#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xgq s VAL 2 N 0.00 4.71 0.01 6.31 0.11 -1.26 -4.23 120.40 126.05 1xgq s VAL 2 Ca 0.00 2.05 0.01 0.00 -2.93 0.00 0.00 61.98 61.11 1xgq s VAL 2 Cb 0.00 -4.31 -0.01 0.00 -1.53 0.00 0.00 36.38 30.53 1xgq s VAL 2 CO 0.00 0.23 -0.04 -1.10 -3.33 0.00 0.00 175.10 170.87 1xgq s GLN 3 N 0.55 0.29 0.17 1.54 -0.21 0.02 -4.97 119.66 117.05 1xgq s GLN 3 Ca 0.49 -0.28 0.10 0.00 0.02 0.00 0.00 55.36 55.69 1xgq s GLN 3 Cb -0.22 -0.19 -0.04 0.00 1.00 0.00 0.00 33.01 33.56 1xgq s GLN 3 CO 0.29 0.04 -0.19 -0.51 -2.12 0.00 0.00 175.29 172.80 1xgq s LEU 4 N -0.51 2.61 -0.19 2.90 1.02 -1.26 -1.06 118.68 122.19 1xgq s LEU 4 Ca -0.03 -0.73 -0.07 0.00 0.02 0.00 0.00 54.13 53.32 1xgq s LEU 4 Cb -0.04 -1.37 0.08 0.00 0.02 0.00 0.00 46.19 44.89 1xgq s LEU 4 CO -0.00 0.13 0.40 -1.58 0.02 0.00 0.00 176.35 175.32 1xgq s GLN 5 N -2.56 0.31 0.31 1.70 2.00 -0.91 -4.38 119.66 116.12 1xgq s GLN 5 Ca 0.21 0.97 -0.14 0.00 -2.00 0.00 0.00 55.36 54.40 1xgq s GLN 5 Cb -0.09 0.25 -0.09 0.00 0.80 0.00 0.00 33.01 33.88 1xgq s GLN 5 CO 0.11 -0.25 0.71 -1.21 -0.50 0.00 0.00 175.29 174.15 1xgq s GLU 6 N 2.46 3.96 -0.11 1.67 8.01 -1.26 -0.84 118.70 132.59 1xgq s GLU 6 Ca -0.02 0.60 -0.29 0.00 0.01 0.00 0.00 54.97 55.27 1xgq s GLU 6 Cb -0.12 -2.46 0.07 0.00 -4.31 0.00 0.00 34.13 27.31 1xgq s GLU 6 CO -0.12 0.17 0.68 -1.54 0.01 0.00 0.00 175.26 174.46 1xgq s SER 7 N -2.32 -0.67 0.00 -0.19 1.04 0.31 -4.90 113.70 106.96 1xgq s SER 7 Ca 0.53 0.92 0.00 0.00 0.48 0.00 0.00 55.95 57.88 1xgq s SER 7 Cb -0.10 0.81 0.00 0.00 0.10 0.00 0.00 66.02 66.82 1xgq s SER 7 CO 0.18 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.52 1xgq n GLY 8 N 1.45 1.07 3.66 7.32 0.00 -1.26 0.19 105.19 117.62 1xgq n GLY 8 Ca -0.18 -1.29 -0.48 0.00 0.00 0.00 0.00 46.02 44.08 1xgq n GLY 8 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1xgq n PRO 9 N -1.15 1.97 0.00 1.61 -0.02 -1.26 -4.86 135.00 131.29 1xgq n PRO 9 Ca 0.00 0.71 0.13 0.00 -2.02 0.00 0.00 63.50 62.33 1xgq n PRO 9 Cb 0.00 -2.47 0.47 0.00 -0.02 0.00 0.00 33.50 31.48 1xgq n PRO 9 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1xgq n SER 10 N 3.88 0.39 -3.87 2.55 3.41 -1.26 -4.77 113.62 113.94 1xgq n SER 10 Ca 0.18 -0.18 -0.24 0.00 -0.26 0.00 0.00 58.87 58.38 1xgq n SER 10 Cb 0.27 -0.07 -0.17 0.00 -0.26 0.00 0.00 64.21 63.98 1xgq n SER 10 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1xgq s LEU 11 N -2.81 1.07 -0.04 1.04 2.96 -1.26 -0.78 118.68 118.85 1xgq s LEU 11 Ca 0.18 -0.19 0.04 0.00 -0.22 0.00 0.00 54.13 53.94 1xgq s LEU 11 Cb 0.19 -0.62 -0.00 0.00 0.50 0.00 0.00 46.19 46.26 1xgq s LEU 11 CO 0.57 -0.11 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.65 1xgq s VAL 12 N 1.50 1.29 0.29 1.68 1.01 0.03 -4.97 120.40 121.23 1xgq s VAL 12 Ca -0.01 -0.64 -0.16 0.00 0.00 0.00 0.00 61.98 61.18 1xgq s VAL 12 Cb -0.13 -1.12 -0.09 0.00 0.00 0.00 0.00 36.38 35.04 1xgq s VAL 12 CO -0.04 0.38 0.72 -0.54 0.00 0.00 0.00 175.10 175.61 1xgq s LYS 13 N 0.10 4.05 0.42 2.72 1.02 -1.26 -1.49 119.74 125.31 1xgq s LYS 13 Ca -0.04 0.69 -0.23 0.00 0.02 0.00 0.00 55.97 56.41 1xgq s LYS 13 Cb -0.11 -2.57 -0.12 0.00 -0.52 0.00 0.00 37.83 34.51 1xgq s LYS 13 CO 0.02 0.24 0.74 -2.30 -0.92 0.00 0.00 175.35 173.12 1xgq n PRO 14 N -0.04 0.86 0.00 -1.68 -0.02 -1.26 -1.30 135.00 131.56 1xgq n PRO 14 Ca 0.02 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1xgq n PRO 14 Cb 0.53 -1.72 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 1xgq n PRO 14 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1xgq n SER 15 N 0.91 0.00 -3.37 2.55 3.41 0.19 -4.93 113.62 112.39 1xgq n SER 15 Ca 0.11 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.55 1xgq n SER 15 Cb 0.39 -0.15 0.11 0.00 -0.26 0.00 0.00 64.21 64.30 1xgq n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xgq n GLN 16 N -1.89 -0.48 -4.21 4.33 1.13 -0.42 -3.81 117.38 112.04 1xgq n GLN 16 Ca 0.00 -1.47 -0.35 0.00 -1.94 0.00 0.00 57.00 53.24 1xgq n GLN 16 Cb 0.00 -0.71 -0.10 0.00 0.11 0.00 0.00 30.24 29.54 1xgq n GLN 16 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1xgq s THR 17 N -2.51 4.47 -0.18 5.09 2.01 -1.26 -2.26 115.64 120.99 1xgq s THR 17 Ca 0.46 -0.17 -0.15 0.00 0.31 0.00 0.00 61.69 62.15 1xgq s THR 17 Cb -0.02 -2.95 -0.04 0.00 0.01 0.00 0.00 72.50 69.50 1xgq s THR 17 CO 0.32 0.53 0.35 -0.22 -0.69 0.00 0.00 174.62 174.91 1xgq s LEU 18 N -0.15 4.19 -0.06 4.42 0.20 -0.02 -4.94 118.68 122.32 1xgq s LEU 18 Ca 0.06 0.50 0.03 0.00 0.69 0.00 0.00 54.13 55.41 1xgq s LEU 18 Cb -0.12 -2.45 0.00 0.00 -0.43 0.00 0.00 46.19 43.19 1xgq s LEU 18 CO 0.02 -0.00 -0.16 -0.44 -0.29 0.00 0.00 176.35 175.48 1xgq s SER 19 N 0.83 2.05 0.04 3.68 0.01 -1.26 -1.07 113.70 117.99 1xgq s SER 19 Ca 0.18 -0.34 0.02 0.00 1.31 0.00 0.00 55.95 57.12 1xgq s SER 19 Cb -0.14 -0.76 -0.02 0.00 0.21 0.00 0.00 66.02 65.31 1xgq s SER 19 CO 0.07 0.10 -0.08 -0.76 0.41 0.00 0.00 173.24 172.98 1xgq s LEU 20 N 0.32 2.26 -0.01 2.44 1.43 -0.78 -4.02 118.68 120.31 1xgq s LEU 20 Ca -0.10 -0.55 0.08 0.00 -1.03 0.00 0.00 54.13 52.53 1xgq s LEU 20 Cb -0.14 -0.18 -0.02 0.00 0.03 0.00 0.00 46.19 45.89 1xgq s LEU 20 CO 0.03 -0.20 -0.25 -0.89 0.23 0.00 0.00 176.35 175.27 1xgq s THR 21 N -1.37 2.11 -0.21 5.49 2.01 0.13 -1.98 115.64 121.82 1xgq s THR 21 Ca -0.10 -1.13 0.01 0.00 0.31 0.00 0.00 61.69 60.79 1xgq s THR 21 Cb -0.10 -1.74 0.04 0.00 0.01 0.00 0.00 72.50 70.71 1xgq s THR 21 CO 0.00 0.55 -0.13 0.00 -0.69 0.00 0.00 174.62 174.36 1xgq s SER 23 N 1.29 6.40 -0.19 0.00 0.01 -0.02 -2.08 113.70 119.11 1xgq s SER 23 Ca -0.02 0.48 -0.12 0.00 1.31 0.00 0.00 55.95 57.60 1xgq s SER 23 Cb -0.16 -2.25 -0.05 0.00 0.21 0.00 0.00 66.02 63.77 1xgq s SER 23 CO -0.09 -0.17 0.21 -0.69 0.41 0.00 0.00 173.24 172.91 1xgq s VAL 24 N 1.79 5.35 0.07 3.43 1.01 -0.61 -2.15 120.40 129.30 1xgq s VAL 24 Ca 0.19 0.34 0.06 0.00 0.00 0.00 0.00 61.98 62.57 1xgq s VAL 24 Cb -0.15 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1xgq s VAL 24 CO 0.09 0.39 -0.15 0.42 0.00 0.00 0.00 175.10 175.85 1xgq s THR 25 N 0.59 1.23 0.00 3.92 -4.23 -0.23 -4.78 115.64 112.14 1xgq s THR 25 Ca 0.11 -1.25 0.00 0.00 -1.18 0.00 0.00 61.69 59.38 1xgq s THR 25 Cb -0.12 -1.14 0.00 0.00 1.34 0.00 0.00 72.50 72.57 1xgq s THR 25 CO 0.02 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.59 1xgq n GLY 26 N 1.46 3.28 3.66 3.99 0.00 -1.26 -0.80 105.19 115.52 1xgq n GLY 26 Ca -0.20 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 1xgq n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xgq s ASP 27 N -0.60 0.19 -0.02 1.61 2.15 -1.26 -4.67 116.67 114.08 1xgq s ASP 27 Ca 0.00 -1.10 -0.14 0.00 0.43 0.00 0.00 52.55 51.73 1xgq s ASP 27 Cb 0.00 0.70 -0.05 0.00 -0.30 0.00 0.00 42.92 43.27 1xgq s ASP 27 CO 0.00 -1.37 0.39 -0.55 -0.17 0.00 0.00 175.17 173.47 1xgq s SER 28 N -3.08 6.77 0.51 -0.34 0.15 -1.26 -4.94 113.70 111.50 1xgq s SER 28 Ca 0.21 0.91 0.16 0.00 0.70 0.00 0.00 55.95 57.93 1xgq s SER 28 Cb -0.03 -2.24 1.23 