#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xgr s VAL 2 N 0.00 2.65 0.03 0.00 0.11 -1.26 -4.48 120.40 117.45 1xgr s VAL 2 Ca 0.00 0.58 0.01 0.00 -2.93 0.00 0.00 61.98 59.64 1xgr s VAL 2 Cb 0.00 -3.37 -0.02 0.00 -1.53 0.00 0.00 36.38 31.46 1xgr s VAL 2 CO 0.00 0.11 -0.05 -1.10 -3.33 0.00 0.00 175.10 170.73 1xgr s GLN 3 N -0.89 0.41 0.13 1.54 -0.21 0.28 -4.99 119.66 115.94 1xgr s GLN 3 Ca 0.56 -0.69 0.10 0.00 0.02 0.00 0.00 55.36 55.35 1xgr s GLN 3 Cb -0.41 -0.06 -0.04 0.00 1.00 0.00 0.00 33.01 33.50 1xgr s GLN 3 CO 0.47 -0.01 -0.25 -0.51 -2.12 0.00 0.00 175.29 172.87 1xgr s LEU 4 N -1.56 2.34 -0.16 2.90 1.02 -1.26 -1.51 118.68 120.44 1xgr s LEU 4 Ca -0.13 -0.76 -0.06 0.00 0.02 0.00 0.00 54.13 53.20 1xgr s LEU 4 Cb -0.09 -1.12 0.07 0.00 0.02 0.00 0.00 46.19 45.07 1xgr s LEU 4 CO -0.01 0.14 0.35 -1.58 0.02 0.00 0.00 176.35 175.27 1xgr s GLN 5 N -2.14 0.26 0.31 1.70 2.00 -1.09 -4.33 119.66 116.37 1xgr s GLN 5 Ca 0.13 0.85 -0.18 0.00 -2.00 0.00 0.00 55.36 54.17 1xgr s GLN 5 Cb -0.10 0.11 -0.09 0.00 0.80 0.00 0.00 33.01 33.73 1xgr s GLN 5 CO 0.06 -0.24 0.77 -1.21 -0.50 0.00 0.00 175.29 174.17 1xgr s GLU 6 N 2.20 4.13 -0.10 1.67 8.01 -1.26 -1.10 118.70 132.26 1xgr s GLU 6 Ca -0.03 0.81 -0.20 0.00 0.01 0.00 0.00 54.97 55.57 1xgr s GLU 6 Cb -0.11 -2.54 0.05 0.00 -4.31 0.00 0.00 34.13 27.22 1xgr s GLU 6 CO -0.11 0.20 0.48 -1.54 0.01 0.00 0.00 175.26 174.30 1xgr s SER 7 N -2.06 -0.45 0.00 -0.19 1.04 0.98 -4.91 113.70 108.11 1xgr s SER 7 Ca 0.52 0.63 0.00 0.00 0.48 0.00 0.00 55.95 57.58 1xgr s SER 7 Cb -0.12 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.67 1xgr s SER 7 CO 0.18 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.64 1xgr n GLY 8 N 1.83 1.81 3.65 7.32 0.00 -1.26 0.84 105.19 119.38 1xgr n GLY 8 Ca -0.18 -1.16 -0.47 0.00 0.00 0.00 0.00 46.02 44.22 1xgr n GLY 8 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1xgr n PRO 9 N -1.05 1.94 0.01 1.61 -0.02 -1.25 -4.85 135.00 131.39 1xgr n PRO 9 Ca 0.00 0.70 0.13 0.00 -2.02 0.00 0.00 63.50 62.30 1xgr n PRO 9 Cb 0.00 -2.43 0.34 0.00 -0.02 0.00 0.00 33.50 31.39 1xgr n PRO 9 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1xgr n SER 10 N 3.13 0.41 -4.07 2.55 3.41 -1.26 -4.80 113.62 112.99 1xgr n SER 10 Ca 0.17 0.03 -0.26 0.00 -0.26 0.00 0.00 58.87 58.54 1xgr n SER 10 Cb 0.27 0.01 -0.17 0.00 -0.26 0.00 0.00 64.21 64.06 1xgr n SER 10 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1xgr s LEU 11 N -3.23 1.75 -0.02 1.04 2.96 -1.26 -0.69 118.68 119.23 1xgr s LEU 11 Ca 0.11 -0.36 0.02 0.00 -0.22 0.00 0.00 54.13 53.68 1xgr s LEU 11 Cb 0.17 -0.95 0.00 0.00 0.50 0.00 0.00 46.19 45.91 1xgr s LEU 11 CO 0.66 0.06 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.99 1xgr s VAL 12 N 0.58 0.58 0.26 1.68 1.01 -0.21 -4.96 120.40 119.35 1xgr s VAL 12 Ca -0.15 -0.26 -0.17 0.00 0.00 0.00 0.00 61.98 61.39 1xgr s VAL 12 Cb -0.16 -0.52 -0.08 0.00 0.00 0.00 0.00 36.38 35.61 1xgr s VAL 12 CO 0.05 0.19 0.72 -0.54 0.00 0.00 0.00 175.10 175.51 1xgr s LYS 13 N 0.15 4.13 0.44 2.72 1.02 -1.25 -1.30 119.74 125.63 1xgr s LYS 13 Ca -0.02 0.76 -0.23 0.00 0.02 0.00 0.00 55.97 56.50 1xgr s LYS 13 Cb -0.06 -2.69 -0.11 0.00 -0.52 0.00 0.00 37.83 34.45 1xgr s LYS 13 CO -0.00 0.30 0.85 -2.30 -0.92 0.00 0.00 175.35 173.28 1xgr n PRO 14 N 0.26 1.04 0.00 -1.68 -0.02 -1.26 -1.56 135.00 131.79 1xgr n PRO 14 Ca -0.00 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1xgr n PRO 14 Cb 0.52 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1xgr n PRO 14 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1xgr n SER 15 N 0.64 0.00 -3.16 2.55 3.41 0.62 -4.92 113.62 112.76 1xgr n SER 15 Ca 0.11 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.58 1xgr n SER 15 Cb 0.40 -0.09 0.09 0.00 -0.26 0.00 0.00 64.21 64.35 1xgr n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xgr n GLN 16 N -1.94 -0.24 -4.06 4.33 1.13 -0.60 -3.78 117.38 112.21 1xgr n GLN 16 Ca 0.00 -1.24 -0.35 0.00 -1.94 0.00 0.00 57.00 53.46 1xgr n GLN 16 Cb 0.00 -0.54 -0.08 0.00 0.11 0.00 0.00 30.24 29.72 1xgr n GLN 16 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1xgr s THR 17 N -2.04 4.89 -0.13 5.09 2.01 -1.26 -2.28 115.64 121.92 1xgr s THR 17 Ca 0.37 -0.01 -0.15 0.00 0.31 0.00 0.00 61.69 62.21 1xgr s THR 17 Cb -0.01 -3.14 -0.05 0.00 0.01 0.00 0.00 72.50 69.30 1xgr s THR 17 CO 0.25 0.55 0.34 -0.22 -0.69 0.00 0.00 174.62 174.85 1xgr s LEU 18 N -0.38 4.28 -0.04 4.42 0.20 0.63 -4.94 118.68 122.86 1xgr s LEU 18 Ca 0.09 0.63 0.02 0.00 0.69 0.00 0.00 54.13 55.56 1xgr s LEU 18 Cb -0.12 -2.46 0.01 0.00 -0.43 0.00 0.00 46.19 43.19 1xgr s LEU 18 CO 0.02 0.12 -0.08 -0.44 -0.29 0.00 0.00 176.35 175.68 1xgr s SER 19 N 0.26 1.15 0.06 3.68 0.01 -1.26 -1.12 113.70 116.48 1xgr s SER 19 Ca 0.19 -0.18 0.01 0.00 1.31 0.00 0.00 55.95 57.29 1xgr s SER 19 Cb -0.14 -0.43 -0.03 0.00 0.21 0.00 0.00 66.02 65.63 1xgr s SER 19 CO 0.06 0.02 -0.06 -0.76 0.41 0.00 0.00 173.24 172.91 1xgr s LEU 20 N 0.51 2.40 0.03 2.44 1.43 -0.96 -3.96 118.68 120.56 1xgr s LEU 20 Ca -0.08 -0.81 0.06 0.00 -1.03 0.00 0.00 54.13 52.27 1xgr s LEU 20 Cb -0.12 -0.03 -0.02 0.00 0.03 0.00 0.00 46.19 46.05 1xgr s LEU 20 CO 0.01 -0.39 -0.17 -0.89 0.23 0.00 0.00 176.35 175.13 1xgr s THR 21 N -2.77 1.36 -0.18 5.49 2.01 0.25 -2.46 115.64 119.34 1xgr s THR 21 Ca 0.01 -1.00 0.01 0.00 0.31 0.00 0.00 61.69 61.02 1xgr s THR 21 Cb -0.00 -1.19 0.04 0.00 0.01 0.00 0.00 72.50 71.35 1xgr s THR 21 CO -0.04 0.17 -0.10 0.00 -0.69 0.00 0.00 174.62 173.96 1xgr s SER 23 N 1.45 6.41 -0.17 0.00 0.01 -0.26 -2.47 113.70 118.67 1xgr s SER 23 Ca 0.00 0.48 -0.17 0.00 1.31 0.00 0.00 55.95 57.58 1xgr s SER 23 Cb -0.15 -2.25 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 1xgr s SER 23 CO -0.09 -0.16 0.45 -0.69 0.41 0.00 0.00 173.24 173.16 1xgr s VAL 24 N 1.76 5.18 0.04 3.43 1.01 -0.39 -2.69 120.40 128.73 1xgr s VAL 24 Ca 0.19 0.85 0.05 0.00 0.00 0.00 0.00 61.98 63.07 1xgr s VAL 24 Cb -0.15 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.42 1xgr s VAL 24 CO 0.09 0.26 -0.15 0.42 0.00 0.00 0.00 175.10 175.72 1xgr s THR 25 N 1.13 1.17 0.00 3.92 -4.23 -0.57 -4.77 115.64 112.29 1xgr s THR 25 Ca 0.23 -1.05 0.00 0.00 -1.18 0.00 0.00 61.69 59.68 1xgr s THR 25 Cb -0.15 -1.06 0.00 0.00 1.34 0.00 0.00 72.50 72.63 1xgr s THR 25 CO 0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 1xgr n GLY 26 N 1.83 3.03 2.81 3.99 0.00 -1.26 -0.56 105.19 115.03 1xgr n GLY 26 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 1xgr n GLY 26 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xgr n ASP 27 N 0.11 -1.28 -4.87 1.61 -0.08 -1.26 -4.62 116.55 106.15 1xgr n ASP 27 Ca 0.00 -2.48 -0.32 0.00 -1.51 0.00 0.00 54.79 50.47 1xgr n ASP 27 Cb 0.00 2.30 -0.05 0.00 2.34 0.00 0.00 41.12 45.71 1xgr n ASP 27 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1xgr s SER 28 N -2.74 6.63 0.54 1.67 0.15 -1.26 -4.93 113.70 113.76 1xgr s SER 28 Ca 0.21 0.89 0.33 0.00 0.70 0.00 0.00 55.95 58.08 1xgr s SER 