#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xrt h LEU 2 N 0.00 0.00 -8.21 4.03 3.38 -1.75 -3.49 115.31 109.27 1xrt h LEU 2 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1xrt h LEU 2 Cb 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.58 1xrt h LEU 2 CO 0.00 0.33 -0.69 -0.54 0.09 0.00 0.00 178.44 177.63 1xrt s LYS 3 N -3.09 0.57 -0.04 1.13 1.02 -1.10 -4.22 119.74 114.02 1xrt s LYS 3 Ca 0.01 -1.06 0.05 0.00 0.02 0.00 0.00 55.97 54.99 1xrt s LYS 3 Cb 0.08 0.07 -0.01 0.00 -0.52 0.00 0.00 37.83 37.46 1xrt s LYS 3 CO 0.77 -0.07 -0.20 -1.17 -0.92 0.00 0.00 175.35 173.76 1xrt s LEU 4 N -2.48 1.98 -0.25 3.17 2.96 -0.57 -0.88 118.68 122.61 1xrt s LEU 4 Ca 0.01 -0.40 -0.02 0.00 -0.22 0.00 0.00 54.13 53.51 1xrt s LEU 4 Cb 0.02 -1.09 0.03 0.00 0.50 0.00 0.00 46.19 45.64 1xrt s LEU 4 CO -0.06 0.20 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.48 1xrt s ILE 5 N -0.13 2.88 -0.52 6.68 1.01 0.11 -0.81 121.20 130.42 1xrt s ILE 5 Ca -0.01 -1.04 -0.23 0.00 0.00 0.00 0.00 60.65 59.37 1xrt s ILE 5 Cb -0.11 -2.47 0.04 0.00 0.01 0.00 0.00 42.46 39.93 1xrt s ILE 5 CO 0.02 0.19 0.85 -0.69 0.00 0.00 0.00 174.94 175.30 1xrt s VAL 6 N 1.32 4.54 -0.01 2.92 1.01 -0.01 -0.59 120.40 129.58 1xrt s VAL 6 Ca -0.00 0.17 -0.00 0.00 0.00 0.00 0.00 61.98 62.15 1xrt s VAL 6 Cb -0.17 -4.44 -0.04 0.00 0.00 0.00 0.00 36.38 31.73 1xrt s VAL 6 CO -0.04 -0.96 0.05 -0.54 0.00 0.00 0.00 175.10 173.61 1xrt s LYS 7 N 3.54 2.98 0.00 2.72 1.02 0.28 -1.04 119.74 129.24 1xrt s LYS 7 Ca 0.27 -0.51 0.00 0.00 0.02 0.00 0.00 55.97 55.75 1xrt s LYS 7 Cb -0.14 -2.80 0.00 0.00 -0.52 0.00 0.00 37.83 34.37 1xrt s LYS 7 CO 0.19 0.65 0.00 0.09 -0.92 0.00 0.00 175.35 175.35 1xrt n ASN 8 N 1.33 -1.44 -4.78 2.83 3.02 -1.26 -0.15 115.26 114.80 1xrt n ASN 8 Ca -0.14 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.14 1xrt n ASN 8 Cb 0.53 -0.65 0.09 0.00 -0.61 0.00 0.00 39.78 39.14 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 1.68 -0.46 7.41 0.00 -1.22 -3.70 107.32 109.03 1xrt s GLY 9 Ca 0.00 -0.96 -0.15 0.00 0.00 0.00 0.00 44.72 43.61 1xrt s GLY 9 CO 0.00 -0.47 0.37 -0.47 0.00 0.00 0.00 173.10 172.54 1xrt s TYR 10 N -3.42 3.26 0.08 1.90 5.04 -0.35 -3.16 117.35 120.70 1xrt s TYR 10 Ca 0.63 -1.01 -0.24 0.00 -2.44 0.00 0.00 57.07 54.01 1xrt s TYR 10 Cb -0.09 -3.13 -0.06 0.00 0.35 0.00 0.00 41.96 39.03 1xrt s TYR 10 CO 0.47 -0.80 0.75 0.08 -1.34 0.00 0.00 175.55 174.71 1xrt s VAL 11 N 1.61 4.64 -0.11 3.14 1.01 0.05 -1.01 120.40 129.74 1xrt s VAL 11 Ca 0.04 1.60 -0.02 0.00 0.00 0.00 0.00 61.98 63.60 1xrt s VAL 11 Cb -0.24 -4.10 0.04 0.00 0.00 0.00 0.00 36.38 32.08 1xrt s VAL 11 CO 0.06 0.42 0.01 -0.63 0.00 0.00 0.00 175.10 174.97 1xrt s ILE 12 N -0.43 0.43 -0.45 2.22 1.01 0.01 -1.60 121.20 122.39 1xrt s ILE 12 Ca 0.37 -0.11 0.02 0.00 0.00 0.00 0.00 60.65 60.93 1xrt s ILE 12 Cb -0.21 -0.71 0.14 0.00 0.01 0.00 0.00 42.46 41.70 1xrt s ILE 12 CO 0.23 0.11 0.26 -0.62 0.00 0.00 0.00 174.94 174.92 1xrt s ASP 13 N 1.93 3.44 0.45 3.58 2.15 -0.15 -4.23 116.67 123.84 1xrt s ASP 13 Ca 0.03 -2.71 0.12 0.00 0.43 0.00 0.00 52.55 50.42 1xrt s ASP 13 Cb -0.14 -0.95 1.03 0.00 -0.30 0.00 0.00 42.92 42.56 1xrt s ASP 13 CO -0.06 -0.25 2.04 -0.65 -0.17 0.00 0.00 175.17 176.08 1xrt h PRO 14 N 6.56 0.36 0.00 4.34 0.11 -1.90 -1.42 132.00 140.04 1xrt h PRO 14 Ca 0.04 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 1xrt h PRO 14 Cb 0.92 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 1xrt h PRO 14 CO 0.46 0.24 -0.02 0.66 -0.21 0.00 0.00 178.00 179.13 1xrt h SER 15 N 0.37 0.00 -0.33 -2.05 4.64 -1.94 -0.84 113.55 113.41 1xrt h SER 15 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1xrt h SER 15 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1xrt h SER 15 CO -0.04 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.94 1xrt n GLN 16 N -3.69 2.88 -4.16 4.77 6.02 -0.60 -4.97 117.38 117.63 1xrt n GLN 16 Ca -0.03 -2.06 -0.35 0.00 -0.01 0.00 0.00 57.00 54.55 1xrt n GLN 16 Cb 0.11 -1.28 -0.02 0.00 1.02 0.00 0.00 30.24 30.06 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 0.42 -3.39 -4.55 1.08 5.15 -0.32 -4.94 115.26 108.72 1xrt n ASN 17 Ca 0.11 -0.96 -0.34 0.00 -0.60 0.00 0.00 54.58 52.79 1xrt n ASN 17 Cb 0.44 -2.77 -0.11 0.00 -0.53 0.00 0.00 39.78 36.80 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 -7.21 3.47 -0.14 1.20 0.20 -0.79 -5.02 118.68 110.39 1xrt s LEU 18 Ca 0.73 -0.05 -0.27 0.00 0.69 0.00 0.00 54.13 55.23 1xrt s LEU 18 Cb -0.40 -1.85 0.07 0.00 -0.43 0.00 0.00 46.19 43.57 1xrt s LEU 18 CO 0.90 0.17 0.66 -1.83 -0.29 0.00 0.00 176.35 175.95 1xrt s GLU 19 N 0.39 0.91 0.00 1.98 -1.05 -1.26 -0.98 118.70 118.69 1xrt s GLU 19 Ca -0.01 0.54 0.00 0.00 -0.15 0.00 0.00 54.97 55.35 1xrt s GLU 19 Cb -0.13 0.44 0.00 0.00 -0.44 0.00 0.00 34.13 33.99 1xrt s GLU 19 CO 0.02 -0.21 0.00 0.41 0.95 0.00 0.00 175.26 176.43 1xrt n GLY 20 N 1.76 -0.26 3.55 -3.83 0.00 -0.63 -4.99 105.19 100.78 1xrt n GLY 20 Ca -0.17 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 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 -1.82 3.32 0.07 1.61 2.02 -1.26 -0.77 118.70 121.87 1xrt s GLU 21 Ca 0.00 -0.57 0.02 0.00 0.02 0.00 0.00 54.97 54.44 1xrt s GLU 21 Cb 0.00 -4.57 -0.03 0.00 0.10 0.00 0.00 34.13 29.63 1xrt s GLU 21 CO 0.00 -2.15 -0.07 -0.06 0.02 0.00 0.00 175.26 173.00 1xrt s PHE 22 N 5.39 0.76 0.35 1.61 0.08 -1.19 -4.67 117.98 120.31 1xrt s PHE 22 Ca 0.38 -0.71 -0.10 0.00 0.12 0.00 0.00 56.93 56.63 1xrt s PHE 22 Cb -0.06 -0.45 -0.07 0.00 -0.57 0.00 0.00 43.02 41.88 1xrt s PHE 22 CO 0.06 -0.12 0.69 -0.51 -0.10 0.00 0.00 175.22 175.24 1xrt s ASP 23 N -2.28 6.55 -0.12 1.36 1.01 -0.09 -3.99 116.67 119.12 1xrt s ASP 23 Ca 0.00 1.04 0.03 0.00 0.71 0.00 0.00 52.55 54.33 1xrt s ASP 23 Cb -0.03 -2.28 0.00 0.00 1.01 0.00 0.00 42.92 41.63 1xrt s ASP 23 CO -0.02 -0.29 -0.21 -0.63 0.21 0.00 0.00 175.17 174.23 1xrt s ILE 24 N -2.19 2.24 -0.21 0.77 1.01 -0.21 -1.64 121.20 120.98 1xrt s ILE 24 Ca 0.50 -0.94 -0.09 0.00 0.00 0.00 0.00 60.65 60.12 1xrt s ILE 24 Cb -0.10 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 1xrt s ILE 24 CO 0.28 0.55 0.10 -0.22 0.00 0.00 0.00 174.94 175.65 1xrt s LEU 25 N 0.49 3.92 -0.11 2.97 2.96 0.02 -0.83 118.68 128.10 1xrt s LEU 25 Ca -0.14 0.08 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 1xrt s LEU 25 Cb -0.17 -2.02 -0.01 0.00 0.50 0.00 0.00 46.19 44.49 1xrt s LEU 25 CO 0.05 0.12 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.35 1xrt s VAL 26 N 0.73 2.77 -0.03 1.68 1.01 0.01 -0.62 120.40 125.95 1xrt s VAL 26 Ca 0.05 -0.77 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 1xrt s VAL 26 Cb -0.13 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.13 1xrt s VAL 26 CO 0.02 0.54 0.15 -1.61 0.00 0.00 0.00 175.10 174.20 1xrt s GLU 27 N 0.26 0.36 -1.58 2.72 2.02 -0.81 -1.51 118.70 120.16 1xrt s GLU 27 Ca -0.11 -0.12 -0.03 0.00 0.02 0.00 0.00 54.97 54.73 1xrt s GLU 27 Cb -0.16 0.16 0.01 0.00 0.10 0.00 0.00 34.13 34.23 1xrt s GLU 27 CO 0.06 -0.08 0.29 0.09 0.02 0.00 0.00 175.26 175.64 1xrt n ASN 28 N 2.12 -5.64 -0.47 -0.19 3.02 -1.26 -1.58 115.26 111.26 1xrt n ASN 28 Ca -0.18 -0.13 -0.06 0.00 -0.03 0.00 0.00 54.58 54.17 1xrt n ASN 28 Cb 0.57 -4.64 -0.03 0.00 -0.61 0.00 0.00 39.78 35.07 1xrt n ASN 28 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xrt n GLY 29 N -1.22 0.77 3.27 7.41 0.00 -1.26 -5.00 105.19 109.16 1xrt n GLY 29 Ca -0.17 -0.23 -0.19 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.09 1.11 -0.08 1.61 1.02 -0.61 -0.82 119.74 119.86 1xrt s LYS 30 Ca 0.00 -1.30 -0.29 0.00 0.02 0.00 0.00 55.97 54.40 1xrt s LYS 30 Cb 0.00 -1.04 -0.05 0.00 -0.52 0.00 0.00 37.83 36.22 1xrt s LYS 30 CO 0.00 0.20 1.70 0.42 -0.92 0.00 0.00 175.35 176.75 1xrt s ILE 31 N -2.13 3.53 -0.26 2.17 -1.09 -0.23 -1.92 121.20 121.26 1xrt s ILE 31 Ca 0.11 0.63 -0.01 0.00 -2.23 0.00 0.00 60.65 59.15 1xrt s ILE 31 Cb -0.05 -3.44 -0.16 0.00 -1.58 0.00 0.00 42.46 37.23 1xrt s ILE 31 CO 0.04 -0.10 -0.25 1.17 -1.23 0.00 0.00 174.94 174.57 1xrt n LYS 32 N 7.34 0.64 -3.59 2.79 3.00 0.21 -0.19 118.16 128.35 1xrt n LYS 32 Ca 0.18 0.17 -0.16 0.00 -0.00 0.00 0.00 58.31 58.51 1xrt n LYS 32 Cb 0.43 -1.51 -0.07 0.00 0.00 0.00 0.00 35.03 33.88 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 -2.52 0.91 -0.16 1.64 2.20 -1.04 -4.87 119.74 115.91 1xrt s LYS 33 Ca -0.36 0.55 0.00 0.00 -0.36 0.00 0.00 55.97 55.81 1xrt s LYS 33 Cb 0.10 0.44 0.03 0.00 -1.51 0.00 0.00 37.83 36.89 1xrt s LYS 33 CO 0.58 -0.21 -0.12 0.42 -0.36 0.00 0.00 175.35 175.66 1xrt s ILE 34 N -0.48 1.48 0.13 5.43 1.01 -1.26 -0.80 121.20 126.72 1xrt s ILE 34 Ca -0.06 -0.69 -0.24 0.00 0.00 0.00 0.00 60.65 59.66 1xrt s ILE 34 Cb -0.02 -1.47 0.08 0.00 0.01 0.00 0.00 42.46 41.05 1xrt s ILE 34 CO 0.05 0.35 0.65 -0.62 0.00 0.00 0.00 174.94 175.37 1xrt s ASP 35 N 1.50 -0.54 0.44 3.58 2.15 -0.65 -4.99 116.67 118.17 1xrt s ASP 35 Ca 0.03 0.01 -0.24 0.00 0.43 0.00 0.00 52.55 52.78 1xrt s ASP 35 Cb -0.14 0.56 -0.08 0.00 -0.30 0.00 0.00 42.92 42.97 1xrt s ASP 35 CO -0.10 -0.90 1.22 -0.54 -0.17 0.00 0.00 175.17 174.68 1xrt s LYS 36 N -3.61 3.81 -1.00 4.34 1.02 -1.26 -0.91 119.74 122.13 1xrt s LYS 36 Ca 0.02 1.94 -0.11 0.00 0.02 0.00 0.00 55.97 57.83 1xrt s LYS 36 Cb -0.01 -2.54 -0.02 0.00 -0.52 0.00 0.00 37.83 34.74 1xrt s LYS 36 CO -0.12 -0.56 0.78 -1.71 -0.92 0.00 0.00 175.35 172.83 1xrt n ASN 37 N -0.27 -6.12 -4.70 2.83 5.15 -1.26 -4.84 115.26 106.05 1xrt n ASN 37 Ca 0.06 -0.74 -0.37 0.00 -0.60 0.00 0.00 54.58 52.93 1xrt n ASN 37 Cb 0.46 -4.02 -0.07 0.00 -0.53 0.00 0.00 39.78 35.62 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 -3.29 5.25 -0.06 -1.44 1.01 -1.26 -5.08 121.20 116.33 1xrt s ILE 38 Ca 0.32 0.68 -0.03 0.00 0.00 0.00 0.00 60.65 61.62 1xrt s ILE 38 Cb -0.09 -3.70 0.04 0.00 0.01 0.00 0.00 42.46 38.72 1xrt s ILE 38 CO 0.81 0.33 0.10 -0.22 0.00 0.00 0.00 174.94 175.96 1xrt s LEU 39 N 0.82 0.12 0.07 2.97 2.96 -1.26 -5.03 118.68 119.32 1xrt s LEU 39 Ca 0.19 0.19 0.03 0.00 -0.22 0.00 0.00 54.13 54.32 1xrt s LEU 39 Cb -0.14 0.06 -0.03 0.00 0.50 0.00 0.00 46.19 46.58 1xrt s LEU 39 CO 0.07 -0.24 -0.09 0.68 -1.32 0.00 0.00 176.35 175.45 1xrt s VAL 40 N 2.13 0.73 0.81 1.68 -7.23 -1.26 -5.16 120.40 112.09 1xrt s VAL 40 Ca 0.03 -1.36 -0.11 0.00 -1.81 0.00 0.00 61.98 58.73 1xrt s VAL 40 Cb -0.12 -0.99 0.08 0.00 0.56 0.00 0.00 36.38 35.90 1xrt s VAL 40 CO -0.04 -0.47 1.09 -2.16 -0.31 0.00 0.00 175.10 173.21 1xrt s PRO 41 N -2.20 1.97 -1.35 4.82 0.04 -1.26 -4.22 135.00 132.81 1xrt s PRO 41 Ca -0.02 0.75 -0.02 0.00 0.04 0.00 0.00 61.00 61.74 1xrt s PRO 41 Cb -0.06 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1xrt s PRO 41 CO -0.00 -1.73 0.30 0.39 0.04 0.00 0.00 177.00 176.00 1xrt n GLU 42 N -3.52 -2.96 -4.63 4.56 1.02 -1.26 -4.87 120.64 108.98 1xrt n GLU 42 Ca 0.07 0.78 -0.30 0.00 -0.02 0.00 0.00 57.16 57.69 1xrt n GLU 42 Cb 0.55 -5.26 -0.13 0.00 -0.02 0.00 0.00 31.44 26.58 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 -2.98 2.43 0.23 0.62 0.00 -1.26 -1.91 121.76 118.89 1xrt s ALA 43 Ca 0.15 -1.32 -0.26 0.00 0.00 0.00 0.00 51.96 50.53 1xrt s ALA 43 Cb -0.07 -0.54 -0.09 0.00 0.00 0.00 0.00 23.12 22.43 1xrt s ALA 43 CO 0.18 0.55 0.86 -2.00 0.00 0.00 0.00 175.76 175.36 1xrt s GLU 44 N -1.63 4.61 -0.16 0.00 2.12 -0.06 -4.93 118.70 118.65 1xrt s GLU 44 Ca 0.14 1.25 -0.01 0.00 0.36 0.00 0.00 54.97 56.72 1xrt s GLU 44 Cb -0.10 -3.10 -0.00 0.00 0.26 0.00 0.00 34.13 31.19 1xrt s GLU 44 CO 0.05 0.46 -0.13 0.42 -0.54 0.00 0.00 175.26 175.52 1xrt s ILE 45 N -1.33 2.84 -0.25 -3.70 1.01 -1.26 0.08 121.20 118.59 1xrt s ILE 45 Ca 0.42 -0.71 -0.09 0.00 0.00 0.00 0.00 60.65 60.27 1xrt s ILE 45 Cb -0.22 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 39.99 1xrt s ILE 45 CO 0.26 0.50 0.14 -0.63 0.00 0.00 0.00 174.94 175.21 1xrt s ILE 46 N 0.85 4.98 -0.73 2.92 1.01 0.24 -4.96 121.20 125.50 1xrt s ILE 46 Ca -0.04 0.05 -0.24 0.00 0.00 0.00 0.00 60.65 60.42 1xrt s ILE 46 Cb -0.15 -3.34 0.05 0.00 0.01 0.00 0.00 42.46 39.04 1xrt s ILE 46 CO -0.00 0.32 1.14 -0.62 0.00 0.00 0.00 174.94 175.78 1xrt s ASP 47 N 1.43 6.21 -0.16 3.58 -1.08 -1.26 -0.55 116.67 