0.00 -1.71 0.00 0.00 66.02 63.27 1xgq s SER 28 CO 0.13 0.30 2.12 1.62 1.20 0.00 0.00 173.24 178.61 1xgq h VAL 29 N 3.82 1.02 0.00 4.45 3.04 -1.91 0.15 116.25 126.81 1xgq h VAL 29 Ca -0.51 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.08 1xgq h VAL 29 Cb 1.22 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.55 1xgq h VAL 29 CO 0.63 0.03 0.00 0.35 -1.01 0.00 0.00 177.57 177.57 1xgq n THR 30 N -4.50 0.03 -1.10 3.17 -2.24 -1.26 -3.69 114.28 104.68 1xgq n THR 30 Ca -0.03 0.01 -0.14 0.00 -2.27 0.00 0.00 64.05 61.62 1xgq n THR 30 Cb 0.12 -0.52 0.25 0.00 -2.10 0.00 0.00 70.33 68.07 1xgq n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1xgq n SER 31 N -1.26 4.35 -3.62 3.42 7.64 0.04 -4.76 113.62 119.43 1xgq n SER 31 Ca 0.15 -3.38 -0.00 0.00 1.01 0.00 0.00 58.87 56.64 1xgq n SER 31 Cb 0.23 -0.79 0.01 0.00 -1.01 0.00 0.00 64.21 62.64 1xgq n SER 31 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1xgq s ASP 32 N -1.11 -0.03 -0.15 6.43 3.68 -1.24 -4.94 116.67 119.31 1xgq s ASP 32 Ca 0.56 -0.36 -0.04 0.00 2.13 0.00 0.00 52.55 54.84 1xgq s ASP 32 Cb 0.45 0.29 -0.03 0.00 -1.45 0.00 0.00 42.92 42.19 1xgq s ASP 32 CO 0.12 -0.57 -0.00 -0.69 0.13 0.00 0.00 175.17 174.16 1xgq s VAL 33 N -2.29 4.23 0.11 1.11 1.01 -1.26 -3.50 120.40 119.82 1xgq s VAL 33 Ca 0.22 -0.24 0.10 0.00 0.00 0.00 0.00 61.98 62.06 1xgq s VAL 33 Cb 0.00 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1xgq s VAL 33 CO 0.01 0.50 -0.25 0.26 0.00 0.00 0.00 175.10 175.62 1xgq s TRP 34 N 0.14 2.17 0.28 5.22 0.52 -0.55 -0.88 118.94 125.84 1xgq s TRP 34 Ca 0.01 -0.39 0.03 0.00 0.02 0.00 0.00 56.10 55.77 1xgq s TRP 34 Cb -0.13 -1.20 -0.06 0.00 -1.15 0.00 0.00 33.47 30.94 1xgq s TRP 34 CO 0.02 0.28 0.06 -1.12 0.02 0.00 0.00 176.95 176.21 1xgq s SER 35 N -1.91 1.84 -0.10 2.95 0.01 0.95 -0.75 113.70 116.69 1xgq s SER 35 Ca 0.12 -1.34 0.01 0.00 1.31 0.00 0.00 55.95 56.04 1xgq s SER 35 Cb -0.10 0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.17 1xgq s SER 35 CO 0.05 -0.63 -0.12 0.26 0.41 0.00 0.00 173.24 173.21 1xgq s TRP 36 N -3.48 1.72 -0.04 2.43 0.52 -0.82 -1.71 118.94 117.56 1xgq s TRP 36 Ca 0.35 -0.81 0.04 0.00 0.02 0.00 0.00 56.10 55.71 1xgq s TRP 36 Cb 0.08 -1.30 -0.00 0.00 -1.15 0.00 0.00 33.47 31.10 1xgq s TRP 36 CO 0.13 -0.46 -0.16 0.42 0.02 0.00 0.00 176.95 176.91 1xgq s ILE 37 N 1.18 1.31 0.06 2.03 1.09 0.16 -1.29 121.20 125.74 1xgq s ILE 37 Ca -0.04 -0.66 0.09 0.00 -1.10 0.00 0.00 60.65 58.95 1xgq s ILE 37 Cb -0.14 -1.12 -0.03 0.00 -1.06 0.00 0.00 42.46 40.11 1xgq s ILE 37 CO -0.03 0.38 -0.25 0.00 -0.10 0.00 0.00 174.94 174.94 1xgq s ARG 38 N -0.01 1.77 -0.27 2.79 1.70 -0.60 -0.07 118.95 124.26 1xgq s ARG 38 Ca -0.02 -1.14 0.03 0.00 -0.47 0.00 0.00 55.73 54.13 1xgq s ARG 38 Cb -0.10 -2.01 0.07 0.00 -0.57 0.00 0.00 34.95 32.34 1xgq s ARG 38 CO 0.01 0.50 -0.08 0.21 -1.08 0.00 0.00 175.30 174.86 1xgq s LYS 39 N -1.48 2.13 0.75 3.89 2.36 0.10 -1.32 119.74 126.17 1xgq s LYS 39 Ca 0.13 -1.43 -0.11 0.00 -2.55 0.00 0.00 55.97 52.00 1xgq s LYS 39 Cb -0.10 -2.95 0.04 0.00 -1.05 0.00 0.00 37.83 33.77 1xgq s LYS 39 CO 0.04 -0.63 1.09 -0.06 1.55 0.00 0.00 175.35 177.34 1xgq s PHE 40 N 1.07 3.08 0.48 4.03 0.08 0.12 -1.57 117.98 125.27 1xgq s PHE 40 Ca -0.06 1.12 -0.24 0.00 0.12 0.00 0.00 56.93 57.87 1xgq s PHE 40 Cb -0.20 -3.08 -0.07 0.00 -0.57 0.00 0.00 43.02 39.10 1xgq s PHE 40 CO -0.05 -1.46 1.39 -2.14 -0.10 0.00 0.00 175.22 172.85 1xgq s PRO 41 N -5.24 3.50 0.00 0.24 0.02 -1.26 -2.91 135.00 129.35 1xgq s PRO 41 Ca 0.59 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.93 1xgq s PRO 41 Cb -0.13 -2.51 0.00 0.00 0.02 0.00 0.00 34.50 31.88 1xgq s PRO 41 CO 0.53 -0.93 0.00 0.41 -0.33 0.00 0.00 177.00 176.68 1xgq n GLY 42 N 0.63 0.70 3.61 0.52 0.00 -1.26 -4.27 105.19 105.13 1xgq n GLY 42 Ca 0.07 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.35 1xgq n GLY 42 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xgq n ASN 43 N 0.95 -3.24 -4.31 1.61 5.03 -1.15 -4.97 115.26 109.19 1xgq n ASN 43 Ca 0.00 -0.68 -0.40 0.00 0.87 0.00 0.00 54.58 54.37 1xgq n ASN 43 Cb 0.00 -4.65 -0.11 0.00 -1.02 0.00 0.00 39.78 34.00 1xgq n ASN 43 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1xgq s LYS 44 N -5.93 2.68 0.01 3.52 -0.14 -1.16 -4.97 119.74 113.75 1xgq s LYS 44 Ca 0.24 -1.30 -0.16 0.00 -1.36 0.00 0.00 55.97 53.39 1xgq s LYS 44 Cb -0.11 -3.74 -0.06 0.00 -1.68 0.00 0.00 37.83 32.25 1xgq s LYS 44 CO 0.77 -0.84 0.44 -0.51 -0.76 0.00 0.00 175.35 174.44 1xgq s LEU 45 N 1.47 4.48 -0.07 3.17 1.43 -1.26 -0.71 118.68 127.19 1xgq s LEU 45 Ca 0.02 1.01 0.01 0.00 -1.03 0.00 0.00 54.13 54.14 1xgq s LEU 45 Cb -0.21 -2.64 0.02 0.00 0.03 0.00 0.00 46.19 43.39 1xgq s LEU 45 CO 0.04 0.31 -0.06 -0.70 0.23 0.00 0.00 176.35 176.16 1xgq s GLU 46 N -1.03 1.12 -0.64 1.70 2.12 -0.43 -5.01 118.70 116.53 1xgq s GLU 46 Ca 0.25 -0.17 -0.24 0.00 0.36 0.00 0.00 54.97 55.16 1xgq s GLU 46 Cb -0.17 -1.12 0.05 0.00 0.26 0.00 0.00 34.13 33.15 1xgq s GLU 46 CO 0.14 -0.12 1.03 -0.47 -0.54 0.00 0.00 175.26 175.30 1xgq s TYR 47 N 1.16 2.63 0.25 5.30 5.04 -1.26 -1.55 117.35 128.90 1xgq s TYR 47 Ca -0.07 -0.27 -0.01 0.00 -2.44 0.00 0.00 57.07 54.29 1xgq s TYR 47 Cb -0.14 -4.31 0.30 0.00 0.35 0.00 0.00 41.96 38.17 1xgq s TYR 47 CO -0.01 -1.65 1.69 0.52 -1.34 0.00 0.00 175.55 174.76 1xgq h MET 48 N 9.59 0.66 0.00 4.97 2.86 -1.56 -3.41 114.93 128.04 1xgq h MET 48 Ca -0.28 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.12 1xgq h MET 48 Cb 1.07 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.68 1xgq h MET 48 CO 1.18 0.81 0.00 0.41 1.06 0.00 0.00 176.91 180.37 1xgq n GLY 49 N -0.36 0.27 3.24 8.32 0.00 -1.20 -1.55 105.19 113.90 1xgq n GLY 49 Ca 0.00 -1.42 -0.11 0.00 0.00 0.00 0.00 46.02 44.49 1xgq n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xgq s TYR 50 N -1.82 -0.06 -0.15 1.61 -0.85 -0.68 -1.95 117.35 113.46 1xgq s TYR 50 Ca 0.00 -0.15 0.01 0.00 -0.52 0.00 0.00 57.07 56.41 1xgq s TYR 50 Cb 0.00 0.08 0.00 0.00 0.38 0.00 0.00 41.96 42.42 1xgq s TYR 50 CO 0.00 -0.52 -0.19 -1.50 -1.52 0.00 0.00 175.55 171.82 1xgq s ILE 51 N -2.89 2.36 0.84 -3.49 2.07 0.08 -1.76 121.20 118.40 1xgq s ILE 51 Ca -0.03 -0.88 -0.14 0.00 -1.41 0.00 0.00 60.65 58.19 1xgq s ILE 51 Cb 0.00 -1.97 0.20 0.00 0.13 0.00 0.00 42.46 40.82 1xgq s ILE 51 CO -0.06 0.53 1.05 -1.54 -1.91 0.00 0.00 174.94 173.02 1xgq n SER 52 N 4.04 -0.29 0.20 4.50 3.41 -0.03 -1.49 113.62 123.97 1xgq n SER 52 Ca -0.19 -1.33 0.05 0.00 -0.26 0.00 0.00 58.87 57.14 1xgq n SER 52 Cb 0.52 -0.83 0.48 0.00 -0.26 0.00 0.00 64.21 64.12 1xgq n SER 52 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 1xgq h TYR 53 N -1.80 0.06 0.00 7.33 -0.00 -1.85 -2.41 116.97 118.30 1xgq h TYR 53 Ca -0.35 -0.01 -0.04 0.00 0.00 0.00 0.00 58.73 58.34 1xgq h TYR 53 Cb 0.98 -0.02 -0.01 0.00 0.00 0.00 0.00 36.73 37.69 1xgq h TYR 53 CO 0.00 0.21 -0.18 0.66 -0.00 0.00 0.00 178.16 178.85 1xgq h SER 54 N 0.06 0.00 0.00 0.10 4.64 -1.90 -3.47 113.55 112.98 1xgq h SER 