#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vas s LYS 5 N 0.00 4.19 0.62 1.61 1.02 -1.26 -5.00 119.74 120.92 2vas s LYS 5 Ca 0.00 2.06 -0.19 0.00 0.02 0.00 0.00 55.97 57.86 2vas s LYS 5 Cb 0.00 -2.89 -0.03 0.00 -0.52 0.00 0.00 37.83 34.39 2vas s LYS 5 CO 0.00 -0.27 1.20 -2.30 -0.92 0.00 0.00 175.35 173.06 2vas n PRO 6 N 0.46 1.14 -4.41 -1.68 -0.02 -1.26 -4.76 135.00 124.46 2vas n PRO 6 Ca 0.02 0.44 -0.20 0.00 -2.02 0.00 0.00 63.50 61.74 2vas n PRO 6 Cb 0.44 -2.42 -0.10 0.00 -0.02 0.00 0.00 33.50 31.39 2vas n PRO 6 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2vas s VAL 7 N -1.41 1.50 -0.07 -1.45 -7.23 -0.25 -4.15 120.40 107.34 2vas s VAL 7 Ca 0.79 -2.10 -0.21 0.00 -1.81 0.00 0.00 61.98 58.65 2vas s VAL 7 Cb -0.40 -2.44 -0.04 0.00 0.56 0.00 0.00 36.38 34.06 2vas s VAL 7 CO 0.44 -0.29 0.62 0.26 -0.31 0.00 0.00 175.10 175.81 2vas s TRP 8 N -3.11 3.57 0.07 2.82 0.52 0.17 -1.53 118.94 121.46 2vas s TRP 8 Ca 0.29 1.13 0.02 0.00 0.02 0.00 0.00 56.10 57.56 2vas s TRP 8 Cb 0.04 -2.70 -0.03 0.00 -1.15 0.00 0.00 33.47 29.63 2vas s TRP 8 CO 0.11 0.15 -0.06 0.00 0.02 0.00 0.00 176.95 177.16 2vas s ALA 9 N 0.62 0.75 0.59 0.98 0.00 -0.46 -1.20 121.76 123.03 2vas s ALA 9 Ca 0.33 -1.10 -0.18 0.00 0.00 0.00 0.00 51.96 51.01 2vas s ALA 9 Cb -0.17 0.13 -0.06 0.00 0.00 0.00 0.00 23.12 23.02 2vas s ALA 9 CO 0.16 -0.17 0.77 -2.30 0.00 0.00 0.00 175.76 174.21 2vas n PRO 10 N 0.57 0.71 -3.76 0.00 -0.02 -1.26 -0.35 135.00 130.89 2vas n PRO 10 Ca -0.17 0.28 -0.13 0.00 -2.02 0.00 0.00 63.50 61.46 2vas n PRO 10 Cb 0.58 -1.96 -0.14 0.00 -0.02 0.00 0.00 33.50 31.97 2vas n PRO 10 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2vas s HIS 11 N -1.61 -0.18 0.44 6.00 2.46 -0.73 -4.51 115.29 117.17 2vas s HIS 11 Ca 0.73 0.49 0.12 0.00 0.47 0.00 0.00 55.06 56.87 2vas s HIS 11 Cb -0.43 -0.03 0.99 0.00 -0.13 0.00 0.00 32.58 32.97 2vas s HIS 11 CO 0.50 -0.15 2.02 -1.00 -2.47 0.00 0.00 174.74 173.64 2vas h PRO 12 N 6.90 0.16 0.00 2.88 0.13 -1.96 -2.09 132.00 138.02 2vas h PRO 12 Ca -0.38 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.67 2vas h PRO 12 Cb 1.16 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2vas h PRO 12 CO 0.42 0.22 -1.43 0.25 -0.23 0.00 0.00 178.00 177.23 2vas n THR 13 N -4.39 0.20 1.05 1.56 -2.24 -1.26 -4.67 114.28 104.52 2vas n THR 13 Ca -0.01 -0.24 0.11 0.00 -2.27 0.00 0.00 64.05 61.65 2vas n THR 13 Cb 0.18 -0.12 0.10 0.00 -2.10 0.00 0.00 70.33 68.39 2vas n THR 13 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2vas n ASP 14 N -1.97 1.13 0.00 3.42 10.43 -1.24 -1.85 116.55 126.47 2vas n ASP 14 Ca -0.06 -0.92 0.00 0.00 2.57 0.00 0.00 54.79 56.39 2vas n ASP 14 Cb 0.42 0.52 0.00 0.00 1.84 0.00 0.00 41.12 43.90 2vas n ASP 14 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2vas n GLY 15 N 1.45 1.82 3.03 0.44 0.00 -0.78 -3.66 105.19 107.48 2vas n GLY 15 Ca 0.07 -0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 2vas n GLY 15 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vas s PHE 16 N 0.00 0.42 0.07 1.61 0.40 -1.26 -1.77 117.98 117.45 2vas s PHE 16 Ca 0.00 -0.67 0.01 0.00 -0.60 0.00 0.00 56.93 55.67 2vas s PHE 16 Cb 0.00 -0.29 -0.04 0.00 0.51 0.00 0.00 43.02 43.21 2vas s PHE 16 CO 0.00 -0.21 -0.06 1.14 0.70 0.00 0.00 175.22 176.79 2vas s GLN 17 N -2.17 0.67 0.18 0.44 -2.07 0.52 -4.74 119.66 112.49 2vas s GLN 17 Ca -0.08 -1.13 -0.30 0.00 -1.82 0.00 0.00 55.36 52.03 2vas s GLN 17 Cb -0.05 -0.09 -0.07 0.00 -1.09 0.00 0.00 33.01 31.71 2vas s GLN 17 CO -0.03 -0.03 1.04 0.08 -1.32 0.00 0.00 175.29 175.03 2vas s VAL 18 N -3.06 4.03 0.16 3.63 1.01 -1.26 -1.35 120.40 123.55 2vas s VAL 18 Ca 0.04 1.79 -0.06 0.00 0.00 0.00 0.00 61.98 63.75 2vas s VAL 18 Cb 0.02 -4.14 0.02 0.00 0.00 0.00 0.00 36.38 32.28 2vas s VAL 18 CO -0.05 0.32 0.32 0.61 0.00 0.00 0.00 175.10 176.30 2vas n GLY 19 N 1.96 1.69 3.15 4.51 0.00 -0.58 -2.49 105.19 113.43 2vas n GLY 19 Ca 0.02 -1.15 -0.24 0.00 0.00 0.00 0.00 46.02 44.65 2vas n GLY 19 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2vas s ASN 20 N -1.86 1.94 -0.25 1.61 -0.87 -0.13 -1.09 114.94 114.28 2vas s ASN 20 Ca 0.07 -0.33 -0.29 0.00 -1.57 0.00 0.00 52.86 50.75 2vas s ASN 20 Cb -0.02 -0.21 -0.00 0.00 -0.02 0.00 0.00 41.25 41.00 2vas s ASN 20 CO 0.05 0.19 1.26 -0.63 -2.57 0.00 0.00 177.10 175.40 2vas s ILE 21 N -0.45 4.25 -0.39 0.60 1.01 -1.26 -1.52 121.20 123.44 2vas s ILE 21 Ca 0.06 1.45 0.15 0.00 0.00 0.00 0.00 60.65 62.31 2vas s ILE 21 Cb -0.07 -4.13 -0.20 0.00 0.01 0.00 0.00 42.46 38.08 2vas s ILE 21 CO -0.00 -0.34 0.50 1.33 0.00 0.00 0.00 174.94 176.42 2vas n VAL 22 N 5.85 0.00 -3.59 2.92 0.24 0.32 -4.86 118.33 119.21 2vas n VAL 22 Ca 0.14 -0.24 -0.16 0.00 -2.04 0.00 0.00 64.34 62.04 2vas n VAL 22 Cb 0.46 0.61 -0.07 0.00 -1.47 0.00 0.00 33.84 33.37 2vas n VAL 22 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2vas s ASP 23 N -3.04 -0.69 -0.22 -1.34 3.68 -1.22 -4.99 116.67 108.86 2vas s ASP 23 Ca 0.00 1.07 -0.01 0.00 2.13 0.00 0.00 52.55 55.75 2vas s ASP 23 Cb 0.11 1.01 0.02 0.00 -1.45 0.00 0.00 42.92 42.60 2vas s ASP 23 CO 0.63 -0.41 -0.12 -0.63 0.13 0.00 0.00 175.17 174.77 2vas s ILE 24 N -0.37 2.58 0.50 4.11 1.01 -1.26 -1.03 121.20 126.74 2vas s ILE 24 Ca -0.05 -0.95 0.06 0.00 0.00 0.00 0.00 60.65 59.71 2vas s ILE 24 Cb -0.03 -2.22 0.02 0.00 0.01 0.00 0.00 42.46 40.24 2vas s ILE 24 CO 0.05 0.35 0.39 -0.83 0.00 0.00 0.00 174.94 174.90 2vas s GLY 25 N 1.32 2.28 0.28 6.18 0.00 -0.74 -5.04 107.32 111.60 2vas s GLY 25 Ca 0.02 -1.55 -0.01 0.00 0.00 0.00 0.00 44.72 43.19 2vas s GLY 25 CO -0.08 -1.87 1.88 -0.56 0.00 0.00 0.00 173.10 172.47 2vas h PRO 26 N 0.87 1.08 0.00 2.90 0.13 -2.03 -3.34 132.00 131.61 2vas h PRO 26 Ca -0.38 -0.06 -0.07 0.00 -0.87 0.00 0.00 66.00 64.62 2vas h PRO 26 Cb 1.29 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 2vas h PRO 26 CO 0.58 0.71 -1.29 -0.25 -0.23 0.00 0.00 178.00 177.52 2vas n ASP 27 N -4.52 3.90 -4.12 1.44 9.92 -1.26 -5.02 116.55 116.88 2vas n ASP 27 Ca 0.16 0.00 -0.10 0.00 -0.53 0.00 0.00 54.79 54.32 2vas n ASP 27 Cb 0.23 0.73 -0.10 0.00 -0.64 0.00 0.00 41.12 41.34 2vas n ASP 27 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 2vas s SER 28 N -3.35 0.89 0.10 -2.24 1.04 -1.25 -2.66 113.70 106.22 2vas s SER 28 Ca -0.02 -0.86 0.05 0.00 0.48 0.00 0.00 55.95 55.59 2vas s SER 28 Cb 0.02 0.10 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 2vas s SER 28 CO 0.19 -0.42 0.02 -0.76 0.98 0.00 0.00 173.24 173.25 2vas s LEU 29 N -2.57 3.54 -0.20 2.42 1.43 0.16 -1.79 118.68 121.67 2vas s LEU 29 Ca 0.04 -0.16 -0.13 0.00 -1.03 0.00 0.00 54.13 52.85 2vas s LEU 29 Cb 0.01 -2.25 -0.05 0.00 0.03 0.00 0.00 46.19 43.94 2vas s LEU 29 CO -0.04 0.16 0.26 -0.89 0.23 0.00 0.00 176.35 176.07 2vas s THR 30 N -1.38 5.31 -0.07 5.49 2.01 -0.20 -1.57 115.64 125.23 2vas s THR 30 Ca 0.27 0.43 0.05 0.00 0.31 0.00 0.00 61.69 62.75 2vas s THR 30 Cb -0.12 -3.60 -0.01 0.00 0.01 0.00 0.00 72.50 68.79 2vas s THR 30 CO 0.19 0.34 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.59 2vas s ILE 31 N 0.88 2.11 -0.22 1.82 -1.09 0.43 -0.52 121.20 124.62 2vas s ILE 31 Ca 0.13 -1.03 -0.06 0.00 -2.23 0.00 0.00 60.65 57.46 2vas s ILE 31 Cb -0.13 -1.78 -0.02 0.00 -1.58 0.00 0.00 42.46 38.94 2vas s ILE 31 CO 0.04 0.57 0.02 -0.70 -1.23 0.00 0.00 174.94 173.64 2vas s GLU 32 N 0.00 3.61 0.41 2.79 2.12 -0.58 -1.42 118.70 125.63 2vas s GLU 32 Ca -0.08 -0.51 -0.26 0.00 0.36 0.00 0.00 54.97 54.47 2vas s GLU 32 Cb -0.15 -3.17 -0.09 0.00 0.26 0.00 0.00 34.13 30.98 2vas s GLU 32 CO 0.05 -0.09 1.33 -2.14 -0.54 0.00 0.00 175.26 173.88 2vas s PRO 33 N 1.29 3.95 0.22 4.30 0.02 -1.26 -0.96 135.00 142.55 2vas s PRO 33 Ca 0.04 2.22 -0.09 0.00 0.02 0.00 0.00 61.00 63.19 2vas s PRO 33 Cb -0.15 -2.77 0.18 0.00 0.02 0.00 0.00 34.50 31.79 2vas s PRO 33 CO 0.02 -0.53 1.89 -0.07 -0.33 0.00 0.00 177.00 177.97 2vas h LEU 34 N 2.67 0.93 -1.77 -5.54 3.38 -1.83 -2.82 115.31 110.33 2vas h LEU 34 Ca -0.50 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.44 2vas h LEU 34 Cb 1.25 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 2vas h LEU 34 CO 0.63 0.67 0.11 -0.55 0.09 0.00 0.00 178.44 179.39 2vas h ASN 35 N 1.09 0.23 -2.87 -0.43 7.08 -1.92 -3.40 115.58 115.36 2vas h ASN 35 Ca 0.30 -0.01 -0.58 0.00 -3.08 0.00 0.00 56.30 52.93 2vas h ASN 35 Cb -0.13 -0.06 -0.39 0.00 -2.08 0.00 0.00 38.32 35.66 2vas h ASN 35 CO -0.06 0.19 -0.81 -1.58 -2.08 0.00 0.00 177.43 173.09 2vas s GLN 36 N -5.23 0.68 0.14 4.14 0.74 -1.06 -5.11 119.66 113.96 2vas s GLN 36 Ca -0.06 -1.34 -0.31 0.00 0.05 0.00 0.00 55.36 53.70 2vas s GLN 36 Cb 0.17 -1.57 -0.08 0.00 1.10 0.00 0.00 33.01 32.63 2vas s GLN 36 CO 0.70 -1.15 1.31 0.21 -0.55 0.00 0.00 175.29 175.81 2vas s LYS 37 N 1.11 4.38 0.00 1.67 2.20 -1.26 -2.50 119.74 125.35 2vas s LYS 37 Ca 0.16 1.99 0.00 0.00 -0.36 0.00 0.00 55.97 57.76 2vas s LYS 37 Cb -0.22 -3.25 0.00 0.00 -1.51 0.00 0.00 37.83 32.85 2vas s LYS 37 CO -0.07 -0.31 0.00 0.41 -0.36 0.00 0.00 175.35 175.03 2vas n GLY 38 N 2.93 3.17 3.80 5.54 0.00 -1.26 -5.04 105.19 114.32 2vas n GLY 38 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2vas n GLY 38 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vas s LYS 39 N -0.40 3.79 -0.14 1.61 2.47 -1.04 -5.06 119.74 120.98 2vas s LYS 39 Ca 0.00 1.34 -0.23 0.00 -1.56 0.00 0.00 55.97 55.52 2vas s LYS 39 Cb 0.00 -2.09 0.06 0.00 -1.46 0.00 0.00 37.83 34.33 2vas s LYS 39 CO 0.00 -0.44 0.58 -0.08 0.16 0.00 0.00 175.35 175.58 2vas s THR 40 N -2.02 0.01 0.16 3.43 -1.32 -1.26 -4.43 115.64 110.20 2vas s THR 40 Ca 0.67 -0.07 -0.17 0.00 -1.21 0.00 0.00 61.69 60.91 2vas s THR 40 Cb -0.16 -0.85 0.04 0.00 -1.51 0.00 0.00 72.50 70.01 2vas s THR 40 CO 0.21 -0.04 0.47 0.72 -2.21 0.00 0.00 174.62 173.76 2vas s PHE 41 N -0.38 -0.20 -0.01 9.09 -0.12 -0.51 -4.99 117.98 120.86 2vas s PHE 41 Ca -0.05 -0.11 -0.02 0.00 -0.05 0.00 0.00 56.93 56.69 2vas s PHE 41 Cb -0.03 0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 42.66 2vas s PHE 41 CO 0.04 -0.80 0.15 -0.51 -0.05 0.00 0.00 175.22 174.05 2vas s LEU 42 N -2.83 4.23 -0.03 -1.99 1.43 -1.26 -0.43 118.68 117.80 2vas s LEU 42 Ca 0.05 0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 53.41 2vas s LEU 42 Cb 0.01 -2.48 0.01 0.00 0.03 0.00 0.00 46.19 43.75 2vas s LEU 42 CO -0.09 0.27 0.08 0.00 0.23 0.00 0.00 176.35 176.85 2vas s ALA 43 N -1.27 -0.20 0.54 4.21 0.00 -0.61 -4.98 121.76 119.45 2vas s ALA 43 Ca 0.25 0.20 -0.22 0.00 0.00 0.00 0.00 51.96 52.19 2vas s ALA 43 Cb -0.12 -0.12 -0.05 0.00 0.00 0.00 0.00 23.12 22.83 2vas s ALA 43 CO 0.16 -0.05 1.31 -0.51 0.00 0.00 0.00 175.76 176.67 2vas s LEU 44 N -0.07 3.85 0.53 0.00 1.43 -1.26 0.39 118.68 123.55 2vas s LEU 44 Ca -0.01 2.65 0.20 0.00 -1.03 0.00 0.00 54.13 55.94 2vas s LEU 44 Cb -0.01 -4.30 1.35 0.00 0.03 0.00 0.00 46.19 43.25 2vas s LEU 44 CO 0.00 -1.48 2.11 0.40 0.23 0.00 0.00 176.35 177.61 2vas h ILE 45 N 1.44 0.88 -0.03 -0.59 2.04 -1.84 0.14 117.51 119.56 2vas h ILE 45 Ca -0.51 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.35 2vas h ILE 45 Cb 1.29 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2vas h ILE 45 CO 0.57 0.00 0.00 -0.46 0.00 0.00 0.00 178.15 178.26 2vas n ASN 46 N -4.43 0.50 -0.79 1.72 0.23 -1.26 -3.24 115.26 107.99 2vas n ASN 46 Ca 0.01 -1.33 0.08 0.00 -0.53 0.00 0.00 54.58 52.81 2vas n ASN 46 Cb 0.24 -0.02 0.14 0.00 -2.08 0.00 0.00 39.78 38.07 2vas n ASN 46 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2vas n GLN 47 N -0.54 2.01 -4.88 -3.83 6.02 0.49 -4.95 117.38 111.70 2vas n GLN 47 Ca 0.19 -1.87 -0.33 0.00 -0.01 0.00 0.00 57.00 54.98 2vas n GLN 47 Cb 0.17 -1.35 -0.14 0.00 1.02 0.00 0.00 30.24 29.94 2vas n GLN 47 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2vas s VAL 48 N -1.18 2.94 0.04 5.09 1.01 -1.20 -4.11 120.40 122.99 2vas s VAL 48 Ca 0.26 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.54 2vas s VAL 48 Cb 0.16 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 2vas s VAL 48 CO 0.22 0.56 -0.10 -0.36 0.00 0.00 0.00 175.10 175.42 2vas s PHE 49 N -0.18 0.86 0.53 5.22 0.40 -0.34 -4.99 117.98 119.48 2vas s PHE 49 Ca -0.01 -0.38 -0.21 0.00 -0.60 0.00 0.00 56.93 55.73 2vas s PHE 49 Cb -0.13 -0.51 -0.05 0.00 0.51 0.00 0.00 43.02 42.83 2vas s PHE 49 CO 0.03 -0.02 1.22 -1.25 0.70 0.00 0.00 175.22 175.91 2vas s PRO 50 N -1.23 3.33 0.09 0.24 0.04 -1.26 -0.65 135.00 135.55 2vas s PRO 50 Ca -0.04 1.90 0.03 0.00 0.04 0.00 0.00 61.00 62.93 2vas s PRO 50 Cb -0.08 -2.19 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 2vas s PRO 50 CO 0.01 -0.94 0.08 0.00 0.04 0.00 0.00 177.00 176.19 2vas s ALA 51 N -1.51 3.54 0.29 8.56 0.00 -1.26 -4.67 121.76 126.71 2vas s ALA 51 Ca 0.71 -1.05 -0.29 0.00 0.00 0.00 0.00 51.96 51.33 2vas s ALA 51 Cb -0.32 -1.41 -0.11 0.00 0.00 0.00 0.00 23.12 21.29 2vas s ALA 51 CO 0.37 0.72 1.45 -1.21 0.00 0.00 0.00 175.76 177.09 2vas s GLU 52 N -2.47 4.23 0.27 0.00 0.41 -1.26 -4.93 118.70 114.94 2vas s GLU 52 Ca 0.29 2.39 -0.03 0.00 -0.41 0.00 0.00 54.97 57.21 2vas s GLU 52 Cb -0.12 -3.06 0.35 0.00 -1.78 0.00 0.00 34.13 29.52 2vas s GLU 52 CO 0.22 -0.44 1.87 0.93 -0.49 0.00 0.00 175.26 177.35 2vas h GLU 53 N 4.36 1.04 -4.73 1.61 5.08 -1.98 -3.37 114.58 116.59 2vas h GLU 53 Ca -0.48 -0.14 -0.69 0.00 -1.00 0.00 0.00 59.36 57.05 2vas h GLU 53 Cb 1.22 -0.20 -0.19 0.00 0.50 0.00 0.00 28.75 30.09 2vas h GLU 53 CO 0.74 0.80 -0.35 0.34 -1.00 0.00 0.00 179.01 179.53 2vas s ASP 54 N -6.39 6.14 0.00 1.42 -1.08 -1.26 -4.94 116.67 110.56 2vas s ASP 54 Ca -0.11 -0.61 0.27 0.00 -0.52 0.00 0.00 52.55 51.58 2vas s ASP 54 Cb 0.17 -2.18 0.94 0.00 -1.46 0.00 0.00 42.92 40.39 2vas s ASP 54 CO 0.81 -0.42 1.68 -1.54 0.52 0.00 0.00 175.17 176.22 2vas n SER 55 N 5.32 1.42 -0.03 -0.34 3.41 -1.26 -3.96 113.62 118.17 2vas n SER 55 Ca -0.10 -1.35 0.05 0.00 -0.26 0.00 0.00 58.87 57.20 2vas n SER 55 Cb 0.48 0.04 -0.16 0.00 -0.26 0.00 0.00 64.21 64.31 2vas n SER 55 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2vas n LYS 56 N -0.01 0.69 -1.66 4.33 4.01 -1.26 -5.00 118.16 119.26 2vas n LYS 56 Ca 0.17 -0.14 -0.30 0.00 -0.51 0.00 0.00 58.31 57.53 2vas n LYS 56 Cb 0.36 -1.50 0.08 0.00 -0.51 0.00 0.00 35.03 33.47 2vas n LYS 56 CO 0.00 0.00 0.00 -1.59 -1.11 0.00 0.00 177.40 174.70 2vas s LYS 57 N -3.16 2.25 0.01 1.97 0.00 -1.25 -5.08 119.74 114.47 2vas s LYS 57 Ca -0.08 0.55 -0.03 0.00 0.00 0.00 0.00 55.97 56.41 2vas s LYS 57 Cb 0.11 -1.94 -0.01 0.00 0.00 0.00 0.00 37.83 35.99 2vas s LYS 57 CO 0.85 -1.49 0.04 0.16 0.00 0.00 0.00 175.35 174.91 2vas s ASP 58 N -4.07 0.12 0.15 0.03 -4.77 -1.26 -4.94 116.67 101.93 2vas s ASP 58 Ca 0.60 -0.31 0.09 0.00 -3.30 0.00 0.00 52.55 49.63 2vas s ASP 58 Cb -0.13 0.14 -0.04 0.00 -1.09 0.00 0.00 42.92 41.80 2vas s ASP 58 CO 0.53 -0.28 -0.14 0.68 0.70 0.00 0.00 175.17 176.66 2vas s VAL 59 N -1.21 3.00 0.05 2.11 -7.23 -1.26 -5.03 120.40 110.82 2vas s VAL 59 Ca -0.13 -1.59 0.12 0.00 -1.81 0.00 0.00 61.98 58.57 2vas s VAL 59 Cb -0.08 -2.43 -0.03 0.00 0.56 0.00 0.00 36.38 34.40 2vas s VAL 59 CO 0.00 -0.00 1.46 -0.33 -0.31 0.00 0.00 175.10 175.91 2vas h GLU 60 N 3.33 0.00 -4.55 4.82 5.08 -1.96 -3.42 114.58 117.88 2vas h GLU 60 Ca -0.48 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.30 2vas h GLU 60 Cb 1.19 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 30.08 2vas h GLU 60 CO 0.50 0.68 -0.82 0.34 -1.00 0.00 0.00 179.01 178.70 2vas s ASP 61 N -6.59 2.51 0.19 1.42 -1.08 -1.26 -1.23 116.67 110.62 2vas s ASP 61 Ca 0.02 -0.43 0.14 0.00 -0.52 0.00 0.00 52.55 51.76 2vas s ASP 61 Cb 0.10 -1.07 0.73 0.00 -1.46 0.00 0.00 42.92 41.22 2vas s ASP 61 CO 0.76 -0.06 1.43 0.59 0.52 0.00 0.00 175.17 178.41 2vas n ASN 62 N 4.75 0.35 0.17 -0.34 3.02 0.16 -0.37 115.26 123.00 2vas n ASN 62 Ca -0.16 0.65 0.13 0.00 -0.03 0.00 0.00 54.58 55.18 2vas n ASN 62 Cb 0.50 -0.70 0.57 0.00 -0.61 0.00 0.00 39.78 39.54 2vas n ASN 62 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vas n SER 64 N -2.45 1.16 -4.79 0.00 7.64 0.50 -4.03 113.62 111.65 2vas n SER 64 Ca 0.01 -1.94 -0.38 0.00 1.01 0.00 0.00 58.87 57.57 2vas n SER 64 Cb 0.21 -0.14 -0.06 0.00 -1.01 0.00 0.00 64.21 63.22 2vas n SER 64 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2vas s LEU 65 N -1.08 4.48 0.33 -3.43 1.43 -0.99 -4.96 118.68 114.46 2vas s LEU 65 Ca 0.17 1.53 0.05 0.00 -1.03 0.00 0.00 54.13 54.85 2vas s LEU 65 Cb 0.09 -3.40 0.70 0.00 0.03 0.00 0.00 46.19 43.61 2vas s LEU 65 CO 0.12 0.14 1.90 0.24 0.23 0.00 0.00 176.35 178.97 2vas h MET 66 N 3.95 0.80 -3.94 1.70 2.86 -1.90 -3.38 114.93 115.02 2vas h MET 66 Ca -0.48 -0.05 -0.50 0.00 -2.06 0.00 0.00 59.70 56.61 2vas h MET 66 Cb 1.20 -0.18 -0.38 0.00 0.06 0.00 0.00 31.60 32.30 2vas h MET 66 CO 0.65 0.53 -0.78 0.71 1.06 0.00 0.00 176.91 179.08 2vas s TYR 67 N -5.77 1.19 -0.44 -0.22 2.02 -1.26 -4.60 117.35 108.27 2vas s TYR 67 Ca -0.10 -0.64 -0.17 0.00 -0.37 0.00 0.00 57.07 55.78 2vas s TYR 67 Cb 0.21 -1.08 0.04 0.00 -0.40 0.00 0.00 41.96 40.73 2vas s TYR 67 CO 0.79 -0.49 0.47 -1.17 -1.57 0.00 0.00 175.55 173.58 2vas s LEU 68 N 1.80 4.99 0.27 -1.29 2.96 -1.26 -4.75 118.68 121.40 2vas s LEU 68 Ca 0.03 -0.81 -0.09 0.00 -0.22 0.00 0.00 54.13 53.05 2vas s LEU 68 Cb -0.14 -2.37 -0.00 0.00 0.50 0.00 0.00 46.19 44.18 2vas s LEU 68 CO -0.07 -0.65 0.46 0.54 -1.32 0.00 0.00 176.35 175.31 2vas s ASN 69 N 2.08 0.21 0.48 3.68 2.20 -1.26 -5.00 114.94 117.32 2vas s ASN 69 Ca 0.12 -1.14 0.20 0.00 -0.94 0.00 0.00 52.86 51.10 2vas s ASN 69 Cb -0.18 0.60 1.21 0.00 -2.00 0.00 0.00 41.25 40.88 2vas s ASN 69 CO 0.12 -1.18 1.97 1.05 -2.94 0.00 0.00 177.10 176.13 2vas h GLU 70 N 2.24 0.21 0.23 3.55 4.11 -1.95 -1.19 114.58 121.77 2vas h GLU 70 Ca -0.28 -0.01 -0.32 0.00 0.07 0.00 0.00 59.36 58.82 2vas h GLU 70 Cb 1.25 -0.05 0.04 0.00 0.50 0.00 0.00 28.75 30.49 2vas h GLU 70 CO 0.38 0.14 -1.38 0.00 0.07 0.00 0.00 179.01 178.22 2vas h ALA 71 N 1.70 -0.14 -0.08 1.06 0.00 -1.96 -2.30 119.26 117.55 2vas h ALA 71 Ca 0.29 -0.83 -0.20 0.00 0.00 0.00 0.00 54.91 54.17 2vas h ALA 71 Cb 0.85 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2vas h ALA 71 CO -0.05 0.66 -0.79 1.79 0.00 0.00 0.00 179.25 180.85 2vas h THR 72 N 0.12 1.35 -0.23 0.00 1.35 -1.79 -2.19 112.91 111.52 2vas h THR 72 Ca -0.24 -2.15 0.05 0.00 -0.55 0.00 0.00 66.41 63.53 2vas h THR 72 Cb 2.08 2.13 -0.05 0.00 -1.73 0.00 0.00 68.15 70.58 2vas h THR 72 CO 0.26 0.65 -0.11 0.25 -0.25 0.00 0.00 175.52 176.32 2vas h LEU 73 N 0.34 -0.38 -0.41 3.87 5.85 -1.31 -0.21 115.31 123.07 2vas h LEU 73 Ca -0.05 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.78 2vas h LEU 73 Cb 1.39 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.60 2vas h LEU 73 CO 0.14 -0.15 0.25 0.25 -0.34 0.00 0.00 178.44 178.59 2vas h LEU 74 N -0.09 0.40 -0.45 2.25 5.85 -1.35 -1.71 115.31 120.22 2vas h LEU 74 Ca 0.12 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2vas h LEU 74 Cb 0.27 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 2vas h LEU 74 CO -0.29 0.29 0.15 -0.74 -0.34 0.00 0.00 178.44 177.51 2vas h HIS 75 N 0.50 0.71 -0.23 1.25 2.76 -1.22 -1.47 115.15 117.44 2vas h HIS 75 Ca 0.16 -0.07 -0.01 0.00 -2.20 0.00 0.00 60.37 58.25 2vas h HIS 75 Cb -0.00 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.74 2vas h HIS 75 CO -0.07 0.63 0.10 -0.97 -1.30 0.00 0.00 177.93 176.32 2vas h ASN 76 N 