124.83 1xrt s ASP 47 Ca 0.06 -0.83 0.11 0.00 -0.52 0.00 0.00 52.55 51.37 1xrt s ASP 47 Cb -0.15 -2.49 0.58 0.00 -1.46 0.00 0.00 42.92 39.40 1xrt s ASP 47 CO 0.06 -1.61 1.40 0.00 0.52 0.00 0.00 175.17 175.55 1xrt n ALA 48 N 8.47 3.41 -1.68 3.66 0.00 0.79 -4.97 120.51 130.19 1xrt n ALA 48 Ca 0.03 -1.34 -0.45 0.00 0.00 0.00 0.00 53.44 51.68 1xrt n ALA 48 Cb 0.48 -1.08 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 1xrt n ALA 48 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1xrt n LYS 49 N 0.50 2.28 -0.97 0.00 4.81 -1.22 -0.96 118.16 122.59 1xrt n LYS 49 Ca 0.20 0.82 0.00 0.00 -0.87 0.00 0.00 58.31 58.46 1xrt n LYS 49 Cb 0.89 -2.61 0.00 0.00 0.02 0.00 0.00 35.03 33.34 1xrt n LYS 49 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xrt n GLY 50 N 3.53 0.61 3.61 3.14 0.00 -1.26 -4.97 105.19 109.85 1xrt n GLY 50 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 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 3.08 -0.14 0.99 1.43 -0.14 -4.85 118.68 119.05 1xrt s LEU 51 Ca 0.00 -0.71 -0.17 0.00 -1.03 0.00 0.00 54.13 52.23 1xrt s LEU 51 Cb 0.00 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 1xrt s LEU 51 CO 0.00 0.01 0.41 -0.63 0.23 0.00 0.00 176.35 176.38 1xrt s ILE 52 N -2.32 5.22 -0.19 -0.59 -1.09 0.15 -1.22 121.20 121.17 1xrt s ILE 52 Ca 0.31 0.80 -0.01 0.00 -2.23 0.00 0.00 60.65 59.52 1xrt s ILE 52 Cb -0.06 -3.75 0.00 0.00 -1.58 0.00 0.00 42.46 37.07 1xrt s ILE 52 CO 0.19 0.33 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.42 1xrt s VAL 53 N 0.68 2.83 0.26 2.92 1.01 -0.18 -1.30 120.40 126.62 1xrt s VAL 53 Ca 0.22 -0.69 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 1xrt s VAL 53 Cb -0.14 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.99 1xrt s VAL 53 CO 0.08 0.48 0.44 0.00 0.00 0.00 0.00 175.10 176.10 1xrt n PRO 55 N -0.40 0.64 -1.77 0.00 -0.02 -1.26 -0.94 135.00 131.25 1xrt n PRO 55 Ca -0.01 0.28 -0.40 0.00 -2.02 0.00 0.00 63.50 61.35 1xrt n PRO 55 Cb 0.62 -2.40 0.02 0.00 -0.02 0.00 0.00 33.50 31.72 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 -1.68 2.92 0.55 -1.23 0.00 -0.27 -4.15 107.32 103.46 1xrt s GLY 56 Ca 0.77 1.50 -0.17 0.00 0.00 0.00 0.00 44.72 46.81 1xrt s GLY 56 CO 0.47 2.12 1.05 -1.36 0.00 0.00 0.00 173.10 175.37 1xrt s PHE 57 N -1.19 3.01 -0.12 1.90 0.08 -0.70 -4.54 117.98 116.42 1xrt s PHE 57 Ca 0.61 1.53 -0.01 0.00 0.12 0.00 0.00 56.93 59.19 1xrt s PHE 57 Cb -0.45 -3.02 0.03 0.00 -0.57 0.00 0.00 43.02 39.01 1xrt s PHE 57 CO 0.58 -0.98 -0.07 0.42 -0.10 0.00 0.00 175.22 175.07 1xrt s ILE 58 N -2.28 1.00 -0.29 0.64 1.01 -0.14 -1.02 121.20 120.12 1xrt s ILE 58 Ca 0.65 -0.33 -0.07 0.00 0.00 0.00 0.00 60.65 60.90 1xrt s ILE 58 Cb -0.16 -1.06 0.00 0.00 0.01 0.00 0.00 42.46 41.25 1xrt s ILE 58 CO 0.30 0.32 0.09 -0.62 0.00 0.00 0.00 174.94 175.02 1xrt s ASP 59 N 1.71 5.17 -0.16 3.58 -1.08 -0.65 -4.74 116.67 120.50 1xrt s ASP 59 Ca 0.04 -0.60 0.12 0.00 -0.52 0.00 0.00 52.55 51.59 1xrt s ASP 59 Cb -0.13 -1.90 0.64 0.00 -1.46 0.00 0.00 42.92 40.07 1xrt s ASP 59 CO -0.08 -0.17 1.49 2.30 0.52 0.00 0.00 175.17 179.24 1xrt n ILE 60 N 4.89 1.97 -3.15 4.11 -5.35 -1.26 -0.65 119.36 119.93 1xrt n ILE 60 Ca -0.15 -1.07 -0.10 0.00 -0.27 0.00 0.00 62.75 61.17 1xrt n ILE 60 Cb 0.49 -0.20 -0.04 0.00 -1.74 0.00 0.00 39.64 38.15 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 -2.20 -0.89 -0.02 4.28 2.46 -1.24 -4.74 115.29 112.93 1xrt s HIS 61 Ca 0.43 -0.66 0.04 0.00 0.47 0.00 0.00 55.06 55.34 1xrt s HIS 61 Cb 0.31 -0.06 -0.00 0.00 -0.13 0.00 0.00 32.58 32.70 1xrt s HIS 61 CO 0.15 -1.10 -0.13 0.08 -2.47 0.00 0.00 174.74 171.28 1xrt s VAL 62 N 1.19 1.04 -0.48 0.89 1.01 -0.46 -0.99 120.40 122.60 1xrt s VAL 62 Ca 0.23 -0.52 -0.14 0.00 0.00 0.00 0.00 61.98 61.54 1xrt s VAL 62 Cb -0.05 -0.89 0.09 0.00 0.00 0.00 0.00 36.38 35.53 1xrt s VAL 62 CO -0.07 0.30 0.39 -1.00 0.00 0.00 0.00 175.10 174.73 1xrt s HIS 63 N -0.04 3.28 -0.91 5.22 3.76 -0.43 -0.98 115.29 125.20 1xrt s HIS 63 Ca -0.00 -1.20 0.25 0.00 -0.15 0.00 0.00 55.06 53.96 1xrt s HIS 63 Cb -0.08 -3.30 0.59 0.00 1.11 0.00 0.00 32.58 30.90 1xrt s HIS 63 CO 0.00 -0.87 1.48 1.28 -0.85 0.00 0.00 174.74 175.78 1xrt n LEU 64 N 5.14 0.47 -1.28 0.89 4.77 -1.26 -4.45 117.00 121.28 1xrt n LEU 64 Ca -0.12 0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 55.87 1xrt n LEU 64 Cb 0.42 -0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1xrt n LEU 64 CO 0.47 0.06 -0.15 0.54 -1.33 0.00 0.00 177.39 176.97 1xrt n ARG 65 N -1.66 -1.00 -3.57 3.23 5.12 -1.26 -3.29 116.66 114.22 1xrt n ARG 65 Ca 0.05 0.81 -0.16 0.00 -1.93 0.00 0.00 57.85 56.62 1xrt n ARG 65 Cb 0.36 -4.97 -0.13 0.00 -1.16 0.00 0.00 32.46 26.56 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 -2.62 0.95 0.74 0.55 -1.08 -1.26 -0.81 116.67 113.13 1xrt s ASP 66 Ca 0.00 0.12 -0.11 0.00 -0.52 0.00 0.00 52.55 52.04 1xrt s ASP 66 Cb 0.00 0.46 0.03 0.00 -1.46 0.00 0.00 42.92 41.96 1xrt s ASP 66 CO 0.00 -0.29 1.09 -2.16 0.52 0.00 0.00 175.17 174.34 1xrt s PRO 67 N 2.35 2.58 0.00 4.34 0.04 -1.26 -4.89 135.00 138.16 1xrt s PRO 67 Ca 0.05 0.55 0.00 0.00 0.04 0.00 0.00 61.00 61.64 1xrt s PRO 67 Cb -0.14 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1xrt s PRO 67 CO -0.10 -1.25 0.00 0.41 0.04 0.00 0.00 177.00 176.10 1xrt n GLY 68 N -2.61 2.80 2.73 0.56 0.00 -1.02 -1.02 105.19 106.62 1xrt n GLY 68 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.94 1.56 0.00 1.61 6.02 0.01 -4.89 117.38 120.76 1xrt n GLN 69 Ca 0.00 -3.44 0.05 0.00 -0.01 0.00 0.00 57.00 53.61 1xrt n GLN 69 Cb 0.00 -1.48 0.24 0.00 1.02 0.00 0.00 30.24 30.02 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 -0.36 1.21 0.23 5.09 -2.24 -1.04 -0.87 114.28 116.31 1xrt n THR 70 Ca 0.10 0.30 0.12 0.00 -2.27 0.00 0.00 64.05 62.30 1xrt n THR 70 Cb 0.81 -1.11 0.46 0.00 -2.10 0.00 0.00 70.33 68.39 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 0.04 4.78 -0.00 -1.93 -3.25 116.97 116.62 1xrt h TYR 71 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 58.73 58.44 1xrt h TYR 71 Cb 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 36.89 1xrt h TYR 71 CO 0.00 0.15 -1.56 0.87 -0.00 0.00 0.00 178.16 177.62 1xrt h LYS 72 N 0.00 0.09 -1.04 0.10 1.57 -1.34 -3.46 116.57 112.50 1xrt h LYS 72 Ca -0.00 -0.16 0.28 0.00 -1.87 0.00 0.00 60.65 58.91 1xrt h LYS 72 Cb 0.75 0.06 -0.25 0.00 0.08 0.00 0.00 32.23 32.87 1xrt h LYS 72 CO 0.02 0.82 0.98 -2.00 -0.57 0.00 0.00 179.45 178.70 1xrt s GLU 73 N -2.62 0.03 0.32 3.15 2.56 -1.23 -3.27 118.70 117.65 1xrt s GLU 73 Ca -0.07 -0.00 0.05 0.00 0.00 0.00 0.00 54.97 54.96 1xrt s GLU 73 Cb 0.08 0.01 -0.03 0.00 2.00 0.00 0.00 34.13 36.19 1xrt s GLU 73 CO 0.83 -0.01 0.23 0.16 -0.56 0.00 0.00 175.26 175.90 1xrt s ASP 74 N -1.41 1.65 0.24 -1.70 1.47 -1.21 -4.02 116.67 111.69 1xrt s ASP 74 Ca 0.10 -1.69 -0.05 0.00 1.18 0.00 0.00 52.55 52.10 1xrt s ASP 74 Cb -0.01 0.52 0.38 0.00 -0.34 0.00 0.00 42.92 43.47 1xrt s ASP 74 CO -0.06 -1.00 1.81 0.40 0.68 0.00 0.00 175.17 176.99 1xrt h ILE 75 N 2.15 0.90 0.05 2.11 2.04 -1.90 -0.20 117.51 122.66 1xrt h ILE 75 Ca -0.28 -0.26 -0.00 0.00 1.00 0.00 0.00 64.86 65.31 1xrt h ILE 75 Cb 1.24 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1xrt h ILE 75 CO 0.43 0.14 -0.02 -0.08 0.00 0.00 0.00 178.15 178.61 1xrt h GLU 76 N 0.76 -0.06 -0.44 2.37 4.81 -1.95 -0.87 114.58 119.19 1xrt h GLU 76 Ca 0.39 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.51 1xrt h GLU 76 Cb 0.36 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1xrt h GLU 76 CO -0.25 0.17 -0.16 0.66 -0.73 0.00 0.00 179.01 178.70 1xrt h SER 77 N -0.29 0.85 -0.57 1.04 4.64 -1.79 -1.35 113.55 116.08 1xrt h SER 77 Ca -0.01 -0.29 -0.09 0.00 -0.47 0.00 0.00 61.79 60.94 1xrt h SER 77 Cb 0.26 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.09 1xrt h SER 77 CO 0.01 1.01 0.02 1.23 -0.87 0.00 0.00 176.83 178.23 1xrt h GLY 78 N 0.96 1.10 1.39 -0.77 0.00 -1.05 -1.45 103.07 103.24 1xrt h GLY 78 Ca 0.11 -0.77 -0.04 0.00 0.00 0.00 0.00 47.33 46.63 1xrt h GLY 78 CO 0.05 0.71 0.16 1.76 0.00 0.00 0.00 176.54 179.23 1xrt h SER 79 N 0.94 0.72 -0.39 0.19 0.02 -0.91 0.65 113.55 114.75 1xrt h SER 79 Ca 0.17 -0.11 -0.08 0.00 -0.84 0.00 0.00 61.79 60.94 1xrt h SER 79 Cb 0.51 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1xrt h SER 79 CO 0.02 0.68 -0.06 0.03 -1.14 0.00 0.00 176.83 176.37 1xrt h ARG 80 N 0.76 0.74 -0.62 3.45 3.08 -1.01 -1.47 114.38 119.31 1xrt h ARG 80 Ca 0.18 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1xrt h ARG 80 Cb 0.22 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.19 1xrt h ARG 80 CO -0.01 0.86 0.30 0.00 -1.07 0.00 0.00 179.97 180.05 1xrt h ALA 82 N 1.13 -0.16 -0.12 0.00 0.00 -0.63 -1.39 119.26 118.08 1xrt h ALA 82 Ca 0.21 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 1xrt h ALA 82 Cb 0.12 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1xrt h ALA 82 CO -0.03 -0.61 -0.56 -0.39 0.00 0.00 0.00 179.25 177.67 1xrt h VAL 83 N -0.20 1.35 0.00 0.00 -1.51 -1.26 0.79 116.25 115.43 1xrt h VAL 83 Ca 0.01 -1.85 -0.02 0.00 -1.23 0.00 0.00 66.70 63.62 1xrt h VAL 83 Cb 0.20 1.87 -0.00 0.00 -2.13 0.00 0.00 31.29 31.23 1xrt h VAL 83 CO -0.04 0.56 -0.08 0.00 -1.23 0.00 0.00 177.57 176.78 1xrt h ALA 84 N 1.13 1.39 -0.70 5.19 0.00 -1.33 -1.76 119.26 123.18 1xrt h ALA 84 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xrt h ALA 84 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1xrt h ALA 84 CO 0.09 0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.85 1xrt n GLY 85 N -0.93 2.37 1.54 0.00 0.00 -0.53 -4.53 105.19 103.10 1xrt n GLY 85 Ca -0.02 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 1.54 0.76 3.66 -0.02 0.00 -0.66 -4.68 105.19 105.80 1xrt n GLY 86 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.79 3.38 -0.72 1.61 0.08 0.17 -1.73 117.98 117.98 1xrt s PHE 87 Ca 0.00 1.01 0.22 0.00 0.12 0.00 0.00 56.93 58.28 1xrt s PHE 87 Cb 0.00 -2.86 -0.15 0.00 -0.57 0.00 0.00 43.02 39.44 1xrt s PHE 87 CO 0.00 -0.20 0.87 0.25 -0.10 0.00 0.00 175.22 176.04 1xrt n THR 88 N 4.72 0.03 -3.72 0.64 -2.24 -0.19 -3.63 114.28 109.90 1xrt n THR 88 Ca 0.00 -0.15 -0.14 0.00 -2.27 0.00 0.00 64.05 61.49 1xrt n THR 88 Cb 0.49 0.59 -0.14 0.00 -2.10 0.00 0.00 70.33 69.17 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 -3.15 -0.13 0.07 4.28 2.01 -1.14 -0.72 115.64 116.85 1xrt s THR 89 Ca 0.04 0.23 0.05 0.00 0.31 0.00 0.00 61.69 62.32 1xrt s THR 89 Cb 0.15 -0.30 -0.03 0.00 0.01 0.00 0.00 72.50 72.34 1xrt s THR 89 CO 0.85 0.09 -0.14 0.27 -0.69 0.00 0.00 174.62 175.01 1xrt s ILE 90 N 1.58 1.11 -0.21 1.82 -4.36 -0.34 -1.64 121.20 119.15 1xrt s ILE 90 Ca -0.05 -1.27 -0.04 0.00 -0.26 0.00 0.00 60.65 59.03 1xrt s ILE 90 Cb -0.12 -1.06 -0.01 0.00 1.25 0.00 0.00 42.46 42.52 1xrt s ILE 90 CO -0.07 -0.20 -0.04 -0.69 0.24 0.00 0.00 174.94 174.18 1xrt s VAL 91 N -1.23 3.41 -0.03 8.37 1.01 0.18 -0.34 120.40 131.77 1xrt s VAL 91 Ca -0.02 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 61.40 1xrt s VAL 91 Cb -0.10 -2.54 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 1xrt s VAL 91 CO 0.02 0.43 0.25 0.00 0.00 0.00 0.00 175.10 175.80 1xrt s MET 93 N -1.48 3.86 -0.04 0.00 -1.94 -0.15 -2.63 119.30 116.92 1xrt s MET 93 Ca 0.24 0.85 0.16 0.00 -1.71 0.00 0.00 55.69 55.22 1xrt s MET 93 Cb -0.13 -2.16 0.52 0.00 2.01 0.00 0.00 34.83 35.07 1xrt s MET 93 CO 0.13 -0.30 1.41 -0.35 -0.01 0.00 0.00 175.02 175.90 1xrt n PRO 94 N -1.79 2.64 -0.54 2.03 -0.04 -1.26 -4.42 135.00 131.62 1xrt n PRO 94 Ca 0.06 -2.07 -0.08 0.00 -0.04 0.00 0.00 63.50 61.37 1xrt n PRO 94 Cb 0.54 -1.57 0.03 0.00 -0.04 0.00 0.00 33.50 32.46 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 0.97 4.75 -4.27 3.54 6.94 -1.25 -1.97 115.26 123.97 1xrt n ASN 95 Ca 0.19 -2.61 -0.29 0.00 -0.02 0.00 0.00 54.58 51.85 1xrt n ASN 95 Cb 0.58 -0.87 0.19 0.00 -2.36 0.00 0.00 39.78 37.32 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 -1.07 1.85 -0.20 5.53 -4.23 -1.26 -4.96 115.64 111.30 1xrt s THR 96 Ca 0.16 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.65 1xrt s THR 96 Cb 0.13 -2.66 0.06 0.00 1.34 0.00 0.00 72.50 71.36 1xrt s THR 96 CO 0.01 0.00 0.02 0.21 -0.54 0.00 0.00 174.62 174.32 1xrt s ASN 97 N -4.07 3.02 0.74 3.99 2.47 -0.19 -1.97 114.94 118.93 1xrt s ASN 97 Ca 0.69 -0.86 -0.11 0.00 0.42 0.00 0.00 52.86 53.00 1xrt s ASN 97 Cb -0.11 -0.68 0.04 0.00 -1.45 0.00 0.00 41.25 39.04 1xrt s ASN 97 CO 0.55 -0.29 1.09 -2.16 -3.72 0.00 0.00 177.10 172.56 1xrt s PRO 98 N 1.79 2.49 0.87 0.43 0.04 -1.26 -2.44 135.00 136.92 1xrt s PRO 98 Ca -0.02 1.15 -0.12 0.00 0.04 0.00 0.00 61.00 62.06 1xrt s PRO 98 Cb -0.17 -1.93 0.11 0.00 0.04 0.00 0.00 34.50 32.55 1xrt s PRO 98 CO -0.08 -1.46 1.10 -1.25 0.04 0.00 0.00 177.00 175.35 1xrt s PRO 99 N -4.80 1.51 -1.28 0.56 0.04 -0.83 -4.72 135.00 125.48 1xrt s PRO 99 Ca 0.61 0.74 -0.13 0.00 0.04 0.00 0.00 61.00 62.26 1xrt s PRO 99 Cb -0.17 -1.84 0.14 0.00 0.04 0.00 0.00 34.50 32.66 1xrt s PRO 99 CO 0.53 -2.05 1.73 -0.89 0.04 0.00 0.00 177.00 176.37 1xrt n ILE 100 N -3.74 4.13 -0.34 0.56 5.41 -0.83 -4.48 119.36 120.08 1xrt n ILE 100 Ca 0.07 -4.30 0.02 0.00 1.00 0.00 0.00 62.75 59.54 1xrt n ILE 100 Cb 0.56 -2.43 0.03 0.00 -0.71 0.00 0.00 39.64 37.08 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 5.61 1.82 -3.91 4.38 5.68 -1.26 -1.90 116.55 126.98 1xrt n ASP 101 Ca 0.42 -2.10 -0.09 0.00 -0.50 0.00 0.00 54.79 52.51 1xrt n ASP 101 Cb 0.41 -0.08 -0.06 0.00 -1.14 0.00 0.00 41.12 40.24 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 -1.24 -0.02 0.42 -1.12 2.20 -1.26 -4.80 114.94 109.11 1xrt s ASN 102 Ca 0.06 -0.77 0.23 0.00 -0.94 0.00 0.00 52.86 51.44 1xrt s ASN 102 Cb 0.05 0.46 0.81 0.00 -2.00 0.00 0.00 41.25 40.57 1xrt s ASN 102 CO 0.01 -0.92 1.78 0.71 -2.94 0.00 0.00 177.10 175.73 1xrt h THR 103 N 2.48 0.55 -0.50 0.54 1.35 -1.97 -2.30 112.91 113.07 1xrt h THR 103 Ca -0.31 -1.23 -0.00 0.00 -0.55 0.00 0.00 66.41 64.32 1xrt h THR 103 Cb 1.23 1.85 -0.02 0.00 -1.73 0.00 0.00 68.15 69.48 1xrt h THR 103 CO 0.46 0.24 0.29 0.74 -0.25 0.00 0.00 175.52 177.00 1xrt h THR 104 N 0.00 1.16 -0.31 6.82 2.02 -1.98 0.16 112.91 120.78 1xrt h THR 104 Ca -0.00 -0.37 -0.18 0.00 0.77 0.00 0.00 66.41 66.62 1xrt h THR 104 Cb 0.83 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1xrt h THR 104 CO 0.03 0.16 -0.51 0.58 0.37 0.00 0.00 175.52 176.16 1xrt h VAL 105 N 0.66 1.27 -0.26 3.16 2.07 -1.80 -1.93 116.25 119.42 1xrt h VAL 105 Ca 0.18 -1.69 0.04 0.00 0.82 0.00 0.00 66.70 66.05 1xrt h VAL 105 Cb 0.01 1.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 1xrt h VAL 105 CO -0.03 0.56 0.02 0.58 0.02 0.00 0.00 177.57 178.71 1xrt h VAL 106 N 0.69 0.84 -0.28 2.57 2.07 -1.20 -2.16 116.25 118.78 1xrt h VAL 106 Ca 0.03 -0.04 -0.09 0.00 0.82 0.00 0.00 66.70 67.42 1xrt h VAL 106 Cb 1.11 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 1xrt h VAL 106 CO 0.12 0.02 -0.19 0.78 0.02 0.00 0.00 177.57 178.32 1xrt h ASN 107 N 0.11 0.50 -0.19 0.57 2.35 -0.59 -1.46 115.58 116.87 1xrt h ASN 107 Ca 0.12 -0.15 0.05 0.00 -0.55 0.00 0.00 56.30 55.77 1xrt h ASN 107 Cb 0.15 -0.13 -0.06 0.00 0.05 0.00 0.00 38.32 38.33 1xrt h ASN 107 CO -0.19 0.70 -0.17 0.22 -1.65 0.00 0.00 177.43 176.35 1xrt h TYR 108 N 0.46 -0.42 -0.43 1.19 3.20 -0.97 -0.94 116.97 119.06 1xrt h TYR 108 Ca 0.08 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.88 1xrt h TYR 108 Cb 0.59 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 39.06 1xrt h TYR 108 CO 0.02 -0.24 -0.11 0.82 -1.64 0.00 0.00 178.16 177.01 1xrt h ILE 109 N -0.18 1.27 -0.73 1.81 2.04 -0.80 -0.81 117.51 120.11 1xrt h ILE 109 Ca 0.12 -1.23 -0.02 0.00 1.00 0.00 0.00 64.86 64.73 1xrt h ILE 109 Cb 0.35 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 1xrt h ILE 109 CO -0.29 0.42 0.39 -0.07 0.00 0.00 0.00 178.15 178.59 1xrt h LEU 110 N 0.66 0.92 -0.44 1.44 3.38 -1.21 -0.21 115.31 119.86 1xrt h LEU 110 Ca 0.11 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 1xrt h LEU 110 Cb 0.65 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1xrt h LEU 110 CO 0.04 0.76 -0.15 1.56 0.09 0.00 0.00 178.44 180.74 1xrt h GLN 111 N 1.01 0.88 -0.21 1.13 1.08 -1.05 -1.24 115.11 116.71 1xrt h GLN 111 Ca 0.26 -0.36 0.05 0.00 -1.45 0.00 0.00 58.65 57.15 1xrt h GLN 111 Cb 0.05 -0.04 -0.05 0.00 -0.05 0.00 0.00 27.48 27.39 1xrt h GLN 111 CO -0.04 1.00 -0.11 0.87 -0.95 0.00 0.00 178.83 179.60 1xrt h LYS 112 N 0.71 -0.08 -0.66 1.46 1.79 -0.91 -0.89 116.57 117.98 1xrt h LYS 112 Ca 0.11 0.01 0.09 0.00 -2.18 0.00 0.00 60.65 58.67 1xrt h LYS 112 Cb 0.70 0.02 -0.07 0.00 -1.58 0.00 0.00 32.23 31.30 1xrt h LYS 112 CO 0.05 -0.05 0.30 1.03 -1.08 0.00 0.00 179.45 179.70 1xrt h SER 113 N -0.09 0.38 -0.37 0.86 0.87 -0.95 0.46 113.55 114.71 1xrt h SER 113 Ca 0.12 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.73 1xrt h SER 113 Cb 0.26 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.21 1xrt h SER 113 CO -0.27 0.22 0.19 0.50 -0.53 0.00 0.00 176.83 176.94 1xrt h LYS 114 N 0.53 0.52 -0.10 2.24 3.64 -0.98 -0.54 116.57 121.88 1xrt h LYS 114 Ca 0.33 -0.07 -0.17 0.00 -1.27 0.00 0.00 60.65 59.47 1xrt h LYS 114 Cb 0.36 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1xrt h LYS 114 CO -0.27 0.45 -0.65 0.66 -2.27 0.00 0.00 179.45 177.36 1xrt h SER 115 N 0.47 0.46 -0.19 4.20 4.64 -0.73 -3.08 113.55 119.32 1xrt h SER 115 Ca 0.13 -0.28 -0.07 0.00 -0.47 0.00 0.00 61.79 61.10 1xrt h SER 115 Cb 0.08 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1xrt h SER 115 CO -0.02 0.99 -0.15 0.58 -0.87 0.00 0.00 176.83 177.36 1xrt h VAL 116 N 0.29 1.33 -1.85 0.95 2.07 -0.86 -3.48 116.25 114.70 1xrt h VAL 116 Ca -0.01 -1.28 -0.25 0.00 0.82 0.00 0.00 66.70 65.98 1xrt h VAL 116 Cb 1.20 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 1xrt h VAL 116 CO 0.11 0.39 -0.32 0.61 0.02 0.00 0.00 177.57 178.37 1xrt n GLY 117 N 0.12 -0.14 0.00 2.17 0.00 -0.22 -4.97 105.19 102.16 1xrt n GLY 117 Ca -0.05 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.84 0.00 -4.85 0.99 4.77 -1.26 -5.01 117.00 109.79 1xrt n LEU 118 Ca -0.14 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.52 1xrt n LEU 118 Cb 0.61 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.65 1xrt n LEU 118 CO 0.18 0.00 0.50 0.00 -1.33 0.00 0.00 177.39 176.74 1xrt s ARG 120 N -3.52 4.24 -0.30 0.00 6.06 0.10 -4.93 118.95 120.59 1xrt s ARG 120 Ca 0.55 2.20 -0.08 0.00 -2.50 0.00 0.00 55.73 55.90 1xrt s ARG 120 Cb -0.10 -3.52 0.00 0.00 0.06 0.00 0.00 34.95 31.39 1xrt s ARG 120 CO 0.24 -0.65 0.11 0.08 -2.50 0.00 0.00 175.30 172.58 1xrt s VAL 121 N 2.29 4.22 -0.22 7.11 1.01 -1.26 -1.20 120.40 132.35 1xrt s VAL 121 Ca 0.70 -0.56 -0.09 0.00 0.00 0.00 0.00 61.98 62.03 1xrt s VAL 121 Cb -0.37 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 1xrt s VAL 121 CO 0.30 0.09 0.10 -0.76 0.00 0.00 0.00 175.10 174.84 1xrt s LEU 122 N 1.55 3.82 0.62 3.92 1.43 0.54 -4.82 118.68 125.72 1xrt s LEU 122 Ca 0.04 0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 53.02 1xrt s LEU 122 Cb -0.17 -2.00 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 1xrt s LEU 122 CO 0.04 0.07 1.03 -2.16 0.23 0.00 0.00 176.35 175.56 1xrt s PRO 123 N 0.99 3.52 0.22 1.29 0.04 -1.26 -1.36 135.00 138.44 1xrt s PRO 123 Ca 0.05 0.85 0.11 0.00 0.04 0.00 0.00 61.00 62.05 1xrt s PRO 123 Cb -0.14 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 1xrt s PRO 123 CO 0.03 -0.64 -0.17 0.95 0.04 0.00 0.00 177.00 177.22 1xrt s THR 124 N -3.03 2.73 0.34 1.26 -4.23 -1.08 -1.55 115.64 110.08 1xrt s THR 124 Ca 0.57 -2.01 0.05 0.00 -1.18 0.00 0.00 61.69 59.11 1xrt s THR 124 Cb -0.12 -2.37 -0.01 0.00 1.34 0.00 0.00 72.50 71.34 1xrt s THR 124 CO 0.50 -0.21 0.49 -0.83 -0.54 0.00 0.00 174.62 174.02 1xrt s GLY 125 N -3.03 1.50 0.58 3.99 0.00 -0.56 -4.47 107.32 105.33 1xrt s GLY 125 Ca 0.25 -1.31 -0.15 0.00 0.00 0.00 0.00 44.72 43.51 1xrt s GLY 125 CO 0.14 -1.23 1.03 -0.51 0.00 0.00 0.00 173.10 172.53 1xrt s THR 126 N -2.21 4.10 0.07 0.90 -4.23 -0.80 -1.42 115.64 112.04 1xrt s THR 126 Ca 0.43 0.95 -0.16 0.00 -1.18 0.00 0.00 61.69 61.73 1xrt s THR 126 Cb -0.09 -3.51 -0.15 0.00 1.34 0.00 0.00 72.50 70.08 1xrt s THR 126 CO 0.32 -0.63 1.29 0.40 -0.54 0.00 0.00 174.62 175.46 1xrt h ILE 127 N 0.42 1.33 -2.79 2.99 2.04 -1.82 -3.41 117.51 116.27 1xrt h ILE 127 Ca -0.46 -1.77 -0.59 0.00 1.00 0.00 0.00 64.86 63.04 1xrt h ILE 127 Cb 1.21 2.00 -0.16 0.00 -0.74 0.00 0.00 36.82 39.13 1xrt h ILE 127 CO 0.59 0.55 -0.78 0.42 0.00 0.00 0.00 178.15 178.93 1xrt s THR 128 N -3.85 2.22 0.11 -0.27 -4.23 -1.26 -1.12 115.64 107.23 1xrt s THR 128 Ca -0.12 -2.18 -0.35 0.00 -1.18 0.00 0.00 61.69 57.86 1xrt s THR 128 Cb 0.07 -2.13 -0.14 0.00 1.34 0.00 0.00 72.50 71.64 1xrt s THR 128 CO 0.85 -0.33 1.57 0.29 -0.54 0.00 0.00 174.62 176.46 1xrt n LYS 129 N -0.16 1.93 -1.12 3.99 4.01 0.15 -1.47 118.16 125.49 1xrt n LYS 129 Ca -0.09 0.70 -0.04 0.00 -0.51 0.00 0.00 58.31 58.37 1xrt n LYS 129 Cb 0.58 -2.45 -0.02 0.00 -0.51 0.00 0.00 35.03 32.64 1xrt n LYS 129 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1xrt n GLY 130 N 3.37 0.39 2.56 0.72 0.00 -1.26 -1.41 105.19 109.56 1xrt n GLY 130 Ca 0.18 -0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 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 0.32 -2.42 0.04 1.61 1.74 -0.54 -4.90 116.66 112.50 1xrt n ARG 131 Ca -0.04 0.66 0.13 0.00 -0.77 0.00 0.00 57.85 57.83 1xrt n ARG 131 Cb 0.53 -5.30 0.45 0.00 -1.02 0.00 0.00 32.46 27.13 1xrt n ARG 131 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1xrt n LYS 132 N -3.00 0.11 -0.49 5.56 4.76 -0.50 -4.93 118.16 119.68 1xrt n LYS 132 Ca -0.15 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.36 1xrt n LYS 132 Cb 0.62 -1.61 0.00 0.00 -1.84 0.00 0.00 35.03 32.20 1xrt n LYS 132 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xrt n GLY 133 N 1.43 0.86 0.13 0.72 0.00 -1.26 -4.90 105.19 102.17 1xrt n GLY 133 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 0.58 -4.53 1.61 5.02 -1.26 -4.84 118.16 112.73 1xrt n LYS 134 Ca 0.00 0.35 -0.32 0.00 -2.02 0.00 0.00 58.31 56.32 1xrt n LYS 134 Cb 0.00 -1.56 -0.16 0.00 -0.02 0.00 0.00 35.03 33.29 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 -2.48 2.80 0.30 1.97 2.12 -1.26 -5.03 118.70 117.12 1xrt s GLU 135 Ca -0.36 -0.77 -0.30 0.00 0.36 0.00 0.00 54.97 53.91 1xrt s GLU 135 Cb 0.12 -2.31 -0.11 0.00 0.26 0.00 0.00 34.13 32.09 1xrt s GLU 135 CO 0.51 -0.06 1.51 -1.50 -0.54 0.00 0.00 175.26 175.18 1xrt s ILE 136 N 0.94 2.29 0.95 -3.70 2.07 -1.26 0.32 121.20 122.80 1xrt s ILE 136 Ca -0.05 0.25 -0.12 0.00 -1.41 0.00 0.00 60.65 59.32 1xrt s ILE 136 Cb -0.15 -3.16 0.16 0.00 0.13 0.00 0.00 42.46 39.44 1xrt s ILE 136 CO -0.03 0.05 1.11 0.00 -1.91 0.00 0.00 174.94 174.15 1xrt s ALA 137 N -0.29 1.34 -1.02 1.50 0.00 -0.28 -4.60 121.76 118.41 1xrt s ALA 137 Ca 0.59 -0.36 -0.20 0.00 0.00 0.00 0.00 51.96 51.99 1xrt s ALA 137 Cb -0.45 -3.10 0.10 0.00 0.00 0.00 0.00 23.12 19.67 1xrt s ALA 137 CO 0.50 -2.55 1.32 0.34 0.00 0.00 0.00 175.76 175.37 1xrt s ASP 138 N -3.64 6.65 0.23 0.00 -1.08 -1.26 -4.82 116.67 112.75 1xrt s ASP 138 Ca 0.64 -1.96 -0.03 0.00 -0.52 0.00 0.00 52.55 50.68 1xrt s ASP 138 Cb -0.17 -2.47 0.25 0.00 -1.46 0.00 0.00 42.92 39.06 1xrt s ASP 138 CO 0.56 -1.20 1.68 -0.26 0.52 0.00 0.00 175.17 176.47 1xrt h PHE 139 N 8.90 0.85 0.17 -5.34 -1.00 -1.92 -2.25 116.94 116.35 1xrt h PHE 139 Ca 0.21 -0.16 0.01 0.00 2.81 0.00 0.00 57.97 60.84 1xrt h PHE 139 Cb 0.99 -0.21 -0.02 0.00 3.61 0.00 0.00 35.95 40.31 1xrt h PHE 139 CO 1.22 0.86 -0.24 -0.92 -1.61 0.00 0.00 178.31 177.62 1xrt h TYR 140 N 0.69 -0.63 -0.80 -0.55 5.03 -1.97 0.65 116.97 119.38 1xrt h TYR 140 Ca 0.11 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.41 1xrt h TYR 140 Cb 0.63 0.26 -0.04 0.00 1.55 0.00 0.00 36.73 39.12 1xrt h TYR 140 CO 0.03 -0.34 0.41 0.77 -1.32 0.00 0.00 178.16 177.71 1xrt h SER 141 N -0.47 1.02 -0.31 -2.11 0.02 -1.95 -1.52 113.55 108.24 1xrt h SER 141 Ca 0.01 -0.12 -0.09 0.00 -0.84 0.00 0.00 61.79 60.75 1xrt h SER 141 Cb 0.47 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 1xrt h SER 141 CO -0.10 0.85 -0.17 -0.07 -1.14 0.00 0.00 176.83 176.20 1xrt h LEU 142 N 1.12 0.68 -0.04 5.07 3.38 -1.25 -1.35 115.31 122.92 1xrt h LEU 142 Ca 0.28 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1xrt h LEU 142 Cb 0.07 