54 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1xgq h SER 54 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1xgq h SER 54 CO 0.02 0.17 0.00 0.61 -0.87 0.00 0.00 176.83 176.76 1xgq n GLY 55 N 1.14 0.82 3.73 -0.77 0.00 -0.91 -5.09 105.19 104.12 1xgq n GLY 55 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1xgq n GLY 55 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xgq s SER 56 N -1.85 3.93 0.08 1.61 0.15 -1.26 -4.71 113.70 111.65 1xgq s SER 56 Ca 0.00 1.99 -0.01 0.00 0.70 0.00 0.00 55.95 58.64 1xgq s SER 56 Cb 0.00 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 1xgq s SER 56 CO 0.00 -2.42 -0.01 0.42 1.20 0.00 0.00 173.24 172.42 1xgq s THR 57 N -2.74 0.27 -0.05 6.45 -4.23 -1.26 -0.85 115.64 113.24 1xgq s THR 57 Ca 0.64 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1xgq s THR 57 Cb -0.20 -1.68 0.02 0.00 1.34 0.00 0.00 72.50 71.98 1xgq s THR 57 CO 0.56 -0.84 -0.03 -0.31 -0.54 0.00 0.00 174.62 173.45 1xgq s TYR 58 N -3.90 0.69 0.04 3.99 2.02 -0.72 -5.01 117.35 114.45 1xgq s TYR 58 Ca 0.12 -0.18 0.09 0.00 -0.37 0.00 0.00 57.07 56.73 1xgq s TYR 58 Cb 0.07 -0.67 -0.03 0.00 -0.40 0.00 0.00 41.96 40.93 1xgq s TYR 58 CO -0.06 -0.22 -0.24 0.71 -1.57 0.00 0.00 175.55 174.17 1xgq s TYR 59 N 1.17 2.38 0.12 2.71 2.02 -1.26 -1.69 117.35 122.81 1xgq s TYR 59 Ca -0.07 -0.37 -0.31 0.00 -0.37 0.00 0.00 57.07 55.94 1xgq s TYR 59 Cb -0.14 -1.41 -0.10 0.00 -0.40 0.00 0.00 41.96 39.91 1xgq s TYR 59 CO -0.01 0.15 1.66 -1.58 -1.57 0.00 0.00 175.55 174.19 1xgq s HIS 60 N -0.83 2.64 0.28 2.71 2.46 -0.60 -4.73 115.29 117.24 1xgq s HIS 60 Ca 0.12 0.37 0.03 0.00 0.47 0.00 0.00 55.06 56.05 1xgq s HIS 60 Cb -0.10 -4.00 0.66 0.00 -0.13 0.00 0.00 32.58 29.01 1xgq s HIS 60 CO 0.03 -3.91 1.74 -1.00 -2.47 0.00 0.00 174.74 169.13 1xgq h PRO 61 N 7.70 0.57 0.00 2.88 0.13 -1.93 0.88 132.00 142.23 1xgq h PRO 61 Ca -0.43 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1xgq h PRO 61 Cb 1.20 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 1xgq h PRO 61 CO 0.93 0.38 -0.03 0.66 -0.23 0.00 0.00 178.00 179.71 1xgq h SER 62 N 0.59 0.00 0.06 1.44 4.64 -1.99 -2.35 113.55 115.94 1xgq h SER 62 Ca 0.53 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.47 1xgq h SER 62 Cb 0.87 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.90 1xgq h SER 62 CO -0.42 0.03 -2.30 0.18 -0.87 0.00 0.00 176.83 173.45 1xgq n LEU 63 N -3.40 2.40 -3.28 5.97 4.32 0.85 -4.96 117.00 118.91 1xgq n LEU 63 Ca -0.02 0.00 -0.46 0.00 -0.02 0.00 0.00 56.01 55.51 1xgq n LEU 63 Cb 0.14 -0.73 -0.07 0.00 -1.62 0.00 0.00 43.42 41.14 1xgq n LEU 63 CO 0.25 0.83 0.67 1.17 -1.22 0.00 0.00 177.39 179.10 1xgq n LYS 64 N -3.24 0.00 0.00 3.23 3.00 0.27 -1.17 118.16 120.24 1xgq n LYS 64 Ca -0.39 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 57.92 1xgq n LYS 64 Cb 1.03 -1.05 0.00 0.00 0.00 0.00 0.00 35.03 35.01 1xgq n LYS 64 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1xgq n SER 65 N 2.24 0.00 0.01 3.14 2.88 -1.26 -4.86 113.62 115.76 1xgq n SER 65 Ca 0.19 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.84 1xgq n SER 65 Cb -0.01 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.40 1xgq n SER 65 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1xgq n ARG 66 N 0.00 0.23 -3.88 -1.46 1.74 -0.32 -4.97 116.66 107.99 1xgq n ARG 66 Ca 0.00 -0.04 -0.32 0.00 -0.77 0.00 0.00 57.85 56.72 1xgq n ARG 66 Cb 0.00 -1.54 -0.05 0.00 -1.02 0.00 0.00 32.46 29.86 1xgq n ARG 66 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1xgq s ILE 67 N -3.17 5.39 -0.15 0.55 2.07 -1.24 -0.97 121.20 123.69 1xgq s ILE 67 Ca 0.04 -0.20 -0.07 0.00 -1.41 0.00 0.00 60.65 59.00 1xgq s ILE 67 Cb 0.15 -3.58 0.06 0.00 0.13 0.00 0.00 42.46 39.22 1xgq s ILE 67 CO 0.84 0.24 0.33 -0.55 -1.91 0.00 0.00 174.94 173.90 1xgq s SER 68 N -2.15 -0.27 -0.13 4.50 0.15 -0.29 -4.98 113.70 110.53 1xgq s SER 68 Ca 0.31 0.74 0.03 0.00 0.70 0.00 0.00 55.95 57.72 1xgq s SER 68 Cb -0.13 0.71 0.01 0.00 -1.71 0.00 0.00 66.02 64.90 1xgq s SER 68 CO 0.22 -0.20 -0.22 -0.63 1.20 0.00 0.00 173.24 173.62 1xgq s ILE 69 N 1.66 2.02 0.33 6.45 1.01 -1.26 -0.65 121.20 130.75 1xgq s ILE 69 Ca -0.07 -0.96 0.04 0.00 0.00 0.00 0.00 60.65 59.65 1xgq s ILE 69 Cb -0.10 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 1xgq s ILE 69 CO -0.11 0.54 0.15 0.42 0.00 0.00 0.00 174.94 175.95 1xgq s THR 70 N 0.74 0.44 0.09 2.92 -4.23 -0.89 -4.95 115.64 109.75 1xgq s THR 70 Ca -0.09 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.37 1xgq s THR 70 Cb -0.16 -2.50 -0.02 0.00 1.34 0.00 0.00 72.50 71.16 1xgq s THR 70 CO 0.00 0.00 0.11 0.00 -0.54 0.00 0.00 174.62 174.19 1xgq s ARG 71 N -3.78 0.82 -0.25 3.99 1.70 -1.26 0.13 118.95 120.30 1xgq s ARG 71 Ca 0.33 -1.15 -0.01 0.00 -0.47 0.00 0.00 55.73 54.42 1xgq s ARG 71 Cb 0.05 0.29 0.08 0.00 -0.57 0.00 0.00 34.95 34.79 1xgq s ARG 71 CO 0.17 -0.23 0.05 0.34 -1.08 0.00 0.00 175.30 174.55 1xgq s ASP 72 N -2.93 3.54 0.47 -2.89 -1.08 0.12 -4.95 116.67 108.95 1xgq s ASP 72 Ca 0.10 -1.23 0.20 0.00 -0.52 0.00 0.00 52.55 51.11 1xgq s ASP 72 Cb 0.06 -0.79 1.18 0.00 -1.46 0.00 0.00 42.92 41.91 1xgq s ASP 72 CO -0.07 -0.34 2.01 0.74 0.52 0.00 0.00 175.17 178.03 1xgq h THR 73 N 6.53 0.88 0.00 1.71 2.02 -1.97 0.18 112.91 122.25 1xgq h THR 73 Ca -0.15 -0.66 -0.19 0.00 0.77 0.00 0.00 66.41 66.18 1xgq h THR 73 Cb 1.07 1.38 -0.03 0.00 -1.74 0.00 0.00 68.15 68.83 1xgq h THR 73 CO 0.41 0.17 -0.98 0.77 0.37 0.00 0.00 175.52 176.26 1xgq h SER 74 N 0.00 0.00 0.62 4.18 4.64 -1.95 -3.29 113.55 117.75 1xgq h SER 74 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1xgq h SER 74 Cb 0.37 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1xgq h SER 74 CO 0.02 0.84 -1.38 0.29 -0.87 0.00 0.00 176.83 175.74 1xgq n LYS 75 N -3.25 0.63 -2.97 4.77 5.02 -1.10 -5.00 118.16 116.25 1xgq n LYS 75 Ca -0.02 0.01 -0.12 0.00 -2.02 0.00 0.00 58.31 56.16 1xgq n LYS 75 Cb 0.89 -1.72 0.06 0.00 -0.02 0.00 0.00 35.03 34.25 1xgq n LYS 75 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1xgq n ASN 76 N -2.53 -3.30 -4.02 4.39 5.15 0.62 -4.85 115.26 110.72 1xgq n ASN 76 Ca -0.02 -0.49 -0.08 0.00 -0.60 0.00 0.00 54.58 53.40 1xgq n ASN 76 Cb 0.57 -3.98 -0.09 0.00 -0.53 0.00 0.00 39.78 35.75 1xgq n ASN 76 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1xgq s GLN 77 N -4.65 0.66 0.06 1.20 -0.21 -1.04 -1.57 119.66 114.10 1xgq s GLN 77 Ca 0.13 -1.10 0.02 0.00 0.02 0.00 0.00 55.36 54.43 1xgq s GLN 77 Cb -0.02 0.24 -0.03 0.00 1.00 0.00 0.00 33.01 34.21 1xgq s GLN 77 CO 0.55 -0.15 -0.08 1.52 -2.12 0.00 0.00 175.29 175.00 1xgq s TYR 78 N -3.72 0.78 0.30 0.91 1.13 -0.88 0.13 117.35 115.99 1xgq s TYR 78 Ca 0.05 -0.56 0.07 0.00 -1.41 0.00 0.00 57.07 55.22 1xgq s TYR 78 Cb 0.06 -0.45 -0.06 0.00 -1.10 0.00 0.00 41.96 40.40 1xgq s TYR 78 CO -0.10 -0.08 -0.07 0.71 -2.51 0.00 0.00 175.55 173.51 1xgq s TYR 79 N -1.75 2.08 -0.06 -3.49 1.51 0.34 -1.60 117.35 114.38 1xgq s TYR 79 Ca -0.05 -0.65 0.03 0.00 -1.01 0.00 0.00 57.07 55.39 