28 Cb -0.02 -2.21 1.47 0.00 -1.71 0.00 0.00 66.02 63.55 1xgr s SER 28 CO 0.15 -0.04 2.03 1.62 1.20 0.00 0.00 173.24 178.21 1xgr h VAL 29 N 2.10 0.21 -0.00 4.45 3.04 -1.90 -1.16 116.25 122.98 1xgr h VAL 29 Ca -0.47 -0.55 0.00 0.00 -1.01 0.00 0.00 66.70 64.68 1xgr h VAL 29 Cb 1.17 1.45 0.00 0.00 -2.01 0.00 0.00 31.29 31.90 1xgr h VAL 29 CO 0.69 0.06 -0.09 0.35 -1.01 0.00 0.00 177.57 177.57 1xgr n THR 30 N -3.25 0.00 -0.01 3.17 -2.24 -1.26 -3.91 114.28 106.79 1xgr n THR 30 Ca -0.01 -0.03 0.04 0.00 -2.27 0.00 0.00 64.05 61.78 1xgr n THR 30 Cb 0.28 -0.23 0.23 0.00 -2.10 0.00 0.00 70.33 68.50 1xgr n THR 30 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1xgr n SER 31 N -1.14 3.56 -3.59 3.42 3.41 -0.44 -4.78 113.62 114.06 1xgr n SER 31 Ca 0.13 -2.48 0.01 0.00 -0.26 0.00 0.00 58.87 56.27 1xgr n SER 31 Cb 0.28 -0.58 -0.01 0.00 -0.26 0.00 0.00 64.21 63.64 1xgr n SER 31 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1xgr s ASP 32 N -0.48 -0.03 -0.01 4.04 3.68 -1.25 -4.98 116.67 117.64 1xgr s ASP 32 Ca 0.31 -0.04 -0.20 0.00 2.13 0.00 0.00 52.55 54.75 1xgr s ASP 32 Cb 0.23 0.06 -0.05 0.00 -1.45 0.00 0.00 42.92 41.70 1xgr s ASP 32 CO 0.10 -0.10 0.57 -0.63 0.13 0.00 0.00 175.17 175.23 1xgr s ILE 33 N -2.15 4.92 0.12 4.11 1.01 -1.26 -3.60 121.20 124.35 1xgr s ILE 33 Ca 0.14 1.19 0.09 0.00 0.00 0.00 0.00 60.65 62.06 1xgr s ILE 33 Cb 0.05 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 1xgr s ILE 33 CO -0.05 0.44 -0.23 0.26 0.00 0.00 0.00 174.94 175.36 1xgr s TRP 34 N -0.29 1.95 0.22 3.97 0.52 0.17 -1.25 118.94 124.23 1xgr s TRP 34 Ca 0.30 -0.41 -0.00 0.00 0.02 0.00 0.00 56.10 56.01 1xgr s TRP 34 Cb -0.18 -1.06 -0.04 0.00 -1.15 0.00 0.00 33.47 31.04 1xgr s TRP 34 CO 0.16 0.26 0.12 -1.54 0.02 0.00 0.00 176.95 175.98 1xgr s SER 35 N -2.02 0.42 -0.11 2.95 1.04 -0.03 0.62 113.70 116.58 1xgr s SER 35 Ca 0.10 -1.39 0.02 0.00 0.48 0.00 0.00 55.95 55.15 1xgr s SER 35 Cb -0.10 0.33 0.01 0.00 0.10 0.00 0.00 66.02 66.37 1xgr s SER 35 CO 0.05 -0.82 -0.18 0.26 0.98 0.00 0.00 173.24 173.53 1xgr s TRP 36 N -4.05 2.16 -0.02 5.02 0.52 -0.79 -2.01 118.94 119.77 1xgr s TRP 36 Ca 0.39 -0.98 0.04 0.00 0.02 0.00 0.00 56.10 55.57 1xgr s TRP 36 Cb 0.07 -1.51 -0.01 0.00 -1.15 0.00 0.00 33.47 30.87 1xgr s TRP 36 CO 0.13 -0.46 -0.15 0.42 0.02 0.00 0.00 176.95 176.91 1xgr s ILE 37 N 0.77 1.19 0.09 2.03 1.01 -0.15 -1.32 121.20 124.82 1xgr s ILE 37 Ca -0.10 -0.63 0.09 0.00 0.00 0.00 0.00 60.65 60.00 1xgr s ILE 37 Cb -0.16 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.27 1xgr s ILE 37 CO 0.01 0.34 -0.23 0.00 0.00 0.00 0.00 174.94 175.07 1xgr s ARG 38 N -0.23 1.29 -0.26 2.79 1.70 -0.45 -0.34 118.95 123.45 1xgr s ARG 38 Ca 0.03 -1.15 0.02 0.00 -0.47 0.00 0.00 55.73 54.16 1xgr s ARG 38 Cb -0.07 -1.57 0.06 0.00 -0.57 0.00 0.00 34.95 32.81 1xgr s ARG 38 CO -0.00 0.38 -0.09 0.21 -1.08 0.00 0.00 175.30 174.72 1xgr s LYS 39 N -1.74 2.02 0.67 3.89 2.20 0.39 -0.84 119.74 126.33 1xgr s LYS 39 Ca 0.09 -1.28 -0.11 0.00 -0.36 0.00 0.00 55.97 54.31 1xgr s LYS 39 Cb -0.10 -2.82 -0.01 0.00 -1.51 0.00 0.00 37.83 33.40 1xgr s LYS 39 CO 0.04 -0.60 1.06 -0.06 -0.36 0.00 0.00 175.35 175.43 1xgr s PHE 40 N 1.17 3.41 0.58 4.03 0.08 -0.02 -2.05 117.98 125.20 1xgr s PHE 40 Ca -0.07 1.23 -0.19 0.00 0.12 0.00 0.00 56.93 58.02 1xgr s PHE 40 Cb -0.20 -2.87 -0.05 0.00 -0.57 0.00 0.00 43.02 39.34 1xgr s PHE 40 CO -0.06 -0.98 1.09 -2.30 -0.10 0.00 0.00 175.22 172.88 1xgr n PRO 41 N -2.93 1.11 -0.81 0.24 -0.02 -1.26 -2.43 135.00 128.90 1xgr n PRO 41 Ca 0.07 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1xgr n PRO 41 Cb 0.55 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1xgr n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xgr n GLY 42 N 1.12 0.61 3.76 -1.23 0.00 -1.26 -4.15 105.19 104.04 1xgr n GLY 42 Ca 0.13 -0.75 -0.24 0.00 0.00 0.00 0.00 46.02 45.16 1xgr n GLY 42 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xgr n ASN 43 N 1.41 -2.41 -4.32 1.61 3.02 -1.15 -4.96 115.26 108.46 1xgr n ASN 43 Ca 0.00 -0.80 -0.42 0.00 -0.03 0.00 0.00 54.58 53.33 1xgr n ASN 43 Cb 0.05 -4.03 -0.09 0.00 -0.61 0.00 0.00 39.78 35.10 1xgr n ASN 43 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1xgr s LYS 44 N -6.18 2.77 0.08 3.52 -0.14 -1.02 -4.97 119.74 113.80 1xgr s LYS 44 Ca 0.22 -1.44 -0.20 0.00 -1.36 0.00 0.00 55.97 53.18 1xgr s LYS 44 Cb -0.11 -3.95 -0.07 0.00 -1.68 0.00 0.00 37.83 32.02 1xgr s LYS 44 CO 0.82 -1.01 0.61 -0.51 -0.76 0.00 0.00 175.35 174.49 1xgr s LEU 45 N 1.52 4.53 -0.06 3.17 1.43 -1.26 -0.84 118.68 127.17 1xgr s LEU 45 Ca 0.04 1.32 0.01 0.00 -1.03 0.00 0.00 54.13 54.47 1xgr s LEU 45 Cb -0.24 -2.97 0.02 0.00 0.03 0.00 0.00 46.19 43.03 1xgr s LEU 45 CO 0.04 0.25 -0.08 -0.70 0.23 0.00 0.00 176.35 176.09 1xgr s GLU 46 N -1.05 1.25 -0.68 1.70 2.12 -0.02 -5.00 118.70 117.02 1xgr s GLU 46 Ca 0.30 -0.25 -0.22 0.00 0.36 0.00 0.00 54.97 55.17 1xgr s GLU 46 Cb -0.20 -1.13 0.08 0.00 0.26 0.00 0.00 34.13 33.14 1xgr s GLU 46 CO 0.20 -0.04 0.95 -0.47 -0.54 0.00 0.00 175.26 175.36 1xgr s TYR 47 N 0.85 2.75 0.29 5.30 5.04 -1.26 -1.34 117.35 128.98 1xgr s TYR 47 Ca -0.12 -0.68 -0.01 0.00 -2.44 0.00 0.00 57.07 53.83 1xgr s TYR 47 Cb -0.15 -4.26 0.42 0.00 0.35 0.00 0.00 41.96 38.32 1xgr s TYR 47 CO 0.01 -1.60 1.83 0.52 -1.34 0.00 0.00 175.55 174.98 1xgr h MET 48 N 9.46 0.79 0.00 4.97 2.86 -1.57 -3.41 114.93 128.03 1xgr h MET 48 Ca -0.25 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.23 1xgr h MET 48 Cb 1.07 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.61 1xgr h MET 48 CO 1.17 0.72 0.00 0.41 1.06 0.00 0.00 176.91 180.27 1xgr n GLY 49 N -0.86 -2.11 3.30 8.32 0.00 -1.20 -1.30 105.19 111.35 1xgr n GLY 49 Ca 0.04 -1.43 -0.11 0.00 0.00 0.00 0.00 46.02 44.52 1xgr n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xgr s TYR 50 N -1.95 -0.18 -0.12 1.61 -0.85 -0.72 -1.89 117.35 113.25 1xgr s TYR 50 Ca 0.00 -0.08 0.03 0.00 -0.52 0.00 0.00 57.07 56.50 1xgr s TYR 50 Cb 0.00 0.21 0.00 0.00 0.38 0.00 0.00 41.96 42.56 1xgr s TYR 50 CO 0.00 -0.65 -0.22 -1.50 -1.52 0.00 0.00 175.55 171.66 1xgr s ILE 51 N -3.46 2.16 0.91 -3.49 2.07 0.20 -1.97 121.20 117.63 1xgr s ILE 51 Ca 0.01 -0.96 -0.12 0.00 -1.41 0.00 0.00 60.65 58.16 1xgr s ILE 51 Cb 0.01 -1.85 0.14 0.00 0.13 0.00 0.00 42.46 40.89 1xgr s ILE 51 CO -0.09 0.55 1.13 -0.55 -1.91 0.00 0.00 174.94 174.07 1xgr s SER 52 N 0.58 3.47 0.48 4.50 0.15 0.14 -0.66 113.70 122.38 1xgr s SER 52 Ca -0.12 0.99 0.32 0.00 0.70 0.00 0.00 55.95 57.84 1xgr s SER 52 Cb -0.17 -1.58 1.76 0.00 -1.71 0.00 0.00 66.02 64.33 1xgr s SER 52 CO 0.03 -2.58 1.99 0.10 1.20 0.00 0.00 173.24 173.99 1xgr h TYR 53 N -1.51 0.00 0.00 3.44 -0.00 -1.86 -0.46 116.97 116.57 1xgr h TYR 53 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.22 1xgr h TYR 53 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.06 1xgr h TYR 53 CO 0.30 0.00 -1.06 -1.13 -0.00 0.00 0.00 178.16 176.26 1xgr n SER 54 N -2.64 0.73 0.00 0.10 3.41 -1.26 -4.83 113.62 