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1xrt h LEU 142 CO -0.04 0.95 0.02 0.50 0.09 0.00 0.00 178.44 179.97 1xrt h LYS 143 N 0.41 0.05 -0.88 1.13 3.64 -0.80 -0.58 116.57 119.53 1xrt h LYS 143 Ca 0.07 -0.00 0.17 0.00 -1.27 0.00 0.00 60.65 59.62 1xrt h LYS 143 Cb 0.71 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.45 1xrt h LYS 143 CO 0.05 0.06 0.58 0.93 -2.27 0.00 0.00 179.45 178.80 1xrt h GLU 144 N 0.03 0.51 0.00 1.90 4.39 -1.12 -1.01 114.58 119.27 1xrt h GLU 144 Ca 0.01 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1xrt h GLU 144 Cb 0.02 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 1xrt h GLU 144 CO -0.00 0.34 -0.07 0.00 -1.16 0.00 0.00 179.01 178.12 1xrt n ALA 145 N -2.48 2.38 0.00 3.43 0.00 -0.52 -4.89 120.51 118.42 1xrt n ALA 145 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1xrt n ALA 145 Cb 0.59 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1xrt n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xrt n GLY 146 N 1.35 0.35 3.76 0.00 0.00 -0.38 -4.86 105.19 105.41 1xrt n GLY 146 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 0.93 0.00 -3.89 0.00 0.24 -0.60 -4.40 118.33 110.61 1xrt n VAL 148 Ca -0.00 -0.24 -0.07 0.00 -2.04 0.00 0.00 64.34 61.98 1xrt n VAL 148 Cb 0.43 0.71 -0.03 0.00 -1.47 0.00 0.00 33.84 33.48 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 -2.45 -0.99 -0.02 2.33 0.00 -1.26 -4.33 121.76 115.04 1xrt s ALA 149 Ca 0.01 -0.44 0.03 0.00 0.00 0.00 0.00 51.96 51.56 1xrt s ALA 149 Cb 0.09 0.90 -0.00 0.00 0.00 0.00 0.00 23.12 24.11 1xrt s ALA 149 CO 0.52 -1.00 -0.10 -0.06 0.00 0.00 0.00 175.76 175.13 1xrt s PHE 150 N -3.92 0.97 -0.12 0.00 0.08 -0.90 -1.49 117.98 112.59 1xrt s PHE 150 Ca 0.14 -0.22 -0.29 0.00 0.12 0.00 0.00 56.93 56.67 1xrt s PHE 150 Cb -0.05 -0.66 0.08 0.00 -0.57 0.00 0.00 43.02 41.82 1xrt s PHE 150 CO 0.08 -0.07 0.75 -0.08 -0.10 0.00 0.00 175.22 175.80 1xrt s THR 151 N 0.01 0.00 -2.35 0.64 -1.32 -0.51 -0.53 115.64 111.58 1xrt s THR 151 Ca -0.00 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.70 1xrt s THR 151 Cb -0.07 -1.00 0.45 0.00 -1.51 0.00 0.00 72.50 70.37 1xrt s THR 151 CO 0.00 0.00 1.44 0.47 -2.21 0.00 0.00 174.62 174.33 1xrt n ASP 152 N 1.35 2.91 -1.27 8.08 8.00 -1.26 -2.69 116.55 131.67 1xrt n ASP 152 Ca -0.16 -1.92 -0.16 0.00 0.71 0.00 0.00 54.79 53.26 1xrt n ASP 152 Cb 0.57 -0.23 -0.02 0.00 -0.02 0.00 0.00 41.12 41.42 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 1.13 -0.13 0.00 -2.24 -0.08 -1.26 -0.68 116.55 113.29 1xrt n ASP 153 Ca 0.18 0.33 0.00 0.00 -1.51 0.00 0.00 54.79 53.79 1xrt n ASP 153 Cb 0.51 -0.27 0.00 0.00 2.34 0.00 0.00 41.12 43.71 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 0.48 2.34 2.62 0.27 0.00 -1.22 -3.93 105.19 105.76 1xrt n GLY 154 Ca 0.05 -0.73 -0.25 0.00 0.00 0.00 0.00 46.02 45.10 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 2.62 0.47 1.61 1.04 0.15 -2.13 113.70 117.45 1xrt s SER 155 Ca 0.00 -0.87 -0.20 0.00 0.48 0.00 0.00 55.95 55.36 1xrt s SER 155 Cb 0.00 -0.08 -0.13 0.00 0.10 0.00 0.00 66.02 65.91 1xrt s SER 155 CO 0.00 -0.39 0.23 -2.65 0.98 0.00 0.00 173.24 171.41 1xrt n PRO 156 N 5.28 0.24 -2.27 4.02 -0.02 -1.25 -4.59 135.00 136.41 1xrt n PRO 156 Ca -0.06 0.09 -0.42 0.00 -2.02 0.00 0.00 63.50 61.09 1xrt n PRO 156 Cb 0.46 -1.27 -0.03 0.00 -0.02 0.00 0.00 33.50 32.64 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 -1.72 3.81 -0.15 -1.45 1.01 -1.26 -4.90 120.40 115.74 1xrt s VAL 157 Ca 0.62 1.18 0.17 0.00 0.00 0.00 0.00 61.98 63.95 1xrt s VAL 157 Cb -0.55 -3.76 -0.25 0.00 0.00 0.00 0.00 36.38 31.82 1xrt s VAL 157 CO 0.61 -0.00 0.26 0.23 0.00 0.00 0.00 175.10 176.19 1xrt n MET 158 N 5.35 0.67 -2.79 2.72 2.81 -1.26 -4.83 117.12 119.79 1xrt n MET 158 Ca 0.13 0.05 -0.43 0.00 -1.81 0.00 0.00 57.70 55.64 1xrt n MET 158 Cb 0.44 -1.59 -0.04 0.00 -0.71 0.00 0.00 33.22 31.32 1xrt n MET 158 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1xrt s ASP 159 N -5.55 6.40 0.38 7.83 -1.08 -1.26 -4.91 116.67 118.47 1xrt s ASP 159 Ca -0.08 -0.16 0.14 0.00 -0.52 0.00 0.00 52.55 51.93 1xrt s ASP 159 Cb 0.07 -2.46 0.98 0.00 -1.46 0.00 0.00 42.92 40.06 1xrt s ASP 159 CO 0.83 -1.22 1.80 -1.28 0.52 0.00 0.00 175.17 175.83 1xrt h SER 160 N 9.29 0.54 0.13 -0.34 0.87 -1.99 -0.84 113.55 121.20 1xrt h SER 160 Ca -0.25 0.07 -0.16 0.00 -1.23 0.00 0.00 61.79 60.22 1xrt h SER 160 Cb 1.07 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 63.00 1xrt h SER 160 CO 1.09 0.18 -0.59 0.77 -0.53 0.00 0.00 176.83 177.75 1xrt h SER 161 N 0.52 0.53 -0.03 6.23 4.64 -1.99 -1.41 113.55 122.03 1xrt h SER 161 Ca 0.54 -0.29 -0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1xrt h SER 161 Cb 1.19 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1xrt h SER 161 CO -0.28 1.00 0.01 0.58 -0.87 0.00 0.00 176.83 177.27 1xrt h VAL 162 N 0.35 1.12 -0.68 0.95 2.07 -1.68 -1.96 116.25 116.42 1xrt h VAL 162 Ca -0.00 -0.36 0.11 0.00 0.82 0.00 0.00 66.70 67.26 1xrt h VAL 162 Cb 1.12 1.31 -0.08 0.00 -1.52 0.00 0.00 31.29 32.13 1xrt h VAL 162 CO 0.10 0.10 0.29 -0.03 0.02 0.00 0.00 177.57 178.05 1xrt h MET 163 N -0.10 0.46 -0.27 1.57 -1.53 -1.12 -0.12 114.93 113.84 1xrt h MET 163 Ca 0.01 -0.03 -0.01 0.00 -3.44 0.00 0.00 59.70 56.24 1xrt h MET 163 Cb 0.15 -0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 31.08 1xrt h MET 163 CO -0.00 0.31 0.14 -0.09 0.14 0.00 0.00 176.91 177.41 1xrt h ARG 164 N 0.48 0.38 -0.63 0.39 2.43 -1.15 -0.28 114.38 115.99 1xrt h ARG 164 Ca 0.35 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.51 1xrt h ARG 164 Cb 0.45 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 1xrt h ARG 164 CO -0.32 0.35 0.37 -0.22 -1.51 0.00 0.00 179.97 178.63 1xrt h LYS 165 N 0.31 0.70 -0.13 0.20 1.63 -0.98 0.92 116.57 119.22 1xrt h LYS 165 Ca 0.09 -0.04 0.02 0.00 -0.85 0.00 0.00 60.65 59.87 1xrt h LYS 165 Cb 0.08 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.53 1xrt h LYS 165 CO -0.01 0.47 -0.01 0.00 -3.45 0.00 0.00 179.45 176.44 1xrt h ALA 166 N 1.29 0.10 -0.24 5.00 0.00 -0.75 -0.37 119.26 124.29 1xrt h ALA 166 Ca 0.26 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.10 1xrt h ALA 166 Cb 0.07 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1xrt h ALA 166 CO -0.12 -0.47 -0.33 -0.07 0.00 0.00 0.00 179.25 178.26 1xrt h LEU 167 N 0.03 0.53 -0.13 0.00 3.38 -0.76 0.17 115.31 118.53 1xrt h LEU 167 Ca 0.06 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.85 1xrt h LEU 167 Cb 0.08 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1xrt h LEU 167 CO -0.12 0.83 -0.04 -0.33 0.09 0.00 0.00 178.44 178.87 1xrt h GLU 168 N 0.44 -0.02 -0.60 1.13 5.08 -0.44 -0.65 114.58 119.52 1xrt h GLU 168 Ca 0.05 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 1xrt h GLU 168 Cb 0.80 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 1xrt h GLU 168 CO 0.06 -0.01 0.00 -0.07 -1.00 0.00 0.00 179.01 177.99 1xrt h LEU 169 N -0.02 1.03 -1.16 1.33 3.38 -0.74 -2.56 115.31 116.58 1xrt h LEU 169 Ca 0.07 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 1xrt h LEU 169 Cb 0.12 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1xrt h LEU 169 CO -0.15 1.09 0.45 0.00 0.09 0.00 0.00 178.44 179.92 1xrt h ALA 170 N 0.98 1.37 -0.38 1.53 0.00 -0.43 -2.06 119.26 120.27 1xrt h ALA 170 Ca 0.17 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1xrt h ALA 170 Cb 0.56 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1xrt h ALA 170 CO 0.03 0.54 -0.05 0.66 0.00 0.00 0.00 179.25 180.43 1xrt h SER 171 N 1.05 0.60 0.09 0.00 4.64 -0.72 -0.28 113.55 118.92 1xrt h SER 171 Ca 0.27 -0.14 -0.12 0.00 -0.47 0.00 0.00 61.79 61.33 1xrt h SER 171 Cb -0.04 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.88 1xrt h SER 171 CO -0.05 0.71 -0.42 1.56 -0.87 0.00 0.00 176.83 177.76 1xrt h GLN 172 N 0.58 0.42 0.00 4.77 4.20 -1.14 -3.22 115.11 120.72 1xrt h GLN 172 Ca 0.11 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1xrt h GLN 172 Cb 0.45 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1xrt h GLN 172 CO 0.02 0.76 -0.83 1.28 -0.67 0.00 0.00 178.83 179.40 1xrt n LEU 173 N -4.02 0.63 -1.54 1.46 4.77 -0.87 -4.99 117.00 112.45 1xrt n LEU 173 Ca -0.02 -0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.86 1xrt n LEU 173 Cb 0.51 -0.14 0.02 0.00 -2.33 0.00 0.00 43.42 41.47 1xrt n LEU 173 CO 0.44 0.06 -0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1xrt n GLY 174 N 1.40 0.12 3.27 -0.72 0.00 -0.15 -5.05 105.19 104.05 1xrt n GLY 174 Ca 0.03 -0.36 -0.19 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.83 1.46 0.38 1.61 -7.23 -1.02 -4.92 120.40 107.84 1xrt s VAL 175 Ca 0.14 -1.81 -0.15 0.00 -1.81 0.00 0.00 61.98 58.36 1xrt s VAL 175 Cb -0.06 -1.65 -0.08 0.00 0.56 0.00 0.00 36.38 35.15 1xrt s VAL 175 CO 0.17 -0.42 0.80 -2.16 -0.31 0.00 0.00 175.10 173.19 1xrt s PRO 176 N -2.81 3.96 -0.16 4.82 0.04 -1.26 -4.48 135.00 135.11 1xrt s PRO 176 Ca 0.12 0.70 -0.17 0.00 0.04 0.00 0.00 61.00 61.69 1xrt s PRO 176 Cb -0.04 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 1xrt s PRO 176 CO 0.04 0.03 0.41 0.42 0.04 0.00 0.00 177.00 177.94 1xrt s ILE 177 N -2.19 5.21 -0.15 0.56 -1.09 -0.36 -2.13 121.20 121.05 1xrt s ILE 177 Ca 0.55 0.79 -0.07 0.00 -2.23 0.00 0.00 60.65 59.69 1xrt s ILE 177 Cb -0.10 -3.75 -0.04 0.00 -1.58 0.00 0.00 42.46 36.99 1xrt s ILE 177 CO 0.22 0.31 0.09 -0.04 -1.23 0.00 0.00 174.94 174.30 1xrt s MET 178 N 0.83 3.72 0.02 2.79 -1.94 0.31 -0.07 119.30 124.96 1xrt s MET 178 Ca 0.22 -0.26 -0.01 0.00 -1.71 0.00 0.00 55.69 53.92 1xrt s MET 178 Cb -0.14 -3.19 -0.02 0.00 2.01 0.00 0.00 34.83 33.49 1xrt s MET 178 CO 0.08 0.50 0.00 0.34 -0.01 0.00 0.00 175.02 175.93 1xrt s ASP 179 N -0.25 0.22 0.00 3.03 2.15 -0.19 -4.34 116.67 117.30 1xrt s ASP 179 Ca 0.09 -0.50 0.00 0.00 0.43 0.00 0.00 52.55 52.58 1xrt s ASP 179 Cb -0.12 0.13 0.00 0.00 -0.30 0.00 0.00 42.92 42.63 1xrt s ASP 179 CO 0.01 -0.34 0.00 1.57 -0.17 0.00 0.00 175.17 176.24 1xrt n HIS 180 N 1.42 0.00 -4.64 -5.34 -0.00 -1.26 -0.55 115.22 104.85 1xrt n HIS 180 Ca -0.23 0.00 -0.33 0.00 0.46 0.00 0.00 57.72 57.62 1xrt n HIS 180 Cb 0.56 -0.86 -0.13 0.00 -0.12 0.00 0.00 29.99 29.43 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 3.44 2.88 0.27 0.00 1.02 -1.26 -3.41 120.64 123.58 1xrt n GLU 182 Ca -0.18 -3.47 0.17 0.00 -0.02 0.00 0.00 57.16 53.66 1xrt n GLU 182 Cb 0.53 -2.29 0.91 0.00 -0.02 0.00 0.00 31.44 30.57 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 2.03 0.00 0.14 1.62 3.58 -1.90 -2.07 116.42 119.82 1xrt h ASP 183 Ca 0.56 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.99 1xrt h ASP 183 Cb 0.98 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.02 1xrt h ASP 183 CO 1.42 0.00 -0.08 0.44 -2.88 0.00 0.00 179.24 178.14 1xrt h ASP 184 N 0.00 0.00 0.14 2.28 5.19 -1.73 0.26 116.42 122.56 1xrt h ASP 184 Ca 0.03 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.43 1xrt h ASP 184 Cb 0.21 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.72 1xrt h ASP 184 CO -0.00 0.08 -0.08 0.11 -3.12 0.00 0.00 179.24 176.23 1xrt h LYS 185 N 0.00 0.00 -1.78 3.56 1.57 -1.60 -1.15 116.57 117.17 1xrt h LYS 185 Ca -0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 1xrt h LYS 185 Cb 0.17 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 32.14 1xrt h LYS 185 CO 0.01 0.08 -0.95 -0.11 -0.57 0.00 0.00 179.45 177.90 1xrt n LEU 186 N -4.03 -0.65 -0.06 2.94 0.00 -0.61 -4.67 117.00 109.91 1xrt n LEU 186 Ca -0.03 -4.31 -0.07 0.00 0.00 0.00 0.00 56.01 51.61 1xrt n LEU 186 Cb 0.16 0.65 -0.09 0.00 0.00 0.00 0.00 43.42 44.14 1xrt n LEU 186 CO 0.31 1.99 -0.91 0.00 0.00 0.00 0.00 177.39 178.79 1xrt n ALA 187 N 1.94 1.70 0.06 1.96 0.00 -0.02 -4.92 120.51 121.23 1xrt n ALA 187 Ca 0.22 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1xrt n ALA 187 Cb 0.53 0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.00 1xrt n ALA 187 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1xrt n TYR 188 N -2.53 -0.63 0.00 0.00 4.02 -0.46 -5.07 117.16 112.49 1xrt n TYR 188 Ca -0.21 0.11 0.00 0.00 -0.01 0.00 0.00 57.90 57.79 1xrt n TYR 188 Cb 0.87 0.21 0.00 0.00 -0.02 0.00 0.00 39.34 40.40 1xrt n TYR 188 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xrt n ALA 209 N -3.25 0.00 0.02 -0.72 0.00 -1.26 -5.03 120.51 110.28 1xrt n ALA 209 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1xrt n ALA 209 Cb 0.11 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.50 1xrt n ALA 209 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1xrt h GLU 210 N 0.00 0.05 -0.74 0.00 4.81 -2.00 -1.86 114.58 114.85 1xrt h GLU 210 Ca 0.00 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1xrt h GLU 210 Cb 0.00 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 1xrt h GLU 210 CO 0.00 0.04 0.23 0.93 -0.73 0.00 0.00 179.01 179.48 1xrt h GLU 211 N 0.06 1.14 -0.53 1.92 3.07 -1.98 -1.34 114.58 116.92 1xrt h GLU 211 Ca 0.02 -0.24 -0.05 0.00 -0.50 0.00 0.00 59.36 58.59 1xrt h GLU 211 Cb -0.00 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 27.72 1xrt h GLU 211 CO -0.01 0.97 0.15 0.97 -1.40 0.00 0.00 179.01 179.69 1xrt h ILE 212 N 1.09 1.24 -0.72 3.13 -0.00 -1.98 -0.46 117.51 119.81 1xrt h ILE 212 Ca 0.24 -0.83 -0.06 0.00 -0.00 0.00 0.00 64.86 64.22 1xrt h ILE 212 Cb 0.30 0.77 -0.03 0.00 -0.00 0.00 0.00 36.82 37.86 1xrt h ILE 212 CO -0.01 0.30 0.23 -0.61 -0.00 0.00 0.00 178.15 178.06 1xrt h GLN 213 N 0.73 1.10 -0.22 2.19 4.15 -0.92 -0.39 115.11 121.76 1xrt h GLN 213 Ca 0.17 -0.23 -0.05 0.00 0.77 0.00 0.00 58.65 59.31 1xrt h GLN 213 Cb 0.31 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 1xrt h GLN 213 CO -0.00 0.94 -0.06 0.82 -1.93 0.00 0.00 178.83 178.60 1xrt h ILE 214 N 1.06 1.29 -0.91 2.39 2.04 -1.05 -1.13 117.51 121.19 1xrt h ILE 214 Ca 0.23 -1.05 0.04 0.00 1.00 0.00 0.00 64.86 65.08 1xrt h ILE 214 Cb 0.29 1.