1xgq s TYR 79 Cb -0.07 -1.20 0.00 0.00 -0.11 0.00 0.00 41.96 40.58 1xgq s TYR 79 CO -0.00 0.36 -0.16 -1.17 -1.11 0.00 0.00 175.55 173.47 1xgq s LEU 80 N -3.49 1.84 -0.07 -1.29 2.96 -0.84 -2.10 118.68 115.69 1xgq s LEU 80 Ca 0.31 -0.35 0.02 0.00 -0.22 0.00 0.00 54.13 53.89 1xgq s LEU 80 Cb 0.04 -0.95 0.01 0.00 0.50 0.00 0.00 46.19 45.79 1xgq s LEU 80 CO 0.13 0.11 -0.12 -1.58 -1.32 0.00 0.00 176.35 173.57 1xgq s GLN 81 N 0.29 1.70 -0.20 1.98 0.74 0.17 -1.87 119.66 122.47 1xgq s GLN 81 Ca -0.09 -0.40 -0.03 0.00 0.05 0.00 0.00 55.36 54.89 1xgq s GLN 81 Cb -0.13 -1.44 0.06 0.00 1.10 0.00 0.00 33.01 32.59 1xgq s GLN 81 CO 0.03 -0.01 0.03 -1.17 -0.55 0.00 0.00 175.29 173.62 1xgq s LEU 82 N 0.80 1.29 0.84 3.68 2.96 -0.23 -1.14 118.68 126.87 1xgq s LEU 82 Ca -0.12 -0.85 -0.13 0.00 -0.22 0.00 0.00 54.13 52.81 1xgq s LEU 82 Cb -0.15 -0.64 0.10 0.00 0.50 0.00 0.00 46.19 46.00 1xgq s LEU 82 CO 0.02 -0.30 1.20 0.20 -1.32 0.00 0.00 176.35 176.15 1xgq s ASN 83 N 1.82 4.23 -0.97 3.68 0.01 -0.15 -0.84 114.94 122.72 1xgq s ASN 83 Ca -0.01 0.66 -0.13 0.00 -0.71 0.00 0.00 52.86 52.66 1xgq s ASN 83 Cb -0.17 -1.06 0.02 0.00 0.41 0.00 0.00 41.25 40.44 1xgq s ASN 83 CO -0.08 -2.07 0.25 -1.20 -1.51 0.00 0.00 177.10 172.50 1xgq n SER 84 N -3.40 -1.20 -4.78 -1.22 7.64 -1.16 -4.88 113.62 104.63 1xgq n SER 84 Ca 0.09 -0.92 -0.30 0.00 1.01 0.00 0.00 58.87 58.75 1xgq n SER 84 Cb 0.61 -1.12 0.09 0.00 -1.01 0.00 0.00 64.21 62.78 1xgq n SER 84 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1xgq s VAL 85 N -3.97 3.29 0.15 0.44 -7.23 -0.96 -4.64 120.40 107.48 1xgq s VAL 85 Ca 0.19 0.42 -0.01 0.00 -1.81 0.00 0.00 61.98 60.76 1xgq s VAL 85 Cb -0.10 -3.04 -0.04 0.00 0.56 0.00 0.00 36.38 33.76 1xgq s VAL 85 CO 0.70 -0.55 0.09 0.42 -0.31 0.00 0.00 175.10 175.45 1xgq s THR 86 N -3.02 0.07 0.63 5.32 -4.23 -1.26 -0.64 115.64 112.52 1xgq s THR 86 Ca 0.61 -1.92 0.20 0.00 -1.18 0.00 0.00 61.69 59.41 1xgq s THR 86 Cb -0.16 -2.17 0.25 0.00 1.34 0.00 0.00 72.50 71.76 1xgq s THR 86 CO 0.55 -0.32 1.50 0.71 -0.54 0.00 0.00 174.62 176.53 1xgq h THR 87 N 2.78 0.08 0.00 3.99 1.35 -1.97 0.41 112.91 119.55 1xgq h THR 87 Ca -0.35 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1xgq h THR 87 Cb 1.22 0.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 1xgq h THR 87 CO 0.57 0.00 0.00 -0.33 -0.25 0.00 0.00 175.52 175.51 1xgq h GLU 88 N 0.00 0.00 -0.11 4.72 3.07 -1.95 -2.36 114.58 117.95 1xgq h GLU 88 Ca 0.17 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 1xgq h GLU 88 Cb 1.70 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.61 1xgq h GLU 88 CO -0.00 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.36 1xgq n ASP 89 N -2.47 1.53 -4.69 1.42 8.00 0.14 -4.84 116.55 115.64 1xgq n ASP 89 Ca 0.01 -1.62 -0.42 0.00 0.71 0.00 0.00 54.79 53.47 1xgq n ASP 89 Cb 0.24 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.24 1xgq n ASP 89 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1xgq s THR 90 N -1.86 3.34 0.02 -3.53 2.01 -0.89 -4.83 115.64 109.89 1xgq s THR 90 Ca 0.34 0.73 -0.28 0.00 0.31 0.00 0.00 61.69 62.80 1xgq s THR 90 Cb 0.18 -3.47 0.10 0.00 0.01 0.00 0.00 72.50 69.32 1xgq s THR 90 CO 0.29 -0.01 1.24 0.00 -0.69 0.00 0.00 174.62 175.44 1xgq s ALA 91 N 2.66 -2.23 -0.23 7.40 0.00 -0.88 -4.62 121.76 123.87 1xgq s ALA 91 Ca 0.70 0.17 -0.11 0.00 0.00 0.00 0.00 51.96 52.72 1xgq s ALA 91 Cb -0.36 0.71 -0.05 0.00 0.00 0.00 0.00 23.12 23.42 1xgq s ALA 91 CO 0.30 -1.10 0.18 0.99 0.00 0.00 0.00 175.76 176.13 1xgq s THR 92 N -2.20 5.35 -0.16 0.00 2.01 -0.61 -1.46 115.64 118.57 1xgq s THR 92 Ca 0.23 0.25 -0.06 0.00 0.31 0.00 0.00 61.69 62.41 1xgq s THR 92 Cb 0.01 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 1xgq s THR 92 CO -0.01 0.35 0.05 -0.31 -0.69 0.00 0.00 174.62 174.02 1xgq s TYR 93 N 0.95 3.26 0.05 4.92 1.51 0.62 0.02 117.35 128.68 1xgq s TYR 93 Ca 0.09 0.12 0.07 0.00 -1.01 0.00 0.00 57.07 56.34 1xgq s TYR 93 Cb -0.13 -2.01 -0.03 0.00 -0.11 0.00 0.00 41.96 39.69 1xgq s TYR 93 CO 0.04 0.26 -0.19 0.71 -1.11 0.00 0.00 175.55 175.26 1xgq s TYR 94 N -0.00 1.63 0.05 2.71 2.02 0.91 -0.63 117.35 124.04 1xgq s TYR 94 Ca 0.06 -0.37 0.05 0.00 -0.37 0.00 0.00 57.07 56.43 1xgq s TYR 94 Cb -0.12 -0.96 -0.04 0.00 -0.40 0.00 0.00 41.96 40.44 1xgq s TYR 94 CO 0.01 0.09 -0.08 0.00 -1.57 0.00 0.00 175.55 174.00 1xgq s ALA 96 N -1.10 -1.07 0.62 0.00 0.00 -0.69 -1.21 121.76 118.31 1xgq s ALA 96 Ca 0.19 -0.03 -0.15 0.00 0.00 0.00 0.00 51.96 51.98 1xgq s ALA 96 Cb -0.11 0.81 -0.02 0.00 0.00 0.00 0.00 23.12 23.80 1xgq s ALA 96 CO 0.11 -0.75 1.06 -1.54 0.00 0.00 0.00 175.76 174.64 1xgq s SER 97 N -2.83 5.60 0.29 0.00 1.04 -0.37 -0.04 113.70 117.39 1xgq s SER 97 Ca 0.06 1.80 -0.02 0.00 0.48 0.00 0.00 55.95 58.27 1xgq s SER 97 Cb -0.00 -2.53 0.41 0.00 0.10 0.00 0.00 66.02 64.00 1xgq s SER 97 CO -0.07 -1.29 1.90 -0.25 0.98 0.00 0.00 173.24 174.50 1xgq h TRP 98 N 0.14 0.98 0.00 5.02 7.01 -1.33 -1.27 115.95 126.50 1xgq h TRP 98 Ca -0.46 -0.03 0.00 0.00 2.11 0.00 0.00 58.89 60.51 1xgq h TRP 98 Cb 1.22 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 27.97 1xgq h TRP 98 CO 0.59 0.70 0.00 0.41 -2.79 0.00 0.00 178.44 177.35 1xgq n GLY 99 N -1.15 -1.01 2.76 2.65 0.00 -1.26 -4.87 105.19 102.31 1xgq n GLY 99 Ca 0.07 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1xgq n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xgq n GLY 100 N -0.47 0.69 0.15 -0.02 0.00 -0.48 -4.91 105.19 100.15 1xgq n GLY 100 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.07 1xgq n GLY 100 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xgq h ASP 101 N 0.00 0.00 -3.69 1.61 3.32 -1.90 -3.45 116.42 112.31 1xgq h ASP 101 Ca 0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 1xgq h ASP 101 Cb 0.06 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 39.29 1xgq h ASP 101 CO 0.00 0.44 -0.83 0.54 -1.72 0.00 0.00 179.24 177.67 1xgq s VAL 102 N -2.99 1.34 0.04 -1.35 0.11 -1.26 -5.03 120.40 111.27 1xgq s VAL 102 Ca 0.04 -0.64 0.03 0.00 -2.93 0.00 0.00 61.98 58.48 1xgq s VAL 102 Cb 0.07 -1.18 -0.02 0.00 -1.53 0.00 0.00 36.38 33.72 1xgq s VAL 102 CO 0.74 0.39 -0.10 0.26 -3.33 0.00 0.00 175.10 173.06 1xgq s TRP 103 N 0.27 0.86 0.74 1.54 0.52 -1.26 -1.23 118.94 120.38 1xgq s TRP 103 Ca -0.08 -0.43 -0.10 0.00 0.02 0.00 0.00 56.10 55.51 1xgq s TRP 103 Cb -0.13 -0.51 0.05 0.00 -1.15 0.00 0.00 33.47 31.73 1xgq s TRP 103 CO 0.03 -0.02 1.09 0.20 0.02 0.00 0.00 176.95 178.27 1xgq s GLY 104 N -1.41 1.62 0.59 0.98 0.00 -0.35 -4.58 107.32 104.17 1xgq s GLY 104 Ca -0.05 -0.66 0.37 0.00 0.00 0.00 0.00 44.72 44.38 1xgq s GLY 104 CO 0.01 -0.23 2.14 0.00 0.00 0.00 0.00 173.10 175.02 1xgq h ALA 105 N -0.76 1.03 0.00 3.20 0.00 -1.91 -3.45 119.26 117.37 1xgq h ALA 105 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1xgq h ALA 105 Cb 1.