0.58 0.31 -0.92 3.26 -1.24 -0.85 -0.43 115.58 116.29 2vas h ASN 76 Ca 0.15 -0.15 0.07 0.00 0.71 0.00 0.00 56.30 57.07 2vas h ASN 76 Cb 0.24 -0.08 -0.06 0.00 0.73 0.00 0.00 38.32 39.15 2vas h ASN 76 CO -0.01 0.37 0.58 0.40 -1.29 0.00 0.00 177.43 177.48 2vas h ILE 77 N 0.22 1.05 0.16 2.57 5.03 -1.31 -1.75 117.51 123.47 2vas h ILE 77 Ca 0.08 -0.36 -0.01 0.00 -0.12 0.00 0.00 64.86 64.45 2vas h ILE 77 Cb 0.15 -0.08 0.00 0.00 -3.03 0.00 0.00 36.82 33.86 2vas h ILE 77 CO -0.01 0.19 -0.07 0.50 -0.68 0.00 0.00 178.15 178.08 2vas h LYS 78 N 1.04 -0.20 -0.08 2.37 3.64 -0.97 -1.13 116.57 121.24 2vas h LYS 78 Ca 0.40 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.83 2vas h LYS 78 Cb 0.19 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2vas h LYS 78 CO -0.18 -0.09 -0.11 0.28 -2.27 0.00 0.00 179.45 177.08 2vas h VAL 79 N -0.26 0.70 -0.93 2.00 2.07 -0.86 -1.84 116.25 117.11 2vas h VAL 79 Ca -0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.54 2vas h VAL 79 Cb 0.21 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.62 2vas h VAL 79 CO 0.04 0.00 0.61 0.03 0.02 0.00 0.00 177.57 178.27 2vas h ARG 80 N -0.15 1.12 -0.57 1.57 3.08 -1.32 -2.94 114.38 115.16 2vas h ARG 80 Ca 0.07 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2vas h ARG 80 Cb 0.25 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 2vas h ARG 80 CO -0.17 0.74 0.22 -0.92 -1.07 0.00 0.00 179.97 178.77 2vas h TYR 81 N 1.15 0.87 0.00 3.04 3.20 -0.65 -0.53 116.97 124.06 2vas h TYR 81 Ca 0.38 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 62.18 2vas h TYR 81 Cb 0.05 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.06 2vas h TYR 81 CO -0.00 0.71 0.00 0.66 -1.64 0.00 0.00 178.16 177.89 2vas h SER 82 N 0.79 0.00 -0.34 -2.11 4.64 -1.17 -1.58 113.55 113.78 2vas h SER 82 Ca 0.19 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.44 2vas h SER 82 Cb 0.21 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.26 2vas h SER 82 CO -0.01 0.00 0.02 0.29 -0.87 0.00 0.00 176.83 176.26 2vas n LYS 83 N -2.95 2.74 -2.20 4.77 5.02 -0.77 -4.96 118.16 119.80 2vas n LYS 83 Ca -0.03 -2.96 -0.17 0.00 -2.02 0.00 0.00 58.31 53.13 2vas n LYS 83 Cb 0.07 -1.89 -0.02 0.00 -0.02 0.00 0.00 35.03 33.17 2vas n LYS 83 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2vas n ASP 84 N -0.63 -5.00 -4.31 4.39 8.00 -0.59 -4.93 116.55 113.47 2vas n ASP 84 Ca 0.27 0.15 -0.46 0.00 0.71 0.00 0.00 54.79 55.46 2vas n ASP 84 Cb 0.99 -4.26 -0.03 0.00 -0.02 0.00 0.00 41.12 37.80 2vas n ASP 84 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2vas s ARG 85 N -4.67 3.42 0.08 -1.24 0.52 -0.28 -4.91 118.95 111.88 2vas s ARG 85 Ca 0.00 -2.37 0.27 0.00 -0.52 0.00 0.00 55.73 53.11 2vas s ARG 85 Cb 0.00 -4.34 0.88 0.00 0.52 0.00 0.00 34.95 32.01 2vas s ARG 85 CO 0.00 -1.28 1.73 0.44 0.02 0.00 0.00 175.30 176.21 2vas n ILE 86 N 4.10 0.24 -4.35 1.52 -5.35 -1.26 -3.35 119.36 110.91 2vas n ILE 86 Ca 0.10 -0.13 -0.34 0.00 -0.27 0.00 0.00 62.75 62.11 2vas n ILE 86 Cb 0.45 -0.38 -0.12 0.00 -1.74 0.00 0.00 39.64 37.85 2vas n ILE 86 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2vas s TYR 87 N -3.05 3.05 0.01 4.28 4.12 -1.26 -1.39 117.35 123.11 2vas s TYR 87 Ca 0.11 -0.26 -0.04 0.00 0.02 0.00 0.00 57.07 56.91 2vas s TYR 87 Cb 0.16 -1.97 -0.01 0.00 -1.52 0.00 0.00 41.96 38.62 2vas s TYR 87 CO 0.60 -0.02 0.06 0.99 0.02 0.00 0.00 175.55 177.20 2vas s THR 88 N 0.38 0.09 0.13 -0.71 2.01 -0.81 -4.65 115.64 112.09 2vas s THR 88 Ca -0.03 -0.75 -0.05 0.00 0.31 0.00 0.00 61.69 61.17 2vas s THR 88 Cb -0.14 -0.34 -0.06 0.00 0.01 0.00 0.00 72.50 71.97 2vas s THR 88 CO 0.03 -0.41 0.37 -0.31 -0.69 0.00 0.00 174.62 173.60 2vas s TYR 89 N -1.34 3.48 -0.48 4.92 4.12 -0.37 -0.80 117.35 126.89 2vas s TYR 89 Ca -0.14 0.56 0.04 0.00 0.02 0.00 0.00 57.07 57.54 2vas s TYR 89 Cb -0.08 -2.00 0.13 0.00 -1.52 0.00 0.00 41.96 38.48 2vas s TYR 89 CO 0.00 0.45 0.23 0.08 0.02 0.00 0.00 175.55 176.33 2vas s VAL 90 N -1.64 2.31 0.00 0.71 1.01 0.24 -0.66 120.40 122.37 2vas s VAL 90 Ca 0.40 -3.03 0.00 0.00 0.00 0.00 0.00 61.98 59.35 2vas s VAL 90 Cb -0.12 -2.62 0.00 0.00 0.00 0.00 0.00 36.38 33.64 2vas s VAL 90 CO 0.24 -0.79 0.00 0.00 0.00 0.00 0.00 175.10 174.55 2vas n ALA 91 N 3.36 0.00 1.36 5.51 0.00 -1.26 -1.89 120.51 127.59 2vas n ALA 91 Ca 0.05 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.63 2vas n ALA 91 Cb 0.34 0.00 0.58 0.00 0.00 0.00 0.00 19.45 20.37 2vas n ALA 91 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2vas n ASN 92 N 7.47 0.49 -4.75 0.00 3.02 -1.26 -4.85 115.26 115.37 2vas n ASN 92 Ca 0.00 -0.54 -0.40 0.00 -0.03 0.00 0.00 54.58 53.62 2vas n ASN 92 Cb 0.00 -0.06 -0.05 0.00 -0.61 0.00 0.00 39.78 39.05 2vas n ASN 92 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2vas s ILE 93 N -2.52 4.72 -0.20 2.41 1.01 -0.79 -4.58 121.20 121.26 2vas s ILE 93 Ca 0.27 1.55 -0.09 0.00 0.00 0.00 0.00 60.65 62.38 2vas s ILE 93 Cb 0.20 -4.08 -0.05 0.00 0.01 0.00 0.00 42.46 38.54 2vas s ILE 93 CO 0.49 0.40 0.11 -0.22 0.00 0.00 0.00 174.94 175.72 2vas s LEU 94 N -0.24 4.09 -0.17 2.97 2.96 -0.60 -0.59 118.68 127.11 2vas s LEU 94 Ca 0.36 0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 54.39 2vas s LEU 94 Cb -0.20 -2.05 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 2vas s LEU 94 CO 0.22 0.17 0.05 -0.63 -1.32 0.00 0.00 176.35 174.84 2vas s ILE 95 N 0.39 4.68 -0.15 6.68 1.01 0.02 0.43 121.20 134.26 2vas s ILE 95 Ca 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.64 2vas s ILE 95 Cb -0.11 -3.08 0.03 0.00 0.01 0.00 0.00 42.46 39.30 2vas s ILE 95 CO -0.01 0.49 -0.12 0.00 0.00 0.00 0.00 174.94 175.29 2vas s ALA 96 N 0.18 1.79 -0.26 9.38 0.00 -0.29 -1.92 121.76 130.64 2vas s ALA 96 Ca 0.04 -0.89 -0.10 0.00 0.00 0.00 0.00 51.96 51.00 2vas s ALA 96 Cb -0.12 -1.07 -0.05 0.00 0.00 0.00 0.00 23.12 21.88 2vas s ALA 96 CO 0.01 -0.46 0.16 0.08 0.00 0.00 0.00 175.76 175.55 2vas s VAL 97 N 1.51 5.19 -0.10 0.00 1.01 -0.48 0.32 120.40 127.84 2vas s VAL 97 Ca 0.04 0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.85 2vas s VAL 97 Cb -0.13 -3.45 -0.08 0.00 0.00 0.00 0.00 36.38 32.72 2vas s VAL 97 CO -0.10 0.30 2.08 -3.20 0.00 0.00 0.00 175.10 174.18 2vas n ASN 98 N 4.74 3.60 0.13 3.32 2.85 0.27 -4.77 115.26 125.40 2vas n ASN 98 Ca -0.15 0.59 0.13 0.00 -0.11 0.00 0.00 54.58 55.04 2vas n ASN 98 Cb 0.52 -1.51 0.35 0.00 1.24 0.00 0.00 39.78 40.39 2vas n ASN 98 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2vas h PRO 99 N 12.40 0.00 -2.21 1.20 0.13 -1.93 -3.41 132.00 138.19 2vas h PRO 99 Ca -0.45 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.34 2vas h PRO 99 Cb 1.25 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.30 2vas h PRO 99 CO 0.95 0.00 -0.37 0.66 -0.23 0.00 0.00 178.00 179.01 2vas n TYR 100 N -2.45 -0.66 -3.90 1.56 0.53 -1.26 -4.16 117.16 106.84 2vas n TYR 100 Ca 0.05 0.00 -0.08 0.00 -1.02 0.00 0.00 57.90 56.85 2vas n TYR 100 Cb 0.45 -3.20 -0.03 0.00 -1.03 0.00 0.00 39.34 35.52 2vas n TYR 100 CO 0.00 0.00 0.00 -0.59 -1.02 0.00 0.00 176.86 175.25 2vas s PHE 101 N -2.63 0.02 -0.50 -0.72 -0.12 -1.26 -4.56 117.98 108.21 2vas s PHE 101 Ca 0.00 -0.43 -0.23 0.00 -0.05 0.00 0.00 56.93 56.22 2vas s PHE 101 Cb 0.00 0.49 0.04 0.00 -0.63 0.00 0.00 43.02 42.92 2vas s PHE 101 CO 0.00 -1.12 0.84 -0.51 -0.05 0.00 0.00 175.22 174.38 2vas s ASP 102 N -2.95 6.36 -0.03 1.98 -0.00 -1.26 -5.04 116.67 115.73 2vas s ASP 102 Ca 0.15 -0.30 -0.30 0.00 -0.00 0.00 0.00 52.55 52.10 2vas s ASP 102 Cb -0.04 -2.40 -0.03 0.00 -0.00 0.00 0.00 42.92 40.45 2vas s ASP 102 CO 0.07 -1.06 1.04 -0.63 -0.00 0.00 0.00 175.17 174.59 2vas s ILE 103 N 3.53 4.67 0.21 0.77 1.01 -1.26 -5.00 121.20 125.13 2vas s ILE 103 Ca 0.29 1.92 -0.21 0.00 0.00 0.00 0.00 60.65 62.65 2vas s ILE 103 Cb -0.13 -4.23 0.16 0.00 0.01 0.00 0.00 42.46 38.27 2vas s ILE 103 CO 0.20 0.09 1.55 -0.65 0.00 0.00 0.00 174.94 176.13 2vas h PRO 104 N 6.95 -0.00 0.00 2.79 0.10 -1.99 -3.32 132.00 136.53 2vas h PRO 104 Ca -0.38 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.72 2vas h PRO 104 Cb 1.19 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.29 2vas h PRO 104 CO 0.80 -0.00 -1.06 1.63 0.10 0.00 0.00 178.00 179.47 2vas n LYS 105 N -5.42 1.74 0.14 1.05 4.01 -1.26 -4.79 118.16 113.63 2vas n LYS 105 Ca 0.08 -0.06 0.14 0.00 -0.51 0.00 0.00 58.31 57.97 2vas n LYS 105 Cb 0.36 -1.15 0.68 0.00 -0.51 0.00 0.00 35.03 34.42 2vas n LYS 105 CO 0.00 0.00 0.00 0.82 -1.11 0.00 0.00 177.40 177.11 2vas h ILE 106 N 0.00 0.82 -0.06 -0.18 1.08 -2.01 -2.34 117.51 114.83 2vas h ILE 106 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2vas h ILE 106 Cb 0.39 0.86 0.00 0.00 -3.07 0.00 0.00 36.82 35.01 2vas h ILE 106 CO 0.00 0.00 0.00 -1.22 -0.69 0.00 0.00 178.15 176.24 2vas n TYR 107 N -4.39 0.08 -2.25 1.37 4.02 -1.26 -4.86 117.16 109.87 2vas n TYR 107 Ca 0.03 -0.51 -0.35 0.00 -0.01 0.00 0.00 57.90 57.06 2vas n TYR 107 Cb 0.35 -0.05 0.00 0.00 -0.02 0.00 0.00 39.34 39.62 2vas n TYR 107 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2vas s SER 108 N -1.05 5.75 0.45 7.72 1.04 -0.88 -4.83 113.70 121.90 2vas s SER 108 Ca 0.05 2.12 0.17 0.00 0.48 0.00 0.00 55.95 58.76 2vas s SER 108 Cb 0.03 -2.57 1.11 0.00 0.10 0.00 0.00 66.02 64.69 2vas s SER 108 CO 0.03 -1.20 1.97 0.28 0.98 0.00 0.00 173.24 175.30 2vas h SER 109 N 1.12 0.29 -0.63 7.02 0.02 -1.97 0.39 113.55 119.80 2vas h SER 109 Ca -0.50 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.43 2vas h SER 109 Cb 1.25 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.72 2vas h SER 109 CO 0.57 0.17 0.24 -0.08 -1.14 0.00 0.00 176.83 176.59 2vas h GLU 110 N 0.32 0.95 -0.53 