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.84 1xrt h ILE 214 CO -0.01 0.32 0.59 0.00 0.00 0.00 0.00 178.15 179.05 1xrt h ALA 215 N 0.74 1.21 -0.11 1.87 0.00 -0.96 0.11 119.26 122.11 1xrt h ALA 215 Ca 0.06 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1xrt h ALA 215 Cb 0.51 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1xrt h ALA 215 CO 0.02 0.44 0.05 -0.09 0.00 0.00 0.00 179.25 179.68 1xrt h ARG 216 N 1.14 0.11 -0.70 0.00 2.43 -0.78 -0.88 114.38 115.69 1xrt h ARG 216 Ca 0.37 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.52 1xrt h ARG 216 Cb 0.02 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 1xrt h ARG 216 CO -0.12 0.07 0.39 -0.44 -1.51 0.00 0.00 179.97 178.36 1xrt h ASP 217 N 0.11 0.88 -0.61 -3.80 3.32 -0.51 -0.72 116.42 115.09 1xrt h ASP 217 Ca 0.05 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 1xrt h ASP 217 Cb 0.01 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 1xrt h ASP 217 CO -0.04 0.72 0.38 1.23 -1.72 0.00 0.00 179.24 179.81 1xrt h GLY 218 N 0.97 0.88 0.94 2.75 0.00 -0.57 -0.33 103.07 107.70 1xrt h GLY 218 Ca 0.25 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 1xrt h GLY 218 CO -0.04 0.34 0.15 -2.22 0.00 0.00 0.00 176.54 174.77 1xrt h ILE 219 N 0.83 1.20 -0.13 2.60 2.04 -0.80 -1.17 117.51 122.08 1xrt h ILE 219 Ca 0.22 -0.63 -0.13 0.00 1.00 0.00 0.00 64.86 65.32 1xrt h ILE 219 Cb -0.05 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1xrt h ILE 219 CO -0.04 0.23 -0.48 -0.07 0.00 0.00 0.00 178.15 177.78 1xrt h LEU 220 N 0.50 0.36 -0.33 1.44 3.38 -0.99 -1.22 115.31 118.45 1xrt h LEU 220 Ca 0.13 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1xrt h LEU 220 Cb 0.21 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1xrt h LEU 220 CO -0.01 0.79 0.11 0.00 0.09 0.00 0.00 178.44 179.42 1xrt h ALA 221 N 1.23 0.43 -0.55 1.53 0.00 -0.87 0.61 119.26 121.65 1xrt h ALA 221 Ca 0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1xrt h ALA 221 Cb 0.95 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1xrt h ALA 221 CO 0.08 0.06 0.27 0.37 0.00 0.00 0.00 179.25 180.03 1xrt h GLN 222 N 0.38 0.79 -0.31 0.00 4.15 -0.97 0.69 115.11 119.83 1xrt h GLN 222 Ca 0.11 -0.11 -0.12 0.00 0.77 0.00 0.00 58.65 59.29 1xrt h GLN 222 Cb 0.23 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 1xrt h GLN 222 CO -0.00 0.64 -0.30 -0.09 -1.93 0.00 0.00 178.83 177.14 1xrt h ARG 223 N 0.74 0.65 0.00 1.69 2.43 -0.90 -3.25 114.38 115.73 1xrt h ARG 223 Ca 0.19 -0.29 -0.11 0.00 -0.81 0.00 0.00 59.98 58.96 1xrt h ARG 223 Cb 0.11 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 1xrt h ARG 223 CO -0.02 0.87 -1.62 0.25 -1.51 0.00 0.00 179.97 177.94 1xrt n THR 224 N -4.08 0.75 -0.92 0.20 -2.24 0.18 -4.96 114.28 103.21 1xrt n THR 224 Ca -0.01 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 1xrt n THR 224 Cb 0.46 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 1xrt n THR 224 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xrt n GLY 225 N 1.36 0.72 3.85 3.38 0.00 0.23 -4.86 105.19 109.86 1xrt n GLY 225 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.97 1.65 -0.26 -0.02 0.00 -1.18 -4.81 107.32 100.73 1xrt s GLY 226 Ca 0.00 -0.10 -0.10 0.00 0.00 0.00 0.00 44.72 44.52 1xrt s GLY 226 CO 0.00 0.22 0.17 -1.58 0.00 0.00 0.00 173.10 171.90 1xrt s HIS 227 N -3.17 3.22 -0.09 1.90 2.46 -1.26 -4.53 115.29 113.82 1xrt s HIS 227 Ca 0.57 0.08 -0.01 0.00 0.47 0.00 0.00 55.06 56.17 1xrt s HIS 227 Cb -0.12 -2.33 -0.03 0.00 -0.13 0.00 0.00 32.58 29.97 1xrt s HIS 227 CO 0.54 -0.13 -0.04 0.54 -2.47 0.00 0.00 174.74 173.18 1xrt s VAL 228 N 1.55 3.90 -0.19 0.89 0.11 -0.69 -1.22 120.40 124.76 1xrt s VAL 228 Ca 0.07 -0.40 0.01 0.00 -2.93 0.00 0.00 61.98 58.73 1xrt s VAL 228 Cb -0.15 -2.62 0.03 0.00 -1.53 0.00 0.00 36.38 32.10 1xrt s VAL 228 CO 0.08 0.59 -0.17 -2.28 -3.33 0.00 0.00 175.10 169.99 1xrt s HIS 229 N -0.66 2.75 -0.31 1.54 2.46 0.91 -1.83 115.29 120.14 1xrt s HIS 229 Ca 0.10 -1.70 -0.24 0.00 0.47 0.00 0.00 55.06 53.70 1xrt s HIS 229 Cb -0.12 -1.86 0.00 0.00 -0.13 0.00 0.00 32.58 30.48 1xrt s HIS 229 CO 0.02 -0.80 0.81 0.42 -2.47 0.00 0.00 174.74 172.72 1xrt s ILE 230 N 1.29 4.76 -0.31 0.89 -1.09 0.22 -1.02 121.20 125.94 1xrt s ILE 230 Ca 0.02 1.19 0.21 0.00 -2.23 0.00 0.00 60.65 59.85 1xrt s ILE 230 Cb -0.14 -4.18 0.17 0.00 -1.58 0.00 0.00 42.46 36.73 1xrt s ILE 230 CO -0.11 -0.29 1.39 1.56 -1.23 0.00 0.00 174.94 176.26 1xrt h GLN 231 N 8.16 0.00 -3.06 2.79 4.20 -1.03 -3.12 115.11 123.05 1xrt h GLN 231 Ca -0.24 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.26 1xrt h GLN 231 Cb 1.09 0.00 -0.31 0.00 0.30 0.00 0.00 27.48 28.57 1xrt h GLN 231 CO 0.90 0.12 -0.52 -1.58 -0.67 0.00 0.00 178.83 177.08 1xrt s HIS 232 N -3.17 -0.30 0.05 2.96 2.46 -1.15 -4.76 115.29 111.38 1xrt s HIS 232 Ca 0.04 0.73 0.06 0.00 0.47 0.00 0.00 55.06 56.36 1xrt s HIS 232 Cb 0.07 0.00 -0.03 0.00 -0.13 0.00 0.00 32.58 32.49 1xrt s HIS 232 CO 0.72 -0.23 -0.18 0.14 -2.47 0.00 0.00 174.74 172.73 1xrt s VAL 233 N 1.37 1.41 0.00 0.89 -7.23 -1.26 -4.95 120.40 110.62 1xrt s VAL 233 Ca -0.08 -1.19 0.00 0.00 -1.81 0.00 0.00 61.98 58.90 1xrt s VAL 233 Cb -0.11 -1.26 0.00 0.00 0.56 0.00 0.00 36.38 35.57 1xrt s VAL 233 CO -0.08 0.04 0.00 -1.54 -0.31 0.00 0.00 175.10 173.21 1xrt n SER 234 N 1.69 0.00 -4.27 4.85 3.41 -1.26 -4.70 113.62 113.33 1xrt n SER 234 Ca -0.18 -0.65 -0.19 0.00 -0.26 0.00 0.00 58.87 57.59 1xrt n SER 234 Cb 0.54 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.38 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 0.00 1.46 0.24 6.66 -4.23 -1.26 -3.48 115.64 115.03 1xrt s THR 235 Ca 0.00 -1.83 -0.06 0.00 -1.18 0.00 0.00 61.69 58.63 1xrt s THR 235 Cb 0.00 -1.67 0.23 0.00 1.34 0.00 0.00 72.50 72.41 1xrt s THR 235 CO 0.00 -0.43 1.89 0.50 -0.54 0.00 0.00 174.62 176.04 1xrt h LYS 236 N 3.33 1.14 -0.50 3.99 3.64 -1.90 -2.37 116.57 123.89 1xrt h LYS 236 Ca -0.40 -0.07 -0.13 0.00 -1.27 0.00 0.00 60.65 58.78 1xrt h LYS 236 Cb 1.20 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 1xrt h LYS 236 CO 0.53 0.76 -0.18 1.25 -2.27 0.00 0.00 179.45 179.53 1xrt h LEU 237 N 1.18 1.04 -0.65 5.20 5.85 -1.99 -0.50 115.31 125.44 1xrt h LEU 237 Ca 0.37 -0.38 0.06 0.00 0.84 0.00 0.00 57.88 58.77 1xrt h LEU 237 Cb -0.00 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.68 1xrt h LEU 237 CO -0.12 1.19 0.35 0.28 -0.34 0.00 0.00 178.44 179.79 1xrt h SER 238 N 0.88 0.50 -0.58 1.25 0.02 -1.89 0.23 113.55 113.95 1xrt h SER 238 Ca 0.12 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 61.05 1xrt h SER 238 Cb 0.77 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.22 1xrt h SER 238 CO 0.06 0.32 0.14 -0.07 -1.14 0.00 0.00 176.83 176.14 1xrt h LEU 239 N 0.64 0.89 -0.67 5.07 3.38 -1.06 -1.29 115.31 122.27 1xrt h LEU 239 Ca 0.30 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1xrt h LEU 239 Cb 0.22 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1xrt h LEU 239 CO -0.20 0.90 0.13 -0.33 0.09 0.00 0.00 178.44 179.04 1xrt h GLU 240 N 0.85 1.09 -0.45 1.13 5.08 -0.46 -1.72 114.58 120.10 1xrt h GLU 240 Ca 0.18 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1xrt h GLU 240 Cb 0.36 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1xrt h GLU 240 CO 0.00 0.99 0.24 0.82 -1.00 0.00 0.00 179.01 180.06 1xrt h ILE 241 N 1.02 1.17 -0.56 3.13 2.04 -0.82 -1.25 117.51 122.23 1xrt h ILE 241 Ca 0.21 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1xrt h ILE 241 Cb 0.41 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 1xrt h ILE 241 CO 0.01 0.18 0.36 0.40 0.00 0.00 0.00 178.15 179.10 1xrt h ILE 242 N 0.59 1.15 -0.62 -0.67 2.04 -0.90 -2.02 117.51 117.07 1xrt h ILE 242 Ca 0.16 -0.30 -0.05 0.00 1.00 0.00 0.00 64.86 65.67 1xrt h ILE 242 Cb 0.07 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 1xrt h ILE 242 CO -0.02 0.15 0.19 -0.08 0.00 0.00 0.00 178.15 178.39 1xrt h GLU 243 N 0.76 0.95 0.13 2.37 4.81 -1.16 -0.37 114.58 122.08 1xrt h GLU 243 Ca 0.21 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1xrt h GLU 243 Cb -0.07 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.17 1xrt h GLU 243 CO -0.04 0.82 -0.06 0.35 -0.73 0.00 0.00 179.01 179.34 1xrt h PHE 244 N 0.92 -0.16 -0.75 0.92 3.57 -0.97 0.06 116.94 120.51 1xrt h PHE 244 Ca 0.20 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 1xrt h PHE 244 Cb 0.27 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 1xrt h PHE 244 CO 0.02 -0.06 0.38 0.74 -2.23 0.00 0.00 178.31 177.16 1xrt h PHE 245 N -0.23 1.07 -0.50 0.41 0.04 -0.97 -2.50 116.94 114.26 1xrt h PHE 245 Ca -0.02 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1xrt h PHE 245 Cb 0.18 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 37.97 1xrt h PHE 245 CO -0.05 0.77 0.32 0.87 -0.60 0.00 0.00 178.31 179.61 1xrt h LYS 246 N 1.05 0.66 -0.03 1.51 1.57 -0.90 -1.14 116.57 119.30 1xrt h LYS 246 Ca 0.26 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 59.00 1xrt h LYS 246 Cb 0.09 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 1xrt h LYS 246 CO -0.04 0.46 0.02 0.93 -0.57 0.00 0.00 179.45 180.26 1xrt h GLU 247 N 0.67 0.00 -0.44 3.15 5.08 -0.62 -1.66 114.58 120.75 1xrt h GLU 247 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1xrt h GLU 247 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1xrt h GLU 247 CO -0.04 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.60 1xrt n LYS 248 N -4.27 2.03 -0.94 2.33 4.76 -0.97 -4.94 118.16 116.16 1xrt n LYS 248 Ca -0.02 -1.55 0.00 0.00 -2.87 0.00 0.00 58.31 53.87 1xrt n LYS 248 Cb 0.12 -1.35 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 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 1.16 0.51 3.75 0.72 0.00 -0.63 -5.03 105.19 105.67 1xrt n GLY 249 Ca 0.14 -0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.00 3.89 -1.28 1.61 1.01 -0.46 -4.93 120.40 118.23 1xrt s VAL 250 Ca 0.00 1.89 -0.15 0.00 0.00 0.00 0.00 61.98 63.72 1xrt s VAL 250 Cb 0.00 -4.20 0.11 0.00 0.00 0.00 0.00 36.38 32.29 1xrt s VAL 250 CO 0.00 0.45 1.69 0.29 0.00 0.00 0.00 175.10 177.53 1xrt n LYS 251 N 1.44 3.26 -4.95 2.72 5.02 -1.26 -4.34 118.16 120.06 1xrt n LYS 251 Ca -0.02 -3.44 -0.27 0.00 -2.02 0.00 0.00 58.31 52.57 1xrt n LYS 251 Cb 0.46 -3.27 -0.16 0.00 -0.02 0.00 0.00 35.03 32.04 1xrt n LYS 251 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1xrt s ILE 252 N 2.88 1.58 0.24 -0.18 2.07 -1.26 -1.70 121.20 124.84 1xrt s ILE 252 Ca 0.48 -0.81 0.02 0.00 -1.41 0.00 0.00 60.65 58.93 