 0.00 0.00 175.76 176.47 1xgu n ASP 110 N 0.99 1.73 -3.73 0.00 8.00 -1.26 -4.79 116.55 117.48 1xgu n ASP 110 Ca -0.00 0.98 -0.13 0.00 0.71 0.00 0.00 54.79 56.35 1xgu n ASP 110 Cb 0.44 -1.44 -0.14 0.00 -0.02 0.00 0.00 41.12 39.96 1xgu n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xgu s ALA 111 N -1.32 -0.43 0.38 2.24 0.00 0.33 -4.88 121.76 118.07 1xgu s ALA 111 Ca 0.67 0.86 -0.26 0.00 0.00 0.00 0.00 51.96 53.24 1xgu s ALA 111 Cb -0.48 -0.58 -0.09 0.00 0.00 0.00 0.00 23.12 21.98 1xgu s ALA 111 CO 0.53 -0.20 1.12 0.00 0.00 0.00 0.00 175.76 177.20 1xgu s ALA 112 N 1.28 3.17 0.50 0.00 0.00 -1.26 -0.70 121.76 124.75 1xgu s ALA 112 Ca -0.09 0.86 -0.20 0.00 0.00 0.00 0.00 51.96 52.53 1xgu s ALA 112 Cb -0.11 -3.33 -0.08 0.00 0.00 0.00 0.00 23.12 19.60 1xgu s ALA 112 CO -0.07 -0.36 1.08 -1.25 0.00 0.00 0.00 175.76 175.15 1xgu s PRO 113 N -2.22 3.68 -0.36 0.00 0.04 -1.26 -4.53 135.00 130.35 1xgu s PRO 113 Ca 0.55 1.48 -0.15 0.00 0.04 0.00 0.00 61.00 62.91 1xgu s PRO 113 Cb -0.28 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.14 1xgu s PRO 113 CO 0.35 -0.55 0.36 0.99 0.04 0.00 0.00 177.00 178.19 1xgu s THR 114 N -1.86 5.17 -0.15 1.26 2.01 -0.47 -4.86 115.64 116.74 1xgu s THR 114 Ca 0.68 -0.07 -0.07 0.00 0.31 0.00 0.00 61.69 62.54 1xgu s THR 114 Cb -0.20 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.42 1xgu s THR 114 CO 0.23 -0.15 0.11 -0.69 -0.69 0.00 0.00 174.62 173.44 1xgu s VAL 115 N 2.00 5.28 -0.02 3.82 1.01 -1.26 -1.56 120.40 129.67 1xgu s VAL 115 Ca 0.11 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.22 1xgu s VAL 115 Cb -0.17 -3.33 0.02 0.00 0.00 0.00 0.00 36.38 32.90 1xgu s VAL 115 CO 0.12 0.55 0.00 -0.44 0.00 0.00 0.00 175.10 175.33 1xgu s SER 116 N -0.48 0.29 0.04 3.32 0.01 -0.33 -4.98 113.70 111.58 1xgu s SER 116 Ca 0.12 -0.01 0.06 0.00 1.31 0.00 0.00 55.95 57.42 1xgu s SER 116 Cb -0.12 -0.14 -0.03 0.00 0.21 0.00 0.00 66.02 65.94 1xgu s SER 116 CO 0.02 -0.08 -0.14 -0.51 0.41 0.00 0.00 173.24 172.95 1xgu s ILE 117 N 0.78 3.13 -0.02 1.44 2.07 -1.26 -0.31 121.20 127.03 1xgu s ILE 117 Ca -0.07 -1.09 0.02 0.00 -1.41 0.00 0.00 60.65 58.09 1xgu s ILE 117 Cb -0.11 -2.36 0.00 0.00 0.13 0.00 0.00 42.46 40.13 1xgu s ILE 117 CO -0.02 0.31 -0.06 -0.36 -1.91 0.00 0.00 174.94 172.90 1xgu s PHE 118 N -1.00 0.65 0.76 3.50 0.40 0.27 -4.98 117.98 117.57 1xgu s PHE 118 Ca 0.17 -0.14 -0.11 0.00 -0.60 0.00 0.00 56.93 56.24 1xgu s PHE 118 Cb -0.11 -0.48 0.05 0.00 0.51 0.00 0.00 43.02 42.99 1xgu s PHE 118 CO 0.07 -0.07 1.13 -2.14 0.70 0.00 0.00 175.22 174.91 1xgu s PRO 119 N 0.22 2.36 0.35 0.24 0.02 -1.26 -1.46 135.00 135.48 1xgu s PRO 119 Ca -0.03 0.23 -0.28 0.00 0.02 0.00 0.00 61.00 60.94 1xgu s PRO 119 Cb -0.07 -2.00 -0.10 0.00 0.02 0.00 0.00 34.50 32.35 1xgu s PRO 119 CO -0.00 -1.33 1.36 -2.14 -0.33 0.00 0.00 177.00 174.56 1xgu s PRO 120 N -5.46 4.25 0.70 5.54 0.02 -1.19 -4.79 135.00 134.07 1xgu s PRO 120 Ca 0.60 2.31 -0.12 0.00 0.02 0.00 0.00 61.00 63.82 1xgu s PRO 120 Cb -0.11 -3.01 0.01 0.00 0.02 0.00 0.00 34.50 31.41 1xgu s PRO 120 CO 0.50 -0.31 1.07 -1.54 -0.33 0.00 0.00 177.00 176.38 1xgu s SER 121 N -0.41 5.21 0.35 2.53 1.04 -1.26 -4.89 113.70 116.26 1xgu s SER 121 Ca 0.51 1.73 0.03 0.00 0.48 0.00 0.00 55.95 58.69 1xgu s SER 121 Cb -0.42 -2.51 0.64 0.00 0.10 0.00 0.00 66.02 63.83 1xgu s SER 121 CO 0.55 -1.56 1.98 0.28 0.98 0.00 0.00 173.24 175.47 1xgu h SER 122 N -0.58 0.66 -0.05 7.02 0.02 -1.99 -2.14 113.55 116.48 1xgu h SER 122 Ca -0.44 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1xgu h SER 122 Cb 1.22 