109.13 1xgr n SER 54 Ca -0.02 -0.61 0.00 0.00 -0.26 0.00 0.00 58.87 57.98 1xgr n SER 54 Cb 0.06 0.98 0.00 0.00 -0.26 0.00 0.00 64.21 64.99 1xgr n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xgr n GLY 55 N 1.44 0.46 3.78 5.00 0.00 -0.18 -5.07 105.19 110.62 1xgr n GLY 55 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1xgr n GLY 55 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xgr s SER 56 N -2.68 5.69 0.11 1.61 0.15 -1.26 -4.72 113.70 112.59 1xgr s SER 56 Ca 0.00 2.09 0.04 0.00 0.70 0.00 0.00 55.95 58.78 1xgr s SER 56 Cb 0.00 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.70 1xgr s SER 56 CO 0.00 -1.24 -0.10 0.42 1.20 0.00 0.00 173.24 173.52 1xgr s THR 57 N -1.95 0.98 -0.05 6.45 -4.23 -1.26 0.28 115.64 115.87 1xgr s THR 57 Ca 0.70 -1.81 -0.01 0.00 -1.18 0.00 0.00 61.69 59.40 1xgr s THR 57 Cb -0.22 -1.56 0.03 0.00 1.34 0.00 0.00 72.50 72.09 1xgr s THR 57 CO 0.29 -0.66 0.01 -0.31 -0.54 0.00 0.00 174.62 173.41 1xgr s TYR 58 N -2.87 0.43 0.05 3.99 2.02 -0.83 -5.02 117.35 115.12 1xgr s TYR 58 Ca 0.10 -0.03 0.06 0.00 -0.37 0.00 0.00 57.07 56.83 1xgr s TYR 58 Cb -0.00 -0.58 -0.03 0.00 -0.40 0.00 0.00 41.96 40.95 1xgr s TYR 58 CO -0.00 -0.21 -0.14 0.71 -1.57 0.00 0.00 175.55 174.33 1xgr s TYR 59 N 1.52 2.65 0.14 2.71 2.02 -1.26 -1.76 117.35 123.38 1xgr s TYR 59 Ca -0.02 -0.20 -0.31 0.00 -0.37 0.00 0.00 57.07 56.17 1xgr s TYR 59 Cb -0.13 -1.48 -0.10 0.00 -0.40 0.00 0.00 41.96 39.85 1xgr s TYR 59 CO -0.03 0.31 1.59 -1.58 -1.57 0.00 0.00 175.55 174.27 1xgr s HIS 60 N -1.00 2.92 0.32 2.71 5.65 -0.42 -4.81 115.29 120.67 1xgr s HIS 60 Ca 0.16 0.56 0.08 0.00 0.25 0.00 0.00 55.06 56.11 1xgr s HIS 60 Cb -0.11 -3.93 0.78 0.00 -1.18 0.00 0.00 32.58 28.14 1xgr s HIS 60 CO 0.07 -3.51 1.80 -1.00 -0.65 0.00 0.00 174.74 171.45 1xgr h PRO 61 N 7.14 0.71 -0.20 2.88 0.13 -1.95 0.16 132.00 140.87 1xgr h PRO 61 Ca -0.43 -0.04 0.06 0.00 -0.87 0.00 0.00 66.00 64.72 1xgr h PRO 61 Cb 1.20 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 1xgr h PRO 61 CO 0.92 0.47 0.18 0.77 -0.23 0.00 0.00 178.00 180.10 1xgr h SER 62 N 0.73 0.00 0.00 1.44 0.02 -1.98 -1.79 113.55 111.97 1xgr h SER 62 Ca 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.50 1xgr h SER 62 Cb 0.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1xgr h SER 62 CO -0.33 0.00 -1.02 0.18 -1.14 0.00 0.00 176.83 174.52 1xgr n LEU 63 N -4.08 0.72 -4.59 5.07 7.99 0.40 -4.98 117.00 117.54 1xgr n LEU 63 Ca 0.02 -0.42 -0.48 0.00 -0.01 0.00 0.00 56.01 55.12 1xgr n LEU 63 Cb 0.31 0.00 -0.04 0.00 -0.11 0.00 0.00 43.42 43.58 1xgr n LEU 63 CO 0.31 0.18 0.75 1.17 -1.51 0.00 0.00 177.39 178.29 1xgr n LYS 64 N -1.55 1.30 0.00 3.23 3.00 -0.18 -0.59 118.16 123.37 1xgr n LYS 64 Ca 0.02 0.46 0.00 0.00 -0.00 0.00 0.00 58.31 58.80 1xgr n LYS 64 Cb 0.32 -1.98 0.00 0.00 0.00 0.00 0.00 35.03 33.37 1xgr n LYS 64 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1xgr n SER 65 N 2.00 0.00 -0.03 3.14 3.41 -1.26 -4.76 113.62 116.11 1xgr n SER 65 Ca 0.14 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.80 1xgr n SER 65 Cb 0.26 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.07 1xgr n SER 65 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xgr n ARG 66 N -0.25 0.72 -3.97 4.33 1.74 0.24 -4.96 116.66 114.51 1xgr n ARG 66 Ca 0.00 -0.13 -0.30 0.00 -0.77 0.00 0.00 57.85 56.66 1xgr n ARG 66 Cb 0.00 -1.43 -0.04 0.00 -1.02 0.00 0.00 32.46 29.96 1xgr n ARG 66 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1xgr s ILE 67 N -3.06 5.11 -0.17 0.55 2.07 -0.94 -1.36 121.20 123.41 1xgr s ILE 67 Ca -0.07 -0.59 -0.09 0.00 -1.41 0.00 0.00 60.65 58.49 1xgr s ILE 67 Cb 0.10 -3.53 0.06 0.00 0.13 0.00 0.00 42.46 39.22 1xgr s ILE 67 CO 0.74 0.07 0.40 -0.55 -1.91 0.00 0.00 174.94 173.70 1xgr s SER 68 N -2.67 -0.49 -0.11 4.50 0.15 -0.54 -4.97 113.70 109.57 1xgr s SER 68 Ca 0.33 0.89 0.02 0.00 0.70 0.00 0.00 55.95 57.89 1xgr s SER 68 Cb -0.12 0.79 0.01 0.00 -1.71 0.00 0.00 66.02 64.99 1xgr s SER 68 CO 0.26 -0.20 -0.19 -0.63 1.20 0.00 0.00 173.24 173.69 1xgr s ILE 69 N 1.48 1.73 0.31 6.45 1.01 -1.26 -0.71 121.20 130.21 1xgr s ILE 69 Ca -0.09 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 59.79 1xgr s ILE 69 Cb -0.09 -1.55 -0.04 0.00 0.01 0.00 0.00 42.46 40.80 1xgr s ILE 69 CO -0.13 0.49 0.14 0.42 0.00 0.00 0.00 174.94 175.86 1xgr s THR 70 N 0.78 0.46 0.14 2.92 -4.23 -1.02 -4.95 115.64 109.75 1xgr s THR 70 Ca -0.10 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.38 1xgr s THR 70 Cb -0.16 -2.54 -0.03 0.00 1.34 0.00 0.00 72.50 71.12 1xgr s THR 70 CO 0.01 0.00 0.12 0.00 -0.54 0.00 0.00 174.62 174.21 1xgr s ARG 71 N -3.85 0.99 -0.23 3.99 1.70 -1.26 0.17 118.95 120.46 1xgr s ARG 71 Ca 0.35 -1.36 -0.02 0.00 -0.47 0.00 0.00 55.73 54.23 1xgr s ARG 71 Cb 0.05 0.28 0.07 0.00 -0.57 0.00 0.00 34.95 34.79 1xgr s ARG 71 CO 0.16 -0.31 0.05 0.34 -1.08 0.00 0.00 175.30 174.46 1xgr s ASP 72 N -3.02 3.25 0.47 -2.89 -1.08 0.76 -4.95 116.67 109.22 1xgr s ASP 72 Ca 0.22 -1.05 0.24 0.00 -0.52 0.00 0.00 52.55 51.44 1xgr s ASP 72 Cb 0.06 -0.68 1.18 0.00 -1.46 0.00 0.00 42.92 42.01 1xgr s ASP 72 CO 0.01 -0.33 1.96 0.74 0.52 0.00 0.00 175.17 178.07 1xgr h THR 73 N 6.52 0.66 0.00 1.71 2.02 -1.98 -0.19 112.91 121.65 1xgr h THR 73 Ca -0.16 -0.84 -0.08 0.00 0.77 0.00 0.00 66.41 66.11 1xgr h THR 73 Cb 1.09 1.53 -0.01 0.00 -1.74 0.00 0.00 68.15 69.02 1xgr h THR 73 CO 0.38 0.19 -0.77 0.77 0.37 0.00 0.00 175.52 176.46 1xgr h SER 74 N 0.00 0.00 0.00 4.18 4.64 -1.95 -3.31 113.55 117.10 1xgr h SER 74 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xgr h SER 74 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1xgr h SER 74 CO 0.03 0.30 -1.10 0.29 -0.87 0.00 0.00 176.83 175.47 1xgr n LYS 75 N -2.98 0.53 -3.27 4.77 5.02 -1.15 -5.01 118.16 116.07 1xgr n LYS 75 Ca -0.01 -0.03 -0.15 0.00 -2.02 0.00 0.00 58.31 56.09 1xgr n LYS 75 Cb 0.68 -1.44 0.07 0.00 -0.02 0.00 0.00 35.03 34.33 1xgr n LYS 75 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1xgr n ASN 76 N -1.60 -5.08 -3.90 4.39 3.02 -0.10 -4.83 115.26 107.17 1xgr n ASN 76 Ca 0.02 -0.66 -0.08 0.00 -0.03 0.00 0.00 54.58 53.83 1xgr n ASN 76 Cb 0.35 -5.07 -0.08 0.00 -0.61 0.00 0.00 39.78 34.37 1xgr n ASN 76 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1xgr s GLN 77 N -4.67 0.80 0.10 3.52 -0.21 -1.09 -1.27 119.66 116.84 1xgr s GLN 77 Ca 0.30 -1.00 0.02 0.00 0.02 0.00 0.00 55.36 54.71 1xgr s GLN 77 Cb -0.04 0.32 -0.04 0.00 1.00 0.00 0.00 33.01 34.25 1xgr s GLN 77 CO 0.72 -0.24 -0.07 1.52 -2.12 0.00 0.00 175.29 175.10 1xgr s TYR 78 N -3.84 0.92 0.26 0.91 1.13 -1.03 -0.17 117.35 115.53 1xgr s TYR 78 Ca 0.05 -0.83 0.04 0.00 -1.41 0.00 0.00 57.07 54.91 1xgr s TYR 78 Cb 0.05 -0.52 -0.06 0.00 -1.10 0.00 0.00 41.96 40.34 1xgr s TYR 78 CO -0.11 -0.11 0.02 0.71 -2.51 0.00 0.00 175.55 173.55 1xgr s TYR 79 N -3.25 1.71 -0.06 -3.49 1.51 0.44 -2.02 117.35 112.20 1xgr s TYR 79 Ca 0.09 -0.93 0.03 0.00 -1.01 0.00 0.00 57.07 55.25 1xgr s TYR 79 Cb 0.03 -1.03 0.01 