#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xrt s MET 1 N 0.00 2.70 -0.04 -2.67 -1.94 -1.26 -5.03 119.30 111.06 1xrt s MET 1 Ca 0.00 -0.74 0.16 0.00 -1.71 0.00 0.00 55.69 53.40 1xrt s MET 1 Cb 0.00 -2.21 -0.21 0.00 2.01 0.00 0.00 34.83 34.42 1xrt s MET 1 CO 0.00 -0.03 0.57 -0.11 -0.01 0.00 0.00 175.02 175.44 1xrt n LEU 2 N 4.10 0.59 -4.11 -0.03 0.00 -1.26 -4.87 117.00 111.42 1xrt n LEU 2 Ca -0.20 0.27 -0.19 0.00 0.00 0.00 0.00 56.01 55.90 1xrt n LEU 2 Cb 0.51 0.20 -0.13 0.00 0.00 0.00 0.00 43.42 44.00 1xrt n LEU 2 CO 0.26 0.29 -0.45 -0.54 0.00 0.00 0.00 177.39 176.95 1xrt s LYS 3 N -2.77 0.85 -0.02 1.96 1.02 -1.26 -1.18 119.74 118.33 1xrt s LYS 3 Ca -0.05 -0.69 0.00 0.00 0.02 0.00 0.00 55.97 55.25 1xrt s LYS 3 Cb 0.08 -0.82 0.02 0.00 -0.52 0.00 0.00 37.83 36.59 1xrt s LYS 3 CO 0.83 0.20 0.01 -1.17 -0.92 0.00 0.00 175.35 174.30 1xrt s LEU 4 N -1.05 1.30 -0.23 3.17 2.96 -0.32 -1.51 118.68 123.00 1xrt s LEU 4 Ca 0.00 0.01 -0.05 0.00 -0.22 0.00 0.00 54.13 53.87 1xrt s LEU 4 Cb -0.07 -0.10 -0.02 0.00 0.50 0.00 0.00 46.19 46.50 1xrt s LEU 4 CO 0.01 -0.09 -0.00 -0.63 -1.32 0.00 0.00 176.35 174.32 1xrt s ILE 5 N 0.82 3.71 -0.44 6.68 1.01 -0.02 -0.41 121.20 132.54 1xrt s ILE 5 Ca -0.07 -0.38 -0.21 0.00 0.00 0.00 0.00 60.65 59.99 1xrt s ILE 5 Cb -0.10 -2.71 0.03 0.00 0.01 0.00 0.00 42.46 39.69 1xrt s ILE 5 CO -0.02 0.39 0.65 -0.69 0.00 0.00 0.00 174.94 175.28 1xrt s VAL 6 N 1.53 4.81 0.11 2.92 1.01 0.29 -0.94 120.40 130.13 1xrt s VAL 6 Ca 0.06 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.22 1xrt s VAL 6 Cb -0.15 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 1xrt s VAL 6 CO -0.01 -0.62 -0.08 -0.54 0.00 0.00 0.00 175.10 173.85 1xrt s LYS 7 N 2.86 2.18 0.00 2.72 1.02 0.04 -1.16 119.74 127.40 1xrt s LYS 7 Ca 0.23 -1.03 0.00 0.00 0.02 0.00 0.00 55.97 55.19 1xrt s LYS 7 Cb -0.14 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.85 1xrt s LYS 7 CO 0.19 0.50 0.00 0.09 -0.92 0.00 0.00 175.35 175.21 1xrt n ASN 8 N 0.57 -1.75 -4.87 2.83 3.02 -1.26 -0.31 115.26 113.50 1xrt n ASN 8 Ca -0.13 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.13 1xrt n ASN 8 Cb 0.53 -1.14 0.09 0.00 -0.61 0.00 0.00 39.78 38.65 1xrt n ASN 8 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1xrt s GLY 9 N -2.00 1.59 -0.47 7.41 0.00 -1.23 -3.83 107.32 108.79 1xrt s GLY 9 Ca 0.00 -0.55 -0.15 0.00 0.00 0.00 0.00 44.72 44.03 1xrt s GLY 9 CO 0.00 -0.07 0.38 -0.47 0.00 0.00 0.00 173.10 172.95 1xrt s TYR 10 N -3.46 3.26 0.05 1.90 5.04 -0.12 -3.06 117.35 120.97 1xrt s TYR 10 Ca 0.62 -1.05 -0.28 0.00 -2.44 0.00 0.00 57.07 53.92 1xrt s TYR 10 Cb -0.12 -3.19 -0.05 0.00 0.35 0.00 0.00 41.96 38.95 1xrt s TYR 10 CO 0.51 -0.82 0.89 0.08 -1.34 0.00 0.00 175.55 174.86 1xrt s VAL 11 N 1.61 4.70 -0.12 3.14 1.01 0.10 -1.08 120.40 129.76 1xrt s VAL 11 Ca 0.04 1.89 -0.01 0.00 0.00 0.00 0.00 61.98 63.90 1xrt s VAL 11 Cb -0.25 -4.24 0.03 0.00 0.00 0.00 0.00 36.38 31.92 1xrt s VAL 11 CO 0.06 0.29 -0.05 -0.63 0.00 0.00 0.00 175.10 174.77 1xrt s ILE 12 N 0.29 0.86 -0.45 2.22 1.01 -0.20 -1.33 121.20 123.59 1xrt s ILE 12 Ca 0.45 -0.26 0.02 0.00 0.00 0.00 0.00 60.65 60.86 1xrt s ILE 12 Cb -0.22 -0.96 0.15 0.00 0.01 0.00 0.00 42.46 41.44 1xrt s ILE 12 CO 0.26 0.27 0.28 -0.62 0.00 0.00 0.00 174.94 175.14 1xrt s ASP 13 N 1.77 3.29 0.56 3.58 2.15 0.17 -4.23 116.67 123.95 1xrt s ASP 13 Ca 0.04 -2.77 0.23 0.00 0.43 0.00 0.00 52.55 50.49 1xrt s ASP 13 Cb -0.13 -0.90 1.52 0.00 -0.30 0.00 0.00 42.92 43.11 1xrt s ASP 13 CO -0.07 -0.24 2.16 -0.65 -0.17 0.00 0.00 175.17 176.20 1xrt h PRO 14 N 6.44 0.00 0.00 4.34 0.11 -1.92 -1.49 132.00 139.48 1xrt h PRO 14 Ca 0.07 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.17 1xrt h PRO 14 Cb 0.91 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 1xrt h PRO 14 CO 0.45 0.00 -0.04 0.66 -0.21 0.00 0.00 178.00 178.86 1xrt h SER 15 N 0.00 0.00 -0.16 -2.05 4.64 -1.94 -1.14 113.55 112.90 1xrt h SER 15 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1xrt h SER 15 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1xrt h SER 15 CO -0.00 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 1xrt n GLN 16 N -3.51 2.79 -4.19 4.77 6.02 -0.62 -4.98 117.38 117.66 1xrt n GLN 16 Ca -0.02 -1.94 -0.33 0.00 -0.01 0.00 0.00 57.00 54.69 1xrt n GLN 16 Cb 0.15 -1.23 -0.04 0.00 1.02 0.00 0.00 30.24 30.14 1xrt n GLN 16 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1xrt n ASN 17 N -0.17 -1.87 -4.49 1.08 5.15 -0.43 -4.94 115.26 109.59 1xrt n ASN 17 Ca 0.08 -1.06 -0.34 0.00 -0.60 0.00 0.00 54.58 52.65 1xrt n ASN 17 Cb 0.41 -2.59 -0.12 0.00 -0.53 0.00 0.00 39.78 36.95 1xrt n ASN 17 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1xrt s LEU 18 N -7.20 3.33 -0.22 1.20 0.20 -0.83 -5.02 118.68 110.14 1xrt s LEU 18 Ca 0.47 -0.14 -0.27 0.00 0.69 0.00 0.00 54.13 54.88 1xrt s LEU 18 Cb -0.26 -1.83 0.08 0.00 -0.43 0.00 0.00 46.19 43.75 1xrt s LEU 18 CO 0.94 0.11 0.77 -1.83 -0.29 0.00 0.00 176.35 176.04 1xrt s GLU 19 N 0.71 0.83 0.00 1.98 -1.05 -1.26 -0.66 118.70 119.25 1xrt s GLU 19 Ca -0.00 0.75 0.00 0.00 -0.15 0.00 0.00 54.97 55.57 1xrt s GLU 19 Cb -0.14 0.40 0.00 0.00 -0.44 0.00 0.00 34.13 33.95 1xrt s GLU 19 CO 0.02 -0.15 0.00 0.41 0.95 0.00 0.00 175.26 176.49 1xrt n GLY 20 N 2.15 1.21 3.57 -3.83 0.00 -0.44 -5.00 105.19 102.85 1xrt n GLY 20 Ca -0.15 -1.47 -0.40 0.00 0.00 0.00 0.00 46.02 44.00 1xrt n GLY 20 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xrt s GLU 21 N -1.80 3.00 0.04 1.61 2.02 -1.26 -0.72 118.70 121.59 1xrt s GLU 21 Ca 0.00 0.60 0.02 0.00 0.02 0.00 0.00 54.97 55.61 1xrt s GLU 21 Cb 0.00 -4.25 -0.02 0.00 0.10 0.00 0.00 34.13 29.95 1xrt s GLU 21 CO 0.00 -2.29 -0.07 -0.06 0.02 0.00 0.00 175.26 172.86 1xrt s PHE 22 N 7.47 0.62 0.36 1.61 0.08 -1.17 -4.63 117.98 122.32 1xrt s PHE 22 Ca 0.61 -0.50 -0.13 0.00 0.12 0.00 0.00 56.93 57.03 1xrt s PHE 22 Cb -0.13 -0.38 -0.08 0.00 -0.57 0.00 0.00 43.02 41.87 1xrt s PHE 22 CO 0.23 -0.10 0.75 -0.51 -0.10 0.00 0.00 175.22 175.49 1xrt s ASP 23 N -1.57 6.65 -0.15 1.36 1.01 0.17 -3.99 116.67 120.16 1xrt s ASP 23 Ca -0.11 1.20 0.01 0.00 0.71 0.00 0.00 52.55 54.36 1xrt s ASP 23 Cb -0.10 -2.34 0.02 0.00 1.01 0.00 0.00 42.92 41.50 1xrt s ASP 23 CO 0.00 -0.30 -0.18 -0.63 0.21 0.00 0.00 175.17 174.27 1xrt s ILE 24 N -2.17 1.84 -0.20 0.77 1.01 -0.31 -1.94 121.20 120.20 1xrt s ILE 24 Ca 0.53 -0.82 -0.18 0.00 0.00 0.00 0.00 60.65 60.18 1xrt s ILE 24 Cb -0.10 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.66 1xrt s ILE 24 CO 0.24 0.51 0.50 -0.22 0.00 0.00 0.00 174.94 175.97 1xrt s LEU 25 N 1.20 4.14 -0.17 2.97 2.96 0.12 -0.54 118.68 129.36 1xrt s LEU 25 Ca 0.01 0.65 -0.04 0.00 -0.22 0.00 0.00 54.13 54.52 1xrt s LEU 25 Cb -0.14 -2.68 -0.03 0.00 0.50 0.00 0.00 46.19 43.85 1xrt s LEU 25 CO -0.08 -0.17 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.06 1xrt s VAL 26 N 1.62 3.91 -0.08 1.68 1.01 0.45 -0.60 120.40 128.39 1xrt s VAL 26 Ca 0.23 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.88 1xrt s VAL 26 Cb -0.15 -2.73 0.02 0.00 0.00 0.00 0.00 36.38 33.51 1xrt s VAL 26 CO 0.09 0.47 -0.11 -0.70 0.00 0.00 0.00 175.10 174.86 1xrt s GLU 27 N 0.60 1.66 -1.51 2.72 2.12 -0.10 -1.18 118.70 123.01 1xrt s GLU 27 Ca -0.02 -0.37 -0.13 0.00 0.36 0.00 0.00 54.97 54.81 1xrt s GLU 27 Cb -0.14 -1.47 0.08 0.00 0.26 0.00 0.00 34.13 32.86 1xrt s GLU 27 CO 0.02 -0.07 0.94 -1.71 -0.54 0.00 0.00 175.26 173.90 1xrt n ASN 28 N 4.17 -4.87 0.00 -1.70 5.15 -0.33 -2.15 115.26 115.52 1xrt n ASN 28 Ca -0.20 -0.72 0.00 0.00 -0.60 0.00 0.00 54.58 53.06 1xrt n ASN 28 Cb 0.51 -3.90 0.00 0.00 -0.53 0.00 0.00 39.78 35.86 1xrt n ASN 28 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1xrt n GLY 29 N -1.65 0.84 3.35 8.20 0.00 -1.26 -5.03 105.19 109.63 1xrt n GLY 29 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 1xrt n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xrt s LYS 30 N -0.28 1.32 -0.04 1.61 1.02 -0.92 -0.71 119.74 121.75 1xrt s LYS 30 Ca 0.00 -1.47 -0.30 0.00 0.02 0.00 0.00 55.97 54.22 1xrt s LYS 30 Cb 0.00 -1.33 -0.05 0.00 -0.52 0.00 0.00 37.83 35.93 1xrt s LYS 30 CO 0.00 0.26 1.49 0.42 -0.92 0.00 0.00 175.35 176.60 1xrt s ILE 31 N -2.26 3.69 -0.20 2.17 -1.09 -0.25 -0.92 121.20 122.34 1xrt s ILE 31 Ca 0.18 0.97 -0.03 0.00 -2.23 0.00 0.00 60.65 59.54 1xrt s ILE 31 Cb -0.05 -3.63 -0.11 0.00 -1.58 0.00 0.00 42.46 37.10 1xrt s ILE 31 CO 0.07 -0.04 -0.21 1.17 -1.23 0.00 0.00 174.94 174.70 1xrt n LYS 32 N 6.17 0.46 -3.65 2.79 3.00 0.23 -0.53 118.16 126.62 1xrt n LYS 32 Ca 0.15 0.14 -0.14 0.00 -0.00 0.00 0.00 58.31 58.46 1xrt n LYS 32 Cb 0.43 -1.31 -0.08 0.00 0.00 0.00 0.00 35.03 34.07 1xrt n LYS 32 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1xrt s LYS 33 N -2.38 0.76 -0.10 1.64 2.20 -0.92 -4.87 119.74 116.06 1xrt s LYS 33 Ca -0.27 0.62 0.02 0.00 -0.36 0.00 0.00 55.97 55.98 1xrt s LYS 33 Cb 0.08 0.37 0.01 0.00 -1.51 0.00 0.00 37.83 36.78 1xrt s LYS 33 CO 0.40 -0.14 -0.15 0.42 -0.36 0.00 0.00 175.35 175.53 1xrt s ILE 34 N -0.13 1.45 0.11 5.43 1.01 -1.26 -0.70 121.20 127.12 1xrt s ILE 34 Ca -0.03 -0.62 -0.25 0.00 0.00 0.00 0.00 60.65 59.74 1xrt s ILE 34 Cb -0.03 -1.33 0.07 0.00 0.01 0.00 0.00 42.46 41.18 1xrt s ILE 34 CO 0.03 0.43 0.79 -0.62 0.00 0.00 0.00 174.94 175.57 1xrt s ASP 35 N 0.95 -0.38 0.31 3.58 2.15 -0.82 -5.00 116.67 117.46 1xrt s ASP 35 Ca -0.08 -0.15 -0.29 0.00 0.43 0.00 0.00 52.55 52.46 1xrt s ASP 35 Cb -0.15 0.52 -0.10 0.00 -0.30 0.00 0.00 42.92 42.89 1xrt s ASP 35 CO -0.01 -0.88 1.20 -0.54 -0.17 0.00 0.00 175.17 174.78 1xrt s LYS 36 N -3.45 4.50 -0.41 4.34 -0.14 -1.26 -0.65 119.74 122.66 1xrt s LYS 36 Ca 0.06 2.00 -0.19 0.00 -1.36 0.00 0.00 55.97 56.48 1xrt s LYS 36 Cb -0.02 -3.12 0.03 0.00 -1.68 0.00 0.00 37.83 33.04 1xrt s LYS 36 CO -0.06 0.01 0.55 -1.71 -0.76 0.00 0.00 175.35 173.38 1xrt n ASN 37 N 0.98 -7.39 -4.44 2.83 5.15 -1.26 -4.80 115.26 106.33 1xrt n ASN 37 Ca -0.01 0.46 -0.33 0.00 -0.60 0.00 0.00 54.58 54.10 1xrt n ASN 37 Cb 0.43 -4.47 -0.13 0.00 -0.53 0.00 0.00 39.78 35.08 1xrt n ASN 37 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1xrt s ILE 38 N -2.23 3.31 -0.12 -1.44 1.01 -1.26 -5.03 121.20 115.44 1xrt s ILE 38 Ca 0.25 -0.59 -0.04 0.00 0.00 0.00 0.00 60.65 60.28 1xrt s ILE 38 Cb -0.06 -2.38 0.06 0.00 0.01 0.00 0.00 42.46 40.09 1xrt s ILE 38 CO 0.77 0.54 0.20 -0.22 0.00 0.00 0.00 174.94 176.23 1xrt s LEU 39 N 0.03 -0.14 0.10 2.97 2.96 -1.26 -5.05 118.68 118.29 1xrt s LEU 39 Ca -0.03 0.26 0.06 0.00 -0.22 0.00 0.00 54.13 54.20 1xrt s LEU 39 Cb -0.14 0.41 -0.03 0.00 0.50 0.00 0.00 46.19 46.92 1xrt s LEU 39 CO 0.04 -0.26 -0.15 0.68 -1.32 0.00 0.00 176.35 175.33 1xrt s VAL 40 N 2.33 1.29 0.72 1.68 -7.23 -1.26 -5.16 120.40 112.77 1xrt s VAL 40 Ca 0.03 -1.52 -0.11 0.00 -1.81 0.00 0.00 61.98 58.58 1xrt s VAL 40 Cb -0.13 -1.34 0.02 0.00 0.56 0.00 0.00 36.38 35.49 1xrt s VAL 40 CO -0.08 -0.29 1.07 -2.16 -0.31 0.00 0.00 175.10 173.33 1xrt s PRO 41 N -2.17 2.72 -1.66 4.82 0.04 -1.26 -4.14 135.00 133.35 1xrt s PRO 41 Ca 0.04 0.97 -0.01 0.00 0.04 0.00 0.00 61.00 62.05 1xrt s PRO 41 Cb -0.08 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1xrt s PRO 41 CO 0.03 -1.26 0.08 0.39 0.04 0.00 0.00 177.00 176.28 1xrt n GLU 42 N -3.24 -2.01 -4.56 4.56 1.02 -1.26 -5.00 120.64 110.16 1xrt n GLU 42 Ca 0.08 0.94 -0.34 0.00 -0.02 0.00 0.00 57.16 57.82 1xrt n GLU 42 Cb 0.54 -5.56 -0.11 0.00 -0.02 0.00 0.00 31.44 26.28 1xrt n GLU 42 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xrt s ALA 43 N -3.01 3.04 0.42 0.62 0.00 -1.26 -4.41 121.76 117.16 1xrt s ALA 43 Ca 0.04 -0.87 -0.26 0.00 0.00 0.00 0.00 51.96 50.88 1xrt s ALA 43 Cb -0.02 -1.31 -0.08 0.00 0.00 0.00 0.00 23.12 21.71 1xrt s ALA 43 CO 0.05 0.54 1.32 -2.00 0.00 0.00 0.00 175.76 175.66 1xrt s GLU 44 N -0.70 3.88 -0.07 0.00 2.12 -0.57 -4.86 118.70 118.50 1xrt s GLU 44 Ca 0.11 2.18 0.05 0.00 0.36 0.00 0.00 54.97 57.66 1xrt s GLU 44 Cb -0.11 -2.70 -0.01 0.00 0.26 0.00 0.00 34.13 31.56 1xrt s GLU 44 CO 0.02 -0.57 -0.21 0.42 -0.54 0.00 0.00 175.26 174.37 1xrt s ILE 45 N -1.27 2.38 -0.24 -3.70 1.01 -1.26 -0.84 121.20 117.28 1xrt s ILE 45 Ca 0.58 -0.95 -0.05 0.00 0.00 0.00 0.00 60.65 60.24 1xrt s ILE 45 Cb -0.38 -1.90 -0.01 0.00 0.01 0.00 0.00 42.46 40.18 1xrt s ILE 45 CO 0.49 0.57 0.00 -0.63 0.00 0.00 0.00 174.94 175.37 1xrt s ILE 46 N -0.19 3.66 -0.62 2.92 1.01 -0.12 -4.97 121.20 122.89 1xrt s ILE 46 Ca -0.02 -0.49 -0.23 0.00 0.00 0.00 0.00 60.65 59.91 1xrt s ILE 46 Cb -0.13 -2.73 0.06 0.00 0.01 0.00 0.00 42.46 39.66 1xrt s ILE 46 CO 0.03 0.33 0.97 -0.62 0.00 0.00 0.00 174.94 175.65 1xrt s ASP 47 N 1.50 6.23 -0.18 3.58 2.15 -1.26 -0.78 116.67 127.91 1xrt s ASP 47 Ca 0.05 -0.73 0.07 0.00 0.43 0.00 0.00 52.55 52.37 1xrt s ASP 47 Cb -0.15 -2.43 0.48 0.00 -0.30 0.00 0.00 42.92 40.52 1xrt s ASP 47 CO -0.01 -1.38 1.34 0.00 -0.17 0.00 0.00 175.17 174.95 1xrt n ALA 48 N 7.70 3.62 -1.92 3.66 0.00 0.57 -4.96 120.51 129.18 1xrt n ALA 48 Ca -0.02 -1.33 -0.42 0.00 0.00 0.00 0.00 53.44 51.68 1xrt n ALA 48 Cb 0.46 -1.13 -0.03 0.00 0.00 0.00 0.00 19.45 18.76 1xrt n ALA 48 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1xrt s LYS 49 N -2.06 4.22 0.00 0.00 2.47 -1.25 -1.07 119.74 122.04 1xrt s LYS 49 Ca 0.34 2.37 0.00 0.00 -1.56 0.00 0.00 55.97 57.11 1xrt s LYS 49 Cb 0.27 -3.14 0.00 0.00 -1.46 0.00 0.00 37.83 33.49 1xrt s LYS 49 CO 0.09 -0.59 0.00 0.41 0.16 0.00 0.00 175.35 175.42 1xrt n GLY 50 N 3.50 0.57 3.43 5.54 0.00 -1.26 -4.98 105.19 111.99 1xrt n GLY 50 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 1xrt n GLY 50 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xrt s LEU 51 N 0.00 2.49 -0.06 0.99 1.43 -0.23 -4.80 118.68 118.50 1xrt s LEU 51 Ca 0.00 -0.72 -0.25 0.00 -1.03 0.00 0.00 54.13 52.13 1xrt s LEU 51 Cb 0.00 -1.