3.45 4.81 -1.94 -2.53 114.58 119.12 2vas h GLU 110 Ca 0.28 -0.18 -0.08 0.00 -0.13 0.00 0.00 59.36 59.25 2vas h GLU 110 Cb 0.69 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 2vas h GLU 110 CO -0.07 0.81 0.00 1.15 -0.73 0.00 0.00 179.01 180.17 2vas h THR 111 N 0.89 1.25 -0.71 0.32 2.02 -1.25 -2.86 112.91 112.57 2vas h THR 111 Ca 0.21 -1.07 0.07 0.00 0.77 0.00 0.00 66.41 66.39 2vas h THR 111 Cb 0.22 0.84 -0.06 0.00 -1.74 0.00 0.00 68.15 67.41 2vas h THR 111 CO -0.02 0.38 0.38 0.40 0.37 0.00 0.00 175.52 177.04 2vas h ILE 112 N 0.84 0.93 -0.77 3.11 2.04 -0.92 -2.58 117.51 120.15 2vas h ILE 112 Ca 0.16 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 2vas h ILE 112 Cb 0.50 0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 2vas h ILE 112 CO 0.02 0.13 0.42 0.11 0.00 0.00 0.00 178.15 178.82 2vas h LYS 113 N 0.69 1.09 0.00 2.37 1.57 -1.24 -2.97 116.57 118.07 2vas h LYS 113 Ca 0.33 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2vas h LYS 113 Cb 0.25 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2vas h LYS 113 CO -0.21 0.81 0.00 -1.13 -0.57 0.00 0.00 179.45 178.35 2vas n SER 114 N -4.42 0.30 -0.00 0.86 3.41 -0.98 -2.10 113.62 110.68 2vas n SER 114 Ca 0.07 0.59 0.10 0.00 -0.26 0.00 0.00 58.87 59.37 2vas n SER 114 Cb 0.10 -0.65 -0.14 0.00 -0.26 0.00 0.00 64.21 63.26 2vas n SER 114 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2vas n TYR 115 N -1.85 0.00 -1.68 7.33 4.01 -1.12 -4.89 117.16 118.96 2vas n TYR 115 Ca 0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.34 2vas n TYR 115 Cb 0.14 -0.25 -0.03 0.00 -0.31 0.00 0.00 39.34 38.89 2vas n TYR 115 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2vas n GLN 116 N -1.86 2.85 0.00 -0.72 6.02 -0.89 -2.54 117.38 120.23 2vas n GLN 116 Ca -0.00 1.04 0.00 0.00 -0.01 0.00 0.00 57.00 58.03 2vas n GLN 116 Cb 0.43 -2.96 0.00 0.00 1.02 0.00 0.00 30.24 28.73 2vas n GLN 116 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2vas n GLY 117 N 4.36 2.35 3.77 1.08 0.00 -1.26 -5.03 105.19 110.46 2vas n GLY 117 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 2vas n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vas s LYS 118 N -0.43 4.67 0.61 1.61 -0.14 -1.05 -5.06 119.74 119.96 2vas s LYS 118 Ca 0.00 1.30 -0.13 0.00 -1.36 0.00 0.00 55.97 55.77 2vas s LYS 118 Cb 0.00 -3.20 -0.03 0.00 -1.68 0.00 0.00 37.83 32.92 2vas s LYS 118 CO 0.00 0.51 1.04 -1.12 -0.76 0.00 0.00 175.35 175.02 2vas s SER 119 N -1.24 5.93 0.22 2.83 0.01 -1.26 -4.78 113.70 115.40 2vas s SER 119 Ca 0.40 1.62 -0.32 0.00 1.31 0.00 0.00 55.95 58.96 2vas s SER 119 Cb -0.23 -2.50 -0.13 0.00 0.21 0.00 0.00 66.02 63.37 2vas s SER 119 CO 0.28 -1.07 1.64 0.18 0.41 0.00 0.00 173.24 174.68 2vas n LEU 120 N -2.43 3.78 0.00 2.44 4.77 -1.26 -2.40 117.00 121.90 2vas n LEU 120 Ca 0.07 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 57.14 2vas n LEU 120 Cb 0.54 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 2vas n LEU 120 CO 0.52 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 2vas n GLY 121 N 3.36 0.79 0.03 -0.72 0.00 -1.26 -4.87 105.19 102.51 2vas n GLY 121 Ca 0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 2vas n GLY 121 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vas n THR 122 N -2.00 0.16 -4.30 2.61 -2.24 -1.01 -4.85 114.28 102.65 2vas n THR 122 Ca 0.00 -0.14 -0.18 0.00 -2.27 0.00 0.00 64.05 61.46 2vas n THR 122 Cb 0.00 0.10 -0.11 0.00 -2.10 0.00 0.00 70.33 68.23 2vas n THR 122 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2vas s MET 123 N -3.09 1.18 0.51 -0.78 -1.94 -1.26 -5.04 119.30 108.88 2vas s MET 123 Ca 0.08 -1.42 -0.20 0.00 -1.71 0.00 0.00 55.69 52.44 2vas s MET 123 Cb 0.15 -1.02 -0.11 0.00 2.01 0.00 0.00 34.83 35.87 2vas s MET 123 CO 0.72 0.18 0.50 -2.30 -0.01 0.00 0.00 175.02 174.11 2vas n PRO 124 N 0.06 0.52 -1.72 2.03 -0.02 -1.26 -4.89 135.00 129.73 2vas n PRO 124 Ca -0.12 0.20 -0.43 0.00 -2.02 0.00 0.00 63.50 61.14 2vas n PRO 124 Cb 0.59 -1.59 -0.01 0.00 -0.02 0.00 0.00 33.50 32.46 2vas n PRO 124 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2vas n PRO 125 N 0.30 2.36 -3.57 0.52 -0.02 -1.26 -4.93 135.00 128.40 2vas n PRO 125 Ca 0.11 0.83 -0.14 0.00 -2.02 0.00 0.00 63.50 62.28 2vas n PRO 125 Cb 0.45 -2.52 -0.06 0.00 -0.02 0.00 0.00 33.50 31.35 2vas n PRO 125 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2vas s HIS 126 N -0.50 -0.59 0.51 6.00 2.46 -1.26 -4.68 115.29 117.22 2vas s HIS 126 Ca 0.61 1.17 0.22 0.00 0.47 0.00 0.00 55.06 57.53 2vas s HIS 126 Cb -0.55 0.39 1.31 0.00 -0.13 0.00 0.00 32.58 33.59 2vas s HIS 126 CO 0.55 -0.46 2.01 -0.24 -2.47 0.00 0.00 174.74 174.13 2vas h VAL 127 N 3.15 0.79 -0.28 0.89 3.04 -1.98 -1.94 116.25 119.93 2vas h VAL 127 Ca -0.25 -0.03 -0.05 0.00 -1.01 0.00 0.00 66.70 65.35 2vas h VAL 127 Cb 1.15 0.70 -0.02 0.00 -2.01 0.00 0.00 31.29 31.12 2vas h VAL 127 CO 0.27 0.01 -0.06 -0.26 -1.01 0.00 0.00 177.57 176.53 2vas h PHE 128 N 0.08 0.46 -0.17 3.17 0.04 -1.95 -1.70 116.94 116.87 2vas h PHE 128 Ca 0.23 -0.05 -0.11 0.00 2.80 0.00 0.00 57.97 60.84 2vas h PHE 128 Cb 0.82 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.82 2vas h PHE 128 CO -0.00 0.50 -0.38 0.00 -0.60 0.00 0.00 178.31 177.83 2vas h ALA 129 N 1.52 1.03 -0.28 2.45 0.00 -1.70 -0.77 119.26 121.51 2vas h ALA 129 Ca 0.09 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 2vas h ALA 129 Cb 0.37 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2vas h ALA 129 CO 0.02 0.60 -0.21 0.82 0.00 0.00 0.00 179.25 180.48 2vas h ILE 130 N 0.32 1.30 -0.70 0.00 1.08 -1.42 -1.97 117.51 116.12 2vas h ILE 130 Ca 0.03 -1.35 -0.05 0.00 -0.39 0.00 0.00 64.86 63.11 2vas h ILE 130 Cb 0.81 1.56 -0.03 0.00 -3.07 0.00 0.00 36.82 36.09 2vas h ILE 130 CO 0.07 0.43 0.23 0.00 -0.69 0.00 0.00 178.15 178.18 2vas h ALA 131 N 0.72 1.10 -0.36 1.87 0.00 -1.20 -2.16 119.26 119.23 2vas h ALA 131 Ca 0.05 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2vas h ALA 131 Cb 0.75 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2vas h ALA 131 CO 0.06 0.62 0.00 0.22 0.00 0.00 0.00 179.25 180.15 2vas h ASP 132 N 1.02 0.62 -0.49 0.00 3.58 -1.10 -2.66 116.42 117.40 2vas h ASP 132 Ca 0.23 -0.31 0.01 0.00 0.42 0.00 0.00 57.03 57.38 2vas h ASP 132 Cb 0.26 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.12 2vas h ASP 132 CO -0.01 0.78 0.33 0.50 -2.88 0.00 0.00 179.24 177.95 2vas h LYS 133 N 0.45 0.63 -0.25 0.28 3.64 -1.26 -0.90 116.57 119.16 2vas h LYS 133 Ca 0.10 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2vas h LYS 133 Cb 0.46 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 2vas h LYS 133 CO 0.02 0.42 0.07 0.00 -2.27 0.00 0.00 179.45 177.69 2vas h ALA 134 N 1.70 0.33 -0.02 5.00 0.00 -1.13 -1.11 119.26 124.02 2vas h ALA 134 Ca 0.18 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2vas h ALA 134 Cb -0.06 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 2vas h ALA 134 CO -0.04 -0.04 0.01 0.35 0.00 0.00 0.00 179.25 179.53 2vas h PHE 135 N 0.24 0.04 -0.83 0.00 3.57 -1.12 -1.72 116.94 117.12 2vas h PHE 135 Ca 0.08 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.66 2vas h PHE 135 Cb 0.25 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 38.91 2vas h PHE 135 CO 0.01 0.26 0.48 0.00 -2.23 0.00 0.00 178.31 176.83 2vas h ARG 136 N -0.19 0.81 -0.07 1.11 3.08 -1.17 -0.25 114.38 117.69 2vas h ARG 136 Ca 0.01 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 59.87 2vas h ARG 136 Cb 0.24 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2vas h ARG 136 CO 0.00 0.53 -0.57 -0.44 -1.07 0.00 0.00 179.97 178.43 2vas h ASP 137 N 0.83 0.25 -0.08 7.04 3.45 -1.15 -1.65 116.42 125.09 2vas h ASP 137 Ca 0.39 -0.13 -0.00 0.00 0.43 0.00 0.00 57.03 57.71 2vas h ASP 137 Cb 0.31 -0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.00 2vas h ASP 137 CO -0.23 0.76 0.04 -0.03 -1.57 0.00 0.00 179.24 178.22 2vas h MET 138 N 0.17 0.12 -0.18 3.56 4.05 -0.44 -0.81 114.93 121.41 2vas h MET 138 Ca -0.00 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.38 2vas h MET 138 Cb 1.05 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.82 2vas h MET 138 CO 0.09 0.21 0.04 -0.22 0.23 0.00 0.00 176.91 177.27 2vas h LYS 139 N 0.00 0.28 0.18 0.39 3.64 -0.98 -2.02 116.57 118.07 2vas h LYS 139 Ca 0.03 -0.07 -0.25 0.00 -1.27 0.00 0.00 60.65 59.09 2vas h LYS 139 Cb 0.13 -0.04 0.03 0.00 -0.41 0.00 0.00 32.23 31.94 2vas h LYS 139 CO -0.00 0.42 -1.13 0.28 -2.27 0.00 0.00 179.45 176.74 2vas h VAL 140 N 0.10 1.38 -0.01 2.00 2.07 -1.37 -3.35 116.25 117.06 2vas h VAL 140 Ca 0.06 -2.59 0.00 0.00 0.82 0.00 0.00 66.70 64.99 2vas h VAL 140 Cb 0.26 3.10 0.00 0.00 -1.52 0.00 0.00 31.29 33.13 2vas h VAL 140 CO 0.00 0.76 -0.37 0.18 0.02 0.00 0.00 177.57 178.16 2vas n LEU 141 N -3.94 1.14 -3.62 2.57 4.77 -0.31 -4.95 117.00 112.66 2vas n LEU 141 Ca -0.16 -0.33 -0.21 0.00 -0.03 0.00 0.00 56.01 55.28 2vas n LEU 141 Cb 0.94 -0.11 0.06 0.00 -2.33 0.00 0.00 43.42 41.98 2vas n LEU 141 CO 0.53 0.22 0.04 0.29 -1.33 0.00 0.00 177.39 177.14 2vas n LYS 142 N -0.68 -5.89 -3.83 3.23 4.76 -0.76 -5.00 118.16 109.98 2vas n LYS 142 Ca 0.10 0.72 -0.14 0.00 -2.87 0.00 0.00 58.31 56.13 2vas n LYS 142 Cb 0.37 -5.53 -0.15 0.00 -1.84 0.00 0.00 35.03 27.88 2vas n LYS 142 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 2vas s LEU 143 N -6.69 1.49 0.71 -0.35 2.96 -1.20 -5.08 118.68 110.52 2vas s LEU 143 Ca 0.13 0.02 -0.16 0.00 -0.22 0.00 0.00 54.13 53.89 2vas s LEU 143 Cb -0.06 -0.05 0.02 0.00 0.50 0.00 0.00 46.19 46.59 2vas s LEU 143 CO 0.78 -0.07 1.15 -1.20 -1.32 0.00 0.00 176.35 175.68 2vas n SER 144 N 3.69 1.22 -4.17 3.68 7.64 -1.26 -3.99 113.62 120.43 