0.00 -0.11 0.00 0.00 41.96 40.86 1xgr s TYR 79 CO -0.03 -0.02 -0.13 -1.17 -1.11 0.00 0.00 175.55 173.08 1xgr s LEU 80 N -3.37 1.73 -0.10 -1.29 2.96 -1.03 -2.42 118.68 115.16 1xgr s LEU 80 Ca 0.32 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.94 1xgr s LEU 80 Cb 0.06 -0.85 0.01 0.00 0.50 0.00 0.00 46.19 45.92 1xgr s LEU 80 CO 0.11 0.06 -0.15 -1.58 -1.32 0.00 0.00 176.35 173.48 1xgr s GLN 81 N 0.49 2.14 -0.19 1.98 0.74 0.11 -2.27 119.66 122.68 1xgr s GLN 81 Ca -0.12 -0.54 -0.02 0.00 0.05 0.00 0.00 55.36 54.73 1xgr s GLN 81 Cb -0.14 -1.80 0.06 0.00 1.10 0.00 0.00 33.01 32.22 1xgr s GLN 81 CO 0.03 -0.03 0.02 -1.17 -0.55 0.00 0.00 175.29 173.59 1xgr s LEU 82 N 0.88 1.32 0.71 3.68 2.96 -0.27 -1.46 118.68 126.50 1xgr s LEU 82 Ca -0.09 -0.79 -0.06 0.00 -0.22 0.00 0.00 54.13 52.97 1xgr s LEU 82 Cb -0.15 -0.67 0.07 0.00 0.50 0.00 0.00 46.19 45.93 1xgr s LEU 82 CO 0.00 -0.28 1.02 0.20 -1.32 0.00 0.00 176.35 175.97 1xgr s ASN 83 N 1.80 4.75 -1.46 3.68 0.01 -0.47 -0.27 114.94 122.98 1xgr s ASN 83 Ca -0.01 0.41 -0.09 0.00 -0.71 0.00 0.00 52.86 52.45 1xgr s ASN 83 Cb -0.17 -1.03 0.01 0.00 0.41 0.00 0.00 41.25 40.47 1xgr s ASN 83 CO -0.07 -1.63 0.18 -1.20 -1.51 0.00 0.00 177.10 172.87 1xgr n SER 84 N -2.93 -0.38 -4.77 -1.22 7.64 -1.11 -4.89 113.62 105.95 1xgr n SER 84 Ca 0.08 -1.29 -0.31 0.00 1.01 0.00 0.00 58.87 58.37 1xgr n SER 84 Cb 0.60 -1.62 0.08 0.00 -1.01 0.00 0.00 64.21 62.27 1xgr n SER 84 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1xgr s VAL 85 N -4.16 3.40 0.20 0.44 -7.23 -0.97 -4.62 120.40 107.47 1xgr s VAL 85 Ca 0.13 0.47 0.00 0.00 -1.81 0.00 0.00 61.98 60.77 1xgr s VAL 85 Cb -0.07 -2.98 -0.04 0.00 0.56 0.00 0.00 36.38 33.85 1xgr s VAL 85 CO 0.99 -0.58 0.09 0.42 -0.31 0.00 0.00 175.10 175.71 1xgr s THR 86 N -2.88 0.27 0.61 5.32 -4.23 -1.26 -0.28 115.64 113.18 1xgr s THR 86 Ca 0.61 -1.98 0.28 0.00 -1.18 0.00 0.00 61.69 59.42 1xgr s THR 86 Cb -0.17 -2.42 0.36 0.00 1.34 0.00 0.00 72.50 71.61 1xgr s THR 86 CO 0.55 -0.14 1.84 0.71 -0.54 0.00 0.00 174.62 177.04 1xgr h THR 87 N 2.60 0.26 0.00 3.99 1.35 -1.97 0.16 112.91 119.30 1xgr h THR 87 Ca -0.37 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1xgr h THR 87 Cb 1.23 0.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 1xgr h THR 87 CO 0.58 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 175.23 1xgr n GLU 88 N -3.49 0.00 0.00 4.72 4.71 -1.26 -1.52 120.64 123.80 1xgr n GLU 88 Ca 0.07 0.30 0.14 0.00 -0.01 0.00 0.00 57.16 57.66 1xgr n GLU 88 Cb 0.67 -1.50 0.48 0.00 -1.01 0.00 0.00 31.44 30.08 1xgr n GLU 88 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1xgr n ASP 89 N -1.50 1.23 -4.71 1.62 8.00 0.56 -4.87 116.55 116.88 1xgr n ASP 89 Ca 0.03 -1.19 -0.42 0.00 0.71 0.00 0.00 54.79 53.92 1xgr n ASP 89 Cb 0.13 0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.25 1xgr n ASP 89 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1xgr s THR 90 N -2.23 2.49 -0.04 -3.53 2.01 -0.57 -4.84 115.64 108.92 1xgr s THR 90 Ca 0.32 0.25 -0.30 0.00 0.31 0.00 0.00 61.69 62.27 1xgr s THR 90 Cb 0.20 -3.16 0.11 0.00 0.01 0.00 0.00 72.50 69.66 1xgr s THR 90 CO 0.42 0.01 1.32 0.00 -0.69 0.00 0.00 174.62 175.68 1xgr s ALA 91 N 1.69 -2.49 -0.23 7.40 0.00 -0.76 -4.68 121.76 122.69 1xgr s ALA 91 Ca 0.74 0.31 -0.11 0.00 0.00 0.00 0.00 51.96 52.89 1xgr s ALA 91 Cb -0.45 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.33 1xgr s ALA 91 CO 0.33 -1.13 0.19 0.99 0.00 0.00 0.00 175.76 176.14 1xgr s THR 92 N -2.09 5.34 -0.16 0.00 2.01 -0.87 -1.24 115.64 118.63 1xgr s THR 92 Ca 0.25 0.26 -0.06 0.00 0.31 0.00 0.00 61.69 62.46 1xgr s THR 92 Cb 0.02 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 1xgr s THR 92 CO -0.02 0.34 0.03 -0.31 -0.69 0.00 0.00 174.62 173.97 1xgr s TYR 93 N 0.99 3.18 0.05 4.92 1.51 0.07 -0.47 117.35 127.60 1xgr s TYR 93 Ca 0.09 -0.01 0.08 0.00 -1.01 0.00 0.00 57.07 56.22 1xgr s TYR 93 Cb -0.13 -2.00 -0.03 0.00 -0.11 0.00 0.00 41.96 39.69 1xgr s TYR 93 CO 0.04 0.15 -0.22 0.71 -1.11 0.00 0.00 175.55 175.13 1xgr s TYR 94 N 0.18 1.89 0.00 2.71 2.02 0.54 -0.74 117.35 123.94 1xgr s TYR 94 Ca 0.02 -0.38 0.04 0.00 -0.37 0.00 0.00 57.07 56.38 1xgr s TYR 94 Cb -0.13 -1.12 -0.03 0.00 -0.40 0.00 0.00 41.96 40.28 1xgr s TYR 94 CO 0.01 0.11 -0.09 0.00 -1.57 0.00 0.00 175.55 174.01 1xgr s ALA 96 N -0.96 -0.47 0.66 0.00 0.00 -0.85 -1.10 121.76 119.03 1xgr s ALA 96 Ca 0.16 -0.54 -0.11 0.00 0.00 0.00 0.00 51.96 51.47 1xgr s ALA 96 Cb -0.11 0.83 -0.02 0.00 0.00 0.00 0.00 23.12 23.82 1xgr s ALA 96 CO 0.07 -0.71 1.05 -1.54 0.00 0.00 0.00 175.76 174.62 1xgr s SER 97 N -2.91 5.85 0.25 0.00 1.04 -0.81 -0.85 113.70 116.28 1xgr s SER 97 Ca 0.12 1.46 -0.05 0.00 0.48 0.00 0.00 55.95 57.96 1xgr s SER 97 Cb 0.01 -2.42 0.28 0.00 0.10 0.00 0.00 66.02 63.99 1xgr s SER 97 CO -0.02 -1.12 1.84 -0.25 0.98 0.00 0.00 173.24 174.67 1xgr h TRP 98 N -0.49 1.10 0.00 5.02 7.01 -1.51 -1.85 115.95 125.23 1xgr h TRP 98 Ca -0.44 -0.06 0.00 0.00 2.11 0.00 0.00 58.89 60.50 1xgr h TRP 98 Cb 1.20 -0.34 0.00 0.00 -2.10 0.00 0.00 29.16 27.93 1xgr h TRP 98 CO 0.63 0.81 0.00 0.41 -2.79 0.00 0.00 178.44 177.50 1xgr n GLY 99 N -1.01 -0.92 3.02 2.65 0.00 -1.26 -4.85 105.19 102.83 1xgr n GLY 99 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1xgr n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xgr n GLY 100 N -0.18 0.58 0.15 -0.02 0.00 -0.69 -4.87 105.19 100.15 1xgr n GLY 100 Ca 0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.18 1xgr n GLY 100 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1xgr h ASP 101 N 0.00 0.00 -4.11 1.61 2.03 -1.89 -3.45 116.42 110.61 1xgr h ASP 101 Ca 0.00 0.00 -0.31 0.00 -0.73 0.00 0.00 57.03 55.99 1xgr h ASP 101 Cb 0.10 0.00 -0.27 0.00 -0.83 0.00 0.00 39.33 38.33 1xgr h ASP 101 CO 0.00 0.00 -0.75 0.54 -1.03 0.00 0.00 179.24 178.00 1xgr s VAL 102 N -3.19 0.43 0.01 4.15 0.11 -1.26 -5.03 120.40 115.62 1xgr s VAL 102 Ca 0.08 -0.43 -0.03 0.00 -2.93 0.00 0.00 61.98 58.68 1xgr s VAL 102 Cb 0.10 -0.40 -0.01 0.00 -1.53 0.00 0.00 36.38 34.53 1xgr s VAL 102 CO 0.59 -0.01 0.04 0.26 -3.33 0.00 0.00 175.10 172.65 1xgr s TRP 103 N -0.43 0.14 0.82 1.54 0.52 -1.26 -1.92 118.94 118.35 1xgr s TRP 103 Ca -0.01 -0.30 -0.11 0.00 0.02 0.00 0.00 56.10 55.70 1xgr s TRP 103 Cb -0.04 -0.11 0.11 0.00 -1.15 0.00 0.00 33.47 32.28 1xgr s TRP 103 CO -0.00 -0.20 1.17 0.20 0.02 0.00 0.00 176.95 178.14 1xgr s GLY 104 N -1.22 1.68 0.47 0.98 0.00 -0.25 -4.53 107.32 104.44 1xgr s GLY 104 Ca -0.13 -0.94 0.27 0.00 0.00 0.00 0.00 44.72 43.91 1xgr s GLY 104 CO -0.00 -0.39 1.86 0.00 0.00 0.00 0.00 173.10 174.56 1xgr h ALA 105 N -1.08 1.01 0.00 3.20 0.00 -1.91 -3.45 119.26 117.04 1xgr h ALA 105 Ca -0.45 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1xgr h ALA 105 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1xgr h ALA 105 CO 0.55 0.18 0.00 0.41 0.00 0.00 0.00 179.25 180.39 1xgr n GLY 106 N 0.19 0.51 3.02 0.00 0.00 -1.26 -5.03 105.19 102.61 1xgr n GLY 106 Ca 0.01 -1.63 -0.13 