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.59 1xgu h SER 122 CO 0.55 0.53 0.03 -0.33 -1.14 0.00 0.00 176.83 176.47 1xgu h GLU 123 N 0.75 0.07 -0.72 3.45 3.07 -1.99 -1.53 114.58 117.70 1xgu h GLU 123 Ca 0.19 -0.01 -0.05 0.00 -0.50 0.00 0.00 59.36 59.00 1xgu h GLU 123 Cb 0.02 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 27.88 1xgu h GLU 123 CO -0.03 0.14 0.26 0.37 -1.40 0.00 0.00 179.01 178.34 1xgu h GLN 124 N -0.01 1.09 -0.94 2.33 4.15 -1.78 -2.54 115.11 117.41 1xgu h GLN 124 Ca 0.02 -0.22 0.02 0.00 0.77 0.00 0.00 58.65 59.25 1xgu h GLN 124 Cb 0.09 -0.17 -0.05 0.00 0.21 0.00 0.00 27.48 27.56 1xgu h GLN 124 CO -0.00 0.92 0.62 -0.07 -1.93 0.00 0.00 178.83 178.36 1xgu h LEU 125 N 1.04 1.05 -1.25 -2.39 3.38 -1.23 -1.00 115.31 114.91 1xgu h LEU 125 Ca 0.24 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.22 1xgu h LEU 125 Cb 0.25 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1xgu h LEU 125 CO -0.01 0.74 0.52 0.74 0.09 0.00 0.00 178.44 180.51 1xgu h THR 126 N 1.23 1.14 -0.02 0.22 2.02 -0.88 0.46 112.91 117.07 1xgu h THR 126 Ca 0.36 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 67.20 1xgu h THR 126 Cb -0.06 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.41 1xgu h THR 126 CO -0.10 0.18 0.00 -1.54 0.37 0.00 0.00 175.52 174.43 1xgu n SER 127 N -4.44 0.23 0.00 4.18 3.41 -0.49 -4.89 113.62 111.62 1xgu n SER 127 Ca 0.10 -1.38 0.00 0.00 -0.26 0.00 0.00 58.87 57.33 1xgu n SER 127 Cb 0.10 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 1xgu n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xgu n GLY 128 N 0.88 0.62 3.59 5.00 0.00 0.15 -5.05 105.19 110.38 1xgu n GLY 128 Ca 0.16 -0.36 -0.27 0.00 0.00 0.00 0.00 46.02 45.55 1xgu n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xgu s GLY 129 N -2.33 2.43 -0.29 -0.02 0.00 -0.52 -2.09 107.32 104.51 1xgu s GLY 129 Ca 0.00 -2.26 0.03 0.00 0.00 0.00 0.00 44.72 42.48 1xgu s GLY 129 CO 0.00 -2.06 0.56 0.00 0.00 0.00 0.00 173.10 171.59 1xgu s ALA 130 N -2.76 -2.13 -0.15 3.20 0.00 -0.52 -2.87 121.76 116.52 1xgu s ALA 130 Ca 0.35 1.22 -0.04 0.00 0.00 0.00 0.00 51.96 53.49 1xgu s ALA 130 Cb 0.09 -2.31 -0.03 0.00 0.00 0.00 0.00 23.12 20.88 1xgu s ALA 130 CO 0.18 -1.62 -0.03 -1.12 0.00 0.00 0.00 175.76 173.17 1xgu s SER 131 N 2.79 4.85 -0.22 0.00 0.01 -1.26 -0.05 113.70 119.82 1xgu s SER 131 Ca 0.14 -0.11 -0.07 0.00 1.31 0.00 0.00 55.95 57.22 1xgu s SER 131 Cb -0.12 -1.77 -0.03 0.00 0.21 0.00 0.00 66.02 64.31 1xgu s SER 131 CO -0.24 0.18 0.05 -0.69 0.41 0.00 0.00 173.24 172.95 1xgu s VAL 132 N 0.29 4.37 -0.08 3.43 1.01 0.19 -3.17 120.40 126.45 1xgu s VAL 132 Ca -0.03 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.79 1xgu s VAL 132 Cb -0.14 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.21 1xgu s VAL 132 CO 0.03 0.39 -0.08 -0.69 0.00 0.00 0.00 175.10 174.75 1xgu s VAL 133 N 1.11 3.61 -0.08 2.92 1.01 -0.53 -0.47 120.40 127.96 1xgu s VAL 133 Ca 0.04 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1xgu s VAL 133 Cb -0.14 -2.48 0.02 0.00 0.00 0.00 0.00 36.38 33.78 1xgu s VAL 133 CO 0.03 0.59 -0.06 0.00 0.00 0.00 0.00 175.10 175.65 1xgu s PHE 135 N 1.35 3.20 -0.35 0.00 0.08 0.57 -0.76 117.98 122.07 1xgu s PHE 135 Ca -0.03 0.11 0.01 0.00 0.12 0.00 0.00 56.93 57.14 1xgu s PHE 135 Cb -0.14 -1.90 0.11 0.00 -0.57 0.00 0.00 43.02 40.52 1xgu s PHE 135 CO -0.03 0.33 0.12 -0.51 -0.10 0.00 0.00 175.22 175.03 1xgu s LEU 136 N -0.39 3.02 0.12 -0.37 1.02 0.40 -1.18 118.68 121.29 1xgu s LEU 136 Ca 0.08 -2.00 0.06 0.00 0.02 0.00 0.00 54.13 52.29 1xgu s