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1xgq h ALA 105 CO 0.64 0.02 0.00 0.41 0.00 0.00 0.00 179.25 180.32 1xgq n GLY 106 N -0.47 -0.69 2.85 0.00 0.00 -1.26 -5.04 105.19 100.58 1xgq n GLY 106 Ca -0.01 -1.47 -0.13 0.00 0.00 0.00 0.00 46.02 44.41 1xgq n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1xgq s THR 107 N -3.02 -0.02 0.09 2.61 -1.32 0.20 -4.93 115.64 109.26 1xgq s THR 107 Ca 0.00 0.06 -0.26 0.00 -1.21 0.00 0.00 61.69 60.28 1xgq s THR 107 Cb 0.00 -0.04 -0.06 0.00 -1.51 0.00 0.00 72.50 70.89 1xgq s THR 107 CO 0.00 0.02 0.80 -0.89 -2.21 0.00 0.00 174.62 172.35 1xgq s THR 108 N 0.29 4.58 -0.12 5.08 2.01 -1.26 -0.27 115.64 125.95 1xgq s THR 108 Ca -0.02 1.73 0.01 0.00 0.31 0.00 0.00 61.69 63.72 1xgq s THR 108 Cb -0.03 -4.16 0.02 0.00 0.01 0.00 0.00 72.50 68.33 1xgq s THR 108 CO -0.01 0.40 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.48 1xgq s VAL 109 N -0.36 1.51 -0.13 3.82 1.01 -0.54 -4.60 120.40 121.11 1xgq s VAL 109 Ca 0.39 -0.64 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 1xgq s VAL 109 Cb -0.22 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 1xgq s VAL 109 CO 0.25 0.44 -0.04 -0.89 0.00 0.00 0.00 175.10 174.86 1xgq s THR 110 N 1.08 3.87 -0.31 3.92 2.01 0.04 -2.06 115.64 124.19 1xgq s THR 110 Ca -0.04 -0.38 -0.09 0.00 0.31 0.00 0.00 61.69 61.49 1xgq s THR 110 Cb -0.14 -2.67 0.00 0.00 0.01 0.00 0.00 72.50 69.70 1xgq s THR 110 CO -0.03 0.53 0.13 -0.69 -0.69 0.00 0.00 174.62 173.86 1xgq s VAL 111 N 0.01 4.35 0.01 3.82 1.01 -1.25 -0.79 120.40 127.56 1xgq s VAL 111 Ca 0.00 -0.55 -0.29 0.00 0.00 0.00 0.00 61.98 61.15 1xgq s VAL 111 Cb -0.13 -3.24 0.07 0.00 0.00 0.00 0.00 36.38 33.07 1xgq s VAL 111 CO 0.03 0.05 0.66 -0.55 0.00 0.00 0.00 175.10 175.29 1xgq s SER 112 N 1.57 -0.63 0.00 3.32 0.15 -0.55 -4.36 113.70 113.19 1xgq s SER 112 Ca 0.04 0.52 0.22 0.00 0.70 0.00 0.00 55.95 57.42 1xgq s SER 112 Cb -0.17 0.56 0.30 0.00 -1.71 0.00 0.00 66.02 65.00 1xgq s SER 112 CO 0.05 -0.71 1.28 -1.54 1.20 0.00 0.00 173.24 173.52 1xgq n SER 113 N 0.55 3.12 -4.77 5.45 3.41 -1.26 -4.04 113.62 116.08 1xgq n SER 113 Ca -0.18 -1.94 -0.36 0.00 -0.26 0.00 0.00 58.87 56.13 1xgq n SER 113 Cb 0.59 -0.14 -0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1xgq n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xgq s ALA 114 N -1.57 2.82 0.26 7.33 0.00 -1.26 -5.05 121.76 124.29 1xgq s ALA 114 Ca 0.31 0.90 0.06 0.00 0.00 0.00 0.00 51.96 53.23 1xgq s ALA 114 Cb 0.20 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.91 1xgq s ALA 114 CO 0.28 -0.75 0.31 0.15 0.00 0.00 0.00 175.76 175.75 1xgq s LYS 115 N -3.00 3.19 0.17 0.00 1.02 -1.26 -5.02 119.74 114.83 1xgq s LYS 115 Ca 0.69 -0.92 -0.34 0.00 0.02 0.00 0.00 55.97 55.42 1xgq s LYS 115 Cb -0.27 -2.74 -0.15 0.00 -0.52 0.00 0.00 37.83 34.15 1xgq s LYS 115 CO 0.31 0.37 1.39 2.41 -0.92 0.00 0.00 175.35 178.91 1xgq n THR 116 N -1.35 0.44 -3.70 2.17 -1.04 -1.26 -4.71 114.28 104.83 1xgq n THR 116 Ca -0.07 -0.11 -0.15 0.00 -2.04 0.00 0.00 64.05 61.68 1xgq n THR 116 Cb 0.58 -1.20 -0.15 0.00 -1.82 0.00 0.00 70.33 67.73 1xgq n THR 116 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1xgq s THR 117 N 0.32 -0.20 0.47 12.58 2.01 0.10 -4.94 115.64 125.99 1xgq s THR 117 Ca 0.76 0.28 -0.22 0.00 0.31 0.00 0.00 61.69 62.81 1xgq s THR 117 Cb -0.77 -0.31 -0.07 0.00 0.01 0.00 0.00 72.50 71.36 1xgq s THR 117 CO 0.46 0.11 1.17 0.00 -0.69 0.00 0.00 174.62 175.67 1xgq s ALA 118 N 1.89 2.93 0.58 7.40 0.00 -1.26 -1.25 121.76 132.03 1xgq s ALA 118 Ca -0.02 0.93 -0.11 0.00 0.00 0.00 0.00 51.96 52.77 1xgq s ALA 118 Cb -0.12 -3.39 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 1xgq s ALA 118 CO -0.06 -0.70 0.98 -1.25 0.00 0.00 0.00 175.76 174.72 1xgq s PRO 119 N -2.79 3.65 -0.17 0.00 0.04 -1.26 -4.51 135.00 129.96 1xgq s PRO 119 Ca 0.65 0.69 -0.08 0.00 0.04 0.00 0.00 61.00 62.30 1xgq s PRO 119 Cb -0.28 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 1xgq s PRO 119 CO 0.34 -0.45 0.10 -1.12 0.04 0.00 0.00 177.00 175.91 1xgq s SER 120 N -3.98 6.01 -0.25 6.66 0.01 -0.30 -4.93 113.70 116.93 1xgq s SER 120 Ca 0.54 0.24 -0.04 0.00 1.31 0.00 0.00 55.95 58.00 1xgq s SER 120 Cb -0.11 -2.00 0.01 0.00 0.21 0.00 0.00 66.02 64.13 1xgq s SER 120 CO 0.49 0.25 -0.02 -0.69 0.41 0.00 0.00 173.24 173.68 1xgq s VAL 121 N -0.08 3.38 -0.06 3.43 1.01 -1.26 -1.21 120.40 125.62 1xgq s VAL 121 Ca 0.09 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.39 1xgq s VAL 121 Cb -0.12 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 1xgq s VAL 121 CO 0.00 0.27 -0.11 -0.31 0.00 0.00 0.00 175.10 174.95 1xgq s TYR 122 N 1.44 2.82 0.30 5.22 2.02 0.00 -4.97 117.35 124.18 1xgq s TYR 122 Ca 0.03 -0.07 -0.25 0.00 -0.37 0.00 0.00 57.07 56.41 1xgq s TYR 122 Cb -0.16 -1.67 -0.10 0.00 -0.40 0.00 0.00 41.96 39.64 1xgq s TYR 122 CO -0.02 0.26 0.91 -1.25 -1.57 0.00 0.00 175.55 173.87 1xgq s PRO 123 N -0.77 4.55 -0.27 -1.71 0.04 -1.26 -0.86 135.00 134.72 1xgq s PRO 123 Ca 0.12 1.26 0.03 0.00 0.04 0.00 0.00 61.00 62.45 1xgq s PRO 123 Cb -0.11 -2.84 0.07 0.00 0.04 0.00 0.00 34.50 31.65 1xgq s PRO 123 CO 0.01 0.31 -0.08 -0.51 0.04 0.00 0.00 177.00 176.77 1xgq s LEU 124 N -1.98 3.60 0.08 -3.56 1.43 0.64 -4.87 118.68 114.02 1xgq s LEU 124 Ca 0.48 -1.50 0.04 0.00 -1.03 0.00 0.00 54.13 52.12 1xgq s LEU 124 Cb -0.19 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.46 1xgq s LEU 124 CO 0.24 -0.22 -0.12 0.00 0.23 0.00 0.00 176.35 176.48 1xgq s ALA 125 N 1.08 1.07 0.41 4.21 0.00 -1.26 -0.33 121.76 126.95 1xgq s ALA 125 Ca -0.06 -1.04 -0.25 0.00 0.00 0.00 0.00 51.96 50.60 1xgq s ALA 125 Cb -0.20 -0.03 -0.10 0.00 0.00 0.00 0.00 23.12 22.79 1xgq s ALA 125 CO -0.06 0.06 1.23 -0.35 0.00 0.00 0.00 175.76 176.64 1xgq n PRO 126 N 1.01 1.84 -1.68 0.00 -0.04 -1.26 -4.85 135.00 130.03 1xgq n PRO 126 Ca -0.19 0.65 -0.45 0.00 -0.04 0.00 0.00 63.50 63.47 1xgq n PRO 126 Cb 0.56 -2.32 -0.04 0.00 -0.04 0.00 0.00 33.50 31.66 1xgq n PRO 126 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1xgq n VAL 127 N -0.21 0.39 -2.33 0.52 0.31 -1.26 -1.39 118.33 114.36 1xgq n VAL 127 Ca 0.07 -0.07 -0.19 0.00 -0.01 0.00 0.00 64.34 64.14 1xgq n VAL 127 Cb 0.39 -1.90 -0.01 0.00 -0.91 0.00 0.00 33.84 31.41 1xgq n VAL 127 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xgq n GLY 129 N -1.00 -0.49 3.12 0.00 0.00 -0.48 -4.82 105.19 101.52 1xgq n GLY 129 Ca -0.23 0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 1xgq n GLY 129 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xgq n ASP 130 N -2.27 4.60 -4.73 1.61 2.03 -1.15 -4.97 116.55 111.67 1xgq n ASP 130 Ca -0.03 -2.93 -0.42 0.00 0.52 0.00 0.00 54.79 51.94 1xgq n ASP 130 Cb 0.55 -1.65 -0.03 0.00 -0.72 0.00 0.00 41.12 39.27 1xgq n ASP 130 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1xgq s THR 131 N 2.83 3.56 0.00 5.18 2.01 -1.26 -4.92 115.64 123.03 1xgq s THR 131 Ca 0.47 1.22 0.00 0.00 0.31 0.00 0.00 61.69 63.69 1xgq s THR 131 Cb 0.08 -3.78 0.00 0.00 0.01 0.00 0.00 72.50 68.81 1xgq s THR 131 CO -0.01 0.15 0.00 0.35 -0.69 0.00 0.00 174.62 174.42 1xgq n THR 132 N 3.12 0.00 0.00 -0.82 -2.24 -1.26 -5.10 114.28 107.97 1xgq n THR 132 Ca 