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.87 1xrt s LEU 51 CO 0.00 0.16 0.77 -0.63 0.23 0.00 0.00 176.35 176.88 1xrt s ILE 52 N -1.27 5.00 -0.18 -0.59 -1.09 -0.05 -0.94 121.20 122.08 1xrt s ILE 52 Ca 0.17 1.60 -0.01 0.00 -2.23 0.00 0.00 60.65 60.18 1xrt s ILE 52 Cb -0.10 -4.11 -0.00 0.00 -1.58 0.00 0.00 42.46 36.67 1xrt s ILE 52 CO 0.09 0.22 -0.11 -0.69 -1.23 0.00 0.00 174.94 173.21 1xrt s VAL 53 N 0.92 2.94 0.28 2.92 1.01 -0.24 -0.75 120.40 127.48 1xrt s VAL 53 Ca 0.41 -0.66 -0.10 0.00 0.00 0.00 0.00 61.98 61.63 1xrt s VAL 53 Cb -0.18 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 33.92 1xrt s VAL 53 CO 0.20 0.49 0.50 0.00 0.00 0.00 0.00 175.10 176.29 1xrt n PRO 55 N -0.44 1.45 -1.80 0.00 -0.02 -1.26 -0.46 135.00 132.48 1xrt n PRO 55 Ca -0.01 0.54 -0.38 0.00 -2.02 0.00 0.00 63.50 61.63 1xrt n PRO 55 Cb 0.62 -2.45 0.05 0.00 -0.02 0.00 0.00 33.50 31.69 1xrt n PRO 55 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1xrt s GLY 56 N -1.01 2.87 0.58 -1.23 0.00 -0.47 -4.10 107.32 103.96 1xrt s GLY 56 Ca 0.73 1.27 -0.14 0.00 0.00 0.00 0.00 44.72 46.57 1xrt s GLY 56 CO 0.48 1.75 1.02 -1.36 0.00 0.00 0.00 173.10 174.99 1xrt s PHE 57 N -1.35 3.39 -0.14 1.90 0.08 -0.58 -4.58 117.98 116.70 1xrt s PHE 57 Ca 0.75 1.42 -0.00 0.00 0.12 0.00 0.00 56.93 59.22 1xrt s PHE 57 Cb -0.39 -2.82 0.03 0.00 -0.57 0.00 0.00 43.02 39.28 1xrt s PHE 57 CO 0.44 -0.67 -0.07 0.42 -0.10 0.00 0.00 175.22 175.24 1xrt s ILE 58 N -2.79 1.12 -0.33 0.64 1.01 0.12 -1.32 121.20 119.65 1xrt s ILE 58 Ca 0.58 -0.46 -0.08 0.00 0.00 0.00 0.00 60.65 60.69 1xrt s ILE 58 Cb -0.12 -1.19 0.02 0.00 0.01 0.00 0.00 42.46 41.18 1xrt s ILE 58 CO 0.41 0.28 0.13 -0.62 0.00 0.00 0.00 174.94 175.15 1xrt s ASP 59 N 1.65 5.42 -0.06 3.58 -1.08 -0.76 -4.75 116.67 120.67 1xrt s ASP 59 Ca 0.03 -0.88 0.08 0.00 -0.52 0.00 0.00 52.55 51.26 1xrt s ASP 59 Cb -0.14 -1.94 0.33 0.00 -1.46 0.00 0.00 42.92 39.71 1xrt s ASP 59 CO -0.08 -0.29 1.13 2.30 0.52 0.00 0.00 175.17 178.75 1xrt n ILE 60 N 4.91 0.87 -3.15 4.11 -5.35 -1.26 -0.65 119.36 118.83 1xrt n ILE 60 Ca -0.13 -0.53 -0.12 0.00 -0.27 0.00 0.00 62.75 61.70 1xrt n ILE 60 Cb 0.47 -0.13 -0.04 0.00 -1.74 0.00 0.00 39.64 38.19 1xrt n ILE 60 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 1xrt s HIS 61 N -1.68 -0.69 -0.02 4.28 2.46 -1.25 -4.74 115.29 113.64 1xrt s HIS 61 Ca 0.23 -0.85 0.04 0.00 0.47 0.00 0.00 55.06 54.94 1xrt s HIS 61 Cb 0.15 -0.15 -0.00 0.00 -0.13 0.00 0.00 32.58 32.45 1xrt s HIS 61 CO 0.10 -1.08 -0.13 0.08 -2.47 0.00 0.00 174.74 171.25 1xrt s VAL 62 N 1.05 1.06 -0.39 0.89 1.01 -0.76 -0.52 120.40 122.74 1xrt s VAL 62 Ca 0.24 -0.54 -0.10 0.00 0.00 0.00 0.00 61.98 61.58 1xrt s VAL 62 Cb -0.05 -0.91 0.05 0.00 0.00 0.00 0.00 36.38 35.47 1xrt s VAL 62 CO -0.07 0.31 0.22 -1.00 0.00 0.00 0.00 175.10 174.56 1xrt s HIS 63 N -0.07 3.28 -1.22 5.22 3.76 -0.38 -0.84 115.29 125.04 1xrt s HIS 63 Ca 0.00 -1.21 0.24 0.00 -0.15 0.00 0.00 55.06 53.95 1xrt s HIS 63 Cb -0.08 -2.64 0.40 0.00 1.11 0.00 0.00 32.58 31.38 1xrt s HIS 63 CO 0.00 -0.74 1.34 1.28 -0.85 0.00 0.00 174.74 175.78 1xrt n LEU 64 N 4.96 0.79 -1.29 0.89 4.77 -1.26 -4.50 117.00 121.35 1xrt n LEU 64 Ca -0.11 -0.19 -0.14 0.00 -0.03 0.00 0.00 56.01 55.54 1xrt n LEU 64 Cb 0.45 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.33 1xrt n LEU 64 CO 0.37 0.18 -0.15 0.54 -1.33 0.00 0.00 177.39 177.00 1xrt n ARG 65 N -1.23 -1.03 -3.57 3.23 5.12 -1.26 -3.38 116.66 114.54 1xrt n ARG 65 Ca 0.07 0.86 -0.18 0.00 -1.93 0.00 0.00 57.85 56.67 1xrt n ARG 65 Cb 0.34 -5.03 -0.14 0.00 -1.16 0.00 0.00 32.46 26.47 1xrt n ARG 65 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1xrt s ASP 66 N -2.65 1.15 0.70 0.55 -1.08 -1.26 -1.11 116.67 112.98 1xrt s ASP 66 Ca 0.00 -0.00 -0.11 0.00 -0.52 0.00 0.00 52.55 51.92 1xrt s ASP 66 Cb 0.00 0.35 0.01 0.00 -1.46 0.00 0.00 42.92 41.82 1xrt s ASP 66 CO 0.00 -0.30 1.08 -2.16 0.52 0.00 0.00 175.17 174.31 1xrt s PRO 67 N 2.31 2.90 0.00 4.34 0.04 -1.26 -4.88 135.00 138.45 1xrt s PRO 67 Ca 0.05 0.60 0.00 0.00 0.04 0.00 0.00 61.00 61.69 1xrt s PRO 67 Cb -0.14 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.38 1xrt s PRO 67 CO -0.10 -1.04 0.00 0.41 0.04 0.00 0.00 177.00 176.32 1xrt n GLY 68 N -2.70 2.22 2.56 0.56 0.00 -1.10 -1.29 105.19 105.45 1xrt n GLY 68 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 1xrt n GLY 68 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xrt n GLN 69 N -0.48 1.10 0.04 1.61 6.02 -0.27 -4.86 117.38 120.54 1xrt n GLN 69 Ca 0.00 -3.21 0.10 0.00 -0.01 0.00 0.00 57.00 53.88 1xrt n GLN 69 Cb 0.00 -1.30 0.41 0.00 1.02 0.00 0.00 30.24 30.37 1xrt n GLN 69 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1xrt n THR 70 N 0.00 0.78 0.35 5.09 -2.24 -1.16 -0.54 114.28 116.55 1xrt n THR 70 Ca 0.12 0.17 0.14 0.00 -2.27 0.00 0.00 64.05 62.22 1xrt n THR 70 Cb 0.78 -0.93 0.55 0.00 -2.10 0.00 0.00 70.33 68.63 1xrt n THR 70 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 1xrt h TYR 71 N 0.00 0.00 0.00 4.78 -0.00 -1.93 -3.19 116.97 116.63 1xrt h TYR 71 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 58.73 58.46 1xrt h TYR 71 Cb 0.35 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.03 1xrt h TYR 71 CO 0.00 0.00 -1.68 1.63 -0.00 0.00 0.00 178.16 178.11 1xrt n LYS 72 N -2.69 0.63 0.00 0.10 5.02 0.29 -4.78 118.16 116.74 1xrt n LYS 72 Ca 0.02 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 1xrt n LYS 72 Cb 0.30 -1.79 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 1xrt n LYS 72 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1xrt n GLU 73 N -3.00 0.00 -4.33 1.97 4.07 -1.20 -3.16 120.64 114.99 1xrt n GLU 73 Ca -0.16 0.00 -0.19 0.00 -0.06 0.00 0.00 57.16 56.75 1xrt n GLU 73 Cb 1.02 0.00 -0.09 0.00 -0.06 0.00 0.00 31.44 32.31 1xrt n GLU 73 CO 0.00 0.00 0.00 0.16 -0.06 0.00 0.00 177.13 177.23 1xrt s ASP 74 N 0.00 1.57 0.30 4.31 1.47 -1.22 -4.00 116.67 119.10 1xrt s ASP 74 Ca 0.00 -1.61 0.00 0.00 1.18 0.00 0.00 52.55 52.12 1xrt s ASP 74 Cb 0.00 0.45 0.52 0.00 -0.34 0.00 0.00 42.92 43.54 1xrt s ASP 74 CO 0.00 -0.94 1.93 0.40 0.68 0.00 0.00 175.17 177.24 1xrt h ILE 75 N 2.19 1.10 -0.06 2.11 2.04 -1.90 0.31 117.51 123.30 1xrt h ILE 75 Ca -0.31 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.18 1xrt h ILE 75 Cb 1.25 -0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1xrt h ILE 75 CO 0.48 0.19 -0.00 -0.08 0.00 0.00 0.00 178.15 178.74 1xrt h GLU 76 N 1.04 0.10 -0.31 2.37 4.81 -1.95 -0.02 114.58 120.62 1xrt h GLU 76 Ca 0.37 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.38 1xrt h GLU 76 Cb 0.12 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 1xrt h GLU 76 CO -0.12 0.40 -0.51 0.66 -0.73 0.00 0.00 179.01 178.70 1xrt h SER 77 N -0.21 0.99 -0.18 1.04 4.64 -1.79 0.05 113.55 118.08 1xrt h SER 77 Ca 0.02 -0.52 -0.09 0.00 -0.47 0.00 0.00 61.79 60.73 1xrt h SER 77 Cb 0.36 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.15 1xrt h SER 77 CO 0.00 1.32 -0.17 1.23 -0.87 0.00 0.00 176.83 178.34 1xrt h GLY 78 N 0.70 0.65 1.11 -0.77 0.00 -0.98 -1.44 103.07 102.34 1xrt h GLY 78 Ca 0.02 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 46.81 1xrt h GLY 78 CO 0.12 0.45 0.29 1.76 0.00 0.00 0.00 176.54 179.16 1xrt h SER 79 N 0.54 1.04 0.05 0.19 0.02 -0.65 -0.59 113.55 114.14 1xrt h SER 79 Ca 0.09 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1xrt h SER 79 Cb 0.60 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1xrt h SER 79 CO 0.04 0.93 -0.02 0.03 -1.14 0.00 0.00 176.83 176.67 1xrt h ARG 80 N 1.10 -0.07 -0.63 3.45 3.08 -0.66 -1.48 114.38 119.18 1xrt h ARG 80 Ca 0.25 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.44 1xrt h ARG 80 Cb 0.22 0.01 -0.11 0.00 0.08 0.00 0.00 29.97 30.17 1xrt h ARG 80 CO -0.02 0.01 -0.04 0.00 -1.07 0.00 0.00 179.97 178.85 1xrt h ALA 82 N 1.60 -0.73 -0.21 0.00 0.00 -0.70 -1.04 119.26 118.18 1xrt h ALA 82 Ca 0.33 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1xrt h ALA 82 Cb 0.53 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1xrt h ALA 82 CO -0.58 -0.93 -0.26 -0.39 0.00 0.00 0.00 179.25 177.10 1xrt h VAL 83 N -0.73 1.26 0.00 0.00 -1.51 -1.20 -0.06 116.25 114.01 1xrt h VAL 83 Ca -0.05 -1.23 -0.03 0.00 -1.23 0.00 0.00 66.70 64.17 1xrt h VAL 83 Cb 0.61 1.38 -0.00 0.00 -2.13 0.00 0.00 31.29 31.15 1xrt h VAL 83 CO 0.03 0.38 -0.14 0.00 -1.23 0.00 0.00 177.57 176.62 1xrt h ALA 84 N 1.39 1.28 -0.01 5.19 0.00 -1.15 -1.87 119.26 124.09 1xrt h ALA 84 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xrt h ALA 84 Cb 0.64 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1xrt h ALA 84 CO 0.05 0.17 -0.03 0.41 0.00 0.00 0.00 179.25 179.85 1xrt n GLY 85 N -0.63 -0.46 1.21 0.00 0.00 -0.41 -4.54 105.19 100.36 1xrt n GLY 85 Ca -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1xrt n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xrt n GLY 86 N 1.14 0.72 3.67 -0.02 0.00 -0.70 -4.66 105.19 105.34 1xrt n GLY 86 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1xrt n GLY 86 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xrt s PHE 87 N -2.72 3.40 -0.61 1.61 0.08 -0.13 -1.52 117.98 118.10 1xrt s PHE 87 Ca 0.00 1.14 0.22 0.00 0.12 0.00 0.00 56.93 58.41 1xrt s PHE 87 Cb 0.00 -2.94 -0.12 0.00 -0.57 0.00 0.00 43.02 39.39 1xrt s PHE 87 CO 0.00 -0.22 0.87 0.25 -0.10 0.00 0.00 175.22 176.02 1xrt n THR 88 N 4.73 0.07 -3.78 0.64 -2.24 -0.43 -3.48 114.28 109.79 1xrt n THR 88 Ca 0.02 -0.22 -0.14 0.00 -2.27 0.00 0.00 64.05 61.44 1xrt n THR 88 Cb 0.49 0.41 -0.15 0.00 -2.10 0.00 0.00 70.33 68.98 1xrt n THR 88 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1xrt s THR 89 N -3.21 -0.04 0.07 4.28 2.01 -1.10 -0.94 115.64 116.71 1xrt s THR 89 Ca 0.02 0.15 0.04 0.00 0.31 0.00 0.00 61.69 62.22 1xrt s THR 89 Cb 0.15 -0.14 -0.03 0.00 0.01 0.00 0.00 72.50 72.49 1xrt s THR 89 CO 0.85 0.06 -0.11 0.27 -0.69 0.00 0.00 174.62 175.00 1xrt s ILE 90 N 0.88 0.85 -0.22 1.82 -4.36 0.16 -1.83 121.20 118.50 1xrt s ILE 90 Ca -0.07 -1.35 -0.04 0.00 -0.26 0.00 0.00 60.65 58.93 1xrt s ILE 90 Cb -0.10 -1.02 -0.01 0.00 1.25 0.00 0.00 42.46 42.59 1xrt s ILE 90 CO -0.03 -0.40 -0.03 -0.69 0.24 0.00 0.00 174.94 174.02 1xrt s VAL 91 N -1.73 3.49 -0.05 8.37 1.01 0.17 -0.49 120.40 131.17 1xrt s VAL 91 Ca -0.02 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.38 1xrt s VAL 91 Cb -0.07 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 1xrt s VAL 91 CO 0.01 0.42 0.31 0.00 0.00 0.00 0.00 175.10 175.84 1xrt s MET 93 N -0.90 3.48 0.00 0.00 -1.94 -0.02 -2.57 119.30 117.35 1xrt s MET 93 Ca 0.20 0.99 0.18 0.00 -1.71 0.00 0.00 55.69 55.35 1xrt s MET 93 Cb -0.15 -2.06 0.50 0.00 2.01 0.00 0.00 34.83 35.13 1xrt s MET 93 CO 0.10 -0.67 1.42 -0.35 -0.01 0.00 0.00 175.02 175.51 1xrt n PRO 94 N -2.26 2.29 -0.87 2.03 -0.04 -1.26 -4.42 135.00 130.46 1xrt n PRO 94 Ca 0.07 -2.00 -0.15 0.00 -0.04 0.00 0.00 63.50 61.39 1xrt n PRO 94 Cb 0.54 -1.44 0.03 0.00 -0.04 0.00 0.00 33.50 32.59 1xrt n PRO 94 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1xrt n ASN 95 N 1.13 6.36 -4.01 3.54 6.94 -1.25 -1.44 115.26 126.53 1xrt n ASN 95 Ca 0.19 -3.00 -0.30 0.00 -0.02 0.00 0.00 54.58 51.45 1xrt n ASN 95 Cb 0.47 -1.07 0.21 0.00 -2.36 0.00 0.00 39.78 37.03 1xrt n ASN 