LEU 136 Cb -0.12 -1.11 -0.04 0.00 0.02 0.00 0.00 46.19 44.94 1xgu s LEU 136 CO 0.02 -0.37 -0.01 0.20 0.02 0.00 0.00 176.35 176.21 1xgu s ASN 137 N 1.14 4.90 -1.15 2.29 0.01 -0.60 0.14 114.94 121.66 1xgu s ASN 137 Ca 0.12 -0.26 -0.22 0.00 -0.71 0.00 0.00 52.86 51.78 1xgu s ASN 137 Cb -0.19 -1.11 -0.00 0.00 0.41 0.00 0.00 41.25 40.35 1xgu s ASN 137 CO -0.15 0.15 0.78 0.59 -1.51 0.00 0.00 177.10 176.95 1xgu n ASN 138 N 0.34 -5.17 -4.63 -1.22 4.13 -0.90 -1.37 115.26 106.43 1xgu n ASN 138 Ca -0.11 -1.05 -0.25 0.00 1.68 0.00 0.00 54.58 54.86 1xgu n ASN 138 Cb 0.53 -3.20 -0.09 0.00 -1.54 0.00 0.00 39.78 35.48 1xgu n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1xgu s PHE 139 N -3.47 2.53 -0.27 3.10 -0.71 0.09 -4.58 117.98 114.66 1xgu s PHE 139 Ca 0.48 -0.47 -0.23 0.00 -1.04 0.00 0.00 56.93 55.66 1xgu s PHE 139 Cb -0.18 -1.54 0.08 0.00 -1.21 0.00 0.00 43.02 40.17 1xgu s PHE 139 CO 0.87 0.46 0.76 -0.47 -1.34 0.00 0.00 175.22 175.51 1xgu s TYR 140 N -2.55 -0.80 1.21 3.49 6.14 0.13 -0.26 117.35 124.71 1xgu s TYR 140 Ca 0.35 1.84 -0.20 0.00 0.64 0.00 0.00 57.07 59.71 1xgu s TYR 140 Cb 0.01 0.36 0.29 0.00 0.42 0.00 0.00 41.96 43.05 1xgu s TYR 140 CO 0.19 -0.39 1.13 -1.25 0.64 0.00 0.00 175.55 175.87 1xgu s PRO 141 N 0.67 -1.30 0.40 4.97 0.04 -1.26 -0.51 135.00 138.01 1xgu s PRO 141 Ca -0.02 -0.16 0.13 0.00 0.04 0.00 0.00 61.00 60.99 1xgu s PRO 141 Cb -0.05 -1.60 0.84 0.00 0.04 0.00 0.00 34.50 33.73 1xgu s PRO 141 CO -0.05 -3.74 1.90 -0.22 0.04 0.00 0.00 177.00 174.93 1xgu h LYS 142 N -2.60 0.03 -6.31 4.56 1.63 -1.98 -3.44 116.57 108.46 1xgu h LYS 142 Ca -0.44 -0.01 -0.56 0.00 -0.85 0.00 0.00 60.65 58.80 1xgu h LYS 142 Cb 1.28 -0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.93 1xgu h LYS 142 CO 0.31 0.30 1.22 -0.25 -3.45 0.00 0.00 179.45 177.58 1xgu n ASP 143 N -4.21 3.91 -3.60 4.20 8.00 -1.26 -4.97 116.55 118.63 1xgu n ASP 143 Ca -0.02 0.88 -0.14 0.00 0.71 0.00 0.00 54.79 56.21 1xgu n ASP 143 Cb 0.32 -1.48 -0.06 0.00 -0.02 0.00 0.00 41.12 39.88 1xgu n ASP 143 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1xgu s ILE 144 N 4.62 0.03 -0.11 0.53 2.07 -1.26 -4.58 121.20 122.51 1xgu s ILE 144 Ca 0.91 -0.25 0.01 0.00 -1.41 0.00 0.00 60.65 59.91 1xgu s ILE 144 Cb -0.50 -0.93 0.02 0.00 0.13 0.00 0.00 42.46 41.18 1xgu s ILE 144 CO 0.44 -0.14 -0.12 0.21 -1.91 0.00 0.00 174.94 173.43 1xgu s ASN 145 N -1.74 2.24 -0.15 4.50 3.84 -0.65 -5.00 114.94 117.99 1xgu s ASN 145 Ca -0.07 -0.36 -0.00 0.00 0.21 0.00 0.00 52.86 52.63 1xgu s ASN 145 Cb -0.01 -0.96 -0.01 0.00 -0.55 0.00 0.00 41.25 39.72 1xgu s ASN 145 CO 0.01 -0.04 -0.14 0.54 -2.79 0.00 0.00 177.10 174.68 1xgu s VAL 146 N 1.26 2.84 -0.07 -5.21 0.11 -1.26 -0.32 120.40 117.74 1xgu s VAL 146 Ca -0.02 -0.72 0.05 0.00 -2.93 0.00 0.00 61.98 58.36 1xgu s VAL 146 Cb -0.14 -2.20 -0.00 0.00 -1.53 0.00 0.00 36.38 32.51 1xgu s VAL 146 CO -0.04 0.51 -0.24 -0.75 -3.33 0.00 0.00 175.10 171.25 1xgu s LYS 147 N 0.67 2.67 0.02 1.54 2.20 0.59 -4.95 119.74 122.49 1xgu s LYS 147 Ca -0.07 -0.86 -0.01 0.00 -0.36 0.00 0.00 55.97 54.67 1xgu s LYS 147 Cb -0.16 -2.15 -0.04 0.00 -1.51 0.00 0.00 37.83 33.97 1xgu s LYS 147 CO 0.02 0.28 0.19 -1.58 -0.36 0.00 0.00 175.35 173.90 1xgu s TRP 148 N 0.08 3.53 -0.03 4.03 0.52 -1.26 -0.35 118.94 125.46 1xgu s TRP 148 Ca -0.10 0.30 -0.02 0.00 0.02 0.00 0.00 56.10 56.30 1xgu s TRP 148 Cb -0.15 -1.79 0.02 0.00 -1.15 0.00 0.00 33.47 30.39 1xgu s TRP 148 CO 0.06 0.62 0.07 0.15 0.02 0.00 0.00 176.95 177.87 1xgu s LYS 149 N -2.20 0.05 -0.17 4.98 1.02 -0.41 -0.80 119.74 122.22 