2vas n SER 144 Ca -0.21 0.72 -0.22 0.00 1.01 0.00 0.00 58.87 60.17 2vas n SER 144 Cb 0.54 -1.49 -0.14 0.00 -1.01 0.00 0.00 64.21 62.12 2vas n SER 144 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2vas s GLN 145 N -3.50 1.10 0.07 1.43 -1.52 -0.45 -1.79 119.66 115.00 2vas s GLN 145 Ca 0.77 -0.77 0.08 0.00 -1.95 0.00 0.00 55.36 53.49 2vas s GLN 145 Cb -0.35 -1.12 -0.03 0.00 -0.22 0.00 0.00 33.01 31.29 2vas s GLN 145 CO 0.46 0.29 -0.20 -1.54 -0.25 0.00 0.00 175.29 174.05 2vas s SER 146 N -1.01 2.46 -0.21 5.90 1.04 -0.12 -0.49 113.70 121.28 2vas s SER 146 Ca 0.04 -0.61 0.01 0.00 0.48 0.00 0.00 55.95 55.87 2vas s SER 146 Cb -0.08 -0.16 0.05 0.00 0.10 0.00 0.00 66.02 65.93 2vas s SER 146 CO 0.01 0.10 -0.08 -0.63 0.98 0.00 0.00 173.24 173.62 2vas s ILE 147 N -1.00 1.53 -0.36 -1.02 1.01 0.33 -1.25 121.20 120.44 2vas s ILE 147 Ca 0.06 -1.04 -0.13 0.00 0.00 0.00 0.00 60.65 59.55 2vas s ILE 147 Cb -0.09 -1.69 -0.00 0.00 0.01 0.00 0.00 42.46 40.69 2vas s ILE 147 CO 0.03 0.06 0.24 -0.63 0.00 0.00 0.00 174.94 174.65 2vas s ILE 148 N 1.43 5.15 -0.20 2.92 1.09 0.08 -1.23 121.20 130.43 2vas s ILE 148 Ca -0.03 -0.40 -0.03 0.00 -1.10 0.00 0.00 60.65 59.10 2vas s ILE 148 Cb -0.17 -3.72 -0.00 0.00 -1.06 0.00 0.00 42.46 37.51 2vas s ILE 148 CO -0.07 -0.09 -0.08 0.54 -0.10 0.00 0.00 174.94 175.13 2vas s VAL 149 N 1.69 3.13 0.37 2.92 0.11 -0.56 -1.50 120.40 126.57 2vas s VAL 149 Ca 0.05 -0.58 0.04 0.00 -2.93 0.00 0.00 61.98 58.56 2vas s VAL 149 Cb -0.18 -2.40 -0.05 0.00 -1.53 0.00 0.00 36.38 32.23 2vas s VAL 149 CO 0.10 0.45 0.08 -0.55 -3.33 0.00 0.00 175.10 171.85 2vas s SER 150 N 1.30 2.72 0.00 3.54 0.15 -0.82 -4.03 113.70 116.57 2vas s SER 150 Ca 0.04 -1.50 0.00 0.00 0.70 0.00 0.00 55.95 55.18 2vas s SER 150 Cb -0.14 0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 2vas s SER 150 CO -0.04 -0.73 0.00 0.61 1.20 0.00 0.00 173.24 174.28 2vas n GLY 151 N -0.82 2.65 3.93 9.45 0.00 -1.26 -0.46 105.19 118.68 2vas n GLY 151 Ca -0.05 -1.56 -0.27 0.00 0.00 0.00 0.00 46.02 44.14 2vas n GLY 151 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2vas s GLU 152 N -1.94 1.71 0.07 1.61 -1.05 -1.26 -1.55 118.70 116.29 2vas s GLU 152 Ca 0.00 -0.33 -0.35 0.00 -0.15 0.00 0.00 54.97 54.14 2vas s GLU 152 Cb 0.00 -2.07 -0.14 0.00 -0.44 0.00 0.00 34.13 31.48 2vas s GLU 152 CO 0.00 -1.62 1.63 0.45 0.95 0.00 0.00 175.26 176.67 2vas n SER 153 N -3.19 2.95 0.00 0.83 2.88 -1.26 -1.55 113.62 114.28 2vas n SER 153 Ca 0.11 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 2vas n SER 153 Cb 0.60 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 2vas n SER 153 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2vas n GLY 154 N 3.57 0.83 0.13 0.46 0.00 -1.26 -4.81 105.19 104.11 2vas n GLY 154 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 2vas n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vas h ALA 155 N 0.00 0.86 0.00 4.61 0.00 -1.61 -3.44 119.26 119.68 2vas h ALA 155 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2vas h ALA 155 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2vas h ALA 155 CO 0.00 0.82 0.00 0.41 0.00 0.00 0.00 179.25 180.48 2vas n GLY 156 N 0.41 1.22 0.11 0.00 0.00 -1.26 -3.89 105.19 101.78 2vas n GLY 156 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 2vas n GLY 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vas h LYS 157 N 0.00 0.20 -0.25 1.61 1.57 -1.89 -1.92 116.57 115.89 2vas h LYS 157 Ca 0.00 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 2vas h LYS 157 Cb 0.00 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 2vas h LYS 157 CO 0.00 0.14 -0.01 1.15 -0.57 0.00 0.00 179.45 180.16 2vas h THR 158 N 0.21 1.26 -0.38 -0.16 2.02 -1.97 -0.43 112.91 113.46 2vas h THR 158 Ca 0.08 -0.92 0.00 0.00 0.77 0.00 0.00 66.41 66.34 2vas h THR 158 Cb 0.02 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 2vas h THR 158 CO -0.05 0.29 0.25 -0.33 0.37 0.00 0.00 175.52 176.04 2vas h GLU 159 N 0.23 0.51 -0.30 6.66 4.39 -1.99 -1.16 114.58 122.92 2vas h GLU 159 Ca 0.07 -0.04 -0.12 0.00 0.34 0.00 0.00 59.36 59.62 2vas h GLU 159 Cb 0.43 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 2vas h GLU 159 CO 0.01 0.35 -0.29 -0.91 -1.16 0.00 0.00 179.01 177.02 2vas h ASN 160 N 0.51 0.64 -0.29 1.42 2.35 -1.28 0.11 115.58 119.06 2vas h ASN 160 Ca 0.14 -0.25 0.03 0.00 -0.55 0.00 0.00 56.30 55.67 2vas h ASN 160 Cb -0.04 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 2vas h ASN 160 CO -0.03 0.90 0.11 0.74 -1.65 0.00 0.00 177.43 177.50 2vas h THR 161 N 0.54 0.94 -0.76 2.81 2.02 -0.89 -0.74 112.91 116.83 2vas h THR 161 Ca 0.07 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 2vas h THR 161 Cb 0.77 0.67 -0.04 0.00 -1.74 0.00 0.00 68.15 67.82 2vas h THR 161 CO 0.06 0.04 0.43 0.50 0.37 0.00 0.00 175.52 176.93 2vas h LYS 162 N 0.24 1.04 -0.63 6.66 3.64 -0.95 -1.42 116.57 125.14 2vas h LYS 162 Ca 0.12 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2vas h LYS 162 Cb 0.08 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.66 2vas h LYS 162 CO -0.12 0.75 0.37 0.74 -2.27 0.00 0.00 179.45 178.92 2vas h PHE 163 N 1.05 0.85 0.15 1.91 0.05 -0.47 -0.67 116.94 119.80 2vas h PHE 163 Ca 0.27 -0.01 0.01 0.00 3.82 0.00 0.00 57.97 62.06 2vas h PHE 163 Cb 0.00 -0.28 -0.02 0.00 2.00 0.00 0.00 35.95 37.66 2vas h PHE 163 CO 0.01 0.59 -0.16 0.28 -0.18 0.00 0.00 178.31 178.84 2vas h VAL 164 N 0.86 0.63 -0.88 -0.55 2.07 -0.76 -0.78 116.25 116.85 2vas h VAL 164 Ca 0.23 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.73 2vas h VAL 164 Cb -0.00 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 2vas h VAL 164 CO -0.04 0.00 0.48 -0.07 0.02 0.00 0.00 177.57 177.96 2vas h LEU 165 N -0.35 1.10 -0.65 2.57 3.38 -1.08 -0.79 115.31 119.49 2vas h LEU 165 Ca 0.01 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2vas h LEU 165 Cb 0.34 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2vas h LEU 165 CO -0.05 0.88 0.29 -0.09 0.09 0.00 0.00 178.44 179.55 2vas h ARG 166 N 1.23 0.95 -0.19 1.13 2.43 -1.08 -2.63 114.38 116.22 2vas h ARG 166 Ca 0.31 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 2vas h ARG 166 Cb 0.03 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 2vas h ARG 166 CO -0.05 0.78 0.08 -0.92 -1.51 0.00 0.00 179.97 178.34 2vas h TYR 167 N 0.90 0.28 -0.11 2.20 3.20 0.01 -1.45 116.97 122.00 2vas h TYR 167 Ca 0.22 -0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.98 2vas h TYR 167 Cb 0.16 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 2vas h TYR 167 CO 0.01 0.33 -0.32 -0.07 -1.64 0.00 0.00 178.16 176.47 2vas h LEU 168 N 0.15 0.21 0.09 2.82 3.38 -1.23 -2.11 115.31 118.62 2vas h LEU 168 Ca 0.06 -0.07 -0.18 0.00 0.09 0.00 0.00 57.88 57.78 2vas h LEU 168 Cb 0.16 -0.06 0.02 0.00 0.09 0.00 0.00 40.66 40.87 2vas h LEU 168 CO -0.01 0.53 -0.75 0.00 0.09 0.00 0.00 178.44 178.30 2vas h THR 169 N 0.19 1.47 0.00 0.22 1.03 -1.35 -0.23 112.91 114.24 2vas h THR 169 Ca 0.03 -2.36 -0.02 0.00 -0.01 0.00 0.00 66.41 64.05 2vas h THR 169 Cb 0.66 2.96 -0.00 0.00 -1.07 0.00 0.00 68.15 70.69 2vas h THR 169 CO 0.05 0.68 -0.08 -0.33 -0.01 0.00 0.00 175.52 175.83 2vas h GLU 170 N -0.24 0.00 0.00 0.00 5.08 -1.25 -2.42 114.58 115.75 2vas h GLU 170 Ca -0.12 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.86 2vas h GLU 170 Cb 1.53 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.71 2vas h GLU 170 CO 0.14 0.08 -2.44 0.43 -1.00 0.00 0.00 179.01 176.22 2vas n SER 171 N -3.17 1.55 -0.15 1.42 7.64 -0.80 -4.70 113.62 115.41 2vas n SER 171 Ca 0.01 -0.10 0.01 0.00 1.01 0.00 0.00 58.87 59.81 2vas n SER 171 Cb 0.41 -0.11 0.02 0.00 -1.01 0.00 0.00 64.21 63.51 2vas n SER 171 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2vas n TYR 172 N -3.15 0.00 -0.92 1.43 4.02 -0.11 -5.08 117.16 113.35 2vas n TYR 172 Ca -0.43 -0.22 -0.14 0.00 -0.01 0.00 0.00 57.90 57.10 2vas n TYR 172 Cb 1.03 -0.04 0.11 0.00 -0.02 0.00 0.00 39.34 40.42 2vas n TYR 172 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2vas n GLY 173 N -0.28 -2.30 0.11 2.72 0.00 -0.91 -4.39 105.19 100.14 2vas n GLY 173 Ca 0.02 -1.52 -0.21 0.00 0.00 0.00 0.00 46.02 44.31 2vas n GLY 173 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2vas n THR 174 N -3.45 1.52 0.05 2.61 -1.04 -1.26 -4.86 114.28 107.85 2vas n THR 174 Ca 0.07 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 2vas n THR 174 Cb 0.28 -2.05 0.00 0.00 -1.82 0.00 0.00 70.33 66.74 2vas n THR 174 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2vas n GLY 175 N 1.42 -1.85 0.00 3.41 0.00 -1.26 -5.01 105.19 101.90 2vas n GLY 175 Ca -0.33 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2vas n GLY 175 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2vas n GLN 176 N -2.63 -0.45 0.00 1.61 3.00 -1.26 -5.11 117.38 112.54 2vas n GLN 176 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2vas n GLN 176 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 2vas n GLN 176 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2vas n ASP 177 N 3.00 2.12 -0.08 1.08 2.03 -1.26 -3.05 116.55 120.40 2vas n ASP 177 Ca 0.00 0.00 0.10 0.00 0.52 0.00 0.00 54.79 55.41 2vas n ASP 177 Cb 0.00 0.19 0.48 0.00 -0.72 0.00 0.00 41.12 41.07 2vas n ASP 177 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 2vas h ILE 178 N 0.00 0.93 0.29 5.18 2.10 -1.99 -3.09 117.51 120.93 2vas h ILE 178 Ca 0.00 -0.16 -0.01 0.00 1.08 0.00 0.00 64.86 65.78 2vas h ILE 178 Cb 0.44 0.44 -0.01 0.00 -1.09 0.00 0.00 36.82 36.60 2vas h ILE 178 CO 0.00 0.08 -0.21 0.44 -1.08 0.00 0.00 178.15 177.38 2vas h ASP 179 N 0.45 -0.54 -0.90 2.19 5.19 -1.94 -0.90 116.42 119.97 2vas h ASP 179 Ca 0.26 