95 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1xrt s THR 96 N -2.05 1.78 -0.21 5.53 -4.23 -1.26 -4.95 115.64 110.24 1xrt s THR 96 Ca 0.29 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.77 1xrt s THR 96 Cb 0.22 -2.70 0.07 0.00 1.34 0.00 0.00 72.50 71.43 1xrt s THR 96 CO -0.01 0.00 0.04 0.21 -0.54 0.00 0.00 174.62 174.32 1xrt s ASN 97 N -4.27 3.13 0.75 3.99 2.47 -0.41 -1.84 114.94 118.77 1xrt s ASN 97 Ca 0.71 -0.96 -0.12 0.00 0.42 0.00 0.00 52.86 52.91 1xrt s ASN 97 Cb -0.08 -0.65 0.05 0.00 -1.45 0.00 0.00 41.25 39.12 1xrt s ASN 97 CO 0.55 -0.32 1.12 -2.16 -3.72 0.00 0.00 177.10 172.56 1xrt s PRO 98 N 1.81 2.23 0.85 0.43 0.04 -1.26 -2.70 135.00 136.41 1xrt s PRO 98 Ca 0.00 1.35 -0.12 0.00 0.04 0.00 0.00 61.00 62.28 1xrt s PRO 98 Cb -0.17 -1.88 0.10 0.00 0.04 0.00 0.00 34.50 32.59 1xrt s PRO 98 CO -0.11 -1.68 1.10 -1.25 0.04 0.00 0.00 177.00 175.09 1xrt s PRO 99 N -4.52 1.63 -1.32 0.56 0.04 -0.77 -4.73 135.00 125.90 1xrt s PRO 99 Ca 0.65 0.72 -0.15 0.00 0.04 0.00 0.00 61.00 62.26 1xrt s PRO 99 Cb -0.20 -1.86 0.10 0.00 0.04 0.00 0.00 34.50 32.58 1xrt s PRO 99 CO 0.51 -1.96 1.82 -0.89 0.04 0.00 0.00 177.00 176.51 1xrt n ILE 100 N -3.67 3.96 -0.88 0.56 5.41 -0.52 -4.53 119.36 119.68 1xrt n ILE 100 Ca 0.07 -4.02 0.03 0.00 1.00 0.00 0.00 62.75 59.83 1xrt n ILE 100 Cb 0.56 -2.44 0.04 0.00 -0.71 0.00 0.00 39.64 37.09 1xrt n ILE 100 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1xrt n ASP 101 N 6.50 1.39 -3.72 4.38 5.68 -1.26 -1.77 116.55 127.75 1xrt n ASP 101 Ca 0.46 -2.17 -0.10 0.00 -0.50 0.00 0.00 54.79 52.48 1xrt n ASP 101 Cb 0.42 -0.17 -0.06 0.00 -1.14 0.00 0.00 41.12 40.17 1xrt n ASP 101 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1xrt s ASN 102 N -1.42 -0.10 0.51 -1.12 2.20 -1.26 -4.76 114.94 108.99 1xrt s ASN 102 Ca 0.10 -0.44 0.32 0.00 -0.94 0.00 0.00 52.86 51.90 1xrt s ASN 102 Cb 0.09 0.42 1.24 0.00 -2.00 0.00 0.00 41.25 41.00 1xrt s ASN 102 CO 0.01 -0.80 1.93 0.71 -2.94 0.00 0.00 177.10 176.01 1xrt h THR 103 N 2.54 0.00 -0.35 0.54 1.35 -1.96 -2.61 112.91 112.42 1xrt h THR 103 Ca -0.34 -0.53 -0.05 0.00 -0.55 0.00 0.00 66.41 64.94 1xrt h THR 103 Cb 1.23 1.51 -0.01 0.00 -1.73 0.00 0.00 68.15 69.15 1xrt h THR 103 CO 0.50 0.00 0.02 0.74 -0.25 0.00 0.00 175.52 176.53 1xrt h THR 104 N 0.00 1.25 -0.59 6.82 2.02 -1.98 0.49 112.91 120.93 1xrt h THR 104 Ca 0.00 -0.93 -0.07 0.00 0.77 0.00 0.00 66.41 66.18 1xrt h THR 104 Cb 0.54 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.11 1xrt h THR 104 CO 0.00 0.31 0.11 0.58 0.37 0.00 0.00 175.52 176.88 1xrt h VAL 105 N 0.42 1.26 -0.11 3.16 2.07 -1.82 -1.58 116.25 119.64 1xrt h VAL 105 Ca 0.10 -0.97 0.02 0.00 0.82 0.00 0.00 66.70 66.68 1xrt h VAL 105 Cb 0.42 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1xrt h VAL 105 CO 0.01 0.36 -0.03 0.58 0.02 0.00 0.00 177.57 178.51 1xrt h VAL 106 N 0.86 0.88 -1.01 2.57 2.07 -1.30 -2.39 116.25 117.93 1xrt h VAL 106 Ca 0.18 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.71 1xrt h VAL 106 Cb 0.40 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 1xrt h VAL 106 CO 0.01 0.00 0.67 -1.13 0.02 0.00 0.00 177.57 177.14 1xrt h ASN 107 N -0.00 1.15 -0.43 0.57 -0.73 -0.80 -1.85 115.58 113.49 1xrt h ASN 107 Ca 0.06 -0.03 0.07 0.00 1.87 0.00 0.00 56.30 58.27 1xrt h ASN 107 Cb 0.09 -0.28 -0.06 0.00 0.27 0.00 0.00 38.32 38.33 1xrt h ASN 107 CO -0.12 0.82 0.07 0.22 -0.37 0.00 0.00 177.43 178.05 1xrt h TYR 108 N 1.35 0.10 -0.20 0.67 3.20 -0.81 -0.16 116.97 121.12 1xrt h TYR 108 Ca 0.38 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.26 1xrt h TYR 108 Cb -0.13 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 1xrt h TYR 108 CO -0.00 -0.01 0.08 0.82 -1.64 0.00 0.00 178.16 177.41 1xrt h ILE 109 N 0.19 1.16 -0.64 1.81 2.04 -1.00 -0.98 117.51 120.10 1xrt h ILE 109 Ca 0.21 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 1xrt h ILE 109 Cb 0.27 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 1xrt h ILE 109 CO -0.29 0.16 0.26 -0.07 0.00 0.00 0.00 178.15 178.21 1xrt h LEU 110 N 0.17 0.87 -0.51 1.44 3.38 -1.18 -0.81 115.31 118.68 1xrt h LEU 110 Ca 0.07 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 1xrt h LEU 110 Cb 0.18 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1xrt h LEU 110 CO -0.01 0.80 -0.09 1.56 0.09 0.00 0.00 178.44 180.79 1xrt h GLN 111 N 0.89 0.96 -0.36 1.13 1.08 -0.86 -1.57 115.11 116.39 1xrt h GLN 111 Ca 0.21 -0.35 0.04 0.00 -1.45 0.00 0.00 58.65 57.10 1xrt h GLN 111 Cb 0.19 -0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.52 1xrt h GLN 111 CO -0.02 1.02 0.14 0.87 -0.95 0.00 0.00 178.83 179.89 1xrt h LYS 112 N 0.82 0.29 -0.71 1.46 1.79 -0.95 -1.24 116.57 118.03 1xrt h LYS 112 Ca 0.13 -0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.61 1xrt h LYS 112 Cb 0.64 -0.07 -0.04 0.00 -1.58 0.00 0.00 32.23 31.19 1xrt h LYS 112 CO 0.04 0.19 0.45 1.03 -1.08 0.00 0.00 179.45 180.09 1xrt h SER 113 N 0.30 0.75 -0.60 0.86 0.87 -1.02 -0.13 113.55 114.58 1xrt h SER 113 Ca 0.16 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.63 1xrt h SER 113 Cb 0.12 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.90 1xrt h SER 113 CO -0.15 0.52 0.03 0.11 -0.53 0.00 0.00 176.83 176.80 1xrt h LYS 114 N 0.89 1.06 -0.16 2.24 1.57 -1.00 -1.62 116.57 119.54 1xrt h LYS 114 Ca 0.28 -0.32 -0.15 0.00 -1.87 0.00 0.00 60.65 58.60 1xrt h LYS 114 Cb 0.00 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1xrt h LYS 114 CO -0.10 1.02 -0.53 0.66 -0.57 0.00 0.00 179.45 179.92 1xrt h SER 115 N 0.97 0.51 -0.28 0.86 4.64 -0.80 -3.20 113.55 116.26 1xrt h SER 115 Ca 0.18 -0.27 -0.14 0.00 -0.47 0.00 0.00 61.79 61.09 1xrt h SER 115 Cb 0.52 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1xrt h SER 115 CO 0.03 0.95 -0.39 0.58 -0.87 0.00 0.00 176.83 177.12 1xrt h VAL 116 N 0.36 1.30 -4.61 0.95 2.07 -0.92 -3.48 116.25 111.92 1xrt h VAL 116 Ca 0.01 -1.58 -0.30 0.00 0.82 0.00 0.00 66.70 65.66 1xrt h VAL 116 Cb 1.05 1.64 0.10 0.00 -1.52 0.00 0.00 31.29 32.57 1xrt h VAL 116 CO 0.10 0.51 -0.51 0.61 0.02 0.00 0.00 177.57 178.29 1xrt n GLY 117 N 0.27 -0.16 0.00 2.17 0.00 -0.62 -4.96 105.19 101.89 1xrt n GLY 117 Ca -0.04 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1xrt n GLY 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xrt n LEU 118 N -3.84 0.00 -4.92 0.99 4.77 -1.26 -5.03 117.00 107.71 1xrt n LEU 118 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.72 1xrt n LEU 118 Cb 0.55 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.63 1xrt n LEU 118 CO 0.48 0.00 0.35 0.00 -1.33 0.00 0.00 177.39 176.89 1xrt s ARG 120 N -4.52 4.35 -0.29 0.00 3.52 -0.11 -4.95 118.95 116.95 1xrt s ARG 120 Ca 0.45 1.67 -0.08 0.00 -0.13 0.00 0.00 55.73 57.64 1xrt s ARG 120 Cb -0.10 -3.56 -0.00 0.00 -1.56 0.00 0.00 34.95 29.73 1xrt s ARG 120 CO 0.41 -0.45 0.10 0.08 -0.81 0.00 0.00 175.30 174.63 1xrt s VAL 121 N 2.23 4.25 -0.27 7.11 1.01 -1.26 -0.67 120.40 132.80 1xrt s VAL 121 Ca 0.56 -0.50 -0.08 0.00 0.00 0.00 0.00 61.98 61.95 1xrt s VAL 121 Cb -0.24 -3.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 1xrt s VAL 121 CO 0.22 0.12 0.11 -0.76 0.00 0.00 0.00 175.10 174.79 1xrt s LEU 122 N 1.56 3.71 0.67 3.92 1.43 0.36 -4.84 118.68 125.48 1xrt s LEU 122 Ca 0.04 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 52.77 1xrt s LEU 122 Cb -0.17 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 1xrt s LEU 122 CO 0.04 -0.08 1.05 -2.16 0.23 0.00 0.00 176.35 175.43 1xrt s PRO 123 N 1.64 3.19 0.22 1.29 0.04 -1.26 -1.19 135.00 138.93 1xrt s PRO 123 Ca 0.06 0.76 0.11 0.00 0.04 0.00 0.00 61.00 61.97 1xrt s PRO 123 Cb -0.16 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 1xrt s PRO 123 CO 0.05 -0.87 -0.15 0.95 0.04 0.00 0.00 177.00 177.02 1xrt s THR 124 N -3.16 2.79 0.37 1.26 -4.23 -1.06 -1.63 115.64 109.97 1xrt s THR 124 Ca 0.57 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 59.11 1xrt s THR 124 Cb -0.12 -2.41 -0.01 0.00 1.34 0.00 0.00 72.50 71.30 1xrt s THR 124 CO 0.54 -0.22 0.54 -0.83 -0.54 0.00 0.00 174.62 174.11 1xrt s GLY 125 N -3.07 1.48 0.72 3.99 0.00 -0.61 -4.51 107.32 105.33 1xrt s GLY 125 Ca 0.26 -1.18 -0.13 0.00 0.00 0.00 0.00 44.72 43.67 1xrt s GLY 125 CO 0.14 -1.08 1.11 -0.51 0.00 0.00 0.00 173.10 172.76 1xrt s THR 126 N -2.31 3.14 0.05 0.90 -4.23 -0.73 -1.22 115.64 111.24 1xrt s THR 126 Ca 0.44 0.46 -0.13 0.00 -1.18 0.00 0.00 61.69 61.27 1xrt s THR 126 Cb -0.10 -2.94 -0.31 0.00 1.34 0.00 0.00 72.50 70.50 1xrt s THR 126 CO 0.34 -0.40 1.08 0.40 -0.54 0.00 0.00 174.62 175.50 1xrt h ILE 127 N -0.57 1.31 -2.70 2.99 2.04 -1.81 -3.41 117.51 115.36 1xrt h ILE 127 Ca -0.45 -2.62 -0.51 0.00 1.00 0.00 0.00 64.86 62.28 1xrt h ILE 127 Cb 1.24 2.84 -0.15 0.00 -0.74 0.00 0.00 36.82 40.02 1xrt h ILE 127 CO 0.52 0.79 -0.75 0.42 0.00 0.00 0.00 178.15 179.13 1xrt s THR 128 N -2.82 1.98 0.28 -0.27 -4.23 -1.26 -1.15 115.64 108.18 1xrt s THR 128 Ca -0.08 -2.25 -0.30 0.00 -1.18 0.00 0.00 61.69 57.87 1xrt s THR 128 Cb 0.05 -2.11 -0.11 0.00 1.34 0.00 0.00 72.50 71.67 1xrt s THR 128 CO 0.93 -0.51 1.57 -0.54 -0.54 0.00 0.00 174.62 175.53 1xrt s LYS 129 N -3.54 4.14 0.00 3.99 1.02 0.19 -1.27 119.74 124.28 1xrt s LYS 129 Ca 0.24 2.53 0.00 0.00 0.02 0.00 0.00 55.97 58.77 1xrt s LYS 129 Cb -0.02 -3.04 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 1xrt s LYS 129 CO 0.09 -0.60 0.00 0.41 -0.92 0.00 0.00 175.35 174.33 1xrt n GLY 130 N 2.21 0.02 2.39 -3.33 0.00 -1.26 -1.54 105.19 103.67 1xrt n GLY 130 Ca 0.08 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.94 1xrt n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xrt n ARG 131 N 0.25 -1.85 0.16 1.61 1.74 -0.40 -4.90 116.66 113.27 1xrt n ARG 131 Ca 0.00 0.82 0.12 0.00 -0.77 0.00 0.00 57.85 58.02 1xrt n ARG 131 Cb 0.38 -5.39 0.18 0.00 -1.02 0.00 0.00 32.46 26.62 1xrt n ARG 131 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1xrt h LYS 132 N 0.00 0.00 0.00 5.56 1.79 -1.48 -3.48 116.57 118.96 1xrt h LYS 132 Ca -0.37 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 1xrt h LYS 132 Cb 1.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 1xrt h LYS 132 CO 0.46 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.24 1xrt n GLY 133 N 1.18 0.77 0.05 3.86 0.00 -1.26 -4.94 105.19 104.85 1xrt n GLY 133 Ca 0.03 -0.14 -0.06 0.00 0.00 0.00 0.00 46.02 45.85 1xrt n GLY 133 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xrt n LYS 134 N -2.43 0.74 -3.90 1.61 5.02 -1.26 -4.82 118.16 113.12 1xrt n LYS 134 Ca 0.00 0.05 -0.27 0.00 -2.02 0.00 0.00 58.31 56.07 1xrt n LYS 134 Cb 0.00 -1.20 -0.17 0.00 -0.02 0.00 0.00 35.03 33.64 1xrt n LYS 134 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1xrt s GLU 135 N -2.20 1.48 0.32 1.97 2.12 -1.26 -5.04 118.70 116.09 1xrt s GLU 135 Ca -0.12 -0.29 -0.29 0.00 0.36 0.00 0.00 54.97 54.63 1xrt s GLU 135 Cb 0.03 -1.66 -0.12 0.00 0.26 0.00 0.00 34.13 32.64 1xrt s GLU 135 CO 0.25 -0.30 1.34 1.51 -0.54 0.00 0.00 175.26 177.52 1xrt n ILE 136 N 4.94 1.77 -1.70 -3.70 3.06 -1.26 -0.63 119.36 121.83 1xrt n ILE 136 Ca -0.12 -0.44 -0.29 0.00 -2.50 0.00 0.00 62.75 59.40 1xrt n ILE 136 Cb 0.50 -1.61 0.12 0.00 0.54 0.00 0.00 39.64 39.19 1xrt n ILE 136 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1xrt s ALA 137 N -0.86 2.16 -1.01 1.51 0.00 -0.30 -4.57 121.76 118.69 1xrt s ALA 137 Ca 0.58 -0.59 -0.20 0.00 0.00 0.00 0.00 51.96 51.75 1xrt s ALA 137 Cb -0.57 -3.00 0.10 0.00 0.00 0.00 0.00 23.12 19.65 1xrt s ALA 137 CO 0.59 -2.03 1.31 0.34 0.00 0.00 0.00 175.76 175.98 1xrt s ASP 138 N -4.28 6.62 0.27 0.00 -1.08 -1.26 -4.80 116.67 112.14 1xrt s ASP 138 Ca 0.63 -1.90 0.02 0.00 -0.52 0.00 0.00 52.55 50.78 1xrt s ASP 138 Cb -0.13 -2.48 0.36 0.00 -1.46 0.00 0.00 42.92 39.21 1xrt s ASP 138 CO 0.51 -1.22 1.68 -0.26 0.52 0.00 0.00 175.17 176.40 1xrt h PHE 139 N 9.02 0.55 0.01 -5.34 -1.00 -1.92 -1.81 116.94 116.45 1xrt h PHE 139 Ca 0.20 -0.13 -0.00 0.00 2.81 0.00 0.00 57.97 60.85 1xrt h PHE 139 Cb 1.00 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 40.43 1xrt h PHE 139 CO 1.22 0.74 -0.00 -0.92 -1.61 0.00 0.00 178.31 177.74 1xrt h TYR 140 N 0.42 -0.01 -0.35 -0.55 5.03 -1.97 0.22 116.97 119.76 1xrt h TYR 140 Ca 0.05 -0.00 -0.08 0.00 2.58 0.00 0.00 58.73 61.29 1xrt h TYR 140 Cb 0.74 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 39.01 1xrt h TYR 140 CO 0.02 0.13 -0.11 0.77 -1.32 0.00 0.00 178.16 177.66 1xrt h SER 141 N -0.15 0.58 -0.01 -2.11 0.02 -1.94 -1.72 113.55 108.21 1xrt h SER 141 Ca -0.00 -0.15 -0.26 0.00 -0.84 0.00 0.00 