1xgu s LYS 149 Ca 0.31 0.18 0.01 0.00 0.02 0.00 0.00 55.97 56.49 1xgu s LYS 149 Cb -0.13 -0.09 0.02 0.00 -0.52 0.00 0.00 37.83 37.11 1xgu s LYS 149 CO 0.23 -0.09 -0.19 0.42 -0.92 0.00 0.00 175.35 174.80 1xgu s ILE 150 N 0.58 1.93 -1.51 2.17 1.01 0.13 -0.66 121.20 124.84 1xgu s ILE 150 Ca -0.05 -0.87 -0.14 0.00 0.00 0.00 0.00 60.65 59.60 1xgu s ILE 150 Cb -0.06 -1.75 0.10 0.00 0.01 0.00 0.00 42.46 40.75 1xgu s ILE 150 CO -0.02 0.52 0.80 0.47 0.00 0.00 0.00 174.94 176.70 1xgu n ASP 151 N 4.57 -4.26 0.00 3.58 8.00 -0.26 -0.93 116.55 127.26 1xgu n ASP 151 Ca -0.20 -0.71 0.00 0.00 0.71 0.00 0.00 54.79 54.59 1xgu n ASP 151 Cb 0.50 -3.45 0.00 0.00 -0.02 0.00 0.00 41.12 38.15 1xgu n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xgu n GLY 152 N -1.48 0.93 3.55 0.44 0.00 -1.26 -5.03 105.19 102.34 1xgu n GLY 152 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1xgu n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xgu s SER 153 N -2.97 5.03 0.26 1.61 0.01 -0.10 -5.05 113.70 112.49 1xgu s SER 153 Ca 0.00 -0.05 -0.30 0.00 1.31 0.00 0.00 55.95 56.91 1xgu s SER 153 Cb 0.00 -1.79 -0.11 0.00 0.21 0.00 0.00 66.02 64.33 1xgu s SER 153 CO 0.00 0.19 1.58 -0.70 0.41 0.00 0.00 173.24 174.72 1xgu s GLU 154 N 0.22 4.16 -0.12 12.44 2.12 -1.26 -0.70 118.70 135.57 1xgu s GLU 154 Ca -0.01 2.51 0.03 0.00 0.36 0.00 0.00 54.97 57.87 1xgu s GLU 154 Cb -0.13 -3.06 0.01 0.00 0.26 0.00 0.00 34.13 31.20 1xgu s GLU 154 CO 0.02 -0.60 -0.22 0.50 -0.54 0.00 0.00 175.26 174.41 1xgu s ARG 155 N -0.13 2.97 -0.10 4.30 6.06 0.02 -4.88 118.95 127.19 1xgu s ARG 155 Ca 0.64 -0.84 0.02 0.00 -2.50 0.00 0.00 55.73 53.05 1xgu s ARG 155 Cb -0.47 -2.33 -0.08 0.00 0.06 0.00 0.00 34.95 32.13 1xgu s ARG 155 CO 0.44 0.07 -0.07 1.04 -2.50 0.00 0.00 175.30 174.28 1xgu n GLN 156 N 3.82 0.81 -2.34 5.12 6.02 -1.26 -4.23 117.38 125.33 1xgu n GLN 156 Ca -0.20 0.05 -0.39 0.00 -0.01 0.00 0.00 57.00 56.45 1xgu n GLN 156 Cb 0.52 -1.22 -0.03 0.00 1.02 0.00 0.00 30.24 30.53 1xgu n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1xgu s ASN 157 N -4.83 6.89 0.00 1.08 0.01 -1.26 -3.17 114.94 113.66 1xgu s ASN 157 Ca -0.12 2.37 0.00 0.00 -0.71 0.00 0.00 52.86 54.40 1xgu s ASN 157 Cb 0.04 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 39.07 1xgu s ASN 157 CO 0.28 -0.42 0.00 0.61 -1.51 0.00 0.00 177.10 176.05 1xgu n GLY 158 N 0.87 0.92 3.71 0.66 0.00 -1.26 -4.86 105.19 105.23 1xgu n GLY 158 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1xgu n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xgu s VAL 159 N -3.16 5.27 -0.06 1.61 1.01 -1.19 -0.85 120.40 123.03 1xgu s VAL 159 Ca 0.00 0.60 0.02 0.00 0.00 0.00 0.00 61.98 62.61 1xgu s VAL 159 Cb 0.00 -3.67 0.01 0.00 0.00 0.00 0.00 36.38 32.72 1xgu s VAL 159 CO 0.00 0.35 -0.12 -0.76 0.00 0.00 0.00 175.10 174.57 1xgu s LEU 160 N 0.73 1.67 0.17 3.92 1.43 0.23 -4.97 118.68 121.86 1xgu s LEU 160 Ca 0.17 -0.28 0.09 0.00 -1.03 0.00 0.00 54.13 53.09 1xgu s LEU 160 Cb -0.14 -0.77 -0.04 0.00 0.03 0.00 0.00 46.19 45.27 1xgu s LEU 160 CO 0.05 0.04 -0.14 0.20 0.23 0.00 0.00 176.35 176.74 1xgu s ASN 161 N 0.55 4.05 -0.01 2.29 0.01 -1.26 -0.62 114.94 119.95 1xgu s ASN 161 Ca -0.12 -0.61 -0.00 0.00 -0.71 0.00 0.00 52.86 51.42 1xgu s ASN 161 Cb -0.14 -0.62 0.02 0.00 0.41 0.00 0.00 41.25 40.92 1xgu s ASN 161 CO 0.03 0.12 0.02 -0.55 -1.51 0.00 0.00 177.10 175.21 1xgu s SER 162 N -2.64 0.03 0.01 -1.22 0.15 -0.06 -5.01 113.70 104.96 1xgu s SER 162 Ca 0.23 0.03 0.08 0.00 0.70 0.00 0.00 55.95 56.99 1xgu s SER 162 Cb -0.09 -0.02 -0.02 0.00 -1.71 0.00 