0.04 0.09 0.00 -0.62 0.00 0.00 57.03 56.80 2vas h ASP 179 Cb 0.44 0.17 -0.07 0.00 0.18 0.00 0.00 39.33 40.05 2vas h ASP 179 CO -0.07 -0.33 0.55 0.44 -3.12 0.00 0.00 179.24 176.71 2vas h ASP 180 N -0.50 0.82 -0.37 6.45 5.19 -1.64 -2.38 116.42 123.99 2vas h ASP 180 Ca -0.02 0.04 -0.07 0.00 -0.62 0.00 0.00 57.03 56.36 2vas h ASP 180 Cb 0.43 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.79 2vas h ASP 180 CO 0.00 0.48 0.01 0.03 -3.12 0.00 0.00 179.24 176.64 2vas h ARG 181 N 0.94 0.75 -0.63 3.56 3.08 -1.38 -1.42 114.38 119.27 2vas h ARG 181 Ca 0.42 -0.19 -0.07 0.00 0.07 0.00 0.00 59.98 60.21 2vas h ARG 181 Cb 0.32 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 2vas h ARG 181 CO -0.22 0.75 0.11 0.82 -1.07 0.00 0.00 179.97 180.36 2vas h ILE 182 N 0.70 1.26 -0.00 2.04 2.04 -0.66 -2.00 117.51 120.89 2vas h ILE 182 Ca 0.14 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 65.00 2vas h ILE 182 Cb 0.42 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 2vas h ILE 182 CO 0.02 0.37 -0.16 1.33 0.00 0.00 0.00 178.15 179.71 2vas n VAL 183 N -4.28 0.00 0.87 1.67 0.24 -1.08 -3.43 118.33 112.33 2vas n VAL 183 Ca 0.04 -0.02 0.09 0.00 -2.04 0.00 0.00 64.34 62.41 2vas n VAL 183 Cb 0.28 -0.17 -0.02 0.00 -1.47 0.00 0.00 33.84 32.46 2vas n VAL 183 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2vas n GLU 184 N -1.27 1.32 -0.05 7.34 -0.58 -0.56 -4.49 120.64 122.35 2vas n GLU 184 Ca 0.10 -0.74 -0.13 0.00 -0.42 0.00 0.00 57.16 55.97 2vas n GLU 184 Cb 0.31 -1.39 -0.07 0.00 -0.57 0.00 0.00 31.44 29.72 2vas n GLU 184 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2vas h ALA 185 N 3.26 0.18 0.75 0.62 0.00 -1.39 -3.10 119.26 119.57 2vas h ALA 185 Ca 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 2vas h ALA 185 Cb 0.62 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.38 2vas h ALA 185 CO 0.00 -0.01 -0.36 -0.91 0.00 0.00 0.00 179.25 177.97 2vas h ASN 186 N -0.09 -0.85 -1.25 0.00 2.35 -1.79 -2.51 115.58 111.45 2vas h ASN 186 Ca 0.03 0.01 0.36 0.00 -0.55 0.00 0.00 56.30 56.15 2vas h ASN 186 Cb 0.57 0.22 -0.05 0.00 0.05 0.00 0.00 38.32 39.11 2vas h ASN 186 CO 0.02 -0.54 0.93 -0.65 -1.65 0.00 0.00 177.43 175.55 2vas h PRO 187 N -1.12 0.00 0.24 0.81 0.11 -1.80 -1.59 132.00 128.66 2vas h PRO 187 Ca -0.10 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.67 2vas h PRO 187 Cb 0.79 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.93 2vas h PRO 187 CO 0.17 0.00 -1.54 1.25 -0.21 0.00 0.00 178.00 177.67 2vas h LEU 188 N 0.00 0.80 -1.59 2.35 5.85 -1.43 -3.30 115.31 117.99 2vas h LEU 188 Ca 0.59 -0.93 -0.04 0.00 0.84 0.00 0.00 57.88 58.35 2vas h LEU 188 Cb 2.46 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 43.22 2vas h LEU 188 CO -0.01 1.73 -0.12 -0.07 -0.34 0.00 0.00 178.44 179.63 2vas h LEU 189 N 0.13 0.10 -1.25 2.25 3.38 -0.89 -3.02 115.31 116.01 2vas h LEU 189 Ca -0.28 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 2vas h LEU 189 Cb 2.15 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.86 2vas h LEU 189 CO 0.25 0.24 -0.24 -0.33 0.09 0.00 0.00 178.44 178.45 2vas h GLU 190 N 0.11 0.20 -0.93 1.13 5.08 -1.41 0.16 114.58 118.92 2vas h GLU 190 Ca 0.02 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2vas h GLU 190 Cb 0.29 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 2vas h GLU 190 CO 0.02 0.44 0.61 0.00 -1.00 0.00 0.00 179.01 179.08 2vas h ALA 191 N 1.57 1.40 0.00 3.43 0.00 -1.61 -0.27 119.26 123.78 2vas h ALA 191 Ca 0.03 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2vas h ALA 191 Cb 0.54 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2vas h ALA 191 CO 0.04 0.51 -1.66 1.19 0.00 0.00 0.00 179.25 179.33 2vas n PHE 192 N -4.44 0.50 0.23 0.00 3.01 -0.93 -0.58 117.46 115.24 2vas n PHE 192 Ca 0.12 0.16 0.03 0.00 1.01 0.00 0.00 57.45 58.77 2vas n PHE 192 Cb 0.10 -0.84 -0.04 0.00 -0.01 0.00 0.00 39.48 38.69 2vas n PHE 192 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vas n GLY 193 N 1.35 0.25 3.84 1.37 0.00 0.50 -4.89 105.19 107.61 2vas n GLY 193 Ca -0.09 -0.17 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 2vas n GLY 193 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2vas s ASN 194 N -1.85 5.78 -0.02 1.61 0.02 -0.12 -1.02 114.94 119.34 2vas s ASN 194 Ca 0.01 -0.02 -0.23 0.00 -1.02 0.00 0.00 52.86 51.60 2vas s ASN 194 Cb 0.05 -1.60 0.05 0.00 0.02 0.00 0.00 41.25 39.77 2vas s ASN 194 CO 0.26 0.07 0.51 0.00 0.02 0.00 0.00 177.10 177.96 2vas s ALA 195 N -1.72 -1.30 -0.04 0.60 0.00 -0.31 -1.80 121.76 117.19 2vas s ALA 195 Ca 0.32 0.82 -0.30 0.00 0.00 0.00 0.00 51.96 52.80 2vas s ALA 195 Cb -0.11 0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.05 2vas s ALA 195 CO 0.25 -0.34 1.18 0.21 0.00 0.00 0.00 175.76 177.06 2vas s LYS 196 N -1.38 4.37 0.27 0.00 2.20 -1.23 -1.37 119.74 122.60 2vas s LYS 196 Ca -0.11 1.66 0.06 0.00 -0.36 0.00 0.00 55.97 57.22 2vas s LYS 196 Cb -0.02 -3.53 -0.06 0.00 -1.51 0.00 0.00 37.83 32.71 2vas s LYS 196 CO 0.06 -0.40 -0.05 0.99 -0.36 0.00 0.00 175.35 175.59 2vas s THR 197 N 2.02 1.55 0.40 3.43 2.01 0.46 -1.55 115.64 123.96 2vas s THR 197 Ca 0.56 -2.11 0.17 0.00 0.31 0.00 0.00 61.69 60.61 2vas s THR 197 Cb -0.25 -2.43 0.17 0.00 0.01 0.00 0.00 72.50 70.01 2vas s THR 197 CO 0.23 -0.31 1.94 1.62 -0.69 0.00 0.00 174.62 177.41 2vas h VAL 198 N 2.31 1.04 0.00 3.82 3.04 -1.96 -3.10 116.25 121.41 2vas h VAL 198 Ca -0.40 -0.88 -0.05 0.00 -1.01 0.00 0.00 66.70 64.36 2vas h VAL 198 Cb 1.23 1.49 -0.01 0.00 -2.01 0.00 0.00 31.29 32.00 2vas h VAL 198 CO 0.67 0.24 -1.16 0.54 -1.01 0.00 0.00 177.57 176.85 2vas n ARG 199 N -4.05 0.61 -3.65 4.17 1.74 -1.26 -4.91 116.66 109.31 2vas n ARG 199 Ca -0.02 0.14 -0.04 0.00 -0.77 0.00 0.00 57.85 57.17 2vas n ARG 199 Cb 0.31 -1.81 -0.06 0.00 -1.02 0.00 0.00 32.46 29.88 2vas n ARG 199 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2vas s ASN 200 N -5.46 -0.89 0.60 0.55 2.47 -1.17 -4.41 114.94 106.62 2vas s ASN 200 Ca -0.02 1.41 0.36 0.00 0.42 0.00 0.00 52.86 55.03 2vas s ASN 200 Cb 0.09 1.92 1.89 0.00 -1.45 0.00 0.00 41.25 43.70 2vas s ASN 200 CO 0.80 -0.22 2.21 0.78 -3.72 0.00 0.00 177.10 176.95 2vas h ASN 201 N 7.89 0.00 -1.71 -4.21 2.35 -1.85 0.13 115.58 118.18 2vas h ASN 201 Ca -0.20 0.00 -0.51 0.00 -0.55 0.00 0.00 56.30 55.04 2vas h ASN 201 Cb 1.12 0.00 -0.41 0.00 0.05 0.00 0.00 38.32 39.08 2vas h ASN 201 CO 0.12 0.03 -0.93 -3.20 -1.65 0.00 0.00 177.43 171.81 2vas n ASN 202 N -3.38 2.98 -4.74 5.81 5.15 -1.26 -3.56 115.26 116.27 2vas n ASN 202 Ca -0.02 -3.31 -0.41 0.00 -0.60 0.00 0.00 54.58 50.24 2vas n ASN 202 Cb 0.15 -0.54 -0.04 0.00 -0.53 0.00 0.00 39.78 38.82 2vas n ASN 202 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2vas s SER 203 N -3.17 7.33 -0.26 1.20 0.15 -0.47 -4.77 113.70 113.71 2vas s SER 203 Ca 0.41 2.01 -0.29 0.00 0.70 0.00 0.00 55.95 58.78 2vas s SER 203 Cb 0.37 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 62.09 2vas s SER 203 CO -0.10 -0.18 1.10 -0.44 1.20 0.00 0.00 173.24 174.82 2vas s SER 204 N -0.07 6.99 -0.39 5.45 0.01 -1.26 -1.16 113.70 123.26 2vas s SER 204 Ca 0.49 1.27 0.06 0.00 1.31 0.00 0.00 55.95 59.08 2vas s SER 204 Cb -0.28 -2.54 0.65 0.00 0.21 0.00 0.00 66.02 64.06 2vas s SER 204 CO 0.33 -0.79 1.81 0.54 0.41 0.00 0.00 173.24 175.54 2vas n ARG 205 N 6.64 2.45 -3.56 12.44 5.12 -0.19 -4.90 116.66 134.67 2vas n ARG 205 Ca 0.12 -3.06 -0.12 0.00 -1.93 0.00 0.00 57.85 52.87 2vas n ARG 205 Cb 0.46 -2.12 -0.04 0.00 -1.16 0.00 0.00 32.46 29.61 2vas n ARG 205 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 2vas s PHE 206 N -3.23 -0.37 0.14 -1.55 -0.12 -1.26 -1.31 117.98 110.28 2vas s PHE 206 Ca 0.54 0.21 -0.04 0.00 -0.05 0.00 0.00 56.93 57.59 2vas s PHE 206 Cb 0.46 0.37 -0.05 0.00 -0.63 0.00 0.00 43.02 43.16 2vas s PHE 206 CO 0.09 -0.72 0.36 0.20 -0.05 0.00 0.00 175.22 175.10 2vas s GLY 207 N -2.50 2.18 0.02 1.99 0.00 0.80 -4.90 107.32 104.91 2vas s GLY 207 Ca -0.00 -0.63 0.01 0.00 0.00 0.00 0.00 44.72 44.10 2vas s GLY 207 CO -0.09 -0.56 -0.04 -1.59 0.00 0.00 0.00 173.10 170.82 2vas s LYS 208 N -2.72 0.35 -0.17 2.90 -2.85 -0.75 0.03 119.74 116.53 2vas s LYS 208 Ca 0.40 -0.55 0.01 0.00 -1.00 0.00 0.00 55.97 54.83 2vas s LYS 208 Cb -0.12 -0.06 0.01 0.00 -2.06 0.00 0.00 37.83 35.60 2vas s LYS 208 CO 0.26 -0.00 -0.19 0.12 0.10 0.00 0.00 175.35 175.64 2vas s PHE 209 N -1.16 2.77 -0.29 1.78 5.36 -0.46 -0.87 117.98 125.11 2vas s PHE 209 Ca -0.11 -1.48 -0.03 0.00 -0.96 0.00 0.00 56.93 54.35 2vas s PHE 209 Cb -0.08 -1.91 0.03 0.00 -0.34 0.00 0.00 43.02 40.72 2vas s PHE 209 CO -0.00 -0.72 0.00 0.08 -1.46 0.00 0.00 175.22 173.12 2vas s VAL 210 N 1.17 3.19 -0.19 3.12 1.01 -0.55 -0.92 120.40 127.23 2vas s VAL 210 Ca 0.02 -1.13 -0.10 0.00 0.00 0.00 0.00 61.98 60.76 2vas s VAL 210 Cb -0.14 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.46 2vas s VAL 210 CO -0.09 0.01 0.15 -1.61 0.00 0.00 0.00 175.10 173.57 2vas s GLU 211 N 1.33 4.17 -0.27 2.72 2.02 0.25 -1.37 118.70 127.55 2vas s GLU 211 Ca -0.02 -0.18 -0.08 0.00 0.02 0.00 0.00 54.97 54.71 2vas s GLU 211 Cb -0.18 -3.41 -0.02 0.00 0.10 0.00 0.00 34.13 30.61 2vas s GLU 211 CO -0.01 0.31 0.10 0.42 0.02 0.00 0.00 175.26 176.10 2vas s ILE 212 N 0.32 4.49 0.10 -1.63 1.01 -0.32 -0.85 121.20 124.33 2vas s ILE 212 Ca 0.09 -0.21 -0.07 0.00 0.00 0.00 0.00 60.65 60.47 2vas s ILE 212 Cb -0.11 -3.16 -0.06 0.00 0.01 0.00 0.00 42.46 39.14 2vas s ILE 212 CO -0.01 0.25 0.37 -1.00 0.00 0.00 0.00 174.94 174.55 2vas s HIS 213 N 1.63 3.53 0.15 3.97 3.76 0.46 -1.35 115.29 127.43 2vas s HIS 213 Ca 0.06 0.65 0.06 0.00 -0.15 0.00 0.00 55.06 55.67 2vas s HIS 213 Cb -0.16 -2.06 -0.04 0.00 