61.79 60.53 1xrt h SER 141 Cb 0.15 -0.15 0.02 0.00 0.14 0.00 0.00 62.40 62.55 1xrt h SER 141 CO 0.00 0.72 -1.02 -0.07 -1.14 0.00 0.00 176.83 175.32 1xrt h LEU 142 N 0.55 0.92 -0.23 5.07 3.38 -1.10 -1.73 115.31 122.16 1xrt h LEU 142 Ca 0.10 -0.73 -0.01 0.00 0.09 0.00 0.00 57.88 57.33 1xrt h LEU 142 Cb 0.52 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1xrt h LEU 142 CO 0.03 1.53 0.09 0.50 0.09 0.00 0.00 178.44 180.68 1xrt h LYS 143 N 0.41 0.35 -0.64 1.13 3.64 -0.46 -1.58 116.57 119.42 1xrt h LYS 143 Ca -0.12 -0.06 0.11 0.00 -1.27 0.00 0.00 60.65 59.30 1xrt h LYS 143 Cb 1.67 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 33.40 1xrt h LYS 143 CO 0.20 0.39 0.43 0.93 -2.27 0.00 0.00 179.45 179.14 1xrt h GLU 144 N 0.22 0.42 0.00 1.90 4.39 -1.28 -1.24 114.58 118.99 1xrt h GLU 144 Ca 0.08 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1xrt h GLU 144 Cb 0.18 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1xrt h GLU 144 CO -0.01 0.28 0.00 0.00 -1.16 0.00 0.00 179.01 178.12 1xrt h ALA 145 N 1.68 1.00 0.00 3.43 0.00 -1.00 -3.46 119.26 120.91 1xrt h ALA 145 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1xrt h ALA 145 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1xrt h ALA 145 CO -0.09 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.57 1xrt n GLY 146 N 0.62 0.00 3.75 0.00 0.00 -0.47 -4.84 105.19 104.25 1xrt n GLY 146 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1xrt n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xrt n VAL 148 N 1.74 0.00 -3.83 0.00 0.24 -0.65 -4.44 118.33 111.40 1xrt n VAL 148 Ca 0.04 -0.20 -0.06 0.00 -2.04 0.00 0.00 64.34 62.08 1xrt n VAL 148 Cb 0.41 1.00 -0.00 0.00 -1.47 0.00 0.00 33.84 33.77 1xrt n VAL 148 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xrt s ALA 149 N -2.20 -1.21 -0.02 2.33 0.00 -1.26 -4.34 121.76 115.06 1xrt s ALA 149 Ca 0.05 -0.34 0.02 0.00 0.00 0.00 0.00 51.96 51.69 1xrt s ALA 149 Cb 0.10 0.76 0.00 0.00 0.00 0.00 0.00 23.12 23.97 1xrt s ALA 149 CO 0.52 -1.03 -0.07 -0.06 0.00 0.00 0.00 175.76 175.12 1xrt s PHE 150 N -3.24 0.74 -0.01 0.00 0.08 -1.01 -1.58 117.98 112.95 1xrt s PHE 150 Ca 0.13 -0.16 -0.26 0.00 0.12 0.00 0.00 56.93 56.76 1xrt s PHE 150 Cb -0.05 -0.52 0.06 0.00 -0.57 0.00 0.00 43.02 41.94 1xrt s PHE 150 CO 0.07 -0.06 0.58 -0.08 -0.10 0.00 0.00 175.22 175.63 1xrt s THR 151 N 0.08 0.02 -2.41 0.64 -1.32 -0.36 -0.80 115.64 111.49 1xrt s THR 151 Ca -0.01 -0.13 0.22 0.00 -1.21 0.00 0.00 61.69 60.56 1xrt s THR 151 Cb -0.06 -0.93 0.44 0.00 -1.51 0.00 0.00 72.50 70.44 1xrt s THR 151 CO -0.00 -0.07 1.44 0.47 -2.21 0.00 0.00 174.62 174.24 1xrt n ASP 152 N 0.81 3.01 -1.00 8.08 8.00 -1.26 -2.63 116.55 131.56 1xrt n ASP 152 Ca -0.19 -1.93 -0.12 0.00 0.71 0.00 0.00 54.79 53.26 1xrt n ASP 152 Cb 0.58 -0.22 -0.01 0.00 -0.02 0.00 0.00 41.12 41.44 1xrt n ASP 152 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1xrt n ASP 153 N 1.20 -0.20 0.00 -2.24 -0.08 -1.26 -1.04 116.55 112.92 1xrt n ASP 153 Ca 0.19 0.26 0.00 0.00 -1.51 0.00 0.00 54.79 53.72 1xrt n ASP 153 Cb 0.53 -0.21 0.00 0.00 2.34 0.00 0.00 41.12 43.78 1xrt n ASP 153 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xrt n GLY 154 N 0.42 2.08 2.92 0.27 0.00 -1.24 -3.87 105.19 105.76 1xrt n GLY 154 Ca 0.04 -0.67 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 1xrt n GLY 154 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xrt s SER 155 N 0.00 0.54 0.82 1.61 1.04 -0.21 -1.93 113.70 115.58 1xrt s SER 155 Ca 0.00 0.23 -0.14 0.00 0.48 0.00 0.00 55.95 56.52 1xrt s SER 155 Cb 0.00 0.86 0.03 0.00 0.10 0.00 0.00 66.02 67.01 1xrt s SER 155 CO 0.00 -0.29 0.75 -2.65 0.98 0.00 0.00 173.24 172.02 1xrt n PRO 156 N 5.35 0.07 -2.29 4.02 -0.02 -1.26 -4.57 135.00 136.31 1xrt n PRO 156 Ca -0.05 0.08 -0.42 0.00 -2.02 0.00 0.00 63.50 61.09 1xrt n PRO 156 Cb 0.50 -2.07 -0.03 0.00 -0.02 0.00 0.00 33.50 31.89 1xrt n PRO 156 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xrt s VAL 157 N -2.14 3.93 -0.04 -1.45 1.01 -1.26 -4.91 120.40 115.54 1xrt s VAL 157 Ca 0.66 1.24 0.06 0.00 0.00 0.00 0.00 61.98 63.94 1xrt s VAL 157 Cb -0.29 -3.80 -0.24 0.00 0.00 0.00 0.00 36.38 32.05 1xrt s VAL 157 CO 0.58 -0.04 0.69 0.24 0.00 0.00 0.00 175.10 176.58 1xrt h MET 158 N 8.05 0.09 -5.56 2.72 2.86 -1.92 -3.46 114.93 117.71 1xrt h MET 158 Ca -0.35 -0.15 -0.63 0.00 -2.06 0.00 0.00 59.70 56.51 1xrt h MET 158 Cb 1.16 0.06 -0.13 0.00 0.06 0.00 0.00 31.60 32.74 1xrt h MET 158 CO 0.92 0.77 0.21 0.34 1.06 0.00 0.00 176.91 180.21 1xrt s ASP 159 N -6.46 6.41 0.39 1.22 -1.08 -1.26 -4.92 116.67 110.97 1xrt s ASP 159 Ca -0.08 0.01 0.09 0.00 -0.52 0.00 0.00 52.55 52.05 1xrt s ASP 159 Cb 0.08 -2.34 0.86 0.00 -1.46 0.00 0.00 42.92 40.06 1xrt s ASP 159 CO 0.82 -0.71 1.98 0.28 0.52 0.00 0.00 175.17 178.05 1xrt h SER 160 N 8.66 0.53 -0.59 -0.34 0.02 -1.99 -1.57 113.55 118.26 1xrt h SER 160 Ca -0.26 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.63 1xrt h SER 160 Cb 1.10 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.51 1xrt h SER 160 CO 0.88 0.34 0.09 0.77 -1.14 0.00 0.00 176.83 177.77 1xrt h SER 161 N 0.60 0.94 0.02 3.07 4.64 -1.99 0.17 113.55 121.00 1xrt h SER 161 Ca 0.28 -0.26 0.01 0.00 -0.47 0.00 0.00 61.79 61.35 1xrt h SER 161 Cb 0.33 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1xrt h SER 161 CO -0.09 0.96 -0.07 0.58 -0.87 0.00 0.00 176.83 177.34 1xrt h VAL 162 N 0.87 0.82 -0.86 0.95 2.07 -1.74 -1.30 116.25 117.06 1xrt h VAL 162 Ca 0.18 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.73 1xrt h VAL 162 Cb 0.43 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 1xrt h VAL 162 CO 0.01 0.00 0.55 -0.03 0.02 0.00 0.00 177.57 178.13 1xrt h MET 163 N -0.13 1.04 -0.02 1.57 -1.53 -1.15 0.08 114.93 114.78 1xrt h MET 163 Ca 0.02 -0.06 0.01 0.00 -3.44 0.00 0.00 59.70 56.23 1xrt h MET 163 Cb 0.16 -0.23 -0.01 0.00 -0.55 0.00 0.00 31.60 30.96 1xrt h MET 163 CO -0.06 0.69 -0.03 -0.09 0.14 0.00 0.00 176.91 177.56 1xrt h ARG 164 N 1.07 -0.04 -0.65 0.39 2.43 -0.46 -0.63 114.38 116.50 1xrt h ARG 164 Ca 0.35 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.46 1xrt h ARG 164 Cb 0.03 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 1xrt h ARG 164 CO -0.12 -0.03 0.14 0.87 -1.51 0.00 0.00 179.97 179.32 1xrt h LYS 165 N -0.04 1.03 -0.23 0.20 1.57 -0.85 -1.27 116.57 116.98 1xrt h LYS 165 Ca 0.02 -0.25 0.03 0.00 -1.87 0.00 0.00 60.65 58.58 1xrt h LYS 165 Cb 0.07 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 1xrt h LYS 165 CO -0.05 0.93 0.07 0.00 -0.57 0.00 0.00 179.45 179.82 1xrt h ALA 166 N 1.16 0.25 -0.25 3.86 0.00 -0.68 -1.40 119.26 122.21 1xrt h ALA 166 Ca 0.20 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 1xrt h ALA 166 Cb 0.37 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1xrt h ALA 166 CO 0.00 -0.35 -0.06 -0.07 0.00 0.00 0.00 179.25 178.77 1xrt h LEU 167 N 0.17 0.36 0.27 0.00 3.38 -0.82 0.02 115.31 118.69 1xrt h LEU 167 Ca 0.10 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1xrt h LEU 167 Cb 0.08 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1xrt h LEU 167 CO -0.12 0.47 -0.13 -0.33 0.09 0.00 0.00 178.44 178.42 1xrt h GLU 168 N 0.37 -0.35 -0.71 1.13 5.08 -0.64 -0.61 114.58 118.84 1xrt h GLU 168 Ca 0.08 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 1xrt h GLU 168 Cb 0.34 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1xrt h GLU 168 CO 0.02 -0.18 0.35 -0.07 -1.00 0.00 0.00 179.01 178.12 1xrt h LEU 169 N -0.44 0.93 -0.83 1.33 3.38 -1.22 -2.05 115.31 116.41 1xrt h LEU 169 Ca -0.04 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1xrt h LEU 169 Cb 0.33 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1xrt h LEU 169 CO 0.06 0.80 0.45 0.00 0.09 0.00 0.00 178.44 179.84 1xrt h ALA 170 N 1.17 1.07 -0.80 1.53 0.00 -0.88 -1.03 119.26 120.32 1xrt h ALA 170 Ca 0.25 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1xrt h ALA 170 Cb 0.11 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 1xrt h ALA 170 CO -0.03 0.58 0.48 0.66 0.00 0.00 0.00 179.25 180.94 1xrt h SER 171 N 1.16 0.96 -0.62 0.00 4.64 -0.84 0.80 113.55 119.66 1xrt h SER 171 Ca 0.29 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.52 1xrt h SER 171 Cb 0.04 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 61.85 1xrt h SER 171 CO -0.05 0.75 0.32 1.56 -0.87 0.00 0.00 176.83 178.54 1xrt h GLN 172 N 1.09 0.90 0.00 4.77 4.20 -0.92 -3.12 115.11 122.04 1xrt h GLN 172 Ca 0.29 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1xrt h GLN 172 Cb -0.03 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.57 1xrt h GLN 172 CO -0.05 0.69 -0.54 1.28 -0.67 0.00 0.00 178.83 179.54 1xrt n LEU 173 N -4.35 0.64 -1.14 1.46 4.77 -0.43 -4.98 117.00 112.97 1xrt n LEU 173 Ca 0.06 0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 56.17 1xrt n LEU 173 Cb 0.12 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1xrt n LEU 173 CO 0.38 -0.03 -0.09 0.61 -1.33 0.00 0.00 177.39 176.93 1xrt n GLY 174 N 1.37 0.03 3.36 -0.72 0.00 0.23 -5.06 105.19 104.40 1xrt n GLY 174 Ca 0.04 -0.48 -0.20 0.00 0.00 0.00 0.00 46.02 45.38 1xrt n GLY 174 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xrt s VAL 175 N -2.53 1.87 0.55 1.61 -7.23 -0.94 -4.96 120.40 108.76 1xrt s VAL 175 Ca 0.03 -2.13 -0.12 0.00 -1.81 0.00 0.00 61.98 57.95 1xrt s VAL 175 Cb -0.01 -2.01 -0.05 0.00 0.56 0.00 0.00 36.38 34.87 1xrt s VAL 175 CO 0.04 -0.47 0.96 -2.16 -0.31 0.00 0.00 175.10 173.16 1xrt s PRO 176 N -3.32 3.71 -0.22 4.82 0.04 -1.26 -4.46 135.00 134.30 1xrt s PRO 176 Ca 0.21 0.70 -0.10 0.00 0.04 0.00 0.00 61.00 61.85 1xrt s PRO 176 Cb -0.03 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 1xrt s PRO 176 CO 0.08 -0.39 0.14 0.42 0.04 0.00 0.00 177.00 177.30 1xrt s ILE 177 N -2.89 5.33 -0.15 0.56 -1.09 -0.02 -2.40 121.20 120.53 1xrt s ILE 177 Ca 0.55 0.17 -0.08 0.00 -2.23 0.00 0.00 60.65 59.05 1xrt s ILE 177 Cb -0.11 -3.47 -0.04 0.00 -1.58 0.00 0.00 42.46 37.26 1xrt s ILE 177 CO 0.44 0.38 0.13 -0.04 -1.23 0.00 0.00 174.94 174.62 1xrt s MET 178 N 0.80 3.76 0.03 2.79 -1.94 0.02 -0.14 119.30 124.62 1xrt s MET 178 Ca 0.07 -0.18 -0.11 0.00 -1.71 0.00 0.00 55.69 53.76 1xrt s MET 178 Cb -0.13 -3.28 0.01 0.00 2.01 0.00 0.00 34.83 33.45 1xrt s MET 178 CO 0.02 0.56 0.23 0.34 -0.01 0.00 0.00 175.02 176.17 1xrt s ASP 179 N -0.41 -0.04 -0.14 3.03 2.15 -0.16 -4.32 116.67 116.79 1xrt s ASP 179 Ca 0.12 -0.22 -0.00 0.00 0.43 0.00 0.00 52.55 52.87 1xrt s ASP 179 Cb -0.12 0.30 -0.00 0.00 -0.30 0.00 0.00 42.92 42.80 1xrt s ASP 179 CO 0.01 -0.53 0.11 1.57 -0.17 0.00 0.00 175.17 176.17 1xrt n HIS 180 N 0.87 -0.25 -5.18 -5.34 -0.00 -1.26 -0.91 115.22 103.14 1xrt n HIS 180 Ca -0.20 0.11 -0.32 0.00 0.46 0.00 0.00 57.72 57.77 1xrt n HIS 180 Cb 0.58 -2.37 -0.16 0.00 -0.12 0.00 0.00 29.99 27.92 1xrt n HIS 180 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1xrt n GLU 182 N 3.29 2.58 0.06 0.00 1.02 -1.26 -3.50 120.64 122.83 1xrt n GLU 182 Ca -0.18 -3.49 0.21 0.00 -0.02 0.00 0.00 57.16 53.68 1xrt n GLU 182 Cb 0.53 -2.09 0.73 0.00 -0.02 0.00 0.00 31.44 30.58 1xrt n GLU 182 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1xrt h ASP 183 N 1.58 0.00 -0.02 1.62 3.58 -1.93 -1.42 116.42 119.84 1xrt h ASP 183 Ca 0.39 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.80 1xrt h ASP 183 Cb 1.51 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.55 1xrt h ASP 183 CO 0.84 0.00 -0.08 0.44 -2.88 0.00 0.00 179.24 177.56 1xrt h ASP 184 N 0.00 0.21 -0.95 2.28 5.19 -1.69 -1.13 116.42 120.35 1xrt h ASP 184 Ca 0.23 -0.03 0.29 0.00 -0.62 0.00 0.00 57.03 56.89 1xrt h ASP 184 Cb 1.23 -0.06 -0.15 0.00 0.18 0.00 0.00 39.33 40.54 1xrt h ASP 184 CO -0.00 0.33 0.37 0.11 -3.12 0.00 0.00 179.24 176.93 1xrt h LYS 185 N 0.23 0.22 -0.00 3.56 1.57 -1.47 -2.88 116.57 117.79 1xrt h LYS 185 Ca 0.05 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1xrt h LYS 185 Cb 0.29 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1xrt h LYS 185 CO 0.01 0.14 -0.02 1.28 -0.57 0.00 0.00 179.45 180.30 1xrt n LEU 186 N -5.18 1.11 0.09 2.94 4.77 -0.95 -5.23 117.00 114.56 1xrt n LEU 186 Ca 0.27 -0.94 -0.02 0.00 -0.03 0.00 0.00 56.01 55.29 1xrt n LEU 186 Cb 0.85 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.90 1xrt n LEU 186 CO 0.06 0.25 0.23 0.00 -1.33 0.00 0.00 177.39 176.60 1xrt h ALA 187 N 0.56 0.56 0.00 -1.18 0.00 -1.00 -3.49 119.26 114.71 1xrt h ALA 187 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1xrt h ALA 187 Cb 0.12 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1xrt