0.00 66.02 64.18 1xgu s SER 162 CO 0.13 -0.07 -0.26 0.26 1.20 0.00 0.00 173.24 174.51 1xgu s TRP 163 N 0.53 2.28 0.51 3.44 0.51 -1.26 -1.02 118.94 123.93 1xgu s TRP 163 Ca -0.04 -0.42 -0.01 0.00 -2.12 0.00 0.00 56.10 53.50 1xgu s TRP 163 Cb -0.06 -1.42 0.01 0.00 -0.81 0.00 0.00 33.47 31.19 1xgu s TRP 163 CO -0.02 0.03 0.76 0.95 -0.51 0.00 0.00 176.95 178.17 1xgu s THR 164 N -0.69 3.59 0.73 2.01 -4.23 -0.87 -5.03 115.64 111.15 1xgu s THR 164 Ca 0.10 -0.40 -0.12 0.00 -1.18 0.00 0.00 61.69 60.10 1xgu s THR 164 Cb -0.10 -3.36 0.03 0.00 1.34 0.00 0.00 72.50 70.41 1xgu s THR 164 CO 0.00 -0.29 1.12 -1.81 -0.54 0.00 0.00 174.62 173.10 1xgu s ASP 165 N -4.29 5.19 0.01 3.99 1.01 -1.26 -4.61 116.67 116.71 1xgu s ASP 165 Ca 0.52 1.05 -0.35 0.00 0.71 0.00 0.00 52.55 54.47 1xgu s ASP 165 Cb -0.10 -1.77 -0.14 0.00 1.01 0.00 0.00 42.92 41.92 1xgu s ASP 165 CO 0.40 -1.50 1.63 1.67 0.21 0.00 0.00 175.17 177.58 1xgu n GLN 166 N -3.10 1.79 -1.68 8.23 7.27 -1.26 -4.75 117.38 123.88 1xgu n GLN 166 Ca 0.07 0.65 -0.45 0.00 0.07 0.00 0.00 57.00 57.34 1xgu n GLN 166 Cb 0.58 -2.40 -0.04 0.00 2.41 0.00 0.00 30.24 30.79 1xgu n GLN 166 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1xgu n ASP 167 N 4.36 3.70 0.23 1.69 4.64 0.60 -4.89 116.55 126.88 1xgu n ASP 167 Ca 0.20 0.97 0.07 0.00 -1.38 0.00 0.00 54.79 54.65 1xgu n ASP 167 Cb 0.24 -1.45 0.57 0.00 -1.04 0.00 0.00 41.12 39.44 1xgu n ASP 167 CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 1xgu h SER 168 N 9.02 0.03 -0.01 1.67 0.02 -1.90 0.13 113.55 122.51 1xgu h SER 168 Ca -0.48 -0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.29 1xgu h SER 168 Cb 1.25 -0.01 0.01 0.00 0.14 0.00 0.00 62.40 63.80 1xgu h SER 168 CO 0.94 0.10 -0.68 0.11 -1.14 0.00 0.00 176.83 176.16 1xgu h LYS 169 N 0.04 0.48 0.00 3.45 1.57 -1.97 -3.41 116.57 116.73 1xgu h LYS 169 Ca 0.01 -0.50 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1xgu h LYS 169 Cb 0.13 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1xgu h LYS 169 CO 0.01 1.14 0.00 -0.40 -0.57 0.00 0.00 179.45 179.63 1xgu n ASP 170 N -4.15 0.32 -0.92 0.86 5.68 -1.20 -5.02 116.55 112.12 1xgu n ASP 170 Ca -0.10 -1.12 -0.12 0.00 -0.50 0.00 0.00 54.79 52.94 1xgu n ASP 170 Cb 0.71 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.63 1xgu n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1xgu n SER 171 N -0.06 -4.77 -3.85 -1.12 7.64 0.43 -4.99 113.62 106.90 1xgu n SER 171 Ca 0.00 0.30 -0.15 0.00 1.01 0.00 0.00 58.87 60.02 1xgu n SER 171 Cb 0.36 -3.33 0.07 0.00 -1.01 0.00 0.00 64.21 60.31 1xgu n SER 171 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1xgu n THR 172 N -2.54 0.00 -4.30 0.44 -2.24 -1.26 -4.62 114.28 99.75 1xgu n THR 172 Ca -0.12 -1.17 -0.21 0.00 -2.27 0.00 0.00 64.05 60.29 1xgu n THR 172 Cb 0.45 -0.93 -0.11 0.00 -2.10 0.00 0.00 70.33 67.63 1xgu n THR 172 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1xgu s TYR 173 N -1.92 1.70 0.08 4.78 2.02 0.65 -0.29 117.35 124.37 1xgu s TYR 173 Ca 0.45 -0.49 0.03 0.00 -0.37 0.00 0.00 57.07 56.69 1xgu s TYR 173 Cb -0.03 -0.86 -0.03 0.00 -0.40 0.00 0.00 41.96 40.64 1xgu s TYR 173 CO 0.30 0.27 -0.10 -1.12 -1.57 0.00 0.00 175.55 173.33 1xgu s SER 174 N -2.55 1.31 -0.00 2.29 0.01 -1.26 -0.74 113.70 112.76 1xgu s SER 174 Ca 0.13 -0.77 -0.07 0.00 1.31 0.00 0.00 55.95 56.56 1xgu s SER 174 Cb -0.06 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.19 1xgu s SER 174 CO 0.05 -0.26 0.13 -0.32 0.41 0.00 0.00 173.24 173.26 1xgu s MET 175 N -2.58 0.45 -0.07 12.44 1.75 0.12 -2.04 119.30 129.37 1xgu