0.00 0.00 0.00 0.00 46.02 44.27 1xgr n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1xgr s THR 107 N -2.76 -0.04 0.20 2.61 -1.32 0.08 -4.91 115.64 109.50 1xgr s THR 107 Ca 0.00 0.15 -0.30 0.00 -1.21 0.00 0.00 61.69 60.33 1xgr s THR 107 Cb 0.00 -0.33 -0.08 0.00 -1.51 0.00 0.00 72.50 70.58 1xgr s THR 107 CO 0.00 0.06 1.02 -0.89 -2.21 0.00 0.00 174.62 172.60 1xgr s THR 108 N 1.17 4.00 -0.09 5.08 2.01 -1.26 -0.75 115.64 125.79 1xgr s THR 108 Ca -0.09 1.85 0.01 0.00 0.31 0.00 0.00 61.69 63.77 1xgr s THR 108 Cb -0.10 -4.18 0.02 0.00 0.01 0.00 0.00 72.50 68.25 1xgr s THR 108 CO -0.07 0.37 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.42 1xgr s VAL 109 N -0.66 1.25 -0.11 3.82 1.01 -0.37 -4.60 120.40 120.74 1xgr s VAL 109 Ca 0.45 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.94 1xgr s VAL 109 Cb -0.27 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.92 1xgr s VAL 109 CO 0.34 0.39 -0.13 -0.89 0.00 0.00 0.00 175.10 174.81 1xgr s THR 110 N 1.03 3.07 -0.34 3.92 2.01 0.13 -1.83 115.64 123.64 1xgr s THR 110 Ca -0.07 -0.67 -0.12 0.00 0.31 0.00 0.00 61.69 61.14 1xgr s THR 110 Cb -0.15 -2.27 -0.01 0.00 0.01 0.00 0.00 72.50 70.09 1xgr s THR 110 CO -0.01 0.54 0.21 -0.69 -0.69 0.00 0.00 174.62 173.98 1xgr s VAL 111 N 0.07 4.99 0.04 3.82 1.01 -1.25 -1.04 120.40 128.04 1xgr s VAL 111 Ca -0.05 -0.35 -0.23 0.00 0.00 0.00 0.00 61.98 61.35 1xgr s VAL 111 Cb -0.15 -3.58 0.05 0.00 0.00 0.00 0.00 36.38 32.70 1xgr s VAL 111 CO 0.04 -0.01 0.52 -0.55 0.00 0.00 0.00 175.10 175.10 1xgr s SER 112 N 1.67 -0.45 0.00 3.32 0.15 -0.42 -4.39 113.70 113.58 1xgr s SER 112 Ca 0.05 0.19 0.17 0.00 0.70 0.00 0.00 55.95 57.06 1xgr s SER 112 Cb -0.17 0.49 0.36 0.00 -1.71 0.00 0.00 66.02 64.99 1xgr s SER 112 CO 0.09 -0.72 1.28 -1.54 1.20 0.00 0.00 173.24 173.55 1xgr n SER 113 N 0.42 3.10 -4.78 5.45 3.41 -1.26 -3.97 113.62 115.98 1xgr n SER 113 Ca -0.18 -1.90 -0.35 0.00 -0.26 0.00 0.00 58.87 56.17 1xgr n SER 113 Cb 0.60 -0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 64.30 1xgr n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xgr s ALA 114 N -1.15 2.83 0.20 7.33 0.00 -1.26 -5.05 121.76 124.66 1xgr s ALA 114 Ca 0.31 0.75 0.03 0.00 0.00 0.00 0.00 51.96 53.04 1xgr s ALA 114 Cb 0.17 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.94 1xgr s ALA 114 CO 0.23 -0.53 0.34 0.15 0.00 0.00 0.00 175.76 175.95 1xgr s LYS 115 N -3.11 3.45 0.18 0.00 1.02 -1.26 -5.02 119.74 115.00 1xgr s LYS 115 Ca 0.68 -0.61 -0.33 0.00 0.02 0.00 0.00 55.97 55.74 1xgr s LYS 115 Cb -0.21 -2.90 -0.14 0.00 -0.52 0.00 0.00 37.83 34.05 1xgr s LYS 115 CO 0.25 0.45 1.40 2.41 -0.92 0.00 0.00 175.35 178.95 1xgr n THR 116 N -0.94 0.53 -3.71 2.17 -1.04 -1.26 -4.70 114.28 105.33 1xgr n THR 116 Ca -0.07 -0.13 -0.16 0.00 -2.04 0.00 0.00 64.05 61.65 1xgr n THR 116 Cb 0.55 -1.28 -0.15 0.00 -1.82 0.00 0.00 70.33 67.62 1xgr n THR 116 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1xgr s THR 117 N 0.27 -0.13 0.47 12.58 2.01 0.16 -4.92 115.64 126.08 1xgr s THR 117 Ca 0.74 0.27 -0.23 0.00 0.31 0.00 0.00 61.69 62.79 1xgr s THR 117 Cb -0.74 -0.23 -0.07 0.00 0.01 0.00 0.00 72.50 71.47 1xgr s THR 117 CO 0.46 0.11 1.18 0.00 -0.69 0.00 0.00 174.62 175.68 1xgr s ALA 118 N 1.66 2.94 0.65 7.40 0.00 -1.26 -1.07 121.76 132.07 1xgr s ALA 118 Ca -0.03 0.95 -0.10 0.00 0.00 0.00 0.00 51.96 52.78 1xgr s ALA 118 Cb -0.12 -3.39 -0.01 0.00 0.00 0.00 0.00 23.12 19.60 1xgr s ALA 118 CO -0.05 -0.72 1.02 -1.25 0.00 0.00 0.00 175.76 174.76 1xgr s PRO 119 N -2.76 3.15 -0.17 0.00 0.04 -1.26 -4.48 135.00 129.52 1xgr s PRO 119 Ca 0.65 0.47 -0.06 0.00 0.04 0.00 0.00 61.00 62.10 1xgr s PRO 119 Cb -0.29 -2.10 -0.03 0.00 0.04 0.00 0.00 34.50 32.11 1xgr s PRO 119 CO 0.35 -0.78 0.02 -1.12 0.04 0.00 0.00 177.00 175.51 1xgr s SER 120 N -4.28 5.26 -0.30 6.66 0.01 0.09 -4.95 113.70 116.20 1xgr s SER 120 Ca 0.56 -0.01 -0.07 0.00 1.31 0.00 0.00 55.95 57.74 1xgr s SER 120 Cb -0.11 -1.88 0.01 0.00 0.21 0.00 0.00 66.02 64.25 1xgr s SER 120 CO 0.51 0.18 0.08 -0.69 0.41 0.00 0.00 173.24 173.73 1xgr s VAL 121 N 0.34 3.94 -0.12 3.43 1.01 -1.26 -1.14 120.40 126.61 1xgr s VAL 121 Ca -0.00 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 1xgr s VAL 121 Cb -0.13 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 1xgr s VAL 121 CO 0.01 0.07 -0.07 -0.31 0.00 0.00 0.00 175.10 174.81 1xgr s TYR 122 N 1.49 2.95 0.29 5.22 2.02 0.44 -4.96 117.35 124.81 1xgr s TYR 122 Ca 0.02 -0.25 -0.29 0.00 -0.37 0.00 0.00 57.07 56.18 1xgr s TYR 122 Cb -0.17 -1.85 -0.09 0.00 -0.40 0.00 0.00 41.96 39.44 1xgr s TYR 122 CO 0.02 0.06 1.07 -1.25 -1.57 0.00 0.00 175.55 173.88 1xgr s PRO 123 N -0.04 4.61 -0.27 -1.71 0.04 -1.26 -0.46 135.00 135.90 1xgr s PRO 123 Ca 0.00 1.71 0.01 0.00 0.04 0.00 0.00 61.00 62.76 1xgr s PRO 123 Cb -0.13 -3.11 0.05 0.00 0.04 0.00 0.00 34.50 31.35 1xgr s PRO 123 CO 0.03 0.21 -0.07 -0.51 0.04 0.00 0.00 177.00 176.70 1xgr s LEU 124 N -1.58 3.53 0.12 -3.56 1.43 -0.20 -4.87 118.68 113.55 1xgr s LEU 124 Ca 0.46 -1.30 0.05 0.00 -1.03 0.00 0.00 54.13 52.31 1xgr s LEU 124 Cb -0.29 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 1xgr s LEU 124 CO 0.38 -0.20 -0.13 0.00 0.23 0.00 0.00 176.35 176.62 1xgr s ALA 125 N 1.17 1.40 0.57 4.21 0.00 -1.26 -0.31 121.76 127.54 1xgr s ALA 125 Ca -0.07 -1.26 -0.21 0.00 0.00 0.00 0.00 51.96 50.42 1xgr s ALA 125 Cb -0.19 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 1xgr s ALA 125 CO -0.04 0.07 1.31 -0.35 0.00 0.00 0.00 175.76 176.75 1xgr n PRO 126 N 0.55 1.51 -1.74 0.00 -0.04 -1.26 -4.89 135.00 129.13 1xgr n PRO 126 Ca -0.16 0.56 -0.42 0.00 -0.04 0.00 0.00 63.50 63.45 1xgr n PRO 126 Cb 0.57 -2.52 -0.02 0.00 -0.04 0.00 0.00 33.50 31.49 1xgr n PRO 126 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1xgr n VAL 127 N -1.25 1.11 -0.84 0.52 0.31 -1.26 -0.62 118.33 116.29 1xgr n VAL 127 Ca 0.12 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1xgr n VAL 127 Cb 0.45 -1.90 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 1xgr n VAL 127 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xgr n GLY 129 N -1.68 -0.35 0.00 0.00 0.00 0.21 -4.99 105.19 98.38 1xgr n GLY 129 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1xgr n GLY 129 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xgr n ASP 130 N -1.68 0.00 0.00 1.61 2.03 -1.04 -4.98 116.55 112.50 1xgr n ASP 130 Ca -0.15 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.16 1xgr n ASP 130 Cb 0.63 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.03 1xgr n ASP 130 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1xgr n THR 131 N 0.00 0.00 0.04 5.18 -1.04 -1.26 -5.00 114.28 112.19 1xgr n THR 131 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1xgr n THR 131 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1xgr n THR 131 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1xgr n THR 132 N -1.06 0.08 0.00 12.58 -1.04 -1.26 -5.13 114.28 118.46 1xgr n THR 132 Ca 0.00 