1xrt s ILE 252 Cb 0.03 -1.34 -0.05 0.00 0.13 0.00 0.00 42.46 41.23 1xrt s ILE 252 CO 0.03 0.45 0.06 0.42 -1.91 0.00 0.00 174.94 173.99 1xrt s THR 253 N -0.11 0.73 0.27 4.00 -4.23 -0.76 -4.82 115.64 110.72 1xrt s THR 253 Ca -0.01 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.38 1xrt s THR 253 Cb -0.11 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.22 1xrt s THR 253 CO 0.02 -0.15 0.50 0.00 -0.54 0.00 0.00 174.62 174.45 1xrt s GLU 255 N -3.74 0.88 0.02 0.00 -1.05 -1.18 -1.82 118.70 111.80 1xrt s GLU 255 Ca 0.23 -1.41 -0.04 0.00 -0.15 0.00 0.00 54.97 53.61 1xrt s GLU 255 Cb -0.01 0.18 -0.01 0.00 -0.44 0.00 0.00 34.13 33.86 1xrt s GLU 255 CO 0.11 -0.22 0.06 0.54 0.95 0.00 0.00 175.26 176.70 1xrt s VAL 256 N -3.98 0.10 -0.36 1.83 0.11 -0.76 -4.53 120.40 112.80 1xrt s VAL 256 Ca 0.21 -0.86 -0.25 0.00 -2.93 0.00 0.00 61.98 58.15 1xrt s VAL 256 Cb 0.07 -0.44 0.01 0.00 -1.53 0.00 0.00 36.38 34.49 1xrt s VAL 256 CO -0.00 -0.47 0.89 0.21 -3.33 0.00 0.00 175.10 172.39 1xrt s ASN 257 N -1.54 6.65 0.47 3.54 2.47 -1.18 -1.85 114.94 123.49 1xrt s ASN 257 Ca -0.14 0.53 0.21 0.00 0.42 0.00 0.00 52.86 53.88 1xrt s ASN 257 Cb -0.07 -2.45 1.17 0.00 -1.45 0.00 0.00 41.25 38.45 1xrt s ASN 257 CO -0.00 -0.82 1.99 1.55 -3.72 0.00 0.00 177.10 176.10 1xrt h PRO 258 N 8.46 0.00 -0.66 0.43 0.13 -1.89 -1.94 132.00 136.53 1xrt h PRO 258 Ca -0.24 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.97 1xrt h PRO 258 Cb 1.08 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.17 1xrt h PRO 258 CO 0.96 0.19 0.44 -0.91 -0.23 0.00 0.00 178.00 178.45 1xrt h ASN 259 N 0.00 0.56 1.21 1.44 2.35 -1.88 -2.75 115.58 116.51 1xrt h ASN 259 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1xrt h ASN 259 Cb 0.41 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1xrt h ASN 259 CO 0.02 0.36 0.00 1.41 -1.65 0.00 0.00 177.43 177.57 1xrt n HIS 260 N -4.48 0.73 0.96 1.19 8.25 -0.73 -3.51 115.22 117.63 1xrt n HIS 260 Ca 0.10 0.23 0.12 0.00 -0.26 0.00 0.00 57.72 57.91 1xrt n HIS 260 Cb 0.26 -0.87 0.30 0.00 1.12 0.00 0.00 29.99 30.80 1xrt n HIS 260 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1xrt n LEU 261 N -2.11 2.40 0.00 2.41 4.77 -1.04 -5.01 117.00 118.42 1xrt n LEU 261 Ca 0.05 -0.95 0.00 0.00 -0.03 0.00 0.00 56.01 55.08 1xrt n LEU 261 Cb 0.36 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1xrt n LEU 261 CO 0.27 0.48 0.00 0.18 -1.33 0.00 0.00 177.39 176.99 1xrt n LEU 262 N 0.82 0.00 -4.89 2.23 7.99 -1.23 -5.08 117.00 116.84 1xrt n LEU 262 Ca 0.17 0.00 -0.30 0.00 -0.01 0.00 0.00 56.01 55.88 1xrt n LEU 262 Cb 0.46 -0.01 0.18 0.00 -0.11 0.00 0.00 43.42 43.93 1xrt n LEU 262 CO 0.15 0.00 0.84 -1.61 -1.51 0.00 0.00 177.39 175.25 1xrt s GLU 285 N -0.61 0.68 -0.85 3.23 2.02 -1.26 -4.84 118.70 117.07 1xrt s GLU 285 Ca 0.00 -0.28 -0.04 0.00 0.02 0.00 0.00 54.97 54.67 1xrt s GLU 285 Cb 0.00 -1.84 0.00 0.00 0.10 0.00 0.00 34.13 32.39 1xrt s GLU 285 CO 0.00 -2.41 0.65 -3.47 0.02 0.00 0.00 175.26 170.06 1xrt n ASP 286 N -3.79 -5.71 -0.30 -0.19 -0.08 -1.23 -4.36 116.55 100.88 1xrt n ASP 286 Ca 0.14 -0.73 0.09 0.00 -1.51 0.00 0.00 54.79 52.77 1xrt n ASP 286 Cb 0.60 -2.89 0.21 0.00 2.34 0.00 0.00 41.12 41.37 1xrt n ASP 286 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 1xrt h ARG 287 N -0.35 0.05 -0.48 -0.67 2.43 -1.95 -2.49 114.38 110.92 1xrt h ARG 287 Ca -0.46 -0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 58.57 1xrt h ARG 287 Cb 1.28 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.81 1xrt h ARG 287 CO 0.37 0.03 -0.21 -0.07 -1.51 0.00 0.00 179.97 178.58 1xrt h LEU 288 N 0.05 1.02 -0.66 3.80 3.38 -1.98 -0.28 115.31 120.65 1xrt h LEU 288 Ca 0.50 -0.39 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1xrt h LEU 288 Cb 0.92 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 1xrt h LEU 288 CO -0.81 1.19 0.18 0.00 0.09 0.00 0.00 178.44 179.08 1xrt h ALA 289 N 0.87 0.87 -0.85 1.53 0.00 -1.83 -1.37 119.26 118.48 1xrt h ALA 289 Ca 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1xrt h ALA 289 Cb 0.79 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1xrt h ALA 289 CO 0.07 0.57 0.49 -0.07 0.00 0.00 0.00 179.25 180.31 1xrt h LEU 290 N 0.98 1.05 -0.48 0.00 3.38 -1.05 0.79 115.31 119.97 1xrt h LEU 290 Ca 0.21 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 1xrt h LEU 290 Cb 0.34 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1xrt h LEU 290 CO -0.00 0.83 -0.03 0.40 0.09 0.00 0.00 178.44 179.72 1xrt h ILE 291 N 1.18 1.27 -0.65 1.22 2.04 -0.83 -0.81 117.51 120.92 1xrt h ILE 291 Ca 0.30 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1xrt h ILE 291 Cb -0.01 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 1xrt h ILE 291 CO -0.05 0.39 0.42 -0.08 0.00 0.00 0.00 178.15 178.82 1xrt h GLU 292 N 0.73 0.86 -0.65 2.37 4.57 -1.03 -0.43 114.58 121.01 1xrt h GLU 292 Ca 0.13 -0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 58.17 1xrt h GLU 292 Cb 0.56 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.93 1xrt h GLU 292 CO 0.03 0.58 0.09 0.78 -1.18 0.00 0.00 179.01 179.32 1xrt h GLY 293 N 0.90 1.16 0.96 1.92 0.00 -0.09 -0.71 103.07 107.20 1xrt h GLY 293 Ca 0.24 -0.78 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 1xrt h GLY 293 CO -0.05 0.72 0.02 -2.08 0.00 0.00 0.00 176.54 175.16 1xrt h VAL 294 N 1.01 1.05 -0.79 4.60 2.07 -0.96 -0.66 116.25 122.56 1xrt h VAL 294 Ca 0.20 -0.13 0.06 0.00 0.82 0.00 0.00 66.70 67.64 1xrt h VAL 294 Cb 0.45 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 1xrt h VAL 294 CO 0.01 0.04 0.48 0.50 0.02 0.00 0.00 177.57 178.63 1xrt h LYS 295 N 0.01 0.86 -0.01 1.57 3.64 -0.77 -2.31 116.57 119.56 1xrt h LYS 295 Ca 0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1xrt h LYS 295 Cb 0.04 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1xrt h LYS 295 CO -0.00 0.57 -0.06 0.54 -2.27 0.00 0.00 179.45 178.22 1xrt n ARG 296 N -4.67 1.20 -0.81 1.90 1.74 -0.30 -4.94 116.66 110.79 1xrt n ARG 296 Ca 0.11 -0.55 0.00 0.00 -0.77 0.00 0.00 57.85 56.64 1xrt n ARG 296 Cb 0.16 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 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 1.19 0.61 0.22 -0.13 0.00 -0.87 -4.93 105.19 101.29 1xrt n GLY 297 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 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 1.29 -3.19 -0.61 2.04 -1.39 -3.41 117.51 112.25 1xrt h ILE 298 Ca 0.00 -1.46 -0.59 0.00 1.00 0.00 0.00 64.86 63.81 1xrt h ILE 298 Cb 0.00 1.52 -0.07 0.00 -0.74 0.00 0.00 36.82 37.53 1xrt h ILE 298 CO 0.00 0.47 0.62 -0.63 0.00 0.00 0.00 178.15 178.61 1xrt s ILE 299 N -4.39 4.77 0.13 -0.67 1.01 -0.99 -4.64 121.20 116.42 1xrt s ILE 299 Ca -0.12 1.78 -0.05 0.00 0.00 0.00 0.00 60.65 62.25 1xrt s ILE 299 Cb 0.09 -4.20 -0.17 0.00 0.01 0.00 0.00 42.46 38.19 1xrt s ILE 299 CO 0.84 -0.12 1.32 0.44 0.00 0.00 0.00 174.94 177.42 1xrt h ASP 300 N 7.57 0.59 -5.11 3.58 5.19 -1.60 -3.45 116.42 123.19 1xrt h ASP 300 Ca -0.21 -0.45 -0.06 0.00 -0.62 0.00 0.00 57.03 55.69 1xrt h ASP 300 Cb 1.08 -0.18 -0.12 0.00 0.18 0.00 0.00 39.33 40.29 1xrt h ASP 300 CO 0.92 1.24 -0.12 0.00 -3.12 0.00 0.00 179.24 178.16 1xrt s PHE 302 N -3.85 3.62 -0.08 0.00 0.08 -0.60 -1.84 117.98 115.32 1xrt s PHE 302 Ca 0.06 1.08 -0.05 0.00 0.12 0.00 0.00 56.93 58.14 1xrt s PHE 302 Cb 0.02 -2.57 0.03 0.00 -0.57 0.00 0.00 43.02 39.92 1xrt s PHE 302 CO -0.08 0.30 0.18 0.00 -0.10 0.00 0.00 175.22 175.52 1xrt s ALA 303 N 0.08 -0.42 0.27 5.36 0.00 -0.77 -4.71 121.76 121.57 1xrt s ALA 303 Ca 0.29 0.67 0.09 0.00 0.00 0.00 0.00 51.96 53.01 1xrt s ALA 303 Cb -0.17 -0.42 0.35 0.00 0.00 0.00 0.00 23.12 22.89 1xrt s ALA 303 CO 0.15 -0.13 1.61 1.79 0.00 0.00 0.00 175.76 179.18 1xrt h THR 304 N 5.42 1.42 -6.51 0.00 1.35 -1.83 -3.13 112.91 109.63 1xrt h THR 304 Ca -0.34 -2.03 -0.51 0.00 -0.55 0.00 0.00 66.41 62.99 1xrt h THR 304 Cb 1.17 2.07 -0.10 0.00 -1.73 0.00 0.00 68.15 69.56 1xrt h THR 304 CO 0.40 0.58 -0.82 -0.67 -0.25 0.00 0.00 175.52 174.76 1xrt n ASP 305 N -3.84 -3.01 -4.54 5.36 2.03 -0.16 -4.74 116.55 107.64 1xrt n ASP 305 Ca -0.02 -0.92 -0.53 0.00 0.52 0.00 0.00 54.79 53.84 1xrt n ASP 305 Cb 0.60 -3.27 -0.07 0.00 -0.72 0.00 0.00 41.12 37.66 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 -4.48 1.81 -3.50 -0.67 -0.00 -1.15 -4.51 115.22 102.72 1xrt n HIS 306 Ca -0.04 0.35 -0.27 0.00 -0.00 0.00 0.00 57.72 57.76 1xrt n HIS 306 Cb 0.56 -2.51 -0.11 0.00 -0.00 0.00 0.00 29.99 27.93 1xrt n HIS 306 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1xrt s ALA 307 N 5.69 1.87 0.26 1.57 0.00 -0.50 -1.31 121.76 129.34 1xrt s ALA 307 Ca 1.05 -2.70 -0.30 0.00 0.00 0.00 0.00 51.96 50.00 1xrt s ALA 307 Cb -0.94 -1.71 -0.11 0.00 0.00 0.00 0.00 23.12 20.36 1xrt s ALA 307 CO 0.56 -2.00 1.54 -2.14 0.00 0.00 0.00 175.76 173.71 1xrt s PRO 308 N -0.19 4.19 0.00 0.00 0.02 -1.26 -3.90 135.00 133.86 1xrt s PRO 308 Ca 0.30 2.45 -0.11 0.00 0.02 0.00 0.00 61.00 63.66 1xrt s PRO 308 Cb 0.01 -3.07 0.01 0.00 0.02 0.00 0.00 34.50 31.46 1xrt s PRO 308 CO -0.18 -0.55 0.22 -1.01 -0.33 0.00 0.00 177.00 175.15 1xrt s HIS 309 N 0.19 -0.06 0.00 6.54 3.76 -1.26 -4.98 115.29 119.48 1xrt s HIS 309 Ca 0.63 0.02 0.00 0.00 -0.15 0.00 0.00 55.06 55.56 1xrt s HIS 309 Cb -0.45 0.02 0.00 0.00 1.11 0.00 0.00 32.58 33.26 1xrt s HIS 309 CO 0.43 -0.36 0.87 1.04 -0.85 0.00 0.00 174.74 175.87 1xrt n GLN 310 N 1.25 2.20 -0.07 1.40 6.02 -1.26 -4.35 117.38 122.57 1xrt n GLN 310 Ca -0.22 -1.24 -0.11 0.00 -0.01 0.00 0.00 57.00 55.43 1xrt n GLN 310 Cb 0.56 -0.88 -0.06 0.00 1.02 0.00 0.00 30.24 30.88 1xrt n GLN 310 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1xrt n THR 311 N -0.37 0.76 -0.85 5.09 -2.24 -1.26 -5.10 114.28 110.31 1xrt n THR 311 Ca 0.00 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1xrt n THR 311 Cb 0.30 -1.13 0.00 0.00 -2.10 0.00 0.00 70.33 67.40 1xrt n THR 311 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xrt n GLY 323 N 2.70 0.00 3.22 3.38 0.00 -1.26 -5.10 105.19 108.12 1xrt n GLY 323 Ca -0.24 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.61 1xrt n GLY 323 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1xrt s ILE 324 N -2.99 1.21 0.61 -0.61 -4.36 -1.25 -4.84 121.20 108.97 1xrt s ILE 324 Ca 0.00 -1.65 -0.17 0.00 -0.26 0.00 0.00 60.65 58.57 1xrt s ILE 324 Cb 0.00 -1.43 -0.02 0.00 1.25 0.00 0.00 42.46 42.25 1xrt s ILE 324 CO 0.00 -0.43 1.14 0.27 0.24 0.00 0.00 174.94 176.16 1xrt s ILE 325 N -2.11 3.04 0.00 8.37 -4.36 -0.66 -1.41 121.20 124.07 1xrt s ILE 325 Ca 0.07 0.57 0.00 0.00 -0.26 0.00 0.00 60.65 61.02 1xrt s ILE 325 Cb -0.05 -3.15 0.00 0.00 1.25 0.00 0.00 42.46 40.51 1xrt s ILE 325 CO 0.02 -0.21 0.00 0.61 0.24 0.00 0.00 174.94 175.60 1xrt n GLY 326 N -0.02 0.92 0.35 6.27 0.00 -1.26 -4.76 105.19 106.68 1xrt n GLY 326 Ca 0.12 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.16 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 0.93 -0.21 0.99 3.38 -1.92 -1.06 115.31 117.42 1xrt h LEU 327 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1xrt h LEU 327 Cb 0.01 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1xrt h LEU 327 CO 0.00 0.57 0.00 -0.61 0.09 0.00 0.00 178.44 178.49 1xrt h GLN 328 N 1.05 0.00 -0.05 1.13 4.15 -1.92 -3.24 115.11 116.23 1xrt h GLN 328 Ca 0.42 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.84 1xrt h GLN 328 Cb 0.24 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.93 1xrt h GLN 328 CO -0.19 0.00 0.00 0.25 -1.93 0.00 0.00 178.83 176.96 1xrt n THR 329 N -2.60 0.25 -0.29 2.39 -2.24 -0.88 -4.64 114.28 106.27 1xrt n THR 329 Ca 0.04 -0.63 -0.04 0.00 -2.27 0.00 0.00 64.05 61.15 1xrt n THR 329 Cb 0.43 0.96 0.07 0.00 -2.10 0.00 0.00 70.33 69.69 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 1.07 1.01 0.48 6.98 0.00 -1.24 -2.56 119.26 125.01 1xrt h ALA 330 Ca 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1xrt h ALA 330 Cb 0.33 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1xrt h ALA 330 CO 0.00 0.46 -0.23 1.25 0.00 0.00 0.00 179.25 180.73 1xrt h LEU 331 N 1.08 -0.55 -1.72 0.00 5.85 -1.84 -0.28 115.31 117.86 1xrt h LEU 331 Ca 0.29 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.98 