h ALA 187 CO 0.00 0.93 0.00 0.39 0.00 0.00 0.00 179.25 180.57 1xrt n GLU 208 N -3.23 0.00 -0.05 0.00 4.71 -1.26 -5.06 120.64 115.75 1xrt n GLU 208 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1xrt n GLU 208 Cb 0.84 -0.67 0.30 0.00 -1.01 0.00 0.00 31.44 30.90 1xrt n GLU 208 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1xrt h ALA 209 N 0.76 1.44 -0.01 0.62 0.00 -2.05 -1.97 119.26 118.05 1xrt h ALA 209 Ca 0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1xrt h ALA 209 Cb 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1xrt h ALA 209 CO 0.00 0.42 0.00 1.49 0.00 0.00 0.00 179.25 181.16 1xrt h GLU 210 N 0.63 0.01 -0.53 0.00 4.81 -2.00 -1.00 114.58 116.49 1xrt h GLU 210 Ca 0.15 -0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.30 1xrt h GLU 210 Cb 0.17 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1xrt h GLU 210 CO -0.01 0.20 0.03 0.93 -0.73 0.00 0.00 179.01 179.43 1xrt h GLU 211 N -0.19 0.88 -0.37 1.92 3.07 -1.93 -1.42 114.58 116.54 1xrt h GLU 211 Ca 0.00 -0.24 -0.13 0.00 -0.50 0.00 0.00 59.36 58.49 1xrt h GLU 211 Cb 0.20 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 1xrt h GLU 211 CO -0.00 0.86 -0.29 0.82 -1.40 0.00 0.00 179.01 179.00 1xrt h ILE 212 N 0.82 1.28 -0.66 3.13 2.04 -1.31 -0.38 117.51 122.45 1xrt h ILE 212 Ca 0.16 -1.46 -0.08 0.00 1.00 0.00 0.00 64.86 64.49 1xrt h ILE 212 Cb 0.45 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 1xrt h ILE 212 CO 0.02 0.48 0.10 -0.61 0.00 0.00 0.00 178.15 178.15 1xrt h GLN 213 N 0.65 1.09 -0.38 2.37 4.15 -0.88 -0.82 115.11 121.29 1xrt h GLN 213 Ca 0.07 -0.29 -0.06 0.00 0.77 0.00 0.00 58.65 59.13 1xrt h GLN 213 Cb 0.87 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.42 1xrt h GLN 213 CO 0.08 1.00 -0.02 0.82 -1.93 0.00 0.00 178.83 178.78 1xrt h ILE 214 N 1.01 1.26 -0.35 2.39 2.04 -1.14 0.06 117.51 122.78 1xrt h ILE 214 Ca 0.20 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 65.03 1xrt h ILE 214 Cb 0.44 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1xrt h ILE 214 CO 0.01 0.34 0.22 0.00 0.00 0.00 0.00 178.15 178.73 1xrt h ALA 215 N 0.87 0.45 -0.29 1.87 0.00 -0.94 -1.12 119.26 120.10 1xrt h ALA 215 Ca 0.10 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.01 1xrt h ALA 215 Cb 0.49 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1xrt h ALA 215 CO 0.02 -0.07 0.09 -0.09 0.00 0.00 0.00 179.25 179.20 1xrt h ARG 216 N 0.47 0.20 -0.87 0.00 2.43 -0.98 -1.20 114.38 114.43 1xrt h ARG 216 Ca 0.13 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1xrt h ARG 216 Cb -0.02 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.44 1xrt h ARG 216 CO -0.03 0.13 0.58 -0.44 -1.51 0.00 0.00 179.97 178.70 1xrt h ASP 217 N 0.21 1.00 -0.63 -3.80 3.32 -0.58 -0.70 116.42 115.23 1xrt h ASP 217 Ca 0.13 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 1xrt h ASP 217 Cb 0.11 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1xrt h ASP 217 CO -0.14 0.72 0.05 1.23 -1.72 0.00 0.00 179.24 179.38 1xrt h GLY 218 N 1.18 1.17 0.90 2.75 0.00 -0.86 0.09 103.07 108.30 1xrt h GLY 218 Ca 0.32 -0.82 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 1xrt h GLY 218 CO -0.07 0.75 0.09 -2.22 0.00 0.00 0.00 176.54 175.09 1xrt h ILE 219 N 1.00 1.20 -0.30 2.60 2.04 -0.97 -0.24 117.51 122.84 1xrt h ILE 219 Ca 0.19 -0.66 -0.13 0.00 1.00 0.00 0.00 64.86 65.26 1xrt h ILE 219 Cb 0.50 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1xrt h ILE 219 CO 0.02 0.22 -0.34 -0.07 0.00 0.00 0.00 178.15 177.98 1xrt h LEU 220 N 0.32 0.70 -0.59 1.44 3.38 -1.02 -2.03 115.31 117.51 1xrt h LEU 220 Ca 0.10 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1xrt h LEU 220 Cb 0.25 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1xrt h LEU 220 CO -0.00 0.98 0.20 0.00 0.09 0.00 0.00 178.44 179.71 1xrt h ALA 221 N 1.06 0.77 -0.54 1.53 0.00 -0.79 -1.32 119.26 119.97 1xrt h ALA 221 Ca 0.06 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.79 1xrt h ALA 221 Cb 0.85 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1xrt h ALA 221 CO 0.07 0.42 0.35 0.37 0.00 0.00 0.00 179.25 180.46 1xrt h GLN 222 N 0.83 0.69 -0.09 0.00 4.15 -0.87 -1.04 115.11 118.78 1xrt h GLN 222 Ca 0.19 -0.04 -0.16 0.00 0.77 0.00 0.00 58.65 59.41 1xrt h GLN 222 Cb 0.26 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.79 1xrt h GLN 222 CO -0.01 0.46 -0.63 0.00 -1.93 0.00 0.00 178.83 176.72 1xrt h ARG 223 N 0.71 0.34 0.00 1.69 2.47 -1.10 -3.25 114.38 115.24 1xrt h ARG 223 Ca 0.20 -0.24 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1xrt h ARG 223 Cb -0.06 0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.30 1xrt h ARG 223 CO -0.05 0.86 -0.86 1.79 0.56 0.00 0.00 179.97 182.27 1xrt h THR 224 N 0.25 0.00 0.00 2.04 1.35 -1.19 -3.48 112.91 111.88 1xrt h THR 224 Ca -0.01 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.00 1xrt h THR 224 Cb 1.16 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 1xrt h THR 224 CO 0.10 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.98 1xrt n GLY 225 N 1.22 0.86 3.84 5.82 0.00 -0.40 -4.82 105.19 111.71 1xrt n GLY 225 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1xrt n GLY 225 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xrt s GLY 226 N -2.00 1.81 -0.29 -0.02 0.00 -1.16 -4.85 107.32 100.80 1xrt s GLY 226 Ca 0.00 0.07 -0.16 0.00 0.00 0.00 0.00 44.72 44.62 1xrt s GLY 226 CO 0.00 0.35 0.44 -1.58 0.00 0.00 0.00 173.10 172.31 1xrt s HIS 227 N -2.94 3.23 -0.12 1.90 2.46 -1.26 -4.52 115.29 114.03 1xrt s HIS 227 Ca 0.58 0.36 -0.03 0.00 0.47 0.00 0.00 55.06 56.44 1xrt s HIS 227 Cb -0.12 -2.70 -0.03 0.00 -0.13 0.00 0.00 32.58 29.60 1xrt s HIS 227 CO 0.47 -0.34 -0.00 0.54 -2.47 0.00 0.00 174.74 172.94 1xrt s VAL 228 N 2.20 4.24 -0.19 0.89 0.11 -0.51 -0.84 120.40 126.29 1xrt s VAL 228 Ca 0.17 -0.25 -0.00 0.00 -2.93 0.00 0.00 61.98 58.96 1xrt s VAL 228 Cb -0.16 -2.83 0.01 0.00 -1.53 0.00 0.00 36.38 31.88 1xrt s VAL 228 CO 0.11 0.55 -0.16 -2.28 -3.33 0.00 0.00 175.10 169.99 1xrt s HIS 229 N -0.28 2.83 -0.36 1.54 2.46 0.81 -1.70 115.29 120.58 1xrt s HIS 229 Ca 0.06 -1.46 -0.22 0.00 0.47 0.00 0.00 55.06 53.91 1xrt s HIS 229 Cb -0.12 -1.97 0.01 0.00 -0.13 0.00 0.00 32.58 30.36 1xrt s HIS 229 CO 0.02 -0.74 0.73 0.42 -2.47 0.00 0.00 174.74 172.70 1xrt s ILE 230 N 1.34 4.79 -0.17 0.89 -1.09 0.32 -0.98 121.20 126.30 1xrt s ILE 230 Ca 0.05 0.74 0.15 0.00 -2.23 0.00 0.00 60.65 59.37 1xrt s ILE 230 Cb -0.13 -4.16 0.07 0.00 -1.58 0.00 0.00 42.46 36.65 1xrt s ILE 230 CO -0.10 -0.40 1.44 1.56 -1.23 0.00 0.00 174.94 176.20 1xrt h GLN 231 N 8.49 0.00 -3.00 2.79 4.20 -1.16 -3.01 115.11 123.41 1xrt h GLN 231 Ca -0.25 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.24 1xrt h GLN 231 Cb 1.10 0.00 -0.31 0.00 0.30 0.00 0.00 27.48 28.57 1xrt h GLN 231 CO 0.88 0.47 -0.53 -1.58 -0.67 0.00 0.00 178.83 177.41 1xrt s HIS 232 N -2.97 -0.33 0.01 2.96 2.46 -0.80 -4.73 115.29 111.89 1xrt s HIS 232 Ca 0.04 0.80 0.04 0.00 0.47 0.00 0.00 55.06 56.41 1xrt s HIS 232 Cb 0.07 -0.02 -0.02 0.00 -0.13 0.00 0.00 32.58 32.49 1xrt s HIS 232 CO 0.74 -0.27 -0.13 0.14 -2.47 0.00 0.00 174.74 172.75 1xrt s VAL 233 N 1.71 1.03 0.00 0.89 -7.23 -1.26 -4.95 120.40 110.59 1xrt s VAL 233 Ca -0.05 -0.76 0.00 0.00 -1.81 0.00 0.00 61.98 59.36 1xrt s VAL 233 Cb -0.11 -0.90 0.00 0.00 0.56 0.00 0.00 36.38 35.92 1xrt s VAL 233 CO -0.08 0.14 0.02 -1.54 -0.31 0.00 0.00 175.10 173.33 1xrt n SER 234 N 2.34 0.05 -4.25 4.85 3.41 -1.26 -5.04 113.62 113.71 1xrt n SER 234 Ca -0.16 -0.45 -0.16 0.00 -0.26 0.00 0.00 58.87 57.84 1xrt n SER 234 Cb 0.55 0.07 -0.11 0.00 -0.26 0.00 0.00 64.21 64.46 1xrt n SER 234 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1xrt s THR 235 N -0.07 1.26 0.20 6.66 -4.23 -1.26 -4.89 115.64 113.31 1xrt s THR 235 Ca 0.00 -1.87 -0.11 0.00 -1.18 0.00 0.00 61.69 58.53 1xrt s THR 235 Cb 0.00 -1.66 0.12 0.00 1.34 0.00 0.00 72.50 72.30 1xrt s THR 235 CO 0.00 -0.57 1.75 0.50 -0.54 0.00 0.00 174.62 175.77 1xrt h LYS 236 N 3.18 0.40 -0.68 3.99 3.64 -2.00 -2.62 116.57 122.48 1xrt h LYS 236 Ca -0.38 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 58.93 1xrt h LYS 236 Cb 1.20 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.90 1xrt h LYS 236 CO 0.56 0.26 0.25 1.25 -2.27 0.00 0.00 179.45 179.51 1xrt h LEU 237 N 0.41 0.95 -0.56 5.20 5.85 -1.99 -0.59 115.31 124.58 1xrt h LEU 237 Ca 0.27 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.87 1xrt h LEU 237 Cb 0.30 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 1xrt h LEU 237 CO -0.26 0.88 0.26 0.28 -0.34 0.00 0.00 178.44 179.26 1xrt h SER 238 N 0.97 0.35 -0.64 1.25 0.02 -1.89 -0.41 113.55 113.20 1xrt h SER 238 Ca 0.22 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.15 1xrt h SER 238 Cb 0.24 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 1xrt h SER 238 CO -0.02 0.24 0.15 -0.07 -1.14 0.00 0.00 176.83 175.99 1xrt h LEU 239 N 0.50 1.00 -0.80 5.07 3.38 -1.03 -0.80 115.31 122.63 1xrt h LEU 239 Ca 0.26 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1xrt h LEU 239 Cb 0.21 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1xrt h LEU 239 CO -0.20 0.97 0.22 -0.33 0.09 0.00 0.00 178.44 179.19 1xrt h GLU 240 N 1.00 1.12 -0.27 1.13 5.08 -0.65 -0.39 114.58 121.61 1xrt h GLU 240 Ca 0.21 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1xrt h GLU 240 Cb 0.36 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1xrt h GLU 240 CO 0.00 0.95 0.02 0.82 -1.00 0.00 0.00 179.01 179.81 1xrt h ILE 241 N 1.07 1.25 -0.46 3.13 2.04 -0.76 -0.67 117.51 123.11 1xrt h ILE 241 Ca 0.23 -0.86 0.01 0.00 1.00 0.00 0.00 64.86 65.24 1xrt h ILE 241 Cb 0.30 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1xrt h ILE 241 CO -0.01 0.27 0.30 0.40 0.00 0.00 0.00 178.15 179.12 1xrt h ILE 242 N 0.26 1.10 -0.93 -0.67 2.04 -0.88 -2.23 117.51 116.19 1xrt h ILE 242 Ca 0.08 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1xrt h ILE 242 Cb 0.38 0.44 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 1xrt h ILE 242 CO 0.01 0.11 0.57 -0.08 0.00 0.00 0.00 178.15 178.76 1xrt h GLU 243 N 0.61 1.26 0.07 2.37 4.81 -0.87 -0.65 114.58 122.19 1xrt h GLU 243 Ca 0.17 -0.11 0.02 0.00 -0.13 0.00 0.00 59.36 59.32 1xrt h GLU 243 Cb -0.05 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.02 1xrt h GLU 243 CO -0.05 0.88 -0.27 0.35 -0.73 0.00 0.00 179.01 179.20 1xrt h PHE 244 N 1.29 -0.71 -0.80 0.92 3.57 -0.72 0.71 116.94 121.20 1xrt h PHE 244 Ca 0.34 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.81 1xrt h PHE 244 Cb -0.07 0.31 -0.04 0.00 2.79 0.00 0.00 35.95 38.94 1xrt h PHE 244 CO 0.00 -0.36 0.34 0.74 -2.23 0.00 0.00 178.31 176.80 1xrt h PHE 245 N -0.45 1.19 -0.36 0.41 0.04 -1.12 -2.02 116.94 114.64 1xrt h PHE 245 Ca 0.04 -0.08 -0.02 0.00 2.80 0.00 0.00 57.97 60.72 1xrt h PHE 245 Cb 0.50 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 38.27 1xrt h PHE 245 CO -0.27 0.89 0.15 0.87 -0.60 0.00 0.00 178.31 179.36 1xrt h LYS 246 N 1.15 0.53 -0.11 1.51 1.57 -0.78 -2.08 116.57 118.36 1xrt h LYS 246 Ca 0.27 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1xrt h LYS 246 Cb 0.18 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1xrt h LYS 246 CO -0.03 0.51 0.06 0.93 -0.57 0.00 0.00 179.45 180.35 1xrt h GLU 247 N 0.43 0.15 -0.22 3.15 5.08 -0.69 -1.86 114.58 120.63 1xrt h GLU 247 Ca 0.12 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1xrt h GLU 247 Cb 0.17 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1xrt h GLU 247 CO -0.01 0.12 0.00 1.63 -1.00 0.00 0.00 179.01 179.75 1xrt n LYS 248 N -4.50 1.53 -0.65 2.33 4.76 -0.78 -4.91 118.16 115.94 1xrt n LYS 248 Ca -0.01 -0.82 0.00 0.00 -2.87 0.00 0.00 58.31 54.61 1xrt n LYS 248 Cb 0.10 -1.20 0.00 0.00 -1.84 0.00 0.00 35.03 32.09 1xrt n LYS 248 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xrt n GLY 249 N 0.88 0.70 3.76 0.72 0.00 -0.70 -5.05 105.19 105.51 1xrt n GLY 249 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1xrt n GLY 249 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xrt s VAL 250 N -2.24 3.58 -1.27 1.61 1.01 -0.82 -4.95 120.40 117.33 1xrt s VAL 250 Ca 0.00 1.50 -0.17 0.00 0.00 0.00 0.00 61.98 63.31 1xrt s VAL 250 Cb 0.00 -3.92 0.10 0.00 0.00 0.00 0.00 36.38 32.56 1xrt s VAL 250 CO 0.00 0.29 1.65 -0.54 0.00 0.00 0.00 175.10 176.50 1xrt s LYS 251 N -1.67 4.01 -0.06 2.72 1.02 -1.26 -4.40 119.74 120.10 1xrt s LYS 251 Ca 0.47 -2.14 0.03 0.00 0.02 0.00 0.00 55.97 54.35 1xrt s LYS 251 Cb -0.29 -5.40 0.01 0.00 -0.52 0.00 0.00 