s MET 175 Ca 0.02 -0.36 0.03 0.00 -1.25 0.00 0.00 55.69 54.13 1xgu s MET 175 Cb -0.04 0.19 0.01 0.00 2.84 0.00 0.00 34.83 37.83 1xgu s MET 175 CO -0.00 -0.10 -0.14 0.45 -0.65 0.00 0.00 175.02 174.57 1xgu s SER 176 N -1.27 2.00 -0.10 1.11 0.15 -0.19 -0.46 113.70 114.94 1xgu s SER 176 Ca -0.14 -0.34 0.01 0.00 0.70 0.00 0.00 55.95 56.19 1xgu s SER 176 Cb -0.07 -0.90 0.02 0.00 -1.71 0.00 0.00 66.02 63.35 1xgu s SER 176 CO 0.01 0.06 -0.13 -0.55 1.20 0.00 0.00 173.24 173.84 1xgu s SER 177 N 0.57 2.19 -0.08 5.45 0.15 0.06 -0.88 113.70 121.16 1xgu s SER 177 Ca -0.15 -0.37 0.04 0.00 0.70 0.00 0.00 55.95 56.18 1xgu s SER 177 Cb -0.16 -0.96 0.00 0.00 -1.71 0.00 0.00 66.02 63.19 1xgu s SER 177 CO 0.04 -0.01 -0.21 -0.89 1.20 0.00 0.00 173.24 173.38 1xgu s THR 178 N 1.04 1.79 -0.31 6.45 2.01 0.21 -0.72 115.64 126.12 1xgu s THR 178 Ca -0.06 -0.87 -0.07 0.00 0.31 0.00 0.00 61.69 60.99 1xgu s THR 178 Cb -0.15 -1.56 0.02 0.00 0.01 0.00 0.00 72.50 70.82 1xgu s THR 178 CO -0.02 0.50 0.10 -0.22 -0.69 0.00 0.00 174.62 174.29 1xgu s LEU 179 N 0.36 4.02 -0.20 4.42 2.96 0.38 -0.60 118.68 130.01 1xgu s LEU 179 Ca -0.16 -0.82 -0.05 0.00 -0.22 0.00 0.00 54.13 52.88 1xgu s LEU 179 Cb -0.17 -1.89 -0.02 0.00 0.50 0.00 0.00 46.19 44.61 1xgu s LEU 179 CO 0.07 -0.23 0.01 -0.89 -1.32 0.00 0.00 176.35 173.98 1xgu s THR 180 N 1.48 4.01 0.38 3.68 2.01 -0.03 0.56 115.64 127.74 1xgu s THR 180 Ca 0.02 -0.29 0.04 0.00 0.31 0.00 0.00 61.69 61.76 1xgu s THR 180 Cb -0.18 -2.82 -0.03 0.00 0.01 0.00 0.00 72.50 69.48 1xgu s THR 180 CO 0.03 0.42 0.12 -0.76 -0.69 0.00 0.00 174.62 173.74 1xgu s LEU 181 N 1.04 1.99 0.57 4.42 1.43 0.92 -4.66 118.68 124.40 1xgu s LEU 181 Ca 0.02 -1.61 -0.03 0.00 -1.03 0.00 0.00 54.13 51.48 1xgu s LEU 181 Cb -0.14 -0.13 0.02 0.00 0.03 0.00 0.00 46.19 45.97 1xgu s LEU 181 CO 0.02 -0.87 0.84 0.42 0.23 0.00 0.00 176.35 176.98 1xgu s THR 182 N -3.26 3.24 0.20 5.49 -4.23 -1.26 -1.44 115.64 114.37 1xgu s THR 182 Ca 0.27 -0.33 -0.11 0.00 -1.18 0.00 0.00 61.69 60.34 1xgu s THR 182 Cb 0.04 -3.27 0.14 0.00 1.34 0.00 0.00 72.50 70.75 1xgu s THR 182 CO 0.15 -0.23 1.87 0.50 -0.54 0.00 0.00 174.62 176.36 1xgu h LYS 183 N -0.06 0.94 -0.45 3.99 3.64 -1.61 -1.72 116.57 121.31 1xgu h LYS 183 Ca -0.45 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 58.89 1xgu h LYS 183 Cb 1.28 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.86 1xgu h LYS 183 CO 0.58 0.63 0.28 -0.44 -2.27 0.00 0.00 179.45 178.22 1xgu h ASP 184 N 0.97 0.46 0.08 4.20 3.45 -1.94 -0.65 116.42 122.99 1xgu h ASP 184 Ca 0.26 -0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.71 1xgu h ASP 184 Cb -0.11 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 38.56 1xgu h ASP 184 CO -0.06 0.33 -0.04 -0.33 -1.57 0.00 0.00 179.24 177.58 1xgu h GLU 185 N 0.56 -0.11 -0.69 3.56 5.08 -1.89 -2.58 114.58 118.51 1xgu h GLU 185 Ca 0.17 0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.65 1xgu h GLU 185 Cb -0.02 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.17 1xgu h GLU 185 CO -0.06 0.00 0.28 -0.92 -1.00 0.00 0.00 179.01 177.31 1xgu h TYR 186 N -0.19 0.49 0.00 4.33 3.20 -1.10 -1.07 116.97 122.63 1xgu h TYR 186 Ca -0.01 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1xgu h TYR 186 Cb 0.16 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.31 1xgu h TYR 186 CO -0.05 0.12 0.00 0.39 -1.64 0.00 0.00 178.16 176.98 1xgu n GLU 187 N -4.97 0.39 0.07 1.82 1.02 -0.27 -2.63 120.64 116.06 1xgu n GLU 187 Ca 0.11 0.05 0.12 0.00 -0.02 0.00 0.00 57.16 57.43 1xgu n GLU 187 Cb 0.33 -1.50 0.17 0.00 -0.02 