0.07 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1xgq n THR 132 Cb 0.44 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.85 1xgq n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xgq n GLY 133 N 3.42 -3.24 0.17 3.38 0.00 -1.26 -4.88 105.19 102.77 1xgq n GLY 133 Ca 0.00 -1.15 0.08 0.00 0.00 0.00 0.00 46.02 44.94 1xgq n GLY 133 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xgq h SER 134 N 0.00 0.00 -2.26 1.61 0.02 -1.99 -3.45 113.55 107.48 1xgq h SER 134 Ca 0.00 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 1xgq h SER 134 Cb 0.00 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.40 1xgq h SER 134 CO 0.00 0.23 -0.68 -0.94 -1.14 0.00 0.00 176.83 174.30 1xgq s SER 135 N -6.17 3.41 -0.01 3.07 1.04 -1.26 0.64 113.70 114.42 1xgq s SER 135 Ca 0.04 -1.20 -0.01 0.00 0.48 0.00 0.00 55.95 55.26 1xgq s SER 135 Cb 0.07 -0.29 0.00 0.00 0.10 0.00 0.00 66.02 65.90 1xgq s SER 135 CO 0.72 -0.25 0.04 0.54 0.98 0.00 0.00 173.24 175.27 1xgq s VAL 136 N -2.74 0.01 -0.11 5.02 0.11 0.93 -4.67 120.40 118.95 1xgq s VAL 136 Ca 0.32 -0.08 0.00 0.00 -2.93 0.00 0.00 61.98 59.29 1xgq s VAL 136 Cb 0.03 -0.09 -0.02 0.00 -1.53 0.00 0.00 36.38 34.77 1xgq s VAL 136 CO 0.15 -0.05 -0.12 0.28 -3.33 0.00 0.00 175.10 172.04 1xgq s THR 137 N -0.12 3.21 0.41 5.04 -1.32 -1.26 -0.86 115.64 120.74 1xgq s THR 137 Ca -0.02 -0.62 0.07 0.00 -1.21 0.00 0.00 61.69 59.91 1xgq s THR 137 Cb -0.01 -2.33 -0.08 0.00 -1.51 0.00 0.00 72.50 68.57 1xgq s THR 137 CO 0.00 0.54 0.01 -0.76 -2.21 0.00 0.00 174.62 172.21 1xgq s LEU 138 N -0.03 2.87 0.30 9.08 2.01 0.60 -4.70 118.68 128.80 1xgq s LEU 138 Ca -0.02 -1.37 -0.08 0.00 0.01 0.00 0.00 54.13 52.67 1xgq s LEU 138 Cb -0.14 -0.91 0.00 0.00 0.01 0.00 0.00 46.19 45.15 1xgq s LEU 138 CO 0.04 -0.46 0.48 -0.83 1.01 0.00 0.00 176.35 176.59 1xgq s GLY 139 N -3.72 1.02 -0.05 -3.19 0.00 0.55 -0.66 107.32 101.27 1xgq s GLY 139 Ca 0.34 -1.21 -0.02 0.00 0.00 0.00 0.00 44.72 43.83 1xgq s GLY 139 CO 0.18 -0.82 0.10 0.00 0.00 0.00 0.00 173.10 172.56 1xgq s LEU 141 N 1.54 3.37 -0.40 0.00 2.96 -0.04 -1.00 118.68 125.11 1xgq s LEU 141 Ca -0.04 -0.46 -0.10 0.00 -0.22 0.00 0.00 54.13 53.31 1xgq s LEU 141 Cb -0.12 -1.83 0.05 0.00 0.50 0.00 0.00 46.19 44.79 1xgq s LEU 141 CO -0.05 -0.08 0.23 -0.69 -1.32 0.00 0.00 176.35 174.44 1xgq s VAL 142 N 1.52 4.41 -0.02 1.68 1.01 0.19 -0.82 120.40 128.37 1xgq s VAL 142 Ca 0.05 -1.11 0.07 0.00 0.00 0.00 0.00 61.98 60.98 1xgq s VAL 142 Cb -0.15 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 1xgq s VAL 142 CO 0.01 -0.36 -0.23 -0.75 0.00 0.00 0.00 175.10 173.76 1xgq s LYS 143 N 1.49 1.91 -0.33 2.72 2.20 -0.35 -0.27 119.74 127.12 1xgq s LYS 143 Ca 0.02 -0.82 -0.02 0.00 -0.36 0.00 0.00 55.97 54.79 1xgq s LYS 143 Cb -0.21 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 34.29 1xgq s LYS 143 CO 0.05 0.48 0.28 0.41 -0.36 0.00 0.00 175.35 176.21 1xgq n GLY 144 N 2.55 0.56 3.71 5.54 0.00 -0.49 -1.14 105.19 115.93 1xgq n GLY 144 Ca -0.16 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.19 1xgq n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xgq s TYR 145 N -3.08 2.82 -0.28 1.61 1.13 -1.00 -4.44 117.35 114.11 1xgq s TYR 145 Ca 0.13 -0.22 -0.21 0.00 -1.41 0.00 0.00 57.07 55.36 1xgq s TYR 145 Cb -0.06 -1.34 0.11 0.00 -1.10 0.00 0.00 41.96 39.57 1xgq s TYR 145 CO 0.18 0.53 0.89 0.12 -2.51 0.00 0.00 175.55 174.77 1xgq s PHE 146 N -2.29 -0.67 0.00 -3.49 5.36 -0.38 -1.09 117.98 115.42 1xgq s PHE 146 Ca 0.33 1.48 0.00 0.00 -0.96 0.00 0.00 56.93 57.79 1xgq s PHE 146 Cb -0.06 0.39 0.00 0.00 -0.34 0.00 0.00 43.02 43.01 1xgq s PHE 146 CO 0.22 -0.33 0.00 -0.35 -1.46 0.00 0.00 175.22 173.30 1xgq n PRO 147 N 3.04 0.79 -1.77 10.12 -0.04 -1.26 0.03 135.00 145.90 1xgq n PRO 147 Ca -0.16 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.00 1xgq n PRO 147 Cb 0.57 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.05 1xgq n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1xgq s GLU 148 N -1.89 3.30 0.18 0.54 2.02 -1.26 -4.81 118.70 116.78 1xgq s GLU 148 Ca 0.00 0.78 0.01 0.00 0.02 0.00 0.00 54.97 55.78 1xgq s GLU 148 Cb 0.00 -2.04 0.01 0.00 0.10 0.00 0.00 34.13 32.20 1xgq s GLU 148 CO 0.00 -0.79 0.08 -0.35 0.02 0.00 0.00 175.26 174.22 1xgq n PRO 149 N -2.90 1.37 -4.30 0.39 -0.04 -1.26 -4.99 135.00 123.27 1xgq n PRO 149 Ca 0.07 -1.19 -0.16 0.00 -0.04 0.00 0.00 63.50 62.17 1xgq n PRO 149 Cb 0.54 0.21 -0.10 0.00 -0.04 0.00 0.00 33.50 34.11 1xgq n PRO 149 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1xgq s VAL 150 N -1.19 1.09 -0.13 0.52 -7.23 -1.26 -4.45 120.40 107.75 1xgq s VAL 150 Ca 0.06 -2.05 0.01 0.00 -1.81 0.00 0.00 61.98 58.20 1xgq s VAL 150 Cb -0.00 -2.18 0.02 0.00 0.56 0.00 0.00 36.38 34.78 1xgq s VAL 150 CO 0.04 -0.47 -0.16 0.42 -0.31 0.00 0.00 175.10 174.62 1xgq s THR 151 N -3.38 1.63 -0.09 5.32 -4.23 -0.10 -4.96 115.64 109.82 1xgq s THR 151 Ca 0.24 -0.70 0.04 0.00 -1.18 0.00 0.00 61.69 60.09 1xgq s THR 151 Cb 0.04 -1.49 -0.01 0.00 1.34 0.00 0.00 72.50 72.38 1xgq s THR 151 CO 0.06 0.47 -0.22 -0.22 -0.54 0.00 0.00 174.62 174.17 1xgq s LEU 152 N 1.17 2.24 0.14 4.79 0.20 -1.26 -1.11 118.68 124.85 1xgq s LEU 152 Ca -0.02 -0.48 0.02 0.00 0.69 0.00 0.00 54.13 54.34 1xgq s LEU 152 Cb -0.14 -1.45 -0.04 0.00 -0.43 0.00 0.00 46.19 44.13 1xgq s LEU 152 CO -0.06 0.19 -0.04 0.42 -0.29 0.00 0.00 176.35 176.58 1xgq s THR 153 N 0.16 0.75 -0.13 3.68 -4.23 -0.17 -4.98 115.64 110.72 1xgq s THR 153 Ca -0.12 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 58.42 1xgq s THR 153 Cb -0.16 -1.91 -0.01 0.00 1.34 0.00 0.00 72.50 71.75 1xgq s THR 153 CO 0.07 -0.67 -0.14 0.26 -0.54 0.00 0.00 174.62 173.60 1xgq s TRP 154 N -3.60 2.80 -1.47 3.99 0.52 -1.26 0.06 118.94 119.98 1xgq s TRP 154 Ca 0.18 -0.65 -0.05 0.00 0.02 0.00 0.00 56.10 55.60 1xgq s TRP 154 Cb 0.05 -1.83 0.04 0.00 -1.15 0.00 0.00 33.47 30.58 1xgq s TRP 154 CO 0.00 -0.21 0.55 0.09 0.02 0.00 0.00 176.95 177.40 1xgq n ASN 155 N 3.50 -1.32 -1.71 2.95 3.02 0.71 -0.72 115.26 121.69 1xgq n ASN 155 Ca -0.18 -0.98 -0.15 0.00 -0.03 0.00 0.00 54.58 53.24 1xgq n ASN 155 Cb 0.53 -3.11 -0.05 0.00 -0.61 0.00 0.00 39.78 36.54 1xgq n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1xgq n SER 156 N -2.91 -4.14 0.00 6.41 7.64 -1.26 -0.68 113.62 118.68 1xgq n SER 156 Ca -0.20 0.31 0.00 0.00 1.01 0.00 0.00 58.87 59.98 1xgq n SER 156 Cb 0.63 -3.70 0.00 0.00 -1.01 0.00 0.00 64.21 60.13 1xgq n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xgq n GLY 157 N -0.44 1.32 0.12 0.23 0.00 0.10 -4.93 105.19 101.58 1xgq n GLY 157 Ca -0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.97 1xgq n GLY 157 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xgq n SER 158 N 0.00 0.58 -3.98 1.61 7.64 0.15 -4.15 113.62 115.47 1xgq n SER 158 Ca 0.00 0.66 -0.31 0.00 1.01 0.00 0.00 58.87 60.23 1xgq n SER 158 Cb 0.00 -0.77 -0.15 0.00 -1.01 0.00 0.00 64.21 62.27 1xgq n SER 158 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1xgq s LEU 159 N -4.31 3.67 