37.83 31.63 1xrt s LYS 251 CO 0.37 -2.12 -0.13 -1.50 -0.92 0.00 0.00 175.35 171.05 1xrt s ILE 252 N 3.51 1.16 0.35 2.17 2.07 -1.26 -1.43 121.20 127.78 1xrt s ILE 252 Ca 0.51 -0.51 0.03 0.00 -1.41 0.00 0.00 60.65 59.27 1xrt s ILE 252 Cb 0.02 -1.05 -0.04 0.00 0.13 0.00 0.00 42.46 41.52 1xrt s ILE 252 CO 0.05 0.36 0.11 0.42 -1.91 0.00 0.00 174.94 173.97 1xrt s THR 253 N 0.56 0.70 0.27 4.00 -4.23 -0.69 -4.83 115.64 111.42 1xrt s THR 253 Ca -0.13 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.17 1xrt s THR 253 Cb -0.15 -2.52 0.02 0.00 1.34 0.00 0.00 72.50 71.19 1xrt s THR 253 CO 0.03 0.00 0.71 0.00 -0.54 0.00 0.00 174.62 174.82 1xrt s GLU 255 N -3.91 1.05 -0.03 0.00 -1.05 -1.14 -1.78 118.70 111.85 1xrt s GLU 255 Ca 0.11 -1.52 -0.09 0.00 -0.15 0.00 0.00 54.97 53.32 1xrt s GLU 255 Cb -0.06 0.08 0.01 0.00 -0.44 0.00 0.00 34.13 33.73 1xrt s GLU 255 CO 0.06 -0.25 0.19 0.54 0.95 0.00 0.00 175.26 176.75 1xrt s VAL 256 N -3.95 0.05 -0.43 1.83 0.11 -0.72 -4.49 120.40 112.81 1xrt s VAL 256 Ca 0.27 -0.44 -0.29 0.00 -2.93 0.00 0.00 61.98 58.59 1xrt s VAL 256 Cb 0.07 -0.43 0.02 0.00 -1.53 0.00 0.00 36.38 34.52 1xrt s VAL 256 CO 0.05 -0.24 1.17 0.21 -3.33 0.00 0.00 175.10 172.96 1xrt s ASN 257 N -0.92 6.65 0.54 3.54 2.47 -1.11 -1.61 114.94 124.50 1xrt s ASN 257 Ca -0.10 0.65 0.26 0.00 0.42 0.00 0.00 52.86 54.08 1xrt s ASN 257 Cb -0.05 -2.55 1.54 0.00 -1.45 0.00 0.00 41.25 38.74 1xrt s ASN 257 CO 0.02 -1.21 2.14 1.55 -3.72 0.00 0.00 177.10 175.88 1xrt h PRO 258 N 9.24 0.00 -0.03 0.43 0.13 -1.90 -2.44 132.00 137.43 1xrt h PRO 258 Ca -0.23 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.85 1xrt h PRO 258 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1xrt h PRO 258 CO 1.10 0.07 -0.22 -0.91 -0.23 0.00 0.00 178.00 177.82 1xrt h ASN 259 N 0.00 0.05 0.97 1.44 2.35 -1.89 -2.79 115.58 115.71 1xrt h ASN 259 Ca -0.00 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 1xrt h ASN 259 Cb 0.18 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.53 1xrt h ASN 259 CO 0.01 0.27 -0.12 -0.74 -1.65 0.00 0.00 177.43 175.21 1xrt h HIS 260 N 0.05 0.00 -0.35 1.19 2.76 -1.83 -3.36 115.15 113.61 1xrt h HIS 260 Ca 0.01 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 1xrt h HIS 260 Cb 0.42 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.38 1xrt h HIS 260 CO 0.00 0.12 0.00 1.28 -1.30 0.00 0.00 177.93 178.03 1xrt n LEU 261 N -3.26 2.33 -1.77 0.26 4.32 -1.05 -4.67 117.00 113.16 1xrt n LEU 261 Ca 0.00 -1.09 -0.14 0.00 -0.02 0.00 0.00 56.01 54.76 1xrt n LEU 261 Cb 0.37 -0.23 0.12 0.00 -1.62 0.00 0.00 43.42 42.06 1xrt n LEU 261 CO 0.30 0.54 0.99 0.18 -1.22 0.00 0.00 177.39 178.19 1xrt n LEU 262 N 0.76 5.33 -4.77 2.23 4.77 -1.26 -5.06 117.00 119.00 1xrt n LEU 262 Ca 0.16 -2.81 -0.37 0.00 -0.03 0.00 0.00 56.01 52.96 1xrt n LEU 262 Cb 0.40 -0.71 -0.02 0.00 -2.33 0.00 0.00 43.42 40.76 1xrt n LEU 262 CO 0.12 0.83 0.82 -0.60 -1.33 0.00 0.00 177.39 177.23 1xrt s ARG 287 N -2.10 3.86 0.17 3.23 6.06 -1.26 -5.23 118.95 123.69 1xrt s ARG 287 Ca 0.36 1.76 -0.01 0.00 -2.50 0.00 0.00 55.73 55.34 1xrt s ARG 287 Cb 0.30 -2.47 0.02 0.00 0.06 0.00 0.00 34.95 32.86 1xrt s ARG 287 CO 0.07 -0.46 1.40 -0.07 -2.50 0.00 0.00 175.30 173.74 1xrt h LEU 288 N 2.21 0.41 -0.97 -0.88 3.38 -1.98 -2.66 115.31 114.82 1xrt h LEU 288 Ca -0.49 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.13 1xrt h LEU 288 Cb 1.24 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 1xrt h LEU 288 CO 0.61 1.06 0.17 0.00 0.09 0.00 0.00 178.44 180.37 1xrt h ALA 289 N 0.92 1.17 -0.57 1.53 0.00 -1.97 -1.11 119.26 119.23 1xrt h ALA 289 Ca -0.04 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1xrt h ALA 289 Cb 1.41 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1xrt h ALA 289 CO 0.13 0.57 0.21 -0.07 0.00 0.00 0.00 179.25 180.10 1xrt h LEU 290 N 0.88 0.80 -0.87 0.00 3.38 -1.83 0.27 115.31 117.93 1xrt h LEU 290 Ca 0.20 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1xrt h LEU 290 Cb 0.28 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1xrt h LEU 290 CO -0.01 0.76 0.51 0.40 0.09 0.00 0.00 178.44 180.20 1xrt h ILE 291 N 0.79 1.25 -0.47 1.22 2.04 -1.25 -1.10 117.51 119.98 1xrt h ILE 291 Ca 0.19 -0.56 -0.06 0.00 1.00 0.00 0.00 64.86 65.42 1xrt h ILE 291 Cb 0.22 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 1xrt h ILE 291 CO -0.01 0.26 0.03 -0.08 0.00 0.00 0.00 178.15 178.35 1xrt h GLU 292 N 1.21 0.76 -0.14 2.37 4.57 -0.68 -0.98 114.58 121.69 1xrt h GLU 292 Ca 0.31 -0.19 -0.07 0.00 -1.18 0.00 0.00 59.36 58.24 1xrt h GLU 292 Cb -0.02 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 1xrt h GLU 292 CO -0.06 0.75 -0.22 0.78 -1.18 0.00 0.00 179.01 179.09 1xrt h GLY 293 N 0.95 0.26 0.44 1.92 0.00 0.25 -0.72 103.07 106.17 1xrt h GLY 293 Ca 0.15 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 1xrt h GLY 293 CO 0.01 0.17 -0.00 -2.08 0.00 0.00 0.00 176.54 174.64 1xrt h VAL 294 N 0.22 1.43 -0.46 4.60 2.07 -1.01 -0.06 116.25 123.04 1xrt h VAL 294 Ca 0.04 -1.30 0.09 0.00 0.82 0.00 0.00 66.70 66.34 1xrt h VAL 294 Cb 0.51 2.31 -0.08 0.00 -1.52 0.00 0.00 31.29 32.51 1xrt h VAL 294 CO 0.03 0.34 -0.04 0.50 0.02 0.00 0.00 177.57 178.43 1xrt h LYS 295 N -0.57 0.07 0.00 1.57 3.64 -0.95 -2.36 116.57 117.97 1xrt h LYS 295 Ca -0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1xrt h LYS 295 Cb 0.56 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1xrt h LYS 295 CO 0.00 0.05 0.00 0.54 -2.27 0.00 0.00 179.45 177.77 1xrt n ARG 296 N -5.26 0.05 -0.71 1.90 1.74 -0.30 -4.92 116.66 109.17 1xrt n ARG 296 Ca 0.04 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.19 1xrt n ARG 296 Cb 0.25 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 1xrt n ARG 296 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xrt n GLY 297 N 1.06 0.67 0.14 -0.13 0.00 -0.89 -4.94 105.19 101.10 1xrt n GLY 297 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 1xrt n GLY 297 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xrt h ILE 298 N 0.00 1.31 -3.06 -0.61 2.04 -1.29 -3.41 117.51 112.49 1xrt h ILE 298 Ca 0.00 -1.13 -0.57 0.00 1.00 0.00 0.00 64.86 64.16 1xrt h ILE 298 Cb 0.00 1.66 -0.05 0.00 -0.74 0.00 0.00 36.82 37.69 1xrt h ILE 298 CO 0.00 0.34 0.90 -0.63 0.00 0.00 0.00 178.15 178.76 1xrt s ILE 299 N -4.60 4.34 0.09 -0.67 1.01 -0.92 -4.63 121.20 115.81 1xrt s ILE 299 Ca -0.14 1.58 -0.09 0.00 0.00 0.00 0.00 60.65 62.00 1xrt s ILE 299 Cb 0.06 -4.15 -0.25 0.00 0.01 0.00 0.00 42.46 38.13 1xrt s ILE 299 CO 0.75 -0.29 1.18 0.44 0.00 0.00 0.00 174.94 177.02 1xrt h ASP 300 N 8.38 0.66 -5.20 3.58 5.19 -1.59 -3.45 116.42 123.99 1xrt h ASP 300 Ca -0.24 -0.60 -0.09 0.00 -0.62 0.00 0.00 57.03 55.48 1xrt h ASP 300 Cb 1.09 -0.21 -0.13 0.00 0.18 0.00 0.00 39.33 40.26 1xrt h ASP 300 CO 1.00 1.42 -0.33 0.00 -3.12 0.00 0.00 179.24 178.21 1xrt s PHE 302 N -3.90 3.64 -0.03 0.00 0.08 -0.51 -1.75 117.98 115.51 1xrt s PHE 302 Ca 0.10 1.41 -0.01 0.00 0.12 0.00 0.00 56.93 58.55 1xrt s PHE 302 Cb 0.04 -2.87 0.02 0.00 -0.57 0.00 0.00 43.02 39.63 1xrt s PHE 302 CO -0.07 0.12 0.06 0.00 -0.10 0.00 0.00 175.22 175.24 1xrt s ALA 303 N 0.58 -0.08 0.13 5.36 0.00 -0.63 -4.71 121.76 122.40 1xrt s ALA 303 Ca 0.41 0.29 0.15 0.00 0.00 0.00 0.00 51.96 52.81 1xrt s ALA 303 Cb -0.19 -0.20 0.40 0.00 0.00 0.00 0.00 23.12 23.13 1xrt s ALA 303 CO 0.22 -0.07 1.61 1.79 0.00 0.00 0.00 175.76 179.30 1xrt h THR 304 N 5.63 1.10 -6.50 0.00 1.35 -1.84 -2.95 112.91 109.70 1xrt h THR 304 Ca -0.34 -1.99 -0.50 0.00 -0.55 0.00 0.00 66.41 63.02 1xrt h THR 304 Cb 1.17 2.17 -0.06 0.00 -1.73 0.00 0.00 68.15 69.69 1xrt h THR 304 CO 0.47 0.51 -0.88 -0.67 -0.25 0.00 0.00 175.52 174.70 1xrt n ASP 305 N -3.52 -0.51 -4.55 5.36 2.03 0.32 -4.76 116.55 110.92 1xrt n ASP 305 Ca -0.00 -1.00 -0.47 0.00 0.52 0.00 0.00 54.79 53.83 1xrt n ASP 305 Cb 0.62 -3.05 -0.05 0.00 -0.72 0.00 0.00 41.12 37.92 1xrt n ASP 305 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 1xrt n HIS 306 N -4.40 1.89 -3.48 -0.67 -0.00 -0.97 -4.48 115.22 103.11 1xrt n HIS 306 Ca -0.29 0.06 -0.27 0.00 -0.00 0.00 0.00 57.72 57.22 1xrt n HIS 306 Cb 0.67 -2.64 -0.10 0.00 -0.00 0.00 0.00 29.99 27.92 1xrt n HIS 306 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1xrt n ALA 307 N 9.92 2.96 -1.91 1.57 0.00 -0.55 -1.25 120.51 131.25 1xrt n ALA 307 Ca 0.33 -3.38 -0.42 0.00 0.00 0.00 0.00 53.44 49.97 1xrt n ALA 307 Cb 0.33 -0.80 -0.03 0.00 0.00 0.00 0.00 19.45 18.95 1xrt n ALA 307 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1xrt s PRO 308 N -0.27 4.22 -0.00 0.00 0.02 -1.26 -3.72 135.00 133.99 1xrt s PRO 308 Ca 0.32 2.36 -0.07 0.00 0.02 0.00 0.00 61.00 63.63 1xrt s PRO 308 Cb 0.03 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.41 1xrt s PRO 308 CO -0.19 -0.58 0.13 -1.01 -0.33 0.00 0.00 177.00 175.02 1xrt s HIS 309 N 0.91 0.03 0.00 6.54 3.76 -1.26 -4.96 115.29 120.31 1xrt s HIS 309 Ca 0.68 -0.10 0.00 0.00 -0.15 0.00 0.00 55.06 55.49 1xrt s HIS 309 Cb -0.44 -0.04 0.00 0.00 1.11 0.00 0.00 32.58 33.21 1xrt s HIS 309 CO 0.34 -0.27 0.00 1.04 -0.85 0.00 0.00 174.74 175.00 1xrt n GLN 310 N 1.58 0.00 0.00 1.40 1.13 -1.26 -4.45 117.38 115.77 1xrt n GLN 310 Ca -0.22 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.84 1xrt n GLN 310 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.91 1xrt n GLN 310 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1xrt n THR 311 N 0.00 0.00 0.00 5.09 -1.04 -1.26 -5.00 114.28 112.07 1xrt n THR 311 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1xrt n THR 311 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1xrt n THR 311 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1xrt n PRO 322 N 0.00 0.00 -2.25 -2.82 -0.04 -1.26 -5.12 135.00 123.52 1xrt n PRO 322 Ca 0.00 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.05 1xrt n PRO 322 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 1xrt n PRO 322 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1xrt s GLY 323 N 0.00 2.98 0.07 0.55 0.00 -1.26 -5.06 107.32 104.61 1xrt s GLY 323 Ca 0.00 1.12 0.03 0.00 0.00 0.00 0.00 44.72 45.87 1xrt s GLY 323 CO 0.00 1.78 -0.09 -0.26 0.00 0.00 0.00 173.10 174.53 1xrt s ILE 324 N -1.05 0.75 0.62 0.90 -4.36 -1.24 -4.86 121.20 111.96 1xrt s ILE 324 Ca 0.48 -1.43 -0.16 0.00 -0.26 0.00 0.00 60.65 59.28 1xrt s ILE 324 Cb -0.37 -1.08 -0.02 0.00 1.25 0.00 0.00 42.46 42.24 1xrt s ILE 324 CO 0.48 -0.51 1.09 0.27 0.24 0.00 0.00 174.94 176.50 1xrt s ILE 325 N -2.11 3.52 0.00 8.37 -4.36 -0.32 -1.48 121.20 124.82 1xrt s ILE 325 Ca -0.00 0.72 0.00 0.00 -0.26 0.00 0.00 60.65 61.11 1xrt s ILE 325 Cb -0.05 -3.25 0.00 0.00 1.25 0.00 0.00 42.46 40.41 1xrt s ILE 325 CO -0.01 -0.42 0.00 0.61 0.24 0.00 0.00 174.94 175.36 1xrt n GLY 326 N -0.72 0.58 0.23 6.27 0.00 -1.26 -4.77 105.19 105.53 1xrt n GLY 326 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 1xrt n GLY 326 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xrt h LEU 327 N 0.00 0.28 -0.28 0.99 3.38 -1.92 -1.48 115.31 116.27 1xrt h LEU 327 Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1xrt h LEU 327 Cb 0.17 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1xrt h LEU 327 CO 0.00 0.17 0.00 1.67 0.09 0.00 0.00 178.44 180.37 1xrt n GLN 328 N -4.96 0.22 0.00 1.13 7.27 -1.25 -3.47 117.38 116.32 1xrt n GLN 328 Ca 0.08 0.29 0.02 0.00 0.07 0.00 0.00 57.00 57.46 1xrt n GLN 328 Cb 0.25 -1.81 0.01 0.00 2.41 0.00 0.00 30.24 31.10 1xrt n GLN 328 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 1xrt n THR 329 N -2.20 0.00 -0.19 1.69 -2.24 -1.03 -4.61 114.28 105.71 1xrt n THR 329 Ca 0.04 -0.49 -0.01 0.00 -2.27 0.00 0.00 64.05 61.32 1xrt n THR 329 Cb 0.34 1.07 0.09 0.00 -2.10 0.00 0.00 70.33 69.73 1xrt n THR 329 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xrt h ALA 330 N 0.75 0.71 0.31 6.98 0.00 -1.31 -2.19 119.26 124.52 1xrt h ALA 330 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1xrt h ALA 330 Cb 0.16 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1xrt h ALA 330 CO 0.00 -0.19 -0.15 1.25 0.00 0.00 0.00 179.25 180.16 1xrt h LEU 331 N 0.39 -0.35 -1.74 0.00 5.85 -1.83 -0.01 115.31 117.62 1xrt h LEU 331 Ca 0.28 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 1xrt h LEU 331 Cb 0.32 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 1xrt h LEU 331 CO -0.28 -0.06 -0.12 1.55 -0.34 0.00 0.00 178.44 179.19 1xrt h PRO 332 N -0.65 0.01 -0.31 5.25 0.13 -1.69 0.61 132.00 135.35 1xrt h PRO 332 Ca -0.04 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.03 1xrt h PRO 