1xrt h LEU 331 Cb -0.06 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1xrt h LEU 331 CO -0.06 -0.29 0.22 1.55 -0.34 0.00 0.00 178.44 179.53 1xrt h PRO 332 N -0.79 0.37 -0.11 5.25 0.13 -1.70 -0.59 132.00 134.57 1xrt h PRO 332 Ca -0.07 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1xrt h PRO 332 Cb 0.56 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.60 1xrt h PRO 332 CO 0.11 0.25 0.07 0.77 -0.23 0.00 0.00 178.00 178.96 1xrt h SER 333 N 0.38 0.13 -0.71 1.44 0.02 -1.27 -2.64 113.55 110.89 1xrt h SER 333 Ca 0.13 -0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.00 1xrt h SER 333 Cb 0.05 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1xrt h SER 333 CO -0.03 0.12 0.26 0.00 -1.14 0.00 0.00 176.83 176.04 1xrt h ALA 334 N 1.01 1.09 0.00 3.77 0.00 -0.51 -2.57 119.26 122.05 1xrt h ALA 334 Ca 0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1xrt h ALA 334 Cb 0.02 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1xrt h ALA 334 CO -0.01 0.63 -0.12 -0.07 0.00 0.00 0.00 179.25 179.69 1xrt h LEU 335 N 1.06 0.00 -1.24 0.00 3.38 -0.96 -0.34 115.31 117.21 1xrt h LEU 335 Ca 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1xrt h LEU 335 Cb 0.25 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1xrt h LEU 335 CO -0.01 0.12 0.38 -0.08 0.09 0.00 0.00 178.44 178.93 1xrt h GLU 336 N 0.00 0.90 -0.33 1.13 4.57 -1.09 0.11 114.58 119.87 1xrt h GLU 336 Ca -0.00 -0.08 -0.10 0.00 -1.18 0.00 0.00 59.36 58.00 1xrt h GLU 336 Cb 0.27 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 1xrt h GLU 336 CO 0.02 0.65 -0.20 -0.07 -1.18 0.00 0.00 179.01 178.22 1xrt h LEU 337 N 0.91 0.62 -0.28 1.64 3.38 -1.15 -1.94 115.31 118.49 1xrt h LEU 337 Ca 0.24 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1xrt h LEU 337 Cb -0.01 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1xrt h LEU 337 CO -0.04 0.82 0.08 0.22 0.09 0.00 0.00 178.44 179.61 1xrt h TYR 338 N 0.55 0.45 0.00 1.13 3.20 -1.16 -1.43 116.97 119.71 1xrt h TYR 338 Ca 0.09 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 1xrt h TYR 338 Cb 0.65 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 1xrt h TYR 338 CO 0.03 0.49 -0.18 0.00 -1.64 0.00 0.00 178.16 176.86 1xrt h ARG 339 N 0.29 0.00 -0.29 1.82 3.08 -0.60 -1.34 114.38 117.33 1xrt h ARG 339 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1xrt h ARG 339 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1xrt h ARG 339 CO -0.00 0.18 0.00 1.63 -1.07 0.00 0.00 179.97 180.71 1xrt n LYS 340 N -3.90 1.75 -0.99 0.04 5.02 -0.75 -4.92 118.16 114.41 1xrt n LYS 340 Ca -0.02 -1.16 0.00 0.00 -2.02 0.00 0.00 58.31 55.11 1xrt n LYS 340 Cb 0.27 -1.29 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 1.05 0.42 0.19 0.72 0.00 -0.51 -4.90 105.19 102.16 1xrt n GLY 341 Ca 0.12 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.99 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 -4.02 -0.61 2.04 -1.47 -3.46 117.51 111.34 1xrt h ILE 342 Ca 0.00 -2.20 -0.18 0.00 1.00 0.00 0.00 64.86 63.48 1xrt h ILE 342 Cb 0.19 2.21 -0.20 0.00 -0.74 0.00 0.00 36.82 38.29 1xrt h ILE 342 CO 0.00 0.67 -0.70 0.27 0.00 0.00 0.00 178.15 178.39 1xrt s ILE 343 N -3.50 0.23 0.74 -0.67 -4.36 -1.21 -4.56 121.20 107.87 1xrt s ILE 343 Ca -0.08 -1.14 -0.11 0.00 -0.26 0.00 0.00 60.65 59.06 1xrt s ILE 343 Cb 0.09 -0.61 0.04 0.00 1.25 0.00 0.00 42.46 43.23 1xrt s ILE 343 CO 0.88 -0.58 1.08 -0.94 0.24 0.00 0.00 174.94 175.62 1xrt s SER 344 N -1.81 4.88 0.21 4.36 1.04 -1.26 -4.20 113.70 116.92 1xrt s SER 344 Ca -0.10 1.65 -0.08 0.00 0.48 0.00 0.00 55.95 57.90 1xrt s SER 344 Cb -0.06 -2.44 0.15 0.00 0.10 0.00 0.00 66.02 63.77 1xrt s SER 344 CO -0.03 -1.77 1.78 0.25 0.98 0.00 0.00 173.24 174.46 1xrt h LEU 345 N -0.94 1.06 -0.92 2.42 5.85 -2.00 -1.62 115.31 119.17 1xrt h LEU 345 Ca -0.44 -0.16 0.08 0.00 0.84 0.00 0.00 57.88 58.20 1xrt h LEU 345 Cb 1.23 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.91 1xrt h LEU 345 CO 0.55 0.93 0.57 0.50 -0.34 0.00 0.00 178.44 180.65 1xrt h LYS 346 N 1.13 0.96 -0.27 1.25 3.64 -1.99 -1.83 116.57 119.45 1xrt h LYS 346 Ca 0.26 -0.06 -0.17 0.00 -1.27 0.00 0.00 60.65 59.41 1xrt h LYS 346 Cb 0.19 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1xrt h LYS 346 CO -0.02 0.63 -0.52 -0.22 -2.27 0.00 0.00 179.45 177.05 1xrt h LYS 347 N 0.99 0.78 -0.61 1.90 1.63 -1.82 -0.50 116.57 118.95 1xrt h LYS 347 Ca 0.42 -0.48 0.09 0.00 -0.85 0.00 0.00 60.65 59.83 1xrt h LYS 347 Cb 0.28 0.05 -0.07 0.00 -0.60 0.00 0.00 32.23 31.89 1xrt h LYS 347 CO -0.21 1.11 0.24 1.25 -3.45 0.00 0.00 179.45 178.39 1xrt h LEU 348 N 0.61 0.25 -0.39 5.20 6.46 -0.96 -0.85 115.31 125.63 1xrt h LEU 348 Ca 0.02 0.07 -0.07 0.00 -0.12 0.00 0.00 57.88 57.78 1xrt h LEU 348 Cb 1.10 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 41.07 1xrt h LEU 348 CO 0.11 0.15 -0.03 0.40 -0.62 0.00 0.00 178.44 178.45 1xrt h ILE 349 N 0.43 1.27 -0.66 4.05 1.08 -0.88 -2.64 117.51 120.16 1xrt h ILE 349 Ca 0.30 -1.07 0.09 0.00 -0.39 0.00 0.00 64.86 63.79 1xrt h ILE 349 Cb 0.36 1.18 -0.07 0.00 -3.07 0.00 0.00 36.82 35.22 1xrt h ILE 349 CO -0.29 0.36 0.31 -0.33 -0.69 0.00 0.00 178.15 177.50 1xrt h GLU 350 N 0.53 0.52 0.00 2.37 5.08 -0.68 -1.63 114.58 120.78 1xrt h GLU 350 Ca 0.11 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1xrt h GLU 350 Cb 0.52 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1xrt h GLU 350 CO 0.03 0.35 0.00 0.52 -1.00 0.00 0.00 179.01 178.90 1xrt h MET 351 N 0.54 0.00 0.00 2.33 2.86 -0.81 -1.16 114.93 118.69 1xrt h MET 351 Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 1xrt h MET 351 Cb 0.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.00 1xrt h MET 351 CO -0.26 0.00 -1.16 1.19 1.06 0.00 0.00 176.91 177.74 1xrt n PHE 352 N -2.67 0.04 0.00 -0.22 3.72 -0.79 -1.56 117.46 115.98 1xrt n PHE 352 Ca 0.01 0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1xrt n PHE 352 Cb 0.28 -0.18 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 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 -1.72 0.00 0.02 4.37 -2.24 -0.68 -0.97 114.28 113.06 1xrt n THR 353 Ca 0.02 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.75 1xrt n THR 353 Cb 0.39 -0.05 0.15 0.00 -2.10 0.00 0.00 70.33 68.72 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 1.29 0.31 2.28 6.09 -1.52 -1.63 117.51 124.34 1xrt h ILE 354 Ca 0.00 -1.49 -0.02 0.00 -1.37 0.00 0.00 64.86 61.99 1xrt h ILE 354 Cb 0.00 1.53 0.00 0.00 0.47 0.00 0.00 36.82 38.82 1xrt h ILE 354 CO 0.00 0.46 -0.15 0.78 -3.07 0.00 0.00 178.15 176.18 1xrt h ASN 355 N 0.41 -0.35 -0.19 2.19 2.35 -1.53 -0.57 115.58 117.88 1xrt h ASN 355 Ca 0.04 -0.11 -0.05 0.00 -0.55 0.00 0.00 56.30 55.63 1xrt h ASN 355 Cb 0.83 0.09 -0.02 0.00 0.05 0.00 0.00 38.32 39.27 1xrt h ASN 355 CO 0.07 -0.09 -0.02 1.55 -1.65 0.00 0.00 177.43 177.28 1xrt h PRO 356 N -0.61 0.48 -0.78 0.81 0.13 -1.75 -1.96 132.00 128.32 1xrt h PRO 356 Ca -0.04 -0.10 0.09 0.00 -0.87 0.00 0.00 66.00 65.07 1xrt h PRO 356 Cb 0.44 -0.07 -0.07 0.00 0.13 0.00 0.00 31.00 31.43 1xrt h PRO 356 CO 0.07 0.53 0.44 0.00 -0.23 0.00 0.00 178.00 178.80 1xrt h ALA 357 N 1.52 1.10 -0.03 -0.56 0.00 -1.10 -1.93 119.26 118.25 1xrt h ALA 357 Ca 0.10 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 1xrt h ALA 357 Cb 0.34 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1xrt h ALA 357 CO 0.01 0.07 -0.59 0.00 0.00 0.00 0.00 179.25 178.74 1xrt h ARG 358 N 0.74 0.10 -0.33 0.00 3.08 -0.39 -0.64 114.38 116.95 1xrt h ARG 358 Ca 0.37 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.33 1xrt h ARG 358 Cb 0.33 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1xrt h ARG 358 CO -0.24 0.67 0.10 0.82 -1.07 0.00 0.00 179.97 180.25 1xrt h ILE 359 N 0.08 1.21 -0.16 2.04 2.04 -0.72 -2.72 117.51 119.28 1xrt h ILE 359 Ca -0.01 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.19 1xrt h ILE 359 Cb 1.07 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 1xrt h ILE 359 CO 0.08 0.23 0.00 2.30 0.00 0.00 0.00 178.15 180.76 1xrt n ILE 360 N -4.67 0.20 -3.08 -0.67 -5.35 -0.96 -4.64 119.36 100.19 1xrt n ILE 360 Ca -0.02 -0.38 -0.19 0.00 -0.27 0.00 0.00 62.75 61.90 1xrt n ILE 360 Cb 0.17 0.51 0.04 0.00 -1.74 0.00 0.00 39.64 38.62 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 1.19 -0.28 3.77 3.28 0.00 -0.30 -4.97 105.19 107.88 1xrt n GLY 361 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.14 4.43 -0.96 1.61 -7.23 -0.88 -5.01 120.40 109.21 1xrt s VAL 362 Ca 0.34 -0.92 -0.04 0.00 -1.81 0.00 0.00 61.98 59.54 1xrt s VAL 362 Cb -0.15 -3.18 0.14 0.00 0.56 0.00 0.00 36.38 33.75 1xrt s VAL 362 CO 0.42 0.04 2.43 -0.67 -0.31 0.00 0.00 175.10 177.01 1xrt n ASP 363 N 0.17 7.41 -1.24 4.85 -0.08 -1.26 -4.61 116.55 121.78 1xrt n ASP 363 Ca -0.09 -3.27 0.00 0.00 -1.51 0.00 0.00 54.79 49.92 1xrt n ASP 363 Cb 0.53 -1.28 0.00 0.00 2.34 0.00 0.00 41.12 42.71 1xrt n ASP 363 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1xrt n LEU 364 N 1.09 0.00 -0.86 -2.67 4.77 -1.26 -4.82 117.00 113.26 1xrt n LEU 364 Ca 0.56 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.42 1xrt n LEU 364 Cb 0.35 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.39 1xrt n LEU 364 CO 0.53 -0.04 -0.11 0.61 -1.33 0.00 0.00 177.39 177.05 1xrt n GLY 365 N 5.00 1.22 3.30 -0.72 0.00 -1.26 -4.79 105.19 107.94 1xrt n GLY 365 Ca 0.00 -0.36 -0.16 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.33 0.77 -0.20 2.61 -1.32 -1.26 -3.26 115.64 110.65 1xrt s THR 366 Ca 0.00 -2.00 0.12 0.00 -1.21 0.00 0.00 61.69 58.59 1xrt s THR 366 Cb 0.00 -2.40 0.41 0.00 -1.51 0.00 0.00 72.50 69.01 1xrt s THR 366 CO 0.00 -0.25 1.22 0.18 -2.21 0.00 0.00 174.62 173.56 1xrt n LEU 367 N -0.39 2.66 -4.77 9.08 4.77 -1.26 -4.71 117.00 122.38 1xrt n LEU 367 Ca -0.04 -3.83 -0.40 0.00 -0.03 0.00 0.00 56.01 51.71 1xrt n LEU 367 Cb 0.65 -0.52 0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1xrt n LEU 367 CO 0.36 1.36 1.07 -0.54 -1.33 0.00 0.00 177.39 178.31 1xrt s LYS 368 N -3.17 3.70 0.18 3.23 1.02 -1.26 -4.89 119.74 118.55 1xrt s LYS 368 Ca 0.38 2.41 -0.33 0.00 0.02 0.00 0.00 55.97 58.44 1xrt s LYS 368 Cb 0.36 -2.66 -0.13 0.00 -0.52 0.00 0.00 37.83 34.88 1xrt s LYS 368 CO -0.07 -0.81 1.63 1.28 -0.92 0.00 0.00 175.35 176.46 1xrt n LEU 369 N -0.18 3.40 0.00 3.17 4.77 -1.26 -1.57 117.00 125.32 1xrt n LEU 369 Ca 0.05 1.08 0.00 0.00 -0.03 0.00 0.00 56.01 57.11 1xrt n LEU 369 Cb 0.42 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.03 1xrt n LEU 369 CO 0.59 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1xrt n GLY 370 N 3.59 0.84 3.85 -0.72 0.00 0.74 -4.98 105.19 108.51 1xrt n GLY 370 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.55 6.02 0.30 1.61 0.01 -0.61 -4.74 113.70 113.74 1xrt s SER 371 Ca 0.00 1.50 -0.28 0.00 1.31 0.00 0.00 55.95 58.48 1xrt s SER 371 Cb 0.00 -2.48 -0.13 0.00 0.21 0.00 0.00 66.02 63.61 1xrt s SER 371 CO 0.00 -1.01 1.14 -2.65 0.41 0.00 0.00 173.24 171.12 1xrt n PRO 372 N -2.73 1.65 -1.99 12.44 -0.02 -1.26 -1.06 135.00 142.02 1xrt n PRO 372 Ca 0.07 0.58 -0.42 0.00 -2.02 0.00 0.00 63.50 61.71 1xrt n PRO 372 Cb 0.54 -2.05 -0.00 0.00 -0.02 0.00 0.00 33.50 31.97 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 0.43 5.76 -2.52 3.55 0.00 -0.00 -4.60 120.51 123.13 1xrt n ALA 373 Ca 0.08 -4.07 -0.42 0.00 0.00 0.00 0.00 53.44 49.03 1xrt n ALA 373 Cb 0.33 -3.20 -0.08 0.00 0.00 0.00 0.00 19.45 16.50 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 1.76 6.26 -0.01 0.00 1.11 -1.26 -1.55 116.67 122.97 1xrt s ASP 374 Ca 0.46 -0.34 -0.00 0.00 0.18 0.00 0.00 52.55 52.85 1xrt s ASP 374 Cb 0.13 -2.25 0.02 0.00 1.07 0.00 0.00 42.92 41.88 1xrt s ASP 374 CO -0.04 -0.56 0.02 -0.63 1.18 0.00 0.00 175.17 175.14 1xrt s ILE 375 N 2.35 -0.03 -0.09 0.77 1.01 -0.11 -1.12 121.20 123.98 1xrt s ILE 375 Ca 0.16 0.11 0.03 0.00 0.00 0.00 0.00 60.65 60.95 1xrt s ILE 375 Cb -0.16 -0.06 -0.02 0.00 0.01 0.00 0.00 42.46 42.24 1xrt s ILE 375 CO 0.14 0.05 -0.16 -0.89 0.00 0.00 0.00 174.94 174.08 1xrt s THR 376 N 0.57 2.82 -0.18 2.92 2.01 -0.12 -0.38 115.64 123.28 1xrt s THR 376 Ca -0.05 -0.78 0.00 0.00 0.31 0.00 0.00 61.69 61.18 1xrt s THR 376 Cb -0.07 -2.12 0.04 0.00 0.01 0.00 0.00 72.50 70.36 1xrt s THR 376 CO -0.02 0.56 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.75 1xrt s ILE 377 N -0.14 1.51 0.07 1.82 1.01 -0.10 -1.16 121.20 124.20 1xrt s ILE 377 Ca -0.02 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1xrt s ILE 377 Cb -0.14 -1.58 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 1xrt s ILE 377 CO 0.04 0.20 -0.07 0.72 0.00 0.00 0.00 174.94 175.83 1xrt s PHE 378 N 1.46 0.74 -0.33 3.97 -0.12 -0.42 -0.32 117.98 122.97 1xrt s PHE 378 Ca 0.00 -0.75 -0.06 0.00 -0.05 0.00 0.00 56.93 56.07 1xrt s PHE 378 Cb -0.16 -0.45 0.03 0.00 -0.63 0.00 0.00 43.02 41.82 1xrt s PHE 378 CO -0.08 -0.14 0.10 0.34 -0.05 0.00 0.00 175.22 175.38 1xrt s ASP 379 N -2.38 5.28 0.58 1.98 -1.08 0.09 -0.67 116.67 120.47 1xrt s ASP 379 Ca 0.02 -1.06 0.39 0.00 -0.52 0.00 0.00 52.55 51.37 1xrt s ASP 379 Cb -0.01 -1.87 1.99 0.00 -1.46 0.00 0.00 42.92 41.57 1xrt s ASP 379 CO -0.03 -0.30 2.18 1.55 0.52 0.00 0.00 175.17 179.09 1xrt h PRO 380 N 8.22 0.00 -0.19 4.34 0.13 -1.89 -0.72 132.00 141.90 1xrt h PRO 380 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1xrt h PRO 380 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1xrt h PRO 380 CO 0.60 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.46 1xrt n ASN 381 N -2.95 2.44 -4.65 1.44 5.03 -1.26 -3.11 115.26 112.20 1xrt n ASN 381 Ca -0.02 -1.90 -0.42 0.00 0.87 0.00 0.00 54.58 53.11 1xrt n ASN 381 Cb 0.13 -0.12 -0.04 0.00 -1.02 0.00 0.00 39.78 38.72 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 -0.94 4.23 0.12 3.52 2.20 -1.12 -4.63 119.74 123.13 1xrt s LYS 382 Ca 0.14 1.06 -0.14 0.00 -0.36 0.00 0.00 55.97 56.66 1xrt s LYS 382 Cb 0.07 -3.62 -0.07 0.00 -1.51 0.00 0.00 37.83 32.70 1xrt s LYS 382 CO 0.10 -0.49 0.53 -1.21 -0.36 0.00 0.00 175.35 173.91 1xrt s GLU 383 N 2.73 3.97 0.21 4.03 2.02 -1.26 -0.40 118.70 130.00 1xrt s GLU 383 Ca 0.38 0.48 -0.23 0.00 0.02 0.00 0.00 54.97 55.62 1xrt s GLU 383 Cb -0.16 -2.98 0.06 0.00 0.10 0.00 0.00 34.13 31.15 1xrt s GLU 383 CO 0.09 0.51 0.91 1.67 0.02 0.00 0.00 175.26 178.46 1xrt s TRP 384 N -1.40 -0.08 -0.02 1.61 1.48 -0.69 -4.99 118.94 114.85 1xrt s TRP 384 Ca 0.36 -0.31 0.01 0.00 -1.06 0.00 0.00 56.10 55.10 1xrt s TRP 384 Cb -0.15 0.68 0.01 0.00 -1.16 0.00 0.00 33.47 32.85 1xrt s TRP 384 CO 0.19 -1.00 -0.04 0.42 -4.06 0.00 0.00 176.95 172.45 1xrt s ILE 385 N -3.14 0.43 -0.42 0.66 1.01 -1.26 -0.67 121.20 117.82 1xrt s ILE 385 Ca 0.14 -0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.36 1xrt s ILE 385 Cb -0.03 -0.43 0.02 0.00 0.01 0.00 0.00 42.46 42.04 1xrt s ILE 385 CO 0.05 0.17 1.16 -0.22 0.00 0.00 0.00 174.94 176.10 1xrt s LEU 386 N 0.45 3.72 0.00 2.97 2.96 -1.26 -4.63 118.68 122.89 1xrt s LEU 386 Ca -0.05 0.71 0.00 0.00 -0.22 0.00 0.00 54.13 54.56 1xrt s LEU 386 Cb -0.09 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.06 1xrt s LEU 386 CO -0.00 -1.17 0.00 -0.46 -1.32 0.00 0.00 176.35 173.40 1xrt n ASN 387 N 7.68 0.00 0.29 3.68 0.23 -1.26 -0.62 115.26 125.27 1xrt n ASN 387 Ca 0.13 -0.82 0.19 0.00 -0.53 0.00 0.00 54.58 53.55 1xrt n ASN 387 Cb 0.48 0.00 0.94 0.00 -2.08 0.00 0.00 39.78 39.13 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 0.00 0.00 -3.83 9.09 -1.94 0.24 114.58 118.14 1xrt h GLU 388 Ca 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.36 1xrt h GLU 388 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.09 1xrt h GLU 388 CO 0.00 0.00 -0.28 0.93 0.05 0.00 0.00 179.01 179.71 1xrt h GLU 389 N 0.00 0.00 0.00 1.06 4.39 -1.95 -3.39 114.58 114.69 1xrt h GLU 389 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1xrt h GLU 389 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1xrt h GLU 389 CO 0.00 0.20 -0.85 0.25 -1.16 0.00 0.00 179.01 177.45 1xrt n THR 390 N -3.12 0.00 -2.02 1.13 -2.24 -0.52 -5.05 114.28 102.45 1xrt n THR 390 Ca 0.03 -0.05 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 1xrt n THR 390 Cb 0.62 0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 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 -1.80 6.68 0.00 3.42 2.47 0.72 -4.88 114.94 121.55 1xrt s ASN 391 Ca 0.00 2.42 0.15 0.00 0.42 0.00 0.00 52.86 55.85 1xrt s ASN 391 Cb 0.00 -2.57 0.02 0.00 -1.45 0.00 0.00 41.25 37.24 1xrt s ASN 391 CO 0.00 -0.81 0.85 0.18 -3.72 0.00 0.00 177.10 173.60 1xrt n LEU 392 N 4.99 1.68 -4.80 3.21 4.77 -1.26 -4.99 117.00 120.60 1xrt n LEU 392 Ca 0.14 -0.80 -0.34 0.00 -0.03 0.00 0.00 56.01 54.97 1xrt n LEU 392 Cb 0.41 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.45 1xrt n LEU 392 CO 0.61 0.32 0.70 -0.55 -1.33 0.00 0.00 177.39 177.14 1xrt s SER 393 N -1.73 6.60 0.00 -1.43 0.15 -1.26 -4.64 113.70 111.39 1xrt s SER 393 Ca 0.13 1.89 0.18 0.00 0.70 0.00 0.00 55.95 58.86 1xrt s SER 393 Cb 0.12 -2.56 0.81 0.00 -1.71 0.00 0.00 66.02 62.68 1xrt s SER 393 CO 0.35 -0.60 1.58 0.29 1.20 0.00 0.00 173.24 176.06 1xrt n LYS 394 N -0.65 0.06 -4.49 5.44 5.02 -1.26 -4.84 118.16 117.43 1xrt n LYS 394 Ca 0.08 0.17 -0.28 0.00 -2.02 0.00 0.00 58.31 56.26 1xrt n LYS 394 Cb 0.52 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.94 1xrt n LYS 394 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1xrt s SER 395 N -2.90 4.07 -0.04 4.39 0.01 -1.20 -4.87 113.70 113.15 1xrt s SER 395 Ca 0.11 -1.32 0.06 0.00 1.31 0.00 0.00 55.95 56.10 1xrt s SER 395 Cb 0.12 -0.30 0.09 0.00 0.21 0.00 0.00 66.02 66.14 1xrt s SER 395 CO 0.32 -0.54 1.04 0.54 0.41 0.00 0.00 173.24 175.02 1xrt n ARG 396 N -1.09 0.42 -2.61 12.44 1.74 -1.26 -4.98 116.66 121.32 1xrt n ARG 396 Ca -0.05 -1.49 -0.42 0.00 -0.77 0.00 0.00 57.85 55.11 1xrt n ARG 396 Cb 0.66 -0.82 -0.01 0.00 -1.02 0.00 0.00 32.46 31.27 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 -1.58 6.73 -0.18 0.55 4.22 -1.26 -4.84 114.94 118.57 1xrt s ASN 397 Ca 0.10 -2.11 -0.23 0.00 -2.14 0.00 0.00 52.86 48.47 1xrt s ASN 397 Cb 0.09 -2.56 0.06 0.00 1.28 0.00 0.00 41.25 40.12 1xrt s ASN 397 CO 0.01 -1.26 0.62 0.28 -2.04 0.00 0.00 177.10 174.71 1xrt s THR 398 N 4.25 0.00 -1.12 0.54 -1.32 -1.26 -1.65 115.64 115.08 1xrt s THR 398 Ca 0.49 -0.03 0.20 0.00 -1.21 0.00 0.00 61.69 61.15 1xrt s THR 398 Cb 0.02 -0.89 0.22 0.00 -1.51 0.00 0.00 72.50 70.34 1xrt s THR 398 CO 0.00 -0.02 1.65 -0.81 -2.21 0.00 0.00 174.62 173.24 1xrt n PRO 399 N 2.26 0.08 0.04 7.08 -0.04 -1.26 -2.26 135.00 140.91 1xrt n PRO 399 Ca -0.15 0.13 0.14 0.00 -0.04 0.00 0.00 63.50 63.58 1xrt n PRO 399 Cb 0.56 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 33.03 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 -1.44 0.36 -4.69 1.53 4.77 -1.26 -4.84 117.00 111.43 1xrt n LEU 400 Ca 0.06 0.51 -0.58 0.00 -0.03 0.00 0.00 56.01 55.98 1xrt n LEU 400 Cb 0.22 -0.41 -0.07 0.00 -2.33 0.00 0.00 43.42 40.82 1xrt n LEU 400 CO 0.18 -0.07 1.23 1.87 -1.33 0.00 0.00 177.39 179.27 1xrt n TRP 401 N -1.82 1.92 -0.93 -1.77 -0.00 -0.96 -0.98 117.44 112.90 1xrt n TRP 401 Ca 0.06 0.61 0.00 0.00 -0.00 0.00 0.00 57.50 58.17 1xrt n TRP 401 Cb 0.38 -2.42 0.00 0.00 -0.00 0.00 0.00 31.31 29.27 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 3.87 1.04 3.87 5.87 0.00 0.21 -5.02 105.19 115.03 1xrt n GLY 402 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.04 3.85 -0.13 1.61 -0.14 -0.15 -4.95 119.74 119.78 1xrt s LYS 403 Ca 0.00 0.36 -0.29 0.00 -1.36 0.00 0.00 55.97 54.68 1xrt s LYS 403 Cb 0.00 -2.60 -0.02 0.00 -1.68 0.00 0.00 37.83 33.53 1xrt s LYS 403 CO 0.00 0.28 1.33 0.08 -0.76 0.00 0.00 175.35 176.28 1xrt s VAL 404 N -1.85 4.14 0.11 3.17 1.01 -1.26 -4.24 120.40 121.47 1xrt s VAL 404 Ca 0.49 1.39 0.04 0.00 0.00 0.00 0.00 61.98 63.89 1xrt s VAL 404 Cb -0.11 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1xrt s VAL 404 CO 0.20 -0.11 0.10 -0.76 0.00 0.00 0.00 175.10 174.53 1xrt s LEU 405 N 3.47 3.80 -0.14 3.92 1.43 0.16 -4.97 118.68 126.35 1xrt s LEU 405 Ca 0.58 -0.05 -0.00 0.00 -1.03 0.00 0.00 54.13 53.63 1xrt s LEU 405 Cb -0.24 -2.46 0.03 0.00 0.03 0.00 0.00 46.19 43.55 1xrt s LEU 405 CO 0.18 0.14 -0.07 -0.75 0.23 0.00 0.00 176.35 176.08 1xrt s LYS 406 N -2.60 1.58 0.00 1.70 2.20 -1.26 -1.70 119.74 119.65 1xrt s LYS 406 Ca 0.30 -0.38 0.00 0.00 -0.36 0.00 0.00 55.97 55.53 1xrt s LYS 406 Cb -0.12 -1.79 0.00 0.00 -1.51 0.00 0.00 37.83 34.41 1xrt s LYS 406 CO 0.22 -0.32 0.00 0.41 -0.36 0.00 0.00 175.35 175.30 1xrt n GLY 407 N 4.90 3.53 3.32 5.54 0.00 0.47 -4.51 105.19 118.44 1xrt n GLY 407 Ca -0.13 -1.20 -0.13 0.00 0.00 0.00 0.00 46.02 44.56 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 -5.39 0.48 0.03 1.61 2.20 -0.29 -4.13 119.74 114.25 1xrt s LYS 408 Ca 0.00 0.64 -0.30 0.00 -0.36 0.00 0.00 55.97 55.94 1xrt s LYS 408 Cb 0.00 0.20 -0.05 0.00 -1.51 0.00 0.00 37.83 36.46 1xrt s LYS 408 CO 0.00 -0.08 1.30 0.08 -0.36 0.00 0.00 175.35 176.29 1xrt s VAL 409 N 0.44 3.86 -0.20 4.02 1.01 -1.26 -0.73 120.40 127.54 1xrt s VAL 409 Ca -0.02 1.28 -0.04 0.00 0.00 0.00 0.00 61.98 63.21 1xrt s VAL 409 Cb -0.04 -3.82 -0.21 0.00 0.00 0.00 0.00 36.38 32.31 1xrt s VAL 409 CO -0.02 0.05 0.04 -0.38 0.00 0.00 0.00 175.10 174.79 1xrt n ILE 410 N 4.31 1.62 -3.88 2.22 2.08 0.56 -4.51 119.36 121.76 1xrt n ILE 410 Ca 0.11 -0.58 -0.11 0.00 0.56 0.00 0.00 62.75 62.73 1xrt n ILE 410 Cb 0.45 -1.60 -0.13 0.00 -0.75 0.00 0.00 39.64 37.61 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 -2.53 0.03 -0.07 1.39 2.02 -0.88 -0.84 117.35 116.47 1xrt s TYR 411 Ca -0.30 -0.05 0.03 0.00 -0.37 0.00 0.00 57.07 56.39 1xrt s TYR 411 Cb 0.08 -0.03 0.01 0.00 -0.40 0.00 0.00 41.96 41.61 1xrt s TYR 411 CO 0.67 -0.08 -0.16 0.99 -1.57 0.00 0.00 175.55 175.40 1xrt s THR 412 N -0.40 1.40 -0.13 -0.71 2.01 -0.30 -0.93 115.64 116.59 1xrt s THR 412 Ca -0.05 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.31 1xrt s THR 412 Cb -0.03 -1.24 0.02 0.00 0.01 0.00 0.00 72.50 71.26 1xrt s THR 412 CO -0.00 0.41 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.56 1xrt s ILE 413 N 0.42 1.58 -0.16 1.82 1.01 0.49 -1.01 121.20 125.34 1xrt s ILE 413 Ca -0.12 -0.67 0.02 0.00 0.00 0.00 0.00 60.65 59.87 1xrt s ILE 413 Cb -0.15 -1.45 0.01 0.00 0.01 0.00 0.00 42.46 40.88 1xrt s ILE 413 CO 0.04 0.46 -0.21 -0.75 0.00 0.00 0.00 174.94 174.49 1xrt s LYS 414 N 1.15 3.01 -1.51 2.79 2.47 0.55 -0.93 119.74 127.26 1xrt s LYS 414 Ca -0.02 -0.84 -0.14 0.00 -1.56 0.00 0.00 55.97 53.41 1xrt s LYS 414 Cb -0.14 -2.52 0.11 0.00 -1.46 0.00 0.00 37.83 33.82 1xrt s LYS 414 CO -0.05 -0.12 0.75 -0.25 0.16 0.00 0.00 175.35 175.84 1xrt n ASP 415 N 4.36 -3.96 0.00 1.43 8.00 -0.95 -1.28 116.55 124.15 1xrt n ASP 415 Ca -0.20 -0.72 0.00 0.00 0.71 0.00 0.00 54.79 54.57 1xrt n ASP 415 Cb 0.51 -3.22 0.00 0.00 -0.02 0.00 0.00 41.12 38.38 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 -1.41 1.28 3.63 0.44 0.00 -0.60 -4.24 105.19 104.29 1xrt n GLY 416 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.23 3.69 -0.18 1.61 2.20 -0.40 -4.95 119.74 121.48 1xrt s LYS 417 Ca 0.00 -0.37 -0.29 0.00 -0.36 0.00 0.00 55.97 54.95 1xrt s LYS 417 Cb 0.00 -3.07 -0.04 0.00 -1.51 0.00 0.00 37.83 33.20 1xrt s LYS 417 CO 0.00 0.39 1.84 1.41 -0.36 0.00 0.00 175.35 178.62 1xrt s MET 418 N 0.03 3.67 -0.00 4.03 -2.45 -1.26 -0.33 119.30 122.98 1xrt s MET 418 Ca 0.04 1.91 0.14 0.00 -1.25 0.00 0.00 55.69 56.53 1xrt s MET 418 Cb -0.12 -4.15 -0.15 0.00 1.25 0.00 0.00 34.83 31.66 1xrt s MET 418 CO 0.01 -1.46 0.58 1.33 1.05 0.00 0.00 175.02 176.53 1xrt n VAL 419 N 6.64 0.00 -3.77 10.11 0.24 -0.18 -4.94 118.33 126.43 1xrt n VAL 419 Ca 0.22 -0.18 -0.13 0.00 -2.04 0.00 0.00 64.34 62.21 1xrt n VAL 419 Cb 0.44 1.00 -0.12 0.00 -1.47 0.00 0.00 33.84 33.69 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 -2.29 -0.30 -0.02 6.34 5.04 -1.02 -4.95 117.35 120.16 1xrt s TYR 420 Ca 0.05 0.72 0.01 0.00 -2.44 0.00 0.00 57.07 55.40 1xrt s TYR 420 Cb 0.10 0.08 0.02 0.00 0.35 0.00 0.00 41.96 42.51 1xrt s TYR 420 CO 0.56 -0.17 -0.01 0.21 -1.34 0.00 0.00 175.55 174.80 1xrt s LYS 421 N 0.49 0.27 0.00 4.97 2.20 -1.26 -1.14 119.74 125.27 1xrt s LYS 421 Ca -0.03 0.02 0.03 0.00 -0.36 0.00 0.00 55.97 55.63 1xrt s LYS 421 Cb -0.04 -0.39 0.18 0.00 -1.51 0.00 0.00 37.83 36.06 1xrt s LYS 421 CO -0.03 -0.07 0.67 -3.47 -0.36 0.00 0.00 175.35 172.09