0.00 -3.43 2.96 -1.06 -4.95 118.68 111.57 1xgq s LEU 159 Ca 0.04 -1.71 0.00 0.00 -0.22 0.00 0.00 54.13 52.24 1xgq s LEU 159 Cb 0.09 -1.42 0.00 0.00 0.50 0.00 0.00 46.19 45.36 1xgq s LEU 159 CO 0.35 -0.31 0.00 -1.54 -1.32 0.00 0.00 176.35 173.53 1xgq n SER 160 N 4.46 4.18 -4.86 3.68 3.41 -1.26 -4.18 113.62 119.05 1xgq n SER 160 Ca -0.04 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.26 1xgq n SER 160 Cb 0.42 0.80 -0.02 0.00 -0.26 0.00 0.00 64.21 65.16 1xgq n SER 160 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1xgq s SER 161 N -1.75 6.46 -1.70 4.04 0.01 -1.26 -4.14 113.70 115.36 1xgq s SER 161 Ca 0.00 1.42 -0.02 0.00 1.31 0.00 0.00 55.95 58.66 1xgq s SER 161 Cb 0.00 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.78 1xgq s SER 161 CO 0.00 -0.65 0.26 0.61 0.41 0.00 0.00 173.24 173.88 1xgq n GLY 162 N -1.95 -0.51 3.65 3.44 0.00 -1.26 -4.63 105.19 103.93 1xgq n GLY 162 Ca 0.05 0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1xgq n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xgq s VAL 163 N -3.11 4.04 -0.18 1.61 1.01 -1.26 -1.03 120.40 121.48 1xgq s VAL 163 Ca 0.13 -0.53 -0.03 0.00 0.00 0.00 0.00 61.98 61.56 1xgq s VAL 163 Cb -0.06 -2.75 0.06 0.00 0.00 0.00 0.00 36.38 33.63 1xgq s VAL 163 CO 0.16 0.47 0.03 -1.00 0.00 0.00 0.00 175.10 174.76 1xgq s HIS 164 N -0.98 1.00 -0.28 5.22 3.76 0.03 -4.98 115.29 119.06 1xgq s HIS 164 Ca 0.17 -0.77 -0.04 0.00 -0.15 0.00 0.00 55.06 54.26 1xgq s HIS 164 Cb -0.11 -1.01 0.02 0.00 1.11 0.00 0.00 32.58 32.59 1xgq s HIS 164 CO 0.07 -0.57 0.02 0.99 -0.85 0.00 0.00 174.74 174.39 1xgq s THR 165 N 1.87 3.44 0.45 1.30 2.01 -1.26 0.02 115.64 123.46 1xgq s THR 165 Ca -0.00 -0.91 -0.11 0.00 0.31 0.00 0.00 61.69 60.98 1xgq s THR 165 Cb -0.16 -2.79 -0.06 0.00 0.01 0.00 0.00 72.50 69.49 1xgq s THR 165 CO -0.08 0.10 0.83 -0.36 -0.69 0.00 0.00 174.62 174.42 1xgq s PHE 166 N 1.40 3.49 0.47 4.92 0.40 -0.70 -5.02 117.98 122.94 1xgq s PHE 166 Ca 0.01 1.12 -0.24 0.00 -0.60 0.00 0.00 56.93 57.21 1xgq s PHE 166 Cb -0.17 -2.51 -0.07 0.00 0.51 0.00 0.00 43.02 40.77 1xgq s PHE 166 CO -0.01 -0.21 1.39 -2.14 0.70 0.00 0.00 175.22 174.95 1xgq s PRO 167 N -4.08 3.56 0.51 0.24 0.02 -1.26 -4.42 135.00 129.58 1xgq s PRO 167 Ca 0.53 2.34 -0.20 0.00 0.02 0.00 0.00 61.00 63.68 1xgq s PRO 167 Cb -0.10 -2.55 -0.07 0.00 0.02 0.00 0.00 34.50 31.80 1xgq s PRO 167 CO 0.34 -0.89 1.11 0.00 -0.33 0.00 0.00 177.00 177.24 1xgq s ALA 168 N -1.24 2.78 0.23 -1.55 0.00 -1.26 -4.81 121.76 115.91 1xgq s ALA 168 Ca 0.64 0.80 0.09 0.00 0.00 0.00 0.00 51.96 53.49 1xgq s ALA 168 Cb -0.42 -3.34 -0.05 0.00 0.00 0.00 0.00 23.12 19.31 1xgq s ALA 168 CO 0.53 -0.65 -0.17 0.14 0.00 0.00 0.00 175.76 175.62 1xgq s VAL 169 N -1.77 2.03 -0.19 0.00 -7.23 -0.20 -4.91 120.40 108.12 1xgq s VAL 169 Ca 0.70 -2.26 -0.21 0.00 -1.81 0.00 0.00 61.98 58.40 1xgq s VAL 169 Cb -0.23 -2.13 -0.02 0.00 0.56 0.00 0.00 36.38 34.56 1xgq s VAL 169 CO 0.27 -0.50 0.64 -0.22 -0.31 0.00 0.00 175.10 174.98 1xgq s LEU 170 N -3.33 4.15 -0.27 1.32 2.96 -1.26 -1.17 118.68 121.07 1xgq s LEU 170 Ca 0.25 0.86 0.01 0.00 -0.22 0.00 0.00 54.13 55.02 1xgq s LEU 170 Cb -0.03 -2.91 0.08 0.00 0.50 0.00 0.00 46.19 43.83 1xgq s LEU 170 CO 0.10 -0.27 0.02 -1.58 -1.32 0.00 0.00 176.35 173.30 1xgq s GLN 171 N 1.88 1.23 -1.18 1.98 0.74 0.41 -4.83 119.66 119.89 1xgq s GLN 171 Ca 0.29 -1.12 -0.13 0.00 0.05 0.00 0.00 55.36 54.45 1xgq s GLN 171 Cb -0.16 -2.48 -0.02 0.00 1.10 0.00 0.00 33.01 31.46 1xgq s GLN 171 CO 0.11 -0.78 0.77 0.43 -0.55 0.00 0.00 175.29 175.26 1xgq n SER 172 N 4.68 -4.39 0.00 6.67 7.64 -1.26 -1.81 113.62 125.16 1xgq n SER 172 Ca -0.06 -0.93 0.00 0.00 1.01 0.00 0.00 58.87 58.89 1xgq n SER 172 Cb 0.43 -3.77 0.00 0.00 -1.01 0.00 0.00 64.21 59.87 1xgq n SER 172 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1xgq n ASP 173 N -2.86 0.00 -4.74 6.43 10.43 -1.26 -4.96 116.55 119.59 1xgq n ASP 173 Ca -0.14 0.00 -0.23 0.00 2.57 0.00 0.00 54.79 56.99 1xgq n ASP 173 Cb 0.62 -0.18 -0.06 0.00 1.84 0.00 0.00 41.12 43.34 1xgq n ASP 173 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1xgq s LEU 174 N 0.00 3.35 0.15 0.64 1.43 -0.75 -4.87 118.68 118.63 1xgq s LEU 174 Ca 0.00 -0.65 -0.04 0.00 -1.03 0.00 0.00 54.13 52.41 1xgq s LEU 174 Cb 0.00 -1.86 -0.05 0.00 0.03 0.00 0.00 46.19 44.30 1xgq s LEU 174 CO 0.00 -0.22 0.37 -0.31 0.23 0.00 0.00 176.35 176.42 1xgq s TYR 175 N -2.36 3.48 -0.01 0.29 2.02 -0.25 0.16 117.35 120.68 1xgq s TYR 175 Ca 0.36 0.50 -0.01 0.00 -0.37 0.00 0.00 57.07 57.56 1xgq s TYR 175 Cb -0.04 -1.97 0.01 0.00 -0.40 0.00 0.00 41.96 39.56 1xgq s TYR 175 CO 0.23 0.44 0.03 0.99 -1.57 0.00 0.00 175.55 175.66 1xgq s THR 176 N -1.68 -0.02 0.05 -0.71 2.01 -0.32 -1.39 115.64 113.58 1xgq s THR 176 Ca 0.40 0.06 -0.03 0.00 0.31 0.00 0.00 61.69 62.43 1xgq s THR 176 Cb -0.12 -0.06 -0.02 0.00 0.01 0.00 0.00 72.50 72.31 1xgq s THR 176 CO 0.26 0.03 0.03 -0.22 -0.69 0.00 0.00 174.62 174.02 1xgq s LEU 177 N 0.33 2.12 0.03 4.42 0.20 0.63 -1.03 118.68 125.38 1xgq s LEU 177 Ca -0.03 -0.74 -0.00 0.00 0.69 0.00 0.00 54.13 54.05 1xgq s LEU 177 Cb -0.04 0.40 -0.03 0.00 -0.43 0.00 0.00 46.19 46.09 1xgq s LEU 177 CO -0.01 -0.54 -0.03 -0.94 -0.29 0.00 0.00 176.35 174.54 1xgq s SER 178 N -2.44 0.36 -0.02 3.68 1.04 -1.26 0.55 113.70 115.61 1xgq s SER 178 Ca -0.00 -0.68 0.01 0.00 0.48 0.00 0.00 55.95 55.75 1xgq s SER 178 Cb 0.02 0.13 0.01 0.00 0.10 0.00 0.00 66.02 66.29 1xgq s SER 178 CO -0.07 -0.40 -0.01 -0.55 0.98 0.00 0.00 173.24 173.19 1xgq s SER 179 N -1.99 0.36 0.04 7.02 0.15 -0.17 -1.73 113.70 117.39 1xgq s SER 179 Ca -0.07 -0.04 0.04 0.00 0.70 0.00 0.00 55.95 56.58 1xgq s SER 179 Cb -0.04 -0.14 -0.04 0.00 -1.71 0.00 0.00 66.02 64.10 1xgq s SER 179 CO -0.04 -0.04 -0.06 -0.94 1.20 0.00 0.00 173.24 173.36 1xgq s SER 180 N 0.54 4.64 -0.03 5.45 1.04 0.10 -0.82 113.70 124.62 1xgq s SER 180 Ca -0.05 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.18 1xgq s SER 180 Cb -0.08 -1.05 0.03 0.00 0.10 0.00 0.00 66.02 65.02 1xgq s SER 180 CO -0.01 0.24 -0.00 0.54 0.98 0.00 0.00 173.24 174.99 1xgq s VAL 181 N -1.09 0.23 -0.13 5.02 0.11 0.17 -0.79 120.40 123.91 1xgq s VAL 181 Ca 0.19 0.07 -0.00 0.00 -2.93 0.00 0.00 61.98 59.31 1xgq s VAL 181 Cb -0.11 -0.32 -0.01 0.00 -1.53 0.00 0.00 36.38 34.40 1xgq s VAL 181 CO 0.11 0.16 -0.13 -0.89 -3.33 0.00 0.00 175.10 171.02 1xgq s THR 182 N 1.09 3.07 0.22 5.04 2.01 -0.19 -0.30 115.64 126.59 1xgq s THR 182 Ca -0.09 -0.65 0.01 0.00 0.31 0.00 0.00 61.69 61.27 1xgq s THR 182 Cb -0.14 -2.29 -0.05 0.00 0.01 0.00 0.00 72.50 70.03 1xgq s THR 182 CO -0.02 0.52 0.08 0.68 -0.69 0.00 0.00 174.62 175.19 1xgq s VAL 183 N 0.40 0.49 0.61 3.82 -7.23 -0.04 -4.60 120.40 113.86 1xgq s VAL 183 Ca -0.10 -1.99 -0.16 0.00 -1.81 0.00 0.00 61.98 57.92 1xgq s VAL 183 Cb -0.16 -2.47 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 1xgq s VAL 183 CO 0.05 -0.13 1.09 0.42 -0.31 0.00 0.00 175.10 176.22 1xgq s THR 184 N -3.80 3.42 0.47 5.32 -4.23 -1.26 -0.05 