332 Cb 0.46 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.58 1xrt h PRO 332 CO 0.07 0.13 -0.04 0.77 -0.23 0.00 0.00 178.00 178.70 1xrt h SER 333 N 0.01 0.57 0.23 1.44 0.02 -1.15 -2.57 113.55 112.09 1xrt h SER 333 Ca 0.00 -0.34 -0.10 0.00 -0.84 0.00 0.00 61.79 60.51 1xrt h SER 333 Cb 0.22 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1xrt h SER 333 CO 0.02 0.77 -0.38 0.00 -1.14 0.00 0.00 176.83 176.10 1xrt h ALA 334 N 0.81 1.18 0.00 3.77 0.00 -0.29 -2.64 119.26 122.09 1xrt h ALA 334 Ca 0.08 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.56 1xrt h ALA 334 Cb 0.51 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1xrt h ALA 334 CO 0.02 0.55 -0.24 -0.07 0.00 0.00 0.00 179.25 179.51 1xrt h LEU 335 N 0.18 0.00 -0.75 0.00 3.38 -0.75 -1.86 115.31 115.52 1xrt h LEU 335 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1xrt h LEU 335 Cb 0.75 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 1xrt h LEU 335 CO 0.06 0.24 0.38 -0.08 0.09 0.00 0.00 178.44 179.13 1xrt h GLU 336 N 0.00 1.07 -0.62 1.13 4.81 -1.08 0.34 114.58 120.23 1xrt h GLU 336 Ca -0.00 -0.15 0.06 0.00 -0.13 0.00 0.00 59.36 59.14 1xrt h GLU 336 Cb 0.55 -0.20 -0.05 0.00 0.63 0.00 0.00 28.75 29.68 1xrt h GLU 336 CO 0.03 0.82 0.33 -0.07 -0.73 0.00 0.00 179.01 179.39 1xrt h LEU 337 N 1.05 0.49 -0.62 1.64 3.38 -1.37 -0.77 115.31 119.11 1xrt h LEU 337 Ca 0.26 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1xrt h LEU 337 Cb 0.09 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1xrt h LEU 337 CO -0.04 0.32 0.39 0.22 0.09 0.00 0.00 178.44 179.43 1xrt h TYR 338 N 0.62 0.79 0.00 1.13 3.20 -1.10 -1.25 116.97 120.36 1xrt h TYR 338 Ca 0.28 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.10 1xrt h TYR 338 Cb 0.18 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 1xrt h TYR 338 CO -0.09 0.51 -0.27 0.00 -1.64 0.00 0.00 178.16 176.67 1xrt h ARG 339 N 0.83 0.00 -0.24 1.82 3.08 -0.65 -2.58 114.38 116.64 1xrt h ARG 339 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1xrt h ARG 339 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1xrt h ARG 339 CO -0.05 0.27 0.00 1.63 -1.07 0.00 0.00 179.97 180.76 1xrt n LYS 340 N -3.71 1.90 -0.81 0.04 5.02 -0.32 -4.93 118.16 115.34 1xrt n LYS 340 Ca -0.01 -1.36 0.00 0.00 -2.02 0.00 0.00 58.31 54.91 1xrt n LYS 340 Cb 0.38 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 1xrt n LYS 340 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xrt n GLY 341 N 1.20 0.63 0.20 0.72 0.00 -0.97 -4.94 105.19 102.03 1xrt n GLY 341 Ca 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 1xrt n GLY 341 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xrt h ILE 342 N 0.00 1.33 -3.95 -0.61 2.04 -1.46 -3.45 117.51 111.40 1xrt h ILE 342 Ca 0.00 -2.10 -0.27 0.00 1.00 0.00 0.00 64.86 63.48 1xrt h ILE 342 Cb 0.00 2.10 -0.21 0.00 -0.74 0.00 0.00 36.82 37.97 1xrt h ILE 342 CO 0.00 0.65 -0.73 0.27 0.00 0.00 0.00 178.15 178.34 1xrt s ILE 343 N -3.62 0.56 0.83 -0.67 -4.36 -1.23 -4.48 121.20 108.23 1xrt s ILE 343 Ca -0.08 -1.16 -0.11 0.00 -0.26 0.00 0.00 60.65 59.04 1xrt s ILE 343 Cb 0.09 -0.71 0.09 0.00 1.25 0.00 0.00 42.46 43.19 1xrt s ILE 343 CO 0.88 -0.42 1.09 -0.94 0.24 0.00 0.00 174.94 175.78 1xrt s SER 344 N -1.71 4.01 0.14 4.36 1.04 -1.26 -4.21 113.70 116.07 1xrt s SER 344 Ca -0.08 1.63 -0.16 0.00 0.48 0.00 0.00 55.95 57.82 1xrt s SER 344 Cb -0.09 -2.33 -0.00 0.00 0.10 0.00 0.00 66.02 63.71 1xrt s SER 344 CO -0.00 -2.32 1.73 0.25 0.98 0.00 0.00 173.24 173.88 1xrt h LEU 345 N -1.33 0.50 -0.78 2.42 5.85 -1.99 -1.83 115.31 118.15 1xrt h LEU 345 Ca -0.47 -0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.24 1xrt h LEU 345 Cb 1.26 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 42.09 1xrt h LEU 345 CO 0.53 0.46 0.43 0.50 -0.34 0.00 0.00 178.44 180.02 1xrt h LYS 346 N 0.50 0.71 -0.60 1.25 3.64 -1.99 -1.48 116.57 118.59 1xrt h LYS 346 Ca 0.14 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.38 1xrt h LYS 346 Cb 0.08 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 1xrt h LYS 346 CO -0.02 0.47 0.03 -0.22 -2.27 0.00 0.00 179.45 177.44 1xrt h LYS 347 N 0.73 1.04 -0.49 1.90 1.63 -1.87 0.39 116.57 119.91 1xrt h LYS 347 Ca 0.37 -0.32 0.07 0.00 -0.85 0.00 0.00 60.65 59.92 1xrt h LYS 347 Cb 0.34 -0.10 -0.06 0.00 -0.60 0.00 0.00 32.23 31.81 1xrt h LYS 347 CO -0.24 1.01 0.16 1.25 -3.45 0.00 0.00 179.45 178.18 1xrt h LEU 348 N 0.94 0.14 -0.40 5.20 6.46 -0.85 -0.35 115.31 126.45 1xrt h LEU 348 Ca 0.17 0.07 -0.03 0.00 -0.12 0.00 0.00 57.88 57.97 1xrt h LEU 348 Cb 0.53 0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.50 1xrt h LEU 348 CO 0.03 0.11 0.14 0.40 -0.62 0.00 0.00 178.44 178.49 1xrt h ILE 349 N 0.32 1.21 -0.77 4.05 2.04 -0.83 -2.48 117.51 121.05 1xrt h ILE 349 Ca 0.24 -0.68 0.12 0.00 1.00 0.00 0.00 64.86 65.54 1xrt h ILE 349 Cb 0.27 0.90 -0.08 0.00 -0.74 0.00 0.00 36.82 37.16 1xrt h ILE 349 CO -0.26 0.24 0.37 -0.33 0.00 0.00 0.00 178.15 178.17 1xrt h GLU 350 N 0.51 0.56 0.00 2.37 5.08 -0.30 -1.66 114.58 121.14 1xrt h GLU 350 Ca 0.13 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1xrt h GLU 350 Cb 0.24 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1xrt h GLU 350 CO -0.01 0.37 0.00 -1.33 -1.00 0.00 0.00 179.01 177.04 1xrt n MET 351 N -4.90 0.20 -0.00 2.33 2.81 -0.20 -1.62 117.12 115.75 1xrt n MET 351 Ca 0.14 0.35 0.10 0.00 -1.81 0.00 0.00 57.70 56.48 1xrt n MET 351 Cb 0.36 -1.83 -0.13 0.00 -0.71 0.00 0.00 33.22 30.91 1xrt n MET 351 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1xrt n PHE 352 N -2.21 0.00 0.00 2.03 3.72 -0.70 -1.43 117.46 118.88 1xrt n PHE 352 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1xrt n PHE 352 Cb 0.29 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 1xrt n PHE 352 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1xrt n THR 353 N -1.69 0.00 0.06 4.37 -2.24 -0.78 -0.70 114.28 113.29 1xrt n THR 353 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1xrt n THR 353 Cb 0.39 0.00 0.31 0.00 -2.10 0.00 0.00 70.33 68.93 1xrt n THR 353 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1xrt h ILE 354 N 0.00 1.21 0.68 2.28 6.09 -1.59 -1.57 117.51 124.61 1xrt h ILE 354 Ca 0.00 -0.94 -0.03 0.00 -1.37 0.00 0.00 64.86 62.51 1xrt h ILE 354 Cb 0.00 1.19 0.01 0.00 0.47 0.00 0.00 36.82 38.49 1xrt h ILE 354 CO 0.00 0.30 -0.33 0.78 -3.07 0.00 0.00 178.15 175.83 1xrt h ASN 355 N 0.35 -0.78 -0.69 2.19 4.21 -1.62 -1.16 115.58 118.09 1xrt h ASN 355 Ca 0.07 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.58 1xrt h ASN 355 Cb 0.45 0.20 -0.03 0.00 -1.12 0.00 0.00 38.32 37.82 1xrt h ASN 355 CO 0.03 -0.50 0.44 1.55 -1.29 0.00 0.00 177.43 177.66 1xrt h PRO 356 N -1.01 0.92 -0.86 0.81 0.13 -1.74 -2.21 132.00 128.04 1xrt h PRO 356 Ca -0.09 -0.07 0.10 0.00 -0.87 0.00 0.00 66.00 65.07 1xrt h PRO 356 Cb 0.73 -0.20 -0.08 0.00 0.13 0.00 0.00 31.00 31.58 1xrt h PRO 356 CO 0.15 0.63 0.50 0.00 -0.23 0.00 0.00 178.00 179.05 1xrt h ALA 357 N 1.54 1.24 -0.16 -0.56 0.00 -1.14 -2.17 119.26 118.01 1xrt h ALA 357 Ca 0.25 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.08 1xrt h ALA 357 Cb -0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1xrt h ALA 357 CO -0.05 0.11 -0.40 0.00 0.00 0.00 0.00 179.25 178.92 1xrt h ARG 358 N 0.82 0.35 -0.28 0.00 3.08 -0.62 0.31 114.38 118.03 1xrt h ARG 358 Ca 0.42 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 60.27 1xrt h ARG 358 Cb 0.40 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1xrt h ARG 358 CO -0.26 0.69 0.05 0.82 -1.07 0.00 0.00 179.97 180.21 1xrt h ILE 359 N 0.29 1.23 -0.26 2.04 2.04 -0.93 -2.83 117.51 119.10 1xrt h ILE 359 Ca 0.03 -0.78 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1xrt h ILE 359 Cb 0.83 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 1xrt h ILE 359 CO 0.07 0.25 0.00 2.30 0.00 0.00 0.00 178.15 180.77 1xrt n ILE 360 N -4.65 0.33 -2.74 -0.67 -5.35 -0.95 -4.66 119.36 100.67 1xrt n ILE 360 Ca -0.03 -0.52 -0.13 0.00 -0.27 0.00 0.00 62.75 61.81 1xrt n ILE 360 Cb 0.21 0.65 0.02 0.00 -1.74 0.00 0.00 39.64 38.78 1xrt n ILE 360 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xrt n GLY 361 N 1.29 0.01 3.64 3.28 0.00 -0.00 -4.95 105.19 108.46 1xrt n GLY 361 Ca 0.17 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 1xrt n GLY 361 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xrt s VAL 362 N -2.93 3.81 -1.31 1.61 -7.23 -0.60 -5.02 120.40 108.73 1xrt s VAL 362 Ca 0.19 -0.95 -0.05 0.00 -1.81 0.00 0.00 61.98 59.35 1xrt s VAL 362 Cb -0.08 -2.76 0.11 0.00 0.56 0.00 0.00 36.38 34.21 1xrt s VAL 362 CO 0.24 0.21 2.41 -0.67 -0.31 0.00 0.00 175.10 176.97 1xrt n ASP 363 N 0.92 8.05 -2.08 4.85 2.03 -1.26 -4.54 116.55 124.52 1xrt n ASP 363 Ca -0.13 -3.13 -0.01 0.00 0.52 0.00 0.00 54.79 52.04 1xrt n ASP 363 Cb 0.52 -1.36 -0.00 0.00 -0.72 0.00 0.00 41.12 39.56 1xrt n ASP 363 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1xrt n LEU 364 N 1.74 0.00 -0.13 -2.67 4.77 -1.26 -4.86 117.00 114.58 1xrt n LEU 364 Ca 0.63 -0.09 -0.02 0.00 -0.03 0.00 0.00 56.01 56.49 1xrt n LEU 364 Cb 0.25 0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.34 1xrt n LEU 364 CO 0.68 -0.09 -0.02 0.61 -1.33 0.00 0.00 177.39 177.24 1xrt n GLY 365 N 4.81 0.53 3.36 -0.72 0.00 -1.26 -4.77 105.19 107.14 1xrt n GLY 365 Ca -0.00 -0.48 -0.18 0.00 0.00 0.00 0.00 46.02 45.36 1xrt n GLY 365 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1xrt s THR 366 N -1.99 0.86 -0.22 2.61 -1.32 -1.26 -3.52 115.64 110.80 1xrt s THR 366 Ca 0.00 -2.01 0.12 0.00 -1.21 0.00 0.00 61.69 58.59 1xrt s THR 366 Cb 0.00 -2.62 0.44 0.00 -1.51 0.00 0.00 72.50 68.81 1xrt s THR 366 CO 0.00 -0.08 1.20 0.18 -2.21 0.00 0.00 174.62 173.72 1xrt n LEU 367 N -0.52 3.17 -4.75 9.08 4.77 -1.26 -4.74 117.00 122.75 1xrt n LEU 367 Ca -0.02 -3.95 -0.37 0.00 -0.03 0.00 0.00 56.01 51.64 1xrt n LEU 367 Cb 0.66 -0.38 0.04 0.00 -2.33 0.00 0.00 43.42 41.41 1xrt n LEU 367 CO 0.39 1.52 0.91 -0.54 -1.33 0.00 0.00 177.39 178.34 1xrt s LYS 368 N -3.09 2.94 0.26 3.23 1.02 -1.26 -4.91 119.74 117.93 1xrt s LYS 368 Ca 0.41 2.03 -0.30 0.00 0.02 0.00 0.00 55.97 58.13 1xrt s LYS 368 Cb 0.38 -2.03 -0.10 0.00 -0.52 0.00 0.00 37.83 35.55 1xrt s LYS 368 CO -0.04 -1.29 1.46 -0.51 -0.92 0.00 0.00 175.35 174.05 1xrt s LEU 369 N -3.93 4.38 0.00 3.17 1.43 -1.26 -1.64 118.68 120.83 1xrt s LEU 369 Ca 0.76 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 56.58 1xrt s LEU 369 Cb -0.36 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.24 1xrt s LEU 369 CO 0.40 -0.73 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1xrt n GLY 370 N 2.10 2.03 3.78 -3.19 0.00 0.31 -4.99 105.19 105.24 1xrt n GLY 370 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1xrt n GLY 370 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xrt s SER 371 N -2.43 5.31 0.23 1.61 0.01 -0.65 -4.70 113.70 113.07 1xrt s SER 371 Ca 0.00 1.92 -0.31 0.00 1.31 0.00 0.00 55.95 58.86 1xrt s SER 371 Cb 0.00 -2.54 -0.14 0.00 0.21 0.00 0.00 66.02 63.55 1xrt s SER 371 CO 0.00 -1.49 1.34 -2.65 0.41 0.00 0.00 173.24 170.86 1xrt n PRO 372 N -2.36 1.82 -1.78 12.44 -0.02 -1.26 -1.09 135.00 142.75 1xrt n PRO 372 Ca 0.10 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.81 1xrt n PRO 372 Cb 0.52 -2.26 -0.01 0.00 -0.02 0.00 0.00 33.50 31.73 1xrt n PRO 372 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xrt n ALA 373 N 1.77 4.99 -2.71 3.55 0.00 0.11 -4.66 120.51 123.57 1xrt n ALA 373 Ca 0.12 -3.80 -0.40 0.00 0.00 0.00 0.00 53.44 49.36 1xrt n ALA 373 Cb 0.30 -3.56 -0.11 0.00 0.00 0.00 0.00 19.45 16.08 1xrt n ALA 373 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xrt s ASP 374 N 3.58 5.81 -0.01 0.00 1.01 -1.26 -1.13 116.67 124.67 1xrt s ASP 374 Ca 0.49 -0.62 0.00 0.00 0.71 0.00 0.00 52.55 53.13 1xrt s ASP 374 Cb 0.12 -2.07 0.02 0.00 1.01 0.00 0.00 42.92 42.00 1xrt s ASP 374 CO -0.04 -0.27 0.01 -0.63 0.21 0.00 0.00 175.17 174.44 1xrt s ILE 375 N 1.64 0.06 -0.04 0.77 1.01 -0.04 -1.37 121.20 123.23 1xrt s ILE 375 Ca 0.05 0.08 0.05 0.00 0.00 0.00 0.00 60.65 60.82 1xrt s ILE 375 Cb -0.18 -0.12 -0.02 0.00 0.01 0.00 0.00 42.46 42.14 1xrt s ILE 375 CO 0.08 0.07 -0.18 -0.89 0.00 0.00 0.00 174.94 174.02 1xrt s THR 376 N 0.59 2.69 -0.15 2.92 2.01 0.40 -0.58 115.64 123.52 1xrt s THR 376 Ca -0.05 -0.86 -0.01 0.00 0.31 0.00 0.00 61.69 61.08 1xrt s THR 376 Cb -0.08 -2.02 0.04 0.00 0.01 0.00 0.00 72.50 70.45 1xrt s THR 376 CO -0.01 0.58 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.82 1xrt s ILE 377 N -0.63 