0.00 0.00 31.44 30.42 1xgu n GLU 187 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xgu h ARG 188 N 0.00 0.00 -5.87 3.49 3.08 -0.79 -3.48 114.38 110.82 1xgu h ARG 188 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1xgu h ARG 188 Cb 0.20 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.13 1xgu h ARG 188 CO 0.00 0.00 -0.62 -1.01 -1.07 0.00 0.00 179.97 177.27 1xgu s HIS 189 N -3.17 2.50 -0.06 3.04 3.76 -1.08 -5.10 115.29 115.18 1xgu s HIS 189 Ca 0.06 -0.55 -0.07 0.00 -0.15 0.00 0.00 55.06 54.35 1xgu s HIS 189 Cb 0.13 -1.60 -0.04 0.00 1.11 0.00 0.00 32.58 32.18 1xgu s HIS 189 CO 0.72 0.47 -0.15 -1.71 -0.85 0.00 0.00 174.74 173.21 1xgu n ASN 190 N -0.94 1.22 -4.71 1.40 5.15 -1.26 -4.77 115.26 111.35 1xgu n ASN 190 Ca -0.04 0.19 -0.37 0.00 -0.60 0.00 0.00 54.58 53.76 1xgu n ASN 190 Cb 0.64 -0.45 -0.08 0.00 -0.53 0.00 0.00 39.78 39.37 1xgu n ASN 190 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1xgu s SER 191 N -6.02 6.37 -0.14 1.20 1.04 -1.26 -1.07 113.70 113.81 1xgu s SER 191 Ca -0.14 0.42 0.02 0.00 0.48 0.00 0.00 55.95 56.73 1xgu s SER 191 Cb 0.04 -2.17 0.01 0.00 0.10 0.00 0.00 66.02 63.99 1xgu s SER 191 CO 0.20 0.07 -0.20 -0.31 0.98 0.00 0.00 173.24 173.98 1xgu s TYR 192 N 0.68 2.70 -0.03 5.02 1.51 -0.62 -1.10 117.35 125.52 1xgu s TYR 192 Ca 0.15 -1.22 0.04 0.00 -1.01 0.00 0.00 57.07 55.02 1xgu s TYR 192 Cb -0.13 -1.84 -0.00 0.00 -0.11 0.00 0.00 41.96 39.88 1xgu s TYR 192 CO 0.04 -0.55 -0.13 0.99 -1.11 0.00 0.00 175.55 174.79 1xgu s THR 193 N 0.79 1.07 -0.24 -0.71 2.01 0.16 -2.30 115.64 116.42 1xgu s THR 193 Ca -0.07 -0.54 -0.03 0.00 0.31 0.00 0.00 61.69 61.36 1xgu s THR 193 Cb -0.16 -0.92 0.01 0.00 0.01 0.00 0.00 72.50 71.45 1xgu s THR 193 CO -0.01 0.31 -0.05 0.00 -0.69 0.00 0.00 174.62 174.19 1xgu s GLU 195 N 1.39 3.36 -0.18 0.00 2.02 0.53 -1.44 118.70 124.38 1xgu s GLU 195 Ca 0.02 -0.68 -0.00 0.00 0.02 0.00 0.00 54.97 54.33 1xgu s GLU 195 Cb -0.16 -2.70 0.01 0.00 0.10 0.00 0.00 34.13 31.38 1xgu s GLU 195 CO -0.04 0.11 -0.16 0.00 0.02 0.00 0.00 175.26 175.20 1xgu s ALA 196 N 0.62 2.46 -0.21 5.21 0.00 0.41 -0.30 121.76 129.95 1xgu s ALA 196 Ca -0.07 -1.15 -0.07 0.00 0.00 0.00 0.00 51.96 50.67 1xgu s ALA 196 Cb -0.15 -1.28 -0.03 0.00 0.00 0.00 0.00 23.12 21.65 1xgu s ALA 196 CO 0.03 -0.25 0.05 0.99 0.00 0.00 0.00 175.76 176.58 1xgu s THR 197 N 1.16 4.42 0.02 0.00 2.01 0.56 -0.09 115.64 123.71 1xgu s THR 197 Ca 0.01 -0.15 -0.06 0.00 0.31 0.00 0.00 61.69 61.81 1xgu s THR 197 Cb -0.14 -3.02 -0.01 0.00 0.01 0.00 0.00 72.50 69.34 1xgu s THR 197 CO -0.07 0.40 0.10 -2.28 -0.69 0.00 0.00 174.62 172.09 1xgu s HIS 198 N 1.00 0.13 0.57 4.92 2.46 -1.26 -1.63 115.29 121.48 1xgu s HIS 198 Ca 0.03 -0.32 0.31 0.00 0.47 0.00 0.00 55.06 55.55 1xgu s HIS 198 Cb -0.14 -0.10 1.43 0.00 -0.13 0.00 0.00 32.58 33.64 1xgu s HIS 198 CO 0.03 -0.30 1.79 -0.22 -2.47 0.00 0.00 174.74 173.57 1xgu h LYS 199 N 4.10 0.00 0.00 2.88 3.64 -1.94 -1.73 116.57 123.53 1xgu h LYS 199 Ca -0.32 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 1xgu h LYS 199 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1xgu h LYS 199 CO 0.44 0.00 0.00 0.25 -2.27 0.00 0.00 179.45 177.87 1xgu n THR 200 N -3.85 1.27 -3.60 1.00 -2.24 -1.26 -4.76 114.28 100.85 1xgu n THR 200 Ca 0.16 0.34 -0.14 0.00 -2.27 0.00 0.00 64.05 62.14 1xgu n THR 200 Cb 0.98 -1.19 -0.07 0.00 -2.10 0.00 0.00 70.33 67.95 1xgu n THR 200 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1xgu s SER 201 N -3.15 -0.68 0.44 3.42 1.04 -0.65 -5.02 113.70 109.10 1xgu s SER 201 Ca 0.04 1.15 0.25 