1.11 0.00 0.00 32.58 31.43 2vas s HIS 213 CO 0.05 0.49 -0.12 -0.06 -0.85 0.00 0.00 174.74 174.25 2vas s PHE 214 N -1.52 1.39 0.44 1.40 0.40 0.94 -0.55 117.98 120.48 2vas s PHE 214 Ca 0.36 -0.66 -0.01 0.00 -0.60 0.00 0.00 56.93 56.03 2vas s PHE 214 Cb -0.13 -0.70 0.09 0.00 0.51 0.00 0.00 43.02 42.79 2vas s PHE 214 CO 0.21 0.15 0.60 0.27 0.70 0.00 0.00 175.22 177.15 2vas n ASN 215 N 0.01 0.77 -0.33 1.36 0.23 -0.61 -0.30 115.26 116.39 2vas n ASN 215 Ca -0.12 -1.66 0.14 0.00 -0.53 0.00 0.00 54.58 52.41 2vas n ASN 215 Cb 0.59 -0.39 0.35 0.00 -2.08 0.00 0.00 39.78 38.25 2vas n ASN 215 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2vas h GLU 216 N 0.00 0.70 -0.00 -3.83 4.81 -1.95 0.17 114.58 114.48 2vas h GLU 216 Ca -0.20 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 2vas h GLU 216 Cb 0.72 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.95 2vas h GLU 216 CO 0.21 0.46 0.00 1.63 -0.73 0.00 0.00 179.01 180.58 2vas n LYS 217 N -4.69 1.00 -3.87 1.92 5.02 -1.26 -4.89 118.16 111.39 2vas n LYS 217 Ca 0.22 -0.01 -0.26 0.00 -2.02 0.00 0.00 58.31 56.25 2vas n LYS 217 Cb 0.58 -1.32 0.01 0.00 -0.02 0.00 0.00 35.03 34.27 2vas n LYS 217 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2vas n SER 218 N -0.81 -1.75 -4.91 4.39 3.41 0.60 -5.02 113.62 109.52 2vas n SER 218 Ca 0.15 -0.89 -0.32 0.00 -0.26 0.00 0.00 58.87 57.55 2vas n SER 218 Cb 0.07 -3.58 -0.04 0.00 -0.26 0.00 0.00 64.21 60.40 2vas n SER 218 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2vas s SER 219 N -4.08 6.37 0.18 4.04 0.01 -1.26 -4.88 113.70 114.09 2vas s SER 219 Ca 0.19 0.32 -0.31 0.00 1.31 0.00 0.00 55.95 57.46 2vas s SER 219 Cb -0.10 -1.99 -0.10 0.00 0.21 0.00 0.00 66.02 64.05 2vas s SER 219 CO 0.85 0.22 1.53 -0.69 0.41 0.00 0.00 173.24 175.56 2vas s VAL 220 N -1.41 2.68 0.00 3.43 1.01 -1.26 -1.57 120.40 123.27 2vas s VAL 220 Ca 0.31 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.79 2vas s VAL 220 Cb -0.13 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2vas s VAL 220 CO 0.23 0.05 0.00 0.55 0.00 0.00 0.00 175.10 175.93 2vas n VAL 221 N 3.62 0.00 -2.67 2.92 3.14 0.29 -4.87 118.33 120.75 2vas n VAL 221 Ca 0.12 -0.14 0.00 0.00 -2.96 0.00 0.00 64.34 61.36 2vas n VAL 221 Cb 0.39 0.64 0.00 0.00 -1.06 0.00 0.00 33.84 33.81 2vas n VAL 221 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2vas n GLY 222 N 2.06 -1.42 3.20 7.55 0.00 -1.18 -4.65 105.19 110.75 2vas n GLY 222 Ca 0.00 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 44.92 2vas n GLY 222 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vas s GLY 223 N 0.00 0.46 -0.12 -0.02 0.00 -0.86 -0.41 107.32 106.37 2vas s GLY 223 Ca 0.00 -0.99 -0.08 0.00 0.00 0.00 0.00 44.72 43.64 2vas s GLY 223 CO 0.00 -1.04 0.31 -0.12 0.00 0.00 0.00 173.10 172.25 2vas s PHE 224 N -3.94 -0.40 -0.17 1.90 5.36 -0.03 -4.67 117.98 116.03 2vas s PHE 224 Ca 0.13 0.92 -0.01 0.00 -0.96 0.00 0.00 56.93 57.01 2vas s PHE 224 Cb 0.06 0.13 -0.00 0.00 -0.34 0.00 0.00 43.02 42.86 2vas s PHE 224 CO -0.05 -0.24 -0.12 0.08 -1.46 0.00 0.00 175.22 173.43 2vas s VAL 225 N 0.90 2.91 -0.09 3.12 1.01 -1.26 -0.58 120.40 126.41 2vas s VAL 225 Ca -0.06 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 2vas s VAL 225 Cb -0.07 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 2vas s VAL 225 CO -0.06 0.49 0.15 -0.44 0.00 0.00 0.00 175.10 175.23 2vas s SER 226 N 0.95 6.34 0.04 3.32 0.01 -0.09 -4.94 113.70 119.32 2vas s SER 226 Ca -0.02 0.42 0.05 0.00 1.31 0.00 0.00 55.95 57.71 2vas s SER 226 Cb -0.15 -2.03 -0.02 0.00 0.21 0.00 0.00 66.02 64.03 2vas s SER 226 CO -0.01 0.37 -0.13 -1.38 0.41 0.00 0.00 173.24 172.50 2vas s HIS 227 N -1.10 1.17 0.01 2.43 -3.43 -1.26 -1.36 115.29 111.75 2vas s HIS 227 Ca 0.18 -0.36 0.01 0.00 -0.80 0.00 0.00 55.06 54.09 2vas s HIS 227 Cb -0.12 -0.69 -0.01 0.00 -1.43 0.00 0.00 32.58 30.33 2vas s HIS 227 CO 0.08 0.03 -0.05 0.71 -2.00 0.00 0.00 174.74 173.50 2vas s TYR 228 N -0.89 0.44 -1.27 0.38 1.51 0.10 -4.95 117.35 112.67 2vas s TYR 228 Ca 0.01 -0.23 -0.03 0.00 -1.01 0.00 0.00 57.07 55.81 2vas s TYR 228 Cb -0.08 -0.28 0.01 0.00 -0.11 0.00 0.00 41.96 41.50 2vas s TYR 228 CO 0.01 -0.04 0.97 1.28 -1.11 0.00 0.00 175.55 176.66 2vas n LEU 229 N 2.43 -3.63 -4.73 -1.29 4.32 -1.26 -0.14 117.00 112.69 2vas n LEU 229 Ca -0.17 -0.66 -0.42 0.00 -0.02 0.00 0.00 56.01 54.75 2vas n LEU 229 Cb 0.57 -2.98 -0.02 0.00 -1.62 0.00 0.00 43.42 39.37 2vas n LEU 229 CO 0.24 0.44 1.31 -0.22 -1.22 0.00 0.00 177.39 177.94 2vas s LEU 230 N -6.67 4.36 -0.39 2.23 2.96 -1.26 -4.41 118.68 115.51 2vas s LEU 230 Ca 0.15 2.89 -0.29 0.00 -0.22 0.00 0.00 54.13 56.67 2vas s LEU 230 Cb -0.07 -3.62 0.01 0.00 0.50 0.00 0.00 46.19 43.01 2vas s LEU 230 CO 0.75 -0.94 1.39 -0.70 -1.32 0.00 0.00 176.35 175.54 2vas s GLU 231 N 0.40 3.64 -0.03 1.98 2.12 -0.42 -4.91 118.70 121.48 2vas s GLU 231 Ca 0.69 1.00 -0.20 0.00 0.36 0.00 0.00 54.97 56.82 2vas s GLU 231 Cb -0.48 -4.00 -0.33 0.00 0.26 0.00 0.00 34.13 29.58 2vas s GLU 231 CO 0.39 -1.48 0.92 0.87 -0.54 0.00 0.00 175.26 175.42 2vas h LYS 232 N 10.44 0.36 -0.75 4.30 1.79 -1.92 -3.35 116.57 127.44 2vas h LYS 232 Ca -0.27 -0.62 0.13 0.00 -2.18 0.00 0.00 60.65 57.70 2vas h LYS 232 Cb 1.10 0.23 -0.05 0.00 -1.58 0.00 0.00 32.23 31.93 2vas h LYS 232 CO 1.08 1.30 0.50 0.66 -1.08 0.00 0.00 179.45 181.90 2vas h SER 233 N -0.24 0.49 0.08 0.86 4.64 -1.92 -1.51 113.55 115.95 2vas h SER 233 Ca -0.17 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 2vas h SER 233 Cb 1.78 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.79 2vas h SER 233 CO 0.18 0.27 0.00 -0.09 -0.87 0.00 0.00 176.83 176.32 2vas h ARG 234 N 0.53 0.00 -0.27 4.77 2.43 -1.69 -2.61 114.38 117.54 2vas h ARG 234 Ca 0.36 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.43 2vas h ARG 234 Cb 0.68 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 2vas h ARG 234 CO -0.13 0.00 -0.25 0.82 -1.51 0.00 0.00 179.97 178.90 2vas h ILE 235 N 0.00 1.27 0.00 1.20 2.04 -1.49 -3.39 117.51 117.15 2vas h ILE 235 Ca 0.00 -1.29 -0.29 0.00 1.00 0.00 0.00 64.86 64.28 2vas h ILE 235 Cb 0.04 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 2vas h ILE 235 CO 0.00 0.41 -1.95 0.00 0.00 0.00 0.00 178.15 176.61 2vas s VAL 237 N -2.36 1.79 0.06 0.00 0.11 -1.08 -4.44 120.40 114.47 2vas s VAL 237 Ca -0.26 -1.38 -0.05 0.00 -2.93 0.00 0.00 61.98 57.37 2vas s VAL 237 Cb 0.10 -1.58 -0.02 0.00 -1.53 0.00 0.00 36.38 33.35 2vas s VAL 237 CO 0.33 0.13 0.08 0.00 -3.33 0.00 0.00 175.10 172.31 2vas s GLN 238 N -1.49 0.66 1.13 1.54 0.00 -1.26 -3.99 119.66 116.24 2vas s GLN 238 Ca 0.08 -0.95 -0.13 0.00 -0.00 0.00 0.00 55.36 54.36 2vas s GLN 238 Cb -0.09 0.25 0.26 0.00 0.00 0.00 0.00 33.01 33.43 2vas s GLN 238 CO 0.03 -0.17 1.04 0.20 0.00 0.00 0.00 175.29 176.40 2vas s GLY 239 N -2.57 1.55 0.19 2.60 0.00 -1.26 -4.89 107.32 102.94 2vas s GLY 239 Ca 0.01 -0.15 -0.16 0.00 0.00 0.00 0.00 44.72 44.43 2vas s GLY 239 CO -0.08 0.54 1.63 0.50 0.00 0.00 0.00 173.10 175.70 2vas h LYS 240 N -2.48 -0.04 -0.52 2.90 1.57 -2.02 -2.48 116.57 113.50 2vas h LYS 240 Ca -0.60 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.17 2vas h LYS 240 Cb 1.33 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.64 2vas h LYS 240 CO 0.51 -0.03 0.02 -1.91 -0.57 0.00 0.00 179.45 177.48 2vas n GLU 241 N -5.40 4.42 -4.46 3.15 4.07 -1.26 -4.98 120.64 116.18 2vas n GLU 241 Ca 0.05 -3.10 -0.23 0.00 -0.06 0.00 0.00 57.16 53.81 2vas n GLU 241 Cb 0.30 -2.18 -0.10 0.00 -0.06 0.00 0.00 31.44 29.40 2vas n GLU 241 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2vas s GLU 242 N -2.81 1.64 0.45 5.31 2.02 -0.94 -4.56 118.70 119.82 2vas s GLU 242 Ca 0.52 -1.78 0.06 0.00 0.02 0.00 0.00 54.97 53.80 2vas s GLU 242 Cb 0.41 -1.61 -0.03 0.00 0.10 0.00 0.00 34.13 32.99 2vas s GLU 242 CO 0.14 0.25 0.18 1.03 0.02 0.00 0.00 175.26 176.88 2vas s ARG 243 N -3.57 2.20 0.64 1.61 0.52 -0.59 -4.70 118.95 115.07 2vas s ARG 243 Ca 0.29 -1.99 -0.09 0.00 -0.52 0.00 0.00 55.73 53.42 2vas s ARG 243 Cb -0.02 -1.90 0.14 0.00 0.52 0.00 0.00 34.95 33.69 2vas s ARG 243 CO 0.14 -0.24 0.87 -1.71 0.02 0.00 0.00 175.30 174.38 2vas n ASN 244 N -1.32 0.27 -4.70 0.23 2.85 -1.26 -4.50 115.26 106.83 2vas n ASN 244 Ca -0.05 -1.44 -0.43 0.00 -0.11 0.00 0.00 54.58 52.56 2vas n ASN 244 Cb 0.65 -0.65 -0.01 0.00 1.24 0.00 0.00 39.78 41.01 2vas n ASN 244 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 2vas n TYR 245 N -3.08 2.30 -0.32 1.20 4.02 -1.26 -4.37 117.16 115.64 2vas n TYR 245 Ca 0.12 0.54 0.21 0.00 -0.01 0.00 0.00 57.90 58.75 2vas n TYR 245 Cb 0.40 -2.42 0.42 0.00 -0.02 0.00 0.00 39.34 37.72 2vas n TYR 245 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2vas h HIS 246 N 2.71 0.69 -0.84 -0.72 3.86 -1.36 -2.71 115.15 116.78 2vas h HIS 246 Ca -0.46 0.04 0.19 0.00 -1.16 0.00 0.00 60.37 58.98 2vas h HIS 246 Cb 1.28 -0.15 -0.11 0.00 1.06 0.00 0.00 27.41 29.49 2vas h HIS 246 CO 0.51 -0.24 0.34 0.97 0.86 0.00 0.00 177.93 180.37 2vas h ILE 247 N 0.23 0.54 -0.82 2.45 6.09 -1.14 -0.31 117.51 124.55 2vas h ILE 247 Ca 0.69 -0.14 -0.02 0.00 -1.37 0.00 0.00 64.86 64.02 2vas h ILE 247 Cb 1.56 0.09 -0.04 0.00 0.47 0.00 0.00 36.82 38.90 2vas h ILE 247 CO -0.66 0.07 0.44 -0.26 -3.07 0.00 0.00 178.15 174.67 2vas h PHE 248 N 0.41 1.14 0.00 2.19 0.04 -1.78 -0.75 116.94 118.18 2vas h PHE 248 Ca 0.50 -0.03 -0.19 0.00 2.80 0.00 0.00 57.97 61.05 2vas h PHE 248 Cb 0.88 -0.36 -0.03 0.00 2.20 0.00 0.00 35.95 38.64 2vas h PHE 248 CO -0.16 0.79 -0.95 1.88 -0.60 0.00 0.00 178.31 179.27 2vas h TYR 249 N 1.16 0.00 0.02 -0.55 -1.99 -1.27 -2.99 116.97 111.34 2vas h TYR 249 Ca 0.29 0.00 -0.24 0.00 2.00 0.00 