115.64 115.51 1xgq s THR 184 Ca 0.34 0.71 0.38 0.00 -1.18 0.00 0.00 61.69 61.95 1xgq s THR 184 Cb 0.07 -3.23 0.40 0.00 1.34 0.00 0.00 72.50 71.08 1xgq s THR 184 CO 0.11 -0.36 2.22 0.28 -0.54 0.00 0.00 174.62 176.33 1xgq h SER 185 N 0.45 0.00 0.65 3.99 0.02 -0.07 0.03 113.55 118.62 1xgq h SER 185 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 1xgq h SER 185 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1xgq h SER 185 CO 0.56 0.02 0.00 -1.54 -1.14 0.00 0.00 176.83 174.73 1xgq n SER 186 N -3.21 0.00 -0.04 3.07 3.41 -1.26 -3.56 113.62 112.03 1xgq n SER 186 Ca -0.02 0.02 -0.20 0.00 -0.26 0.00 0.00 58.87 58.41 1xgq n SER 186 Cb 0.16 -0.34 -0.13 0.00 -0.26 0.00 0.00 64.21 63.64 1xgq n SER 186 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1xgq n THR 187 N -1.34 1.69 -4.75 6.66 -1.04 -0.01 -4.75 114.28 110.74 1xgq n THR 187 Ca 0.12 -0.63 -0.25 0.00 -2.04 0.00 0.00 64.05 61.25 1xgq n THR 187 Cb 0.26 -1.62 -0.15 0.00 -1.82 0.00 0.00 70.33 67.00 1xgq n THR 187 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1xgq s TRP 188 N -2.55 1.70 -1.96 -1.42 -0.00 -1.21 -0.76 118.94 112.75 1xgq s TRP 188 Ca -0.26 -0.34 0.07 0.00 -0.00 0.00 0.00 56.10 55.57 1xgq s TRP 188 Cb 0.07 -1.05 0.21 0.00 -0.00 0.00 0.00 33.47 32.70 1xgq s TRP 188 CO 0.72 0.03 1.17 -0.35 -0.00 0.00 0.00 176.95 178.51 1xgq n PRO 189 N 2.24 1.58 -0.29 5.86 -0.04 -1.26 -4.76 135.00 138.34 1xgq n PRO 189 Ca -0.16 -0.87 0.11 0.00 -0.04 0.00 0.00 63.50 62.53 1xgq n PRO 189 Cb 0.54 -1.21 0.35 0.00 -0.04 0.00 0.00 33.50 33.14 1xgq n PRO 189 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1xgq h SER 190 N 1.41 0.71 -3.71 3.54 4.64 -1.85 -3.38 113.55 114.90 1xgq h SER 190 Ca 0.00 0.04 -0.68 0.00 -0.47 0.00 0.00 61.79 60.68 1xgq h SER 190 Cb 0.35 -0.10 -0.23 0.00 -0.31 0.00 0.00 62.40 62.11 1xgq h SER 190 CO 0.01 0.37 -0.74 -1.58 -0.87 0.00 0.00 176.83 174.01 1xgq s GLN 191 N -5.74 2.87 0.44 4.77 0.74 0.06 -5.10 119.66 117.70 1xgq s GLN 191 Ca -0.10 -0.64 -0.24 0.00 0.05 0.00 0.00 55.36 54.43 1xgq s GLN 191 Cb 0.22 -2.53 -0.08 0.00 1.10 0.00 0.00 33.01 31.72 1xgq s GLN 191 CO 0.79 0.51 1.16 -1.54 -0.55 0.00 0.00 175.29 175.66 1xgq s SER 192 N -0.41 6.31 -0.09 6.67 1.04 -1.26 -4.52 113.70 121.44 1xgq s SER 192 Ca 0.05 2.29 0.01 0.00 0.48 0.00 0.00 55.95 58.79 1xgq s SER 192 Cb -0.12 -2.60 0.02 0.00 0.10 0.00 0.00 66.02 63.41 1xgq s SER 192 CO 0.02 -0.82 -0.11 -0.63 0.98 0.00 0.00 173.24 172.69 1xgq s ILE 193 N -1.52 1.14 -0.01 -1.02 1.01 -1.26 -5.01 121.20 114.53 1xgq s ILE 193 Ca 0.61 -0.42 0.06 0.00 0.00 0.00 0.00 60.65 60.89 1xgq s ILE 193 Cb -0.29 -1.09 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 1xgq s ILE 193 CO 0.35 0.37 -0.18 -0.89 0.00 0.00 0.00 174.94 174.59 1xgq s THR 194 N 1.13 1.41 -0.21 2.92 2.01 -1.26 -0.76 115.64 120.87 1xgq s THR 194 Ca -0.05 -0.79 -0.15 0.00 0.31 0.00 0.00 61.69 61.00 1xgq s THR 194 Cb -0.14 -1.18 -0.04 0.00 0.01 0.00 0.00 72.50 71.15 1xgq s THR 194 CO -0.02 0.37 0.37 0.00 -0.69 0.00 0.00 174.62 174.65 1xgq s ASN 196 N 1.08 4.76 -0.15 0.00 -0.87 0.11 0.16 114.94 120.03 1xgq s ASN 196 Ca 0.17 -0.50 0.02 0.00 -1.57 0.00 0.00 52.86 50.97 1xgq s ASN 196 Cb -0.15 -1.82 0.02 0.00 -0.02 0.00 0.00 41.25 39.28 1xgq s ASN 196 CO 0.08 -0.09 -0.19 -0.69 -2.57 0.00 0.00 177.10 173.63 1xgq s VAL 197 N 1.50 1.91 -0.10 1.60 1.01 0.73 -1.00 120.40 126.05 1xgq s VAL 197 Ca 0.04 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.17 1xgq s VAL 197 Cb -0.16 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 1xgq s VAL 197 CO -0.00 0.52 -0.16 0.00 0.00 0.00 0.00 175.10 175.46 1xgq s ALA 198 N 1.12 2.53 -0.46 5.51 0.00 -0.27 -0.35 121.76 129.85 1xgq s ALA 198 Ca -0.01 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 51.04 1xgq s ALA 198 Cb -0.14 -1.05 0.13 0.00 0.00 0.00 0.00 23.12 22.06 1xgq s ALA 198 CO -0.07 0.35 0.23 -1.58 0.00 0.00 0.00 175.76 174.69 1xgq s HIS 199 N 0.03 2.40 0.23 0.00 2.46 0.42 -0.92 115.29 119.92 1xgq s HIS 199 Ca -0.06 -2.66 -0.09 0.00 0.47 0.00 0.00 55.06 52.73 1xgq s HIS 199 Cb -0.15 -2.21 0.38 0.00 -0.13 0.00 0.00 32.58 30.47 1xgq s HIS 199 CO 0.05 -0.78 1.64 -1.35 -2.47 0.00 0.00 174.74 171.83 1xgq h PRO 200 N 6.73 0.09 -0.27 2.88 0.11 -1.78 -1.82 132.00 137.93 1xgq h PRO 200 Ca -0.04 -0.01 0.08 0.00 0.11 0.00 0.00 66.00 66.14 1xgq h PRO 200 Cb 0.92 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 1xgq h PRO 200 CO 0.55 0.06 0.20 0.00 -0.21 0.00 0.00 178.00 178.60 1xgq h ALA 201 N 1.67 2.21 -0.36 -0.75 0.00 -1.92 -0.71 119.26 119.40 1xgq h ALA 201 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1xgq h ALA 201 Cb 0.65 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1xgq h ALA 201 CO -0.64 -0.34 0.00 -1.13 0.00 0.00 0.00 179.25 177.14 1xgq n SER 202 N -4.37 3.08 -3.42 0.00 3.41 -0.75 -4.96 113.62 106.61 1xgq n SER 202 Ca 0.03 -1.90 -0.25 0.00 -0.26 0.00 0.00 58.87 56.50 1xgq n SER 202 Cb 0.36 -0.23 0.02 0.00 -0.26 0.00 0.00 64.21 64.10 1xgq n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1xgq n SER 203 N 1.03 -4.99 -4.49 4.04 7.64 -0.27 -4.97 113.62 111.62 1xgq n SER 203 Ca 0.15 -0.47 -0.31 0.00 1.01 0.00 0.00 58.87 59.25 1xgq n SER 203 Cb 0.49 -4.03 -0.12 0.00 -1.01 0.00 0.00 64.21 59.54 1xgq n SER 203 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1xgq s THR 204 N -3.14 2.94 -0.11 0.44 -4.23 -0.98 -5.01 115.64 105.55 1xgq s THR 204 Ca 0.46 -1.19 -0.04 0.00 -1.18 0.00 0.00 61.69 59.74 1xgq s THR 204 Cb -0.22 -2.27 0.06 0.00 1.34 0.00 0.00 72.50 71.40 1xgq s THR 204 CO 0.56 0.30 0.23 -0.75 -0.54 0.00 0.00 174.62 174.41 1xgq s LYS 205 N -1.59 0.12 0.02 3.99 2.36 -1.26 -0.44 119.74 122.95 1xgq s LYS 205 Ca 0.16 0.64 0.02 0.00 -2.55 0.00 0.00 55.97 54.24 1xgq s LYS 205 Cb -0.11 -0.12 -0.02 0.00 -1.05 0.00 0.00 37.83 36.54 1xgq s LYS 205 CO 0.07 -0.26 -0.08 0.14 1.55 0.00 0.00 175.35 176.76 1xgq s VAL 206 N 2.12 0.59 -0.05 4.02 -7.23 0.53 -4.98 120.40 115.40 1xgq s VAL 206 Ca -0.01 -0.71 0.03 0.00 -1.81 0.00 0.00 61.98 59.48 1xgq s VAL 206 Cb -0.12 -0.57 -0.03 0.00 0.56 0.00 0.00 36.38 36.22 1xgq s VAL 206 CO -0.08 -0.11 -0.14 -1.81 -0.31 0.00 0.00 175.10 172.66 1xgq s ASP 207 N -0.90 4.07 -0.19 4.85 -0.00 -1.26 -0.19 116.67 123.04 1xgq s ASP 207 Ca -0.03 -0.19 -0.01 0.00 -0.00 0.00 0.00 52.55 52.31 1xgq s ASP 207 Cb -0.06 -0.91 0.05 0.00 -0.00 0.00 0.00 42.92 42.00 1xgq s ASP 207 CO 0.00 0.34 -0.00 -0.75 -0.00 0.00 0.00 175.17 174.76 1xgq s LYS 208 N -0.68 1.03 0.22 8.23 2.47 0.12 -4.94 119.74 126.20 1xgq s LYS 208 Ca 0.10 -0.55 -0.30 0.00 -1.56 0.00 0.00 55.97 53.66 1xgq s LYS 208 Cb -0.11 -2.15 -0.08 0.00 -1.46 0.00 0.00 37.83 34.03 1xgq s LYS 208 CO 0.01 -0.57 0.99 0.21 0.16 0.00 0.00 175.35 176.14 1xgq s LYS 209 N 1.71 4.77 0.00 4.03 2.20 -1.26 -0.02 119.74 131.17 1xgq s LYS 209 Ca -0.02 1.56 0.30 0.00 -0.36 0.00 0.00 55.97 57.46 1xgq s LYS 209 Cb -0.17 -3.28 1.45 0.00 -1.51 0.00 0.00 37.83 34.32 1xgq s LYS 209 CO -0.07 0.37 1.97 -0.89 -0.36 0.00 0.00 175.35 176.37