0.00 0.48 0.00 0.00 55.95 57.87 1xgu s SER 201 Cb 0.07 1.11 0.64 0.00 0.10 0.00 0.00 66.02 67.94 1xgu s SER 201 CO 0.20 -0.34 1.71 0.71 0.98 0.00 0.00 173.24 176.50 1xgu h THR 202 N 3.63 0.23 -3.42 2.02 1.35 -1.86 -3.40 112.91 111.46 1xgu h THR 202 Ca -0.28 -1.09 -0.61 0.00 -0.55 0.00 0.00 66.41 63.88 1xgu h THR 202 Cb 1.16 1.91 -0.13 0.00 -1.73 0.00 0.00 68.15 69.36 1xgu h THR 202 CO 0.16 0.11 -0.46 -0.94 -0.25 0.00 0.00 175.52 174.14 1xgu s SER 203 N -6.12 6.21 0.56 5.36 1.04 -1.26 -5.05 113.70 114.44 1xgu s SER 203 Ca 0.04 0.23 -0.20 0.00 0.48 0.00 0.00 55.95 56.50 1xgu s SER 203 Cb 0.07 -2.12 -0.05 0.00 0.10 0.00 0.00 66.02 64.03 1xgu s SER 203 CO 0.65 0.10 1.22 -2.16 0.98 0.00 0.00 173.24 174.03 1xgu s PRO 204 N 0.74 3.17 -0.09 4.02 0.04 -1.26 -4.89 135.00 136.72 1xgu s PRO 204 Ca 0.09 1.86 -0.27 0.00 0.04 0.00 0.00 61.00 62.72 1xgu s PRO 204 Cb -0.13 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.32 1xgu s PRO 204 CO 0.02 -1.06 0.90 0.42 0.04 0.00 0.00 177.00 177.32 1xgu s ILE 205 N -1.55 4.88 -0.16 0.56 1.01 0.87 -4.85 121.20 121.95 1xgu s ILE 205 Ca 0.74 1.83 -0.00 0.00 0.00 0.00 0.00 60.65 63.22 1xgu s ILE 205 Cb -0.31 -4.22 -0.00 0.00 0.01 0.00 0.00 42.46 37.94 1xgu s ILE 205 CO 0.35 0.09 -0.14 -0.69 0.00 0.00 0.00 174.94 174.55 1xgu s VAL 206 N 1.61 2.78 -0.07 2.92 1.01 -1.26 -0.45 120.40 126.94 1xgu s VAL 206 Ca 0.45 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.74 1xgu s VAL 206 Cb -0.18 -2.19 -0.00 0.00 0.00 0.00 0.00 36.38 34.01 1xgu s VAL 206 CO 0.19 0.50 -0.21 -0.54 0.00 0.00 0.00 175.10 175.05 1xgu s LYS 207 N 0.88 2.41 0.30 2.72 -0.14 -0.52 -5.01 119.74 120.38 1xgu s LYS 207 Ca -0.04 -0.74 -0.13 0.00 -1.36 0.00 0.00 55.97 53.70 1xgu s LYS 207 Cb -0.15 -1.94 0.01 0.00 -1.68 0.00 0.00 37.83 34.07 1xgu s LYS 207 CO -0.01 0.21 0.59 0.45 -0.76 0.00 0.00 175.35 175.83 1xgu s SER 208 N 0.22 0.07 0.00 2.83 0.15 -1.26 -0.55 113.70 115.17 1xgu s SER 208 Ca -0.11 -1.00 -0.29 0.00 0.70 0.00 0.00 55.95 55.24 1xgu s SER 208 Cb -0.15 0.68 0.07 0.00 -1.71 0.00 0.00 66.02 64.91 1xgu s SER 208 CO 0.05 -1.32 0.66 0.72 1.20 0.00 0.00 173.24 174.55 1xgu s PHE 209 N -3.48 -0.63 0.01 3.44 -0.12 -0.97 -5.02 117.98 111.21 1xgu s PHE 209 Ca 0.20 0.92 0.07 0.00 -0.05 0.00 0.00 56.93 58.08 1xgu s PHE 209 Cb -0.03 0.45 -0.03 0.00 -0.63 0.00 0.00 43.02 42.78 1xgu s PHE 209 CO 0.11 -0.67 -0.22 -0.80 -0.05 0.00 0.00 175.22 173.60 1xgu s ASN 210 N -1.59 3.49 0.45 1.98 0.01 -1.26 -1.59 114.94 116.44 1xgu s ASN 210 Ca -0.08 -0.45 0.25 0.00 -0.71 0.00 0.00 52.86 51.88 1xgu s ASN 210 Cb -0.00 -0.50 0.83 0.00 0.41 0.00 0.00 41.25 41.99 1xgu s ASN 210 CO 0.04 0.29 1.78 0.03 -1.51 0.00 0.00 177.10 177.73 1xgu h ARG 211 N 4.95 0.00 -0.00 -0.60 3.08 -1.40 -2.89 114.38 117.51 1xgu h ARG 211 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1xgu h ARG 211 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1xgu h ARG 211 CO 0.47 0.16 0.00 0.27 -1.07 0.00 0.00 179.97 179.79 1xgu n ASN 212 N -3.23 0.07 -3.88 7.04 0.23 -1.26 -4.82 115.26 109.40 1xgu n ASN 212 Ca 0.01 -1.31 -0.11 0.00 -0.53 0.00 0.00 54.58 52.64 1xgu n ASN 212 Cb 0.45 -0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.04 1xgu n ASN 212 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1xgu s GLU 213 N -1.99 0.36 0.00 -3.83 2.12 -1.09 -5.25 118.70 109.01 1xgu s GLU 213 Ca 0.34 -0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.40 1xgu s GLU 213 Cb 0.16 0.15 0.00 0.00 0.26 0.00 0.00 34.13 34.70 1xgu s GLU 213 CO 0.26 -0.08 0.00 0.00 -0.54 0.00 0.00 175.26 174.91