1.04 0.04 1.82 1.01 -0.29 -1.10 121.20 123.10 1xrt s ILE 377 Ca 0.10 -0.50 0.02 0.00 0.00 0.00 0.00 60.65 60.27 1xrt s ILE 377 Cb -0.11 -1.18 -0.02 0.00 0.01 0.00 0.00 42.46 41.16 1xrt s ILE 377 CO 0.00 0.19 -0.08 0.72 0.00 0.00 0.00 174.94 175.77 1xrt s PHE 378 N 1.67 0.71 -0.42 3.97 -0.12 0.07 -0.43 117.98 123.43 1xrt s PHE 378 Ca 0.02 -0.49 -0.16 0.00 -0.05 0.00 0.00 56.93 56.25 1xrt s PHE 378 Cb -0.14 -0.42 0.03 0.00 -0.63 0.00 0.00 43.02 41.85 1xrt s PHE 378 CO -0.08 -0.07 0.37 0.34 -0.05 0.00 0.00 175.22 175.73 1xrt s ASP 379 N -1.56 6.15 0.14 1.98 -1.08 0.16 -0.87 116.67 121.58 1xrt s ASP 379 Ca -0.09 -0.87 0.19 0.00 -0.52 0.00 0.00 52.55 51.25 1xrt s ASP 379 Cb -0.10 -2.19 0.79 0.00 -1.46 0.00 0.00 42.92 39.96 1xrt s ASP 379 CO 0.01 -0.53 1.57 -0.81 0.52 0.00 0.00 175.17 175.92 1xrt n PRO 380 N 5.35 0.10 -0.06 4.34 -0.04 -1.26 -1.02 135.00 142.41 1xrt n PRO 380 Ca -0.10 0.36 0.05 0.00 -0.04 0.00 0.00 63.50 63.77 1xrt n PRO 380 Cb 0.47 -1.70 0.08 0.00 -0.04 0.00 0.00 33.50 32.31 1xrt n PRO 380 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1xrt n ASN 381 N -1.88 2.22 -4.67 3.54 5.03 -1.26 -3.24 115.26 114.99 1xrt n ASN 381 Ca 0.02 -1.63 -0.42 0.00 0.87 0.00 0.00 54.58 53.43 1xrt n ASN 381 Cb 0.19 -0.07 -0.03 0.00 -1.02 0.00 0.00 39.78 38.84 1xrt n ASN 381 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1xrt s LYS 382 N -0.92 4.33 0.10 3.52 2.47 -1.12 -4.68 119.74 123.45 1xrt s LYS 382 Ca 0.16 1.21 -0.20 0.00 -1.56 0.00 0.00 55.97 55.59 1xrt s LYS 382 Cb 0.10 -3.58 -0.07 0.00 -1.46 0.00 0.00 37.83 32.82 1xrt s LYS 382 CO 0.14 -0.39 0.60 -1.21 0.16 0.00 0.00 175.35 174.65 1xrt s GLU 383 N 2.34 4.23 0.32 4.03 2.02 -1.26 -0.55 118.70 129.82 1xrt s GLU 383 Ca 0.43 0.78 -0.17 0.00 0.02 0.00 0.00 54.97 56.02 1xrt s GLU 383 Cb -0.17 -3.18 0.03 0.00 0.10 0.00 0.00 34.13 30.91 1xrt s GLU 383 CO 0.13 0.60 0.71 1.67 0.02 0.00 0.00 175.26 178.38 1xrt s TRP 384 N -1.18 0.04 -0.03 1.61 1.48 -0.58 -4.98 118.94 115.29 1xrt s TRP 384 Ca 0.32 -0.56 0.03 0.00 -1.06 0.00 0.00 56.10 54.83 1xrt s TRP 384 Cb -0.19 0.66 0.00 0.00 -1.16 0.00 0.00 33.47 32.78 1xrt s TRP 384 CO 0.20 -1.33 -0.11 0.42 -4.06 0.00 0.00 176.95 172.08 1xrt s ILE 385 N -3.32 0.90 -0.49 0.66 1.01 -1.26 -0.03 121.20 118.67 1xrt s ILE 385 Ca 0.15 -0.43 -0.26 0.00 0.00 0.00 0.00 60.65 60.11 1xrt s ILE 385 Cb -0.05 -0.79 0.03 0.00 0.01 0.00 0.00 42.46 41.66 1xrt s ILE 385 CO 0.09 0.27 0.97 -0.22 0.00 0.00 0.00 174.94 176.06 1xrt s LEU 386 N 0.13 3.95 0.00 2.97 2.96 -1.26 -4.69 118.68 122.74 1xrt s LEU 386 Ca -0.03 0.07 -0.00 0.00 -0.22 0.00 0.00 54.13 53.96 1xrt s LEU 386 Cb -0.09 -3.17 0.00 0.00 0.50 0.00 0.00 46.19 43.43 1xrt s LEU 386 CO 0.01 -1.13 0.01 -0.46 -1.32 0.00 0.00 176.35 173.46 1xrt n ASN 387 N 7.37 -0.03 -0.16 3.68 0.23 -1.26 -0.69 115.26 124.40 1xrt n ASN 387 Ca 0.06 -1.04 0.13 0.00 -0.53 0.00 0.00 54.58 53.20 1xrt n ASN 387 Cb 0.48 0.06 0.47 0.00 -2.08 0.00 0.00 39.78 38.71 1xrt n ASN 387 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1xrt h GLU 388 N 0.00 0.47 0.00 -3.83 9.09 -1.94 -0.05 114.58 118.33 1xrt h GLU 388 Ca -0.01 -0.03 -0.07 0.00 0.05 0.00 0.00 59.36 59.30 1xrt h GLU 388 Cb 0.02 -0.11 -0.01 0.00 -1.65 0.00 0.00 28.75 27.01 1xrt h GLU 388 CO 0.01 0.31 -0.35 1.05 0.05 0.00 0.00 179.01 180.08 1xrt h GLU 389 N 0.49 0.00 0.00 1.06 9.09 -1.96 -3.36 114.58 119.90 1xrt h GLU 389 Ca 0.35 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.73 1xrt h GLU 389 Cb 0.68 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.77 1xrt h GLU 389 CO -0.11 0.35 -1.35 0.25 0.05 0.00 0.00 179.01 178.19 1xrt n THR 390 N -3.51 0.08 -2.27 -1.06 -2.24 -0.82 -5.03 114.28 99.44 1xrt n THR 390 Ca -0.00 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 1xrt n THR 390 Cb 0.50 0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.83 1xrt n THR 390 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1xrt s ASN 391 N -3.00 6.90 0.00 3.42 2.47 -0.09 -4.89 114.94 119.76 1xrt s ASN 391 Ca -0.03 2.12 0.18 0.00 0.42 0.00 0.00 52.86 55.56 1xrt s ASN 391 Cb 0.04 -2.57 -0.05 0.00 -1.45 0.00 0.00 41.25 37.22 1xrt s ASN 391 CO 0.29 -0.65 0.89 0.18 -3.72 0.00 0.00 177.10 174.09 1xrt n LEU 392 N 4.74 1.54 -4.80 3.21 4.77 -1.26 -4.97 117.00 120.23 1xrt n LEU 392 Ca 0.12 -0.70 -0.34 0.00 -0.03 0.00 0.00 56.01 55.06 1xrt n LEU 392 Cb 0.44 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.50 1xrt n LEU 392 CO 0.58 0.30 0.71 -0.55 -1.33 0.00 0.00 177.39 177.10 1xrt s SER 393 N -2.24 6.27 0.28 -1.43 0.15 -1.26 -4.66 113.70 110.81 1xrt s SER 393 Ca 0.13 1.87 0.25 0.00 0.70 0.00 0.00 55.95 58.90 1xrt s SER 393 Cb 0.14 -2.55 0.98 0.00 -1.71 0.00 0.00 66.02 62.89 1xrt s SER 393 CO 0.53 -0.83 1.74 0.11 1.20 0.00 0.00 173.24 175.99 1xrt h LYS 394 N 1.29 0.00 -5.91 5.44 1.57 -1.90 -3.45 116.57 113.61 1xrt h LYS 394 Ca -0.49 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.73 1xrt h LYS 394 Cb 1.22 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.45 1xrt h LYS 394 CO 0.59 0.00 -0.44 -1.12 -0.57 0.00 0.00 179.45 177.91 1xrt s SER 395 N -4.41 4.55 0.00 0.86 0.01 -1.19 -4.91 113.70 108.62 1xrt s SER 395 Ca 0.05 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.22 1xrt s SER 395 Cb 0.10 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.07 1xrt s SER 395 CO 0.43 -0.69 0.91 0.54 0.41 0.00 0.00 173.24 174.84 1xrt n ARG 396 N -1.40 0.00 -2.64 12.44 1.74 -1.26 -4.97 116.66 120.58 1xrt n ARG 396 Ca -0.02 -0.88 -0.42 0.00 -0.77 0.00 0.00 57.85 55.76 1xrt n ARG 396 Cb 0.64 -0.47 -0.02 0.00 -1.02 0.00 0.00 32.46 31.59 1xrt n ARG 396 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1xrt s ASN 397 N -0.82 6.67 -0.24 0.55 4.22 -1.26 -4.87 114.94 119.19 1xrt s ASN 397 Ca 0.00 -1.96 -0.22 0.00 -2.14 0.00 0.00 52.86 48.54 1xrt s ASN 397 Cb 0.00 -2.54 0.06 0.00 1.28 0.00 0.00 41.25 40.05 1xrt s ASN 397 CO 0.00 -1.29 0.63 0.28 -2.04 0.00 0.00 177.10 174.69 1xrt s THR 398 N 4.21 -0.00 -1.67 0.54 -1.32 -1.26 -1.17 115.64 114.97 1xrt s THR 398 Ca 0.47 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 61.23 1xrt s THR 398 Cb 0.01 -0.88 0.61 0.00 -1.51 0.00 0.00 72.50 70.73 1xrt s THR 398 CO -0.03 0.00 1.98 -0.81 -2.21 0.00 0.00 174.62 173.55 1xrt n PRO 399 N 2.83 0.60 0.03 7.08 -0.04 -1.26 -2.41 135.00 141.82 1xrt n PRO 399 Ca -0.14 0.02 0.14 0.00 -0.04 0.00 0.00 63.50 63.47 1xrt n PRO 399 Cb 0.56 -1.50 0.54 0.00 -0.04 0.00 0.00 33.50 33.06 1xrt n PRO 399 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1xrt n LEU 400 N -1.17 0.25 -4.63 1.53 4.77 -1.26 -4.86 117.00 111.63 1xrt n LEU 400 Ca 0.16 0.49 -0.54 0.00 -0.03 0.00 0.00 56.01 56.10 1xrt n LEU 400 Cb 0.17 -0.44 -0.06 0.00 -2.33 0.00 0.00 43.42 40.76 1xrt n LEU 400 CO 0.19 -0.04 1.05 1.87 -1.33 0.00 0.00 177.39 179.12 1xrt n TRP 401 N -1.71 1.70 -0.60 -1.77 -0.00 -1.01 -1.08 117.44 112.98 1xrt n TRP 401 Ca 0.06 0.60 0.00 0.00 -0.00 0.00 0.00 57.50 58.16 1xrt n TRP 401 Cb 0.37 -2.38 0.00 0.00 -0.00 0.00 0.00 31.31 29.30 1xrt n TRP 401 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1xrt n GLY 402 N 3.09 1.44 3.82 5.87 0.00 0.13 -5.02 105.19 114.53 1xrt n GLY 402 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1xrt n GLY 402 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xrt s LYS 403 N -0.10 4.23 -0.09 1.61 -0.14 -0.24 -4.91 119.74 120.09 1xrt s LYS 403 Ca 0.00 0.96 -0.30 0.00 -1.36 0.00 0.00 55.97 55.27 1xrt s LYS 403 Cb 0.00 -2.53 -0.03 0.00 -1.68 0.00 0.00 37.83 33.59 1xrt s LYS 403 CO 0.00 0.18 1.24 0.08 -0.76 0.00 0.00 175.35 176.09 1xrt s VAL 404 N -1.87 4.22 0.17 3.17 1.01 -1.26 -4.15 120.40 121.69 1xrt s VAL 404 Ca 0.53 1.53 0.05 0.00 0.00 0.00 0.00 61.98 64.09 1xrt s VAL 404 Cb -0.13 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 1xrt s VAL 404 CO 0.18 -0.05 0.12 -0.76 0.00 0.00 0.00 175.10 174.58 1xrt s LEU 405 N 2.74 3.73 -0.15 3.92 1.43 0.95 -4.97 118.68 126.33 1xrt s LEU 405 Ca 0.56 -0.18 -0.01 0.00 -1.03 0.00 0.00 54.13 53.48 1xrt s LEU 405 Cb -0.24 -2.34 0.04 0.00 0.03 0.00 0.00 46.19 43.68 1xrt s LEU 405 CO 0.19 0.07 -0.03 -0.75 0.23 0.00 0.00 176.35 176.06 1xrt s LYS 406 N -3.11 1.15 0.00 1.70 2.20 -1.26 -1.53 119.74 118.89 1xrt s LYS 406 Ca 0.30 -0.37 0.00 0.00 -0.36 0.00 0.00 55.97 55.54 1xrt s LYS 406 Cb -0.10 -1.81 0.00 0.00 -1.51 0.00 0.00 37.83 34.41 1xrt s LYS 406 CO 0.23 -0.44 0.00 0.41 -0.36 0.00 0.00 175.35 175.19 1xrt n GLY 407 N 4.96 3.87 3.27 5.54 0.00 0.28 -4.55 105.19 118.56 1xrt n GLY 407 Ca -0.11 -1.15 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 1xrt n GLY 407 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xrt s LYS 408 N -5.42 0.42 0.16 1.61 2.20 -0.19 -4.10 119.74 114.42 1xrt s LYS 408 Ca 0.00 0.68 -0.30 0.00 -0.36 0.00 0.00 55.97 55.98 1xrt s LYS 408 Cb 0.00 0.09 -0.08 0.00 -1.51 0.00 0.00 37.83 36.32 1xrt s LYS 408 CO 0.00 -0.11 1.30 0.08 -0.36 0.00 0.00 175.35 176.26 1xrt s VAL 409 N 0.87 3.38 -0.23 4.02 1.01 -1.26 -0.67 120.40 127.52 1xrt s VAL 409 Ca -0.05 1.08 0.05 0.00 0.00 0.00 0.00 61.98 63.06 1xrt s VAL 409 Cb -0.06 -3.69 -0.18 0.00 0.00 0.00 0.00 36.38 32.46 1xrt s VAL 409 CO -0.07 0.13 -0.15 -0.38 0.00 0.00 0.00 175.10 174.63 1xrt n ILE 410 N 3.13 1.38 -3.87 2.22 2.08 0.43 -4.51 119.36 120.21 1xrt n ILE 410 Ca 0.08 -0.60 -0.11 0.00 0.56 0.00 0.00 62.75 62.68 1xrt n ILE 410 Cb 0.43 -1.17 -0.12 0.00 -0.75 0.00 0.00 39.64 38.04 1xrt n ILE 410 CO 0.00 0.00 0.00 -0.31 0.56 0.00 0.00 176.55 176.80 1xrt s TYR 411 N -2.48 -0.00 -0.10 1.39 2.02 -0.87 -1.12 117.35 116.18 1xrt s TYR 411 Ca -0.28 0.02 0.01 0.00 -0.37 0.00 0.00 57.07 56.45 1xrt s TYR 411 Cb 0.08 -0.03 0.02 0.00 -0.40 0.00 0.00 41.96 41.63 1xrt s TYR 411 CO 0.61 -0.14 -0.12 0.99 -1.57 0.00 0.00 175.55 175.33 1xrt s THR 412 N -0.61 1.23 -0.14 -0.71 2.01 -0.49 -1.13 115.64 115.81 1xrt s THR 412 Ca -0.07 -0.47 0.02 0.00 0.31 0.00 0.00 61.69 61.48 1xrt s THR 412 Cb -0.04 -1.17 0.00 0.00 0.01 0.00 0.00 72.50 71.30 1xrt s THR 412 CO 0.00 0.39 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.50 1xrt s ILE 413 N 1.16 2.35 -0.14 1.82 1.01 0.25 -0.56 121.20 127.09 1xrt s ILE 413 Ca -0.04 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.73 1xrt s ILE 413 Cb -0.14 -1.95 0.02 0.00 0.01 0.00 0.00 42.46 40.39 1xrt s ILE 413 CO -0.03 0.54 -0.16 -0.75 0.00 0.00 0.00 174.94 174.54 1xrt s LYS 414 N 0.67 2.43 -1.55 2.79 2.20 -0.18 -0.86 119.74 125.23 1xrt s LYS 414 Ca -0.09 -0.62 -0.14 0.00 -0.36 0.00 0.00 55.97 54.75 1xrt s LYS 414 Cb -0.16 -2.14 0.10 0.00 -1.51 0.00 0.00 37.83 34.12 1xrt s LYS 414 CO 0.02 -0.18 0.92 -0.25 -0.36 0.00 0.00 175.35 175.50 1xrt n ASP 415 N 4.57 -4.55 0.00 1.43 8.00 -0.96 -1.44 116.55 123.60 1xrt n ASP 415 Ca -0.18 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.53 1xrt n ASP 415 Cb 0.50 -3.65 0.00 0.00 -0.02 0.00 0.00 41.12 37.96 1xrt n ASP 415 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xrt n GLY 416 N -1.60 1.12 3.51 0.44 0.00 -0.28 -4.31 105.19 104.06 1xrt n GLY 416 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1xrt n GLY 416 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xrt s LYS 417 N -0.02 3.70 -0.08 1.61 2.20 -0.52 -4.93 119.74 121.71 1xrt s LYS 417 Ca 0.00 -0.50 -0.29 0.00 -0.36 0.00 0.00 55.97 54.82 1xrt s LYS 417 Cb 0.00 -2.98 -0.07 0.00 -1.51 0.00 0.00 37.83 33.28 1xrt s LYS 417 CO 0.00 0.22 1.98 1.41 -0.36 0.00 0.00 175.35 178.60 1xrt s MET 418 N 0.45 3.78 -0.00 4.03 1.75 -1.26 -1.01 119.30 127.04 1xrt s MET 418 Ca -0.02 2.29 0.13 0.00 -1.25 0.00 0.00 55.69 56.83 1xrt s MET 418 Cb -0.14 -4.20 -0.15 0.00 2.84 0.00 0.00 34.83 33.17 1xrt s MET 418 CO 0.02 -1.35 0.48 1.33 -0.65 0.00 0.00 175.02 174.86 1xrt n VAL 419 N 6.34 0.00 -3.80 10.11 0.24 0.28 -4.95 118.33 126.55 1xrt n VAL 419 Ca 0.23 -0.22 -0.13 0.00 -2.04 0.00 0.00 64.34 62.18 1xrt n VAL 419 Cb 0.43 0.82 -0.12 0.00 -1.47 0.00 0.00 33.84 33.50 1xrt n VAL 419 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1xrt s TYR 420 N -2.36 -0.23 -0.05 6.34 5.04 -1.04 -4.96 117.35 120.08 1xrt s TYR 420 Ca 0.03 0.56 -0.02 0.00 -2.44 0.00 0.00 57.07 55.20 1xrt s TYR 420 Cb 0.09 0.08 0.03 0.00 0.35 0.00 0.00 41.96 42.51 1xrt s TYR 420 CO 0.53 -0.14 0.10 0.21 -1.34 0.00 0.00 175.55 174.91 1xrt s LYS 421 N -0.01 0.05 0.00 4.97 2.20 -1.26 -1.39 119.74 124.30 1xrt s LYS 421 Ca -0.01 0.27 0.04 0.00 -0.36 0.00 0.00 55.97 55.90 1xrt s LYS 421 Cb -0.02 -0.15 0.22 0.00 -1.51 0.00 0.00 37.83 36.36 1xrt s LYS 421 CO 0.01 -0.14 0.70 -3.47 -0.36 0.00 0.00 175.35 172.09