0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1xgr n THR 132 Cb 0.00 -0.38 0.00 0.00 -1.82 0.00 0.00 70.33 68.13 1xgr n THR 132 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xgr n GLY 133 N 1.94 -2.51 0.05 3.41 0.00 -1.26 -4.88 105.19 101.94 1xgr n GLY 133 Ca 0.00 -1.33 0.13 0.00 0.00 0.00 0.00 46.02 44.82 1xgr n GLY 133 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xgr n SER 134 N 0.00 0.37 -4.26 1.61 7.64 -1.26 -4.79 113.62 112.93 1xgr n SER 134 Ca 0.00 -0.15 -0.14 0.00 1.01 0.00 0.00 58.87 59.58 1xgr n SER 134 Cb 0.00 -0.08 -0.10 0.00 -1.01 0.00 0.00 64.21 63.02 1xgr n SER 134 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1xgr s SER 135 N -2.82 1.34 -0.04 6.43 1.04 -1.26 -0.83 113.70 117.56 1xgr s SER 135 Ca 0.18 -1.19 -0.06 0.00 0.48 0.00 0.00 55.95 55.36 1xgr s SER 135 Cb 0.19 0.10 0.01 0.00 0.10 0.00 0.00 66.02 66.42 1xgr s SER 135 CO 0.57 -0.56 0.14 0.54 0.98 0.00 0.00 173.24 174.91 1xgr s VAL 136 N -3.61 0.03 -0.08 5.02 0.11 0.40 -4.64 120.40 117.63 1xgr s VAL 136 Ca 0.26 -0.25 0.05 0.00 -2.93 0.00 0.00 61.98 59.11 1xgr s VAL 136 Cb 0.06 -0.29 -0.01 0.00 -1.53 0.00 0.00 36.38 34.61 1xgr s VAL 136 CO 0.06 -0.14 -0.24 0.28 -3.33 0.00 0.00 175.10 171.73 1xgr s THR 137 N -0.43 2.15 0.51 5.04 -1.32 -1.26 -1.00 115.64 119.32 1xgr s THR 137 Ca -0.05 -1.02 0.05 0.00 -1.21 0.00 0.00 61.69 59.47 1xgr s THR 137 Cb -0.03 -1.80 0.01 0.00 -1.51 0.00 0.00 72.50 69.17 1xgr s THR 137 CO 0.01 0.56 0.31 -0.76 -2.21 0.00 0.00 174.62 172.53 1xgr s LEU 138 N 0.02 2.78 0.32 9.08 2.01 0.21 -4.72 118.68 128.39 1xgr s LEU 138 Ca -0.09 -1.22 -0.08 0.00 0.01 0.00 0.00 54.13 52.75 1xgr s LEU 138 Cb -0.15 -1.26 0.01 0.00 0.01 0.00 0.00 46.19 44.80 1xgr s LEU 138 CO 0.06 -0.94 0.52 -0.83 1.01 0.00 0.00 176.35 176.16 1xgr s GLY 139 N -4.15 1.03 -0.11 -3.19 0.00 0.58 -1.57 107.32 99.90 1xgr s GLY 139 Ca 0.33 -1.21 -0.04 0.00 0.00 0.00 0.00 44.72 43.79 1xgr s GLY 139 CO 0.20 -0.79 0.23 0.00 0.00 0.00 0.00 173.10 172.73 1xgr s LEU 141 N 2.19 3.93 -0.52 0.00 2.96 0.39 -1.15 118.68 126.48 1xgr s LEU 141 Ca 0.00 -0.57 -0.12 0.00 -0.22 0.00 0.00 54.13 53.22 1xgr s LEU 141 Cb -0.12 -1.94 0.13 0.00 0.50 0.00 0.00 46.19 44.76 1xgr s LEU 141 CO -0.08 -0.18 0.44 -0.69 -1.32 0.00 0.00 176.35 174.52 1xgr s VAL 142 N 1.57 4.68 -0.04 1.68 1.01 0.16 -0.42 120.40 129.04 1xgr s VAL 142 Ca 0.04 -1.75 0.03 0.00 0.00 0.00 0.00 61.98 60.30 1xgr s VAL 142 Cb -0.17 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 1xgr s VAL 142 CO 0.04 -0.83 -0.11 -0.75 0.00 0.00 0.00 175.10 173.45 1xgr s LYS 143 N 1.34 2.56 -0.19 2.72 2.20 -0.29 -0.60 119.74 127.48 1xgr s LYS 143 Ca 0.06 -0.67 -0.00 0.00 -0.36 0.00 0.00 55.97 54.99 1xgr s LYS 143 Cb -0.27 -2.46 0.00 0.00 -1.51 0.00 0.00 37.83 33.60 1xgr s LYS 143 CO 0.00 0.63 0.04 0.41 -0.36 0.00 0.00 175.35 176.07 1xgr n GLY 144 N 2.07 0.43 3.82 5.54 0.00 -0.54 -0.73 105.19 115.78 1xgr n GLY 144 Ca -0.17 -0.73 -0.22 0.00 0.00 0.00 0.00 46.02 44.90 1xgr n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xgr s TYR 145 N -2.39 3.11 -0.28 1.61 1.13 -0.92 -4.50 117.35 115.11 1xgr s TYR 145 Ca 0.02 -0.11 -0.19 0.00 -1.41 0.00 0.00 57.07 55.38 1xgr s TYR 145 Cb -0.01 -1.40 0.09 0.00 -1.10 0.00 0.00 41.96 39.54 1xgr s TYR 145 CO 0.02 0.52 0.78 0.12 -2.51 0.00 0.00 175.55 174.48 1xgr s PHE 146 N -2.13 -0.86 0.13 -3.49 5.36 -0.23 -0.99 117.98 115.77 1xgr s PHE 146 Ca 0.33 1.83 0.01 0.00 -0.96 0.00 0.00 56.93 58.14 1xgr s PHE 146 Cb -0.08 0.47 0.02 0.00 -0.34 0.00 0.00 43.02 43.09 1xgr s PHE 146 CO 0.25 -0.42 0.18 -0.35 -1.46 0.00 0.00 175.22 173.42 1xgr n PRO 147 N 3.56 0.63 -1.43 10.12 -0.04 -1.26 0.37 135.00 146.96 1xgr n PRO 147 Ca -0.17 -0.55 -0.31 0.00 -0.04 0.00 0.00 63.50 62.43 1xgr n PRO 147 Cb 0.57 -0.10 0.07 0.00 -0.04 0.00 0.00 33.50 34.01 1xgr n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1xgr s GLU 148 N -2.76 2.52 0.49 0.54 0.41 -1.26 -4.81 118.70 113.82 1xgr s GLU 148 Ca 0.12 1.16 0.04 0.00 -0.41 0.00 0.00 54.97 55.89 1xgr s GLU 148 Cb -0.01 -1.93 0.04 0.00 -1.78 0.00 0.00 34.13 30.45 1xgr s GLU 148 CO 0.08 -1.44 0.33 -0.35 -0.49 0.00 0.00 175.26 173.39 1xgr n PRO 149 N -3.21 0.77 -4.16 0.39 -0.04 -1.26 -5.00 135.00 122.50 1xgr n PRO 149 Ca 0.09 -3.10 -0.14 0.00 -0.04 0.00 0.00 63.50 60.31 1xgr n PRO 149 Cb 0.53 0.38 -0.11 0.00 -0.04 0.00 0.00 33.50 34.26 1xgr n PRO 149 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1xgr s VAL 150 N -2.46 0.87 -0.10 0.52 -7.23 -1.26 -4.54 120.40 106.19 1xgr s VAL 150 Ca 0.25 -1.55 0.01 0.00 -1.81 0.00 0.00 61.98 58.88 1xgr s VAL 150 Cb -0.02 -1.25 -0.02 0.00 0.56 0.00 0.00 36.38 35.66 1xgr s VAL 150 CO 0.16 -0.53 -0.13 0.42 -0.31 0.00 0.00 175.10 174.70 1xgr s THR 151 N -2.29 3.06 -0.08 5.32 -4.23 -0.40 -4.94 115.64 112.08 1xgr s THR 151 Ca 0.03 -0.68 0.03 0.00 -1.18 0.00 0.00 61.69 59.89 1xgr s THR 151 Cb -0.04 -2.26 0.01 0.00 1.34 0.00 0.00 72.50 71.55 1xgr s THR 151 CO -0.00 0.55 -0.17 -0.22 -0.54 0.00 0.00 174.62 174.23 1xgr s LEU 152 N -0.02 1.83 0.16 4.79 0.20 -1.26 -1.03 118.68 123.35 1xgr s LEU 152 Ca -0.03 -0.41 0.02 0.00 0.69 0.00 0.00 54.13 54.39 1xgr s LEU 152 Cb -0.14 -1.08 -0.05 0.00 -0.43 0.00 0.00 46.19 44.49 1xgr s LEU 152 CO 0.04 0.08 -0.02 0.42 -0.29 0.00 0.00 176.35 176.59 1xgr s THR 153 N 0.55 0.73 -0.13 3.68 -4.23 -0.27 -4.98 115.64 110.99 1xgr s THR 153 Ca -0.16 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 58.38 1xgr s THR 153 Cb -0.17 -2.03 -0.01 0.00 1.34 0.00 0.00 72.50 71.63 1xgr s THR 153 CO 0.06 -0.56 -0.17 0.26 -0.54 0.00 0.00 174.62 173.66 1xgr s TRP 154 N -3.62 2.72 -1.33 3.99 0.52 -1.26 -0.20 118.94 119.76 1xgr s TRP 154 Ca 0.22 -0.88 -0.04 0.00 0.02 0.00 0.00 56.10 55.42 1xgr s TRP 154 Cb 0.06 -1.81 -0.00 0.00 -1.15 0.00 0.00 33.47 30.57 1xgr s TRP 154 CO 0.02 -0.35 0.55 0.09 0.02 0.00 0.00 176.95 177.28 1xgr n ASN 155 N 3.65 -1.41 -1.79 2.95 3.02 0.12 -0.70 115.26 121.09 1xgr n ASN 155 Ca -0.19 -0.97 -0.14 0.00 -0.03 0.00 0.00 54.58 53.25 1xgr n ASN 155 Cb 0.53 -3.32 -0.04 0.00 -0.61 0.00 0.00 39.78 36.33 1xgr n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1xgr n SER 156 N -2.94 -3.93 0.00 6.41 7.64 -1.26 -0.47 113.62 119.06 1xgr n SER 156 Ca -0.27 0.27 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1xgr n SER 156 Cb 0.67 -3.51 0.00 0.00 -1.01 0.00 0.00 64.21 60.35 1xgr n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xgr n GLY 157 N -0.48 0.18 0.13 0.23 0.00 0.12 -4.94 105.19 100.43 1xgr n GLY 157 Ca -0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.00 1xgr n GLY 157 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1xgr h SER 158 N 0.00 0.00 -3.69 1.61 0.87 -0.55 -3.37 113.55 108.42 1xgr h SER 158 Ca 0.00 0.00 -0.68 0.00 -1.23 0.00 0.00 61.79 59.88 1xgr h SER 158 Cb 0.00 0.00 -0.34 0.00 -0.44 0.00 0.00 62.40 61.62 1xgr h SER 158 CO 0.00 0.00 -0.66 -0.22 -0.53 0.00 0.00 176.83 175.42 1xgr s LEU 159 N -4.72 4.33 0.00 2.23 2.96 -0.94 -4.92 118.68 117.62 1xgr s LEU 159 Ca 0.07 -1.54 0.00 0.00 -0.22 0.00 0.00 54.13 52.44 1xgr s LEU 159 Cb 0.11 -1.74 0.00 0.00 0.50 0.00 0.00 46.19 45.06 1xgr s LEU 159 CO 0.52 -0.35 0.00 -1.54 -1.32 0.00 0.00 176.35 173.67 1xgr n SER 160 N 4.59 3.98 -4.90 3.68 3.41 -1.26 -4.12 113.62 119.00 1xgr n SER 160 Ca -0.09 -0.02 -0.28 0.00 -0.26 0.00 0.00 58.87 58.22 1xgr n SER 160 Cb 0.43 0.84 -0.00 0.00 -0.26 0.00 0.00 64.21 65.21 1xgr n SER 160 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1xgr s SER 161 N -1.63 6.28 -1.60 4.04 0.01 -1.26 -4.25 113.70 115.29 1xgr s SER 161 Ca 0.00 1.03 -0.02 0.00 1.31 0.00 0.00 55.95 58.27 1xgr s SER 161 Cb 0.00 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.94 1xgr s SER 161 CO 0.00 -0.61 0.18 0.61 0.41 0.00 0.00 173.24 173.83 1xgr n GLY 162 N -2.27 -0.51 3.65 3.44 0.00 -1.26 -4.58 105.19 103.66 1xgr n GLY 162 Ca 0.02 0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1xgr n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xgr s VAL 163 N -3.01 4.09 -0.18 1.61 1.01 -1.26 -0.54 120.40 122.12 1xgr s VAL 163 Ca 0.10 -0.40 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 1xgr s VAL 163 Cb -0.04 -2.73 0.05 0.00 0.00 0.00 0.00 36.38 33.66 1xgr s VAL 163 CO 0.12 0.55 0.02 -1.00 0.00 0.00 0.00 175.10 174.79 1xgr s HIS 164 N -0.91 1.11 -0.22 5.22 3.76 0.06 -4.99 115.29 119.32 1xgr s HIS 164 Ca 0.14 -0.83 -0.05 0.00 -0.15 0.00 0.00 55.06 54.18 1xgr s HIS 164 Cb -0.11 -1.05 -0.01 0.00 1.11 0.00 0.00 32.58 32.51 1xgr s HIS 164 CO 0.04 -0.58 -0.01 0.99 -0.85 0.00 0.00 174.74 174.33 1xgr s THR 165 N 1.83 3.63 0.44 1.30 2.01 -1.26 -0.55 115.64 123.04 1xgr s THR 165 Ca -0.00 -0.40 -0.04 0.00 0.31 0.00 0.00 61.69 61.55 1xgr s THR 165 Cb -0.16 -2.66 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 1xgr s THR 165 CO -0.07 0.40 0.73 -0.36 -0.69 0.00 0.00 174.62 174.63 1xgr s PHE 166 N 1.47 3.54 0.33 4.92 0.40 -0.78 -5.03 117.98 122.83 1xgr s PHE 166 Ca 0.05 0.73 -0.28 0.00 -0.60 0.00 0.00 56.93 56.83 1xgr s PHE 166 Cb -0.14 -2.22 -0.10 0.00 0.51 0.00 0.00 43.02 41.07 1xgr s PHE 166 CO -0.01 -0.17 1.27 -2.14 0.70 0.00 0.00 175.22 174.87 1xgr s PRO 167 N -4.54 4.36 0.58 0.24 0.02 -1.26 -4.48 135.00 129.92 1xgr s PRO 167 Ca 0.46 2.13 -0.19 0.00 0.02 0.00 0.00 61.00 63.42 1xgr s PRO 167 Cb -0.10 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.33 1xgr s PRO 167 CO 0.42 -0.15 1.21 0.00 -0.33 0.00 0.00 177.00 178.14 1xgr s ALA 168 N -1.17 2.57 0.13 -1.55 0.00 -1.26 -4.84 121.76 115.65 1xgr s ALA 168 Ca 0.49 1.01 0.10 0.00 0.00 0.00 0.00 51.96 53.56 1xgr s ALA 168 Cb -0.38 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.25 1xgr s ALA 168 CO 0.50 -1.13 -0.24 0.14 0.00 0.00 0.00 175.76 175.03 1xgr s VAL 169 N -1.59 2.03 -0.13 0.00 -7.23 -0.15 -4.91 120.40 108.42 1xgr s VAL 169 Ca 0.77 -1.72 -0.25 0.00 -1.81 0.00 0.00 61.98 58.97 1xgr s VAL 169 Cb -0.30 -1.83 -0.02 0.00 0.56 0.00 0.00 36.38 34.78 1xgr s VAL 169 CO 0.33 -0.02 0.79 -0.22 -0.31 0.00 0.00 175.10 175.67 1xgr s LEU 170 N -2.11 4.23 -0.24 1.32 2.96 -1.26 -1.28 118.68 122.30 1xgr s LEU 170 Ca 0.12 1.20 -0.01 0.00 -0.22 0.00 0.00 54.13 55.22 1xgr s LEU 170 Cb -0.09 -3.19 0.07 0.00 0.50 0.00 0.00 46.19 43.47 1xgr s LEU 170 CO 0.06 -0.29 0.02 -1.58 -1.32 0.00 0.00 176.35 173.23 1xgr s GLN 171 N 1.64 1.08 -1.25 1.98 0.74 0.30 -4.84 119.66 119.30 1xgr s GLN 171 Ca 0.39 -0.85 -0.11 0.00 0.05 0.00 0.00 55.36 54.83 1xgr s GLN 171 Cb -0.17 -2.32 -0.00 0.00 1.10 0.00 0.00 33.01 31.61 1xgr s GLN 171 CO 0.15 -0.71 0.65 -1.13 -0.55 0.00 0.00 175.29 173.70 1xgr n SER 172 N 4.82 -3.09 0.00 6.67 3.41 -1.26 -1.76 113.62 122.41 1xgr n SER 172 Ca -0.08 -0.99 0.00 0.00 -0.26 0.00 0.00 58.87 57.54 1xgr n SER 172 Cb 0.45 -3.35 0.00 0.00 -0.26 0.00 0.00 64.21 61.05 1xgr n SER 172 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1xgr n ASP 173 N -2.83 0.00 -4.72 4.04 10.43 -1.26 -5.00 116.55 117.22 1xgr n ASP 173 Ca -0.19 0.00 -0.24 0.00 2.57 0.00 0.00 54.79 56.93 1xgr n ASP 173 Cb 0.63 -0.02 -0.07 0.00 1.84 0.00 0.00 41.12 43.51 1xgr n ASP 173 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1xgr s LEU 174 N 0.00 3.18 0.11 0.64 1.43 -0.72 -4.88 118.68 118.43 1xgr s LEU 174 Ca 0.00 -0.88 -0.05 0.00 -1.03 0.00 0.00 54.13 52.16 1xgr s LEU 174 Cb 0.00 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.56 1xgr s LEU 174 CO 0.00 -0.35 0.35 -0.31 0.23 0.00 0.00 176.35 176.27 1xgr s TYR 175 N -2.48 3.50 -0.02 0.29 2.02 -0.17 0.11 117.35 120.60 1xgr s TYR 175 Ca 0.38 0.56 0.00 0.00 -0.37 0.00 0.00 57.07 57.65 1xgr s TYR 175 Cb -0.01 -2.00 0.02 0.00 -0.40 0.00 0.00 41.96 39.57 1xgr s TYR 175 CO 0.22 0.48 -0.00 0.99 -1.57 0.00 0.00 175.55 175.67 1xgr s THR 176 N -1.57 0.12 0.03 -0.71 2.01 -0.40 -1.47 115.64 113.66 1xgr s THR 176 Ca 0.38 0.05 0.01 0.00 0.31 0.00 0.00 61.69 62.45 1xgr s THR 176 Cb -0.13 -0.19 -0.02 0.00 0.01 0.00 0.00 72.50 72.17 1xgr s THR 176 CO 0.23 0.10 -0.06 -0.22 -0.69 0.00 0.00 174.62 173.98 1xgr s LEU 177 N 0.67 2.25 0.09 4.42 0.20 0.23 -0.98 118.68 125.55 1xgr s LEU 177 Ca -0.06 -0.52 0.04 0.00 0.69 0.00 0.00 54.13 54.27 1xgr s LEU 177 Cb -0.09 -0.06 -0.03 0.00 -0.43 0.00 0.00 46.19 45.57 1xgr s LEU 177 CO -0.01 -0.24 -0.11 -0.94 -0.29 0.00 0.00 176.35 174.76 1xgr s SER 178 N -1.51 1.46 -0.01 3.68 1.04 -1.26 0.37 113.70 117.48 1xgr s SER 178 Ca -0.12 -0.77 -0.00 0.00 0.48 0.00 0.00 55.95 55.54 1xgr s SER 178 Cb -0.10 -0.00 0.01 0.00 0.10 0.00 0.00 66.02 66.03 1xgr s SER 178 CO -0.00 -0.23 0.02 -0.55 0.98 0.00 0.00 173.24 173.46 1xgr s SER 179 N -2.29 0.02 0.08 7.02 0.15 -0.30 -1.87 113.70 116.51 1xgr s SER 179 Ca 0.03 0.03 0.07 0.00 0.70 0.00 0.00 55.95 56.78 1xgr s SER 179 Cb -0.04 -0.02 -0.04 0.00 -1.71 0.00 0.00 66.02 64.21 1xgr s SER 179 CO 0.00 -0.06 -0.12 -0.94 1.20 0.00 0.00 173.24 173.33 1xgr s SER 180 N 0.46 4.24 -0.02 5.45 1.04 0.29 -1.15 113.70 124.02 1xgr s SER 180 Ca -0.04 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.01 1xgr s SER 180 Cb -0.05 -0.79 0.02 0.00 0.10 0.00 0.00 66.02 65.29 1xgr s SER 180 CO -0.01 0.21 0.01 0.54 0.98 0.00 0.00 173.24 174.97 1xgr s VAL 181 N -1.11 0.03 -0.14 5.02 0.11 -0.61 -0.76 120.40 122.94 1xgr s VAL 181 Ca 0.19 0.11 0.01 0.00 -2.93 0.00 0.00 61.98 59.35 1xgr s VAL 181 Cb -0.11 -0.11 -0.00 0.00 -1.53 0.00 0.00 36.38 34.63 1xgr s VAL 181 CO 0.11 0.08 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.89 1xgr s THR 182 N 0.69 2.60 0.27 5.04 2.01 0.30 -0.62 115.64 125.94 1xgr s THR 182 Ca -0.06 -0.80 0.02 0.00 0.31 0.00 0.00 61.69 61.15 1xgr s THR 182 Cb -0.09 -2.08 -0.05 0.00 0.01 0.00 0.00 72.50 70.29 1xgr s THR 182 CO -0.02 0.53 0.10 0.68 -0.69 0.00 0.00 174.62 175.22 1xgr s VAL 183 N 0.63 0.57 0.57 3.82 -7.23 -0.17 -4.59 120.40 113.99 1xgr s VAL 183 Ca -0.09 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 57.91 1xgr s VAL 183 Cb -0.16 -2.62 -0.05 0.00 0.56 0.00 0.00 36.38 34.11 1xgr s VAL 183 CO 0.03 0.00 1.05 0.42 -0.31 0.00 0.00 175.10 176.29 1xgr s THR 184 N -3.69 3.84 0.57 5.32 -4.23 -1.26 -0.45 115.64 115.73 1xgr s THR 184 Ca 0.37 0.92 0.26 0.00 -1.18 0.00 0.00 61.69 62.06 1xgr s THR 184 Cb 0.07 -3.41 0.35 0.00 1.34 0.00 0.00 72.50 70.85 1xgr s THR 184 CO 0.14 -0.47 2.12 0.28 -0.54 0.00 0.00 174.62 176.16 1xgr h SER 185 N 0.67 0.00 0.40 3.99 0.02 -1.26 0.01 113.55 117.37 1xgr h SER 185 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1xgr h SER 185 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1xgr h SER 185 CO 0.58 0.00 -0.02 -1.54 -1.14 0.00 0.00 176.83 174.71 1xgr n SER 186 N -4.03 0.11 -0.06 3.07 3.41 -1.26 -3.71 113.62 111.15 1xgr n SER 186 Ca 0.01 -0.43 -0.22 0.00 -0.26 0.00 0.00 58.87 57.97 1xgr n SER 186 Cb 0.28 -0.18 -0.13 0.00 -0.26 0.00 0.00 64.21 63.92 1xgr n SER 186 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1xgr n THR 187 N -1.14 1.65 -4.97 6.66 -1.04 -0.01 -4.70 114.28 110.73 1xgr n THR 187 Ca 0.16 -0.46 -0.27 0.00 -2.04 0.00 0.00 64.05 61.45 1xgr n THR 187 Cb 0.22 -1.78 -0.15 0.00 -1.82 0.00 0.00 70.33 66.80 1xgr n THR 187 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1xgr s TRP 188 N -2.50 1.82 -1.86 -1.42 -0.00 -1.21 0.31 118.94 114.08 1xgr s TRP 188 Ca -0.28 -0.35 0.04 0.00 -0.00 0.00 0.00 56.10 55.52 1xgr s TRP 188 Cb 0.08 -1.17 0.14 0.00 -0.00 0.00 0.00 33.47 32.52 1xgr s TRP 188 CO 0.67 -0.02 1.07 -0.35 -0.00 0.00 0.00 176.95 178.32 1xgr n PRO 189 N 2.52 1.41 -0.17 5.86 -0.04 -1.26 -4.77 135.00 138.55 1xgr n PRO 189 Ca -0.15 -0.56 -0.03 0.00 -0.04 0.00 0.00 63.50 62.72 1xgr n PRO 189 Cb 0.53 -1.18 0.04 0.00 -0.04 0.00 0.00 33.50 32.84 1xgr n PRO 189 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1xgr h SER 190 N 0.89 -0.60 -3.29 3.54 0.02 -1.82 -3.36 113.55 108.93 1xgr h SER 190 Ca 0.00 0.17 -0.63 0.00 -0.84 0.00 0.00 61.79 60.49 1xgr h SER 190 Cb 0.28 0.37 -0.19 0.00 0.14 0.00 0.00 62.40 63.00 1xgr h SER 190 CO 0.01 -0.21 -0.62 -1.58 -1.14 0.00 0.00 176.83 173.30 1xgr s GLN 191 N -6.19 3.77 0.67 3.45 0.74 0.15 -5.09 119.66 117.16 1xgr s GLN 191 Ca -0.14 -0.43 -0.16 0.00 0.05 0.00 0.00 55.36 54.68 1xgr s GLN 191 Cb 0.17 -3.04 0.01 0.00 1.10 0.00 0.00 33.01 31.25 1xgr s GLN 191 CO 0.72 0.28 1.15 -1.54 -0.55 0.00 0.00 175.29 175.36 1xgr s SER 192 N 0.29 4.81 -0.05 6.67 1.04 -1.26 -4.45 113.70 120.75 1xgr s SER 192 Ca -0.00 2.17 0.01 0.00 0.48 0.00 0.00 55.95 58.60 1xgr s SER 192 Cb -0.13 -2.57 0.02 0.00 0.10 0.00 0.00 66.02 63.44 1xgr s SER 192 CO 0.02 -1.84 -0.03 -0.63 0.98 0.00 0.00 173.24 171.74 1xgr s ILE 193 N -2.12 0.49 -0.03 -1.02 1.01 -1.26 -5.02 121.20 113.24 1xgr s ILE 193 Ca 0.71 -0.07 0.05 0.00 0.00 0.00 0.00 60.65 61.34 1xgr s ILE 193 Cb -0.24 -0.54 -0.01 0.00 0.01 0.00 0.00 42.46 41.67 1xgr s ILE 193 CO 0.41 0.23 -0.18 -0.89 0.00 0.00 0.00 174.94 174.51 1xgr s THR 194 N 1.11 1.47 -0.13 2.92 2.01 -1.26 -0.60 115.64 121.17 1xgr s THR 194 Ca -0.08 -0.77 -0.18 0.00 0.31 0.00 0.00 61.69 60.97 1xgr s THR 194 Cb -0.14 -1.24 -0.04 0.00 0.01 0.00 0.00 72.50 71.09 1xgr s THR 194 CO -0.01 0.42 0.48 0.00 -0.69 0.00 0.00 174.62 174.81 1xgr s ASN 196 N 0.66 3.95 -0.08 0.00 -0.87 0.72 -0.34 114.94 118.98 1xgr s ASN 196 Ca 0.26 -0.44 0.04 0.00 -1.57 0.00 0.00 52.86 51.14 1xgr s ASN 196 Cb -0.15 -1.65 0.00 0.00 -0.02 0.00 0.00 41.25 39.44 1xgr s ASN 196 CO 0.10 0.03 -0.19 -0.69 -2.57 0.00 0.00 177.10 173.78 1xgr s VAL 197 N 1.16 1.66 -0.07 1.60 1.01 -0.23 -1.11 120.40 124.42 1xgr s VAL 197 Ca 0.01 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.25 1xgr s VAL 197 Cb -0.14 -1.46 -0.00 0.00 0.00 0.00 0.00 36.38 34.78 1xgr s VAL 197 CO -0.03 0.47 -0.23 0.00 0.00 0.00 0.00 175.10 175.31 1xgr s ALA 198 N 0.40 2.01 -0.45 5.51 0.00 -0.19 -0.78 121.76 128.25 1xgr s ALA 198 Ca -0.15 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 50.91 1xgr s ALA 198 Cb -0.16 -0.68 0.14 0.00 0.00 0.00 0.00 23.12 22.42 1xgr s ALA 198 CO 0.06 0.34 0.27 -1.58 0.00 0.00 0.00 175.76 174.84 1xgr s HIS 199 N 0.08 1.97 0.24 0.00 2.46 0.96 -1.28 115.29 119.73 1xgr s HIS 199 Ca -0.09 -2.45 -0.06 0.00 0.47 0.00 0.00 55.06 52.92 1xgr s HIS 199 Cb -0.15 -1.82 0.43 0.00 -0.13 0.00 0.00 32.58 30.91 1xgr s HIS 199 CO 0.05 -0.77 1.66 -1.35 -2.47 0.00 0.00 174.74 171.87 1xgr h PRO 200 N 6.54 0.18 -0.82 2.88 0.11 -1.80 -1.61 132.00 137.47 1xgr h PRO 200 Ca 0.03 -0.01 0.13 0.00 0.11 0.00 0.00 66.00 66.27 1xgr h PRO 200 Cb 0.91 -0.04 -0.06 0.00 0.11 0.00 0.00 31.00 31.92 1xgr h PRO 200 CO 0.48 0.12 0.53 0.00 -0.21 0.00 0.00 178.00 178.92 1xgr h ALA 201 N 1.64 1.92 -0.48 -0.75 0.00 -1.92 -1.31 119.26 118.37 1xgr h ALA 201 Ca 0.40 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1xgr h ALA 201 Cb 0.70 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1xgr h ALA 201 CO -0.57 -0.13 0.00 -1.13 0.00 0.00 0.00 179.25 177.42 1xgr n SER 202 N -4.52 3.91 -3.90 0.00 3.41 -0.89 -4.96 113.62 106.67 1xgr n SER 202 Ca 0.15 -2.38 -0.29 0.00 -0.26 0.00 0.00 58.87 56.09 1xgr n SER 202 Cb 0.46 -0.45 0.02 0.00 -0.26 0.00 0.00 64.21 63.98 1xgr n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1xgr n SER 203 N 0.63 -4.11 -4.43 4.04 7.64 -0.49 -4.95 113.62 111.95 1xgr n SER 203 Ca 0.20 -0.80 -0.30 0.00 1.01 0.00 0.00 58.87 58.98 1xgr n SER 203 Cb 0.72 -3.83 -0.13 0.00 -1.01 0.00 0.00 64.21 59.96 1xgr n SER 203 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1xgr s THR 204 N -3.37 2.57 -0.23 0.44 -4.23 -0.66 -5.01 115.64 105.15 1xgr s THR 204 Ca 0.56 -1.47 -0.09 0.00 -1.18 0.00 0.00 61.69 59.51 1xgr s THR 204 Cb -0.28 -2.12 0.10 0.00 1.34 0.00 0.00 72.50 71.54 1xgr s THR 204 CO 0.83 0.20 0.51 -0.75 -0.54 0.00 0.00 174.62 174.88 1xgr s LYS 205 N -1.80 0.45 0.04 3.99 2.20 -1.26 -0.03 119.74 123.34 1xgr s LYS 205 Ca 0.15 1.13 0.03 0.00 -0.36 0.00 0.00 55.97 56.92 1xgr s LYS 205 Cb -0.10 0.40 -0.02 0.00 -1.51 0.00 0.00 37.83 36.60 1xgr s LYS 205 CO 0.07 -0.21 -0.09 0.14 -0.36 0.00 0.00 175.35 174.90 1xgr s VAL 206 N 2.39 0.63 -0.09 4.02 -7.23 0.04 -4.99 120.40 115.17 1xgr s VAL 206 Ca -0.05 -1.08 0.03 0.00 -1.81 0.00 0.00 61.98 59.07 1xgr s VAL 206 Cb -0.11 -0.67 -0.02 0.00 0.56 0.00 0.00 36.38 36.14 1xgr s VAL 206 CO -0.15 -0.33 -0.16 -1.81 -0.31 0.00 0.00 175.10 172.33 1xgr s ASP 207 N -1.54 3.82 -0.20 4.85 -0.00 -1.26 -1.07 116.67 121.28 1xgr s ASP 207 Ca -0.08 -0.32 -0.01 0.00 -0.00 0.00 0.00 52.55 52.14 1xgr s ASP 207 Cb -0.10 -1.18 0.05 0.00 -0.00 0.00 0.00 42.92 41.70 1xgr s ASP 207 CO 0.01 0.25 -0.02 -0.75 -0.00 0.00 0.00 175.17 174.65 1xgr s LYS 208 N -0.15 1.24 0.28 8.23 2.47 0.54 -4.95 119.74 127.40 1xgr s LYS 208 Ca -0.01 -0.64 -0.29 0.00 -1.56 0.00 0.00 55.97 53.46 1xgr s LYS 208 Cb -0.14 -2.23 -0.10 0.00 -1.46 0.00 0.00 37.83 33.91 1xgr s LYS 208 CO 0.03 -0.55 1.13 0.21 0.16 0.00 0.00 175.35 176.33 1xgr s LYS 209 N 1.62 4.60 0.00 4.03 2.20 -1.26 -0.44 119.74 130.50 1xgr s LYS 209 Ca -0.02 1.86 0.26 0.00 -0.36 0.00 0.00 55.97 57.71 1xgr s LYS 209 Cb -0.17 -3.17 0.62 0.00 -1.51 0.00 0.00 37.83 33.60 1xgr s LYS 209 CO -0.07 0.15 1.51 -0.89 -0.36 0.00 0.00 175.35 175.69