0.00 58.73 60.78 2vas h TYR 249 Cb 0.04 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.78 2vas h TYR 249 CO 0.01 0.88 -1.01 0.00 -0.00 0.00 0.00 178.16 178.04 2vas h ARG 250 N 0.00 0.47 -0.31 4.88 3.08 -0.97 -2.63 114.38 118.89 2vas h ARG 250 Ca -0.03 -0.53 -0.05 0.00 0.07 0.00 0.00 59.98 59.44 2vas h ARG 250 Cb 1.70 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.90 2vas h ARG 250 CO 0.11 1.18 0.01 1.25 -1.07 0.00 0.00 179.97 181.45 2vas h LEU 251 N 0.25 0.52 -0.71 3.04 5.85 -1.21 -2.01 115.31 121.05 2vas h LEU 251 Ca -0.10 -0.30 -0.07 0.00 0.84 0.00 0.00 57.88 58.25 2vas h LEU 251 Cb 1.66 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.52 2vas h LEU 251 CO 0.18 0.69 0.18 0.00 -0.34 0.00 0.00 178.44 179.16 2vas h ALA 253 N 1.09 0.20 -0.05 0.00 0.00 -1.31 -3.39 119.26 115.80 2vas h ALA 253 Ca 0.22 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2vas h ALA 253 Cb 0.36 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2vas h ALA 253 CO 0.00 0.55 0.00 0.41 0.00 0.00 0.00 179.25 180.21 2vas n GLY 254 N 0.85 1.45 3.76 0.00 0.00 -0.77 -4.82 105.19 105.67 2vas n GLY 254 Ca -0.09 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 2vas n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vas s ALA 255 N -0.72 2.53 0.72 4.61 0.00 -1.13 -4.95 121.76 122.83 2vas s ALA 255 Ca 0.04 0.81 -0.12 0.00 0.00 0.00 0.00 51.96 52.69 2vas s ALA 255 Cb 0.02 -3.39 0.03 0.00 0.00 0.00 0.00 23.12 19.79 2vas s ALA 255 CO 0.03 -1.12 1.08 -1.54 0.00 0.00 0.00 175.76 174.21 2vas s SER 256 N -1.96 4.94 0.42 0.00 1.04 -1.26 -4.78 113.70 112.10 2vas s SER 256 Ca 0.73 1.80 0.19 0.00 0.48 0.00 0.00 55.95 59.15 2vas s SER 256 Cb -0.25 -2.52 1.13 0.00 0.10 0.00 0.00 66.02 64.47 2vas s SER 256 CO 0.34 -1.74 1.83 -0.08 0.98 0.00 0.00 173.24 174.57 2vas h GLU 257 N -0.69 0.36 0.38 4.02 4.57 -1.98 -0.10 114.58 121.14 2vas h GLU 257 Ca -0.44 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 57.70 2vas h GLU 257 Cb 1.23 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.74 2vas h GLU 257 CO 0.54 0.24 -0.18 0.22 -1.18 0.00 0.00 179.01 178.64 2vas h ASP 258 N 0.37 -0.43 -0.08 1.04 -0.00 -1.99 -1.36 116.42 113.97 2vas h ASP 258 Ca 0.51 -0.09 -0.00 0.00 -0.00 0.00 0.00 57.03 57.45 2vas h ASP 258 Cb 1.35 0.11 -0.00 0.00 -0.00 0.00 0.00 39.33 40.79 2vas h ASP 258 CO -0.20 -0.16 0.04 0.40 -0.00 0.00 0.00 179.24 179.32 2vas h ILE 259 N -0.70 1.11 -0.99 2.25 2.04 -1.73 -1.85 117.51 117.64 2vas h ILE 259 Ca -0.05 -0.33 0.18 0.00 1.00 0.00 0.00 64.86 65.66 2vas h ILE 259 Cb 0.49 1.19 -0.10 0.00 -0.74 0.00 0.00 36.82 37.67 2vas h ILE 259 CO 0.09 0.10 0.62 -0.09 0.00 0.00 0.00 178.15 178.86 2vas h ARG 260 N -0.00 0.76 0.25 2.37 2.43 -1.11 -0.12 114.38 118.96 2vas h ARG 260 Ca 0.03 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 2vas h ARG 260 Cb 0.12 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 2vas h ARG 260 CO -0.00 0.50 -0.12 0.93 -1.51 0.00 0.00 179.97 179.77 2vas h GLU 261 N 0.78 -0.33 -0.40 0.20 5.08 -0.90 -0.19 114.58 118.82 2vas h GLU 261 Ca 0.55 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.93 2vas h GLU 261 Cb 0.84 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 2vas h GLU 261 CO -0.33 -0.01 0.24 0.00 -1.00 0.00 0.00 179.01 177.91 2vas h ARG 262 N -0.68 0.54 -0.02 2.33 3.08 -0.93 -2.86 114.38 115.84 2vas h ARG 262 Ca -0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2vas h ARG 262 Cb 0.47 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.41 2vas h ARG 262 CO 0.06 0.38 -0.19 1.28 -1.07 0.00 0.00 179.97 180.43 2vas n LEU 263 N -4.45 2.58 -3.53 3.04 4.77 -0.09 -4.99 117.00 114.33 2vas n LEU 263 Ca 0.03 -0.89 -0.20 0.00 -0.03 0.00 0.00 56.01 54.92 2vas n LEU 263 Cb 0.08 -0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.25 2vas n LEU 263 CO 0.36 0.45 0.12 1.41 -1.33 0.00 0.00 177.39 178.39 2vas n HIS 264 N 0.78 -2.32 -3.37 -1.77 8.25 -0.24 -4.96 115.22 111.59 2vas n HIS 264 Ca 0.12 0.94 -0.38 0.00 -0.26 0.00 0.00 57.72 58.15 2vas n HIS 264 Cb 0.54 -4.93 -0.06 0.00 1.12 0.00 0.00 29.99 26.66 2vas n HIS 264 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2vas s LEU 265 N -6.68 4.39 0.00 2.41 1.43 -0.30 -5.05 118.68 114.89 2vas s LEU 265 Ca 0.17 0.95 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 2vas s LEU 265 Cb -0.08 -2.70 -0.00 0.00 0.03 0.00 0.00 46.19 43.45 2vas s LEU 265 CO 0.75 0.16 0.01 -1.20 0.23 0.00 0.00 176.35 176.29 2vas n SER 266 N 2.70 1.59 -4.77 2.29 7.64 -1.26 -4.90 113.62 116.91 2vas n SER 266 Ca -0.10 -1.17 -0.34 0.00 1.01 0.00 0.00 58.87 58.27 2vas n SER 266 Cb 0.52 0.05 0.03 0.00 -1.01 0.00 0.00 64.21 63.79 2vas n SER 266 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2vas s SER 267 N -1.20 5.37 0.57 6.43 1.04 -1.26 -4.82 113.70 119.83 2vas s SER 267 Ca 0.01 2.13 0.29 0.00 0.48 0.00 0.00 55.95 58.85 2vas s SER 267 Cb 0.00 -2.57 1.47 0.00 0.10 0.00 0.00 66.02 65.02 2vas s SER 267 CO 0.01 -1.46 1.91 -0.65 0.98 0.00 0.00 173.24 174.02 2vas h PRO 268 N 0.64 0.00 0.00 4.02 0.11 -1.96 -1.53 132.00 133.28 2vas h PRO 268 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2vas h PRO 268 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2vas h PRO 268 CO 0.55 0.00 0.00 0.38 -0.21 0.00 0.00 178.00 178.72 2vas h ASP 269 N 0.00 0.00 0.68 -2.05 -0.00 -1.92 -2.47 116.42 110.66 2vas h ASP 269 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.28 2vas h ASP 269 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.57 2vas h ASP 269 CO -0.00 0.00 -0.14 0.59 -0.00 0.00 0.00 179.24 179.69 2vas n ASN 270 N -2.54 0.23 -4.26 4.15 3.02 -0.57 -4.83 115.26 110.46 2vas n ASN 270 Ca -0.00 -0.01 -0.33 0.00 -0.03 0.00 0.00 54.58 54.21 2vas n ASN 270 Cb 0.16 -0.20 -0.16 0.00 -0.61 0.00 0.00 39.78 38.97 2vas n ASN 270 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2vas s PHE 271 N -2.82 2.72 0.42 3.10 0.40 -0.93 -5.00 117.98 115.87 2vas s PHE 271 Ca 0.19 -1.03 0.09 0.00 -0.60 0.00 0.00 56.93 55.58 2vas s PHE 271 Cb 0.19 -1.83 0.92 0.00 0.51 0.00 0.00 43.02 42.81 2vas s PHE 271 CO 0.55 -0.44 2.04 -0.09 0.70 0.00 0.00 175.22 177.97 2vas h ARG 272 N 7.09 0.49 0.00 0.44 2.43 -1.86 -2.04 114.38 120.93 2vas h ARG 272 Ca -0.29 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2vas h ARG 272 Cb 1.20 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 2vas h ARG 272 CO 0.54 0.32 0.00 0.66 -1.51 0.00 0.00 179.97 179.99 2vas n TYR 273 N -4.48 0.00 -0.00 2.20 4.01 -1.26 -3.56 117.16 114.07 2vas n TYR 273 Ca 0.05 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.82 2vas n TYR 273 Cb 0.15 -0.39 -0.04 0.00 -0.31 0.00 0.00 39.34 38.75 2vas n TYR 273 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2vas n LEU 274 N -1.39 0.00 -4.47 7.72 4.77 -0.80 -4.67 117.00 118.16 2vas n LEU 274 Ca 0.08 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.71 2vas n LEU 274 Cb 0.22 0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.20 2vas n LEU 274 CO 0.19 0.01 -0.30 0.54 -1.33 0.00 0.00 177.39 176.50 2vas s ASN 275 N -2.71 5.05 0.00 -1.43 2.20 -1.02 -4.75 114.94 112.28 2vas s ASN 275 Ca -0.02 -0.17 0.00 0.00 -0.94 0.00 0.00 52.86 51.73 2vas s ASN 275 Cb 0.04 -1.88 0.00 0.00 -2.00 0.00 0.00 41.25 37.40 2vas s ASN 275 CO 0.24 0.04 0.00 -2.65 -2.94 0.00 0.00 177.10 171.79 2vas n PRO 309 N 4.42 0.00 -1.15 3.55 -0.02 -1.26 -5.05 135.00 135.49 2vas n PRO 309 Ca -0.17 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.06 2vas n PRO 309 Cb 0.52 0.00 0.12 0.00 -0.02 0.00 0.00 33.50 34.11 2vas n PRO 309 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2vas n LEU 310 N 0.00 6.82 -4.08 2.45 4.32 -1.26 -4.87 117.00 120.39 2vas n LEU 310 Ca 0.00 -3.68 -0.33 0.00 -0.02 0.00 0.00 56.01 51.98 2vas n LEU 310 Cb 0.00 -0.89 -0.14 0.00 -1.62 0.00 0.00 43.42 40.77 2vas n LEU 310 CO 0.00 1.18 -0.32 -0.76 -1.22 0.00 0.00 177.39 176.27 2vas s LEU 311 N -3.11 4.52 -1.21 2.23 1.43 -1.26 -5.03 118.68 116.24 2vas s LEU 311 Ca 0.53 -1.86 -0.12 0.00 -1.03 0.00 0.00 54.13 51.65 2vas s LEU 311 Cb 0.43 -1.67 0.19 0.00 0.03 0.00 0.00 46.19 45.17 2vas s LEU 311 CO 0.05 -0.37 1.51 -0.67 0.23 0.00 0.00 176.35 177.10 2vas n ASP 312 N 4.42 5.27 -0.33 2.29 4.64 -1.26 -4.80 116.55 126.79 2vas n ASP 312 Ca -0.03 -3.03 -0.02 0.00 -1.38 0.00 0.00 54.79 50.32 2vas n ASP 312 Cb 0.42 -1.52 0.13 0.00 -1.04 0.00 0.00 41.12 39.11 2vas n ASP 312 CO 0.00 0.00 0.00 0.44 -0.82 0.00 0.00 177.20 176.82 2vas h ASP 313 N 6.69 1.08 0.15 1.67 3.32 -1.96 -0.29 116.42 127.08 2vas h ASP 313 Ca 0.32 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.30 2vas h ASP 313 Cb 0.80 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.08 2vas h ASP 313 CO 1.32 0.82 -0.07 -0.74 -1.72 0.00 0.00 179.24 178.85 2vas h HIS 314 N 1.25 -0.19 -0.29 4.55 2.76 -1.87 -2.43 115.15 118.94 2vas h HIS 314 Ca 0.33 -0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.39 2vas h HIS 314 Cb -0.07 0.06 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 2vas h HIS 314 CO 0.00 0.01 -0.25 0.78 -1.30 0.00 0.00 177.93 177.18 2vas h GLY 315 N -0.36 0.60 1.92 5.26 0.00 -1.94 -3.05 103.07 105.50 2vas h GLY 315 Ca -0.02 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.73 2vas h GLY 315 CO 0.03 0.46 -0.32 -0.55 0.00 0.00 0.00 176.54 176.16 2vas h ASP 316 N 0.49 0.10 -0.41 0.19 3.32 -1.01 -2.02 116.42 117.08 2vas h ASP 316 Ca 0.07 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 2vas h ASP 316 Cb 0.69 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 2vas h ASP 316 CO 0.05 0.42 0.22 0.15 -1.72 0.00 0.00 179.24 178.36 2vas h PHE 317 N 0.09 0.56 -0.20 4.55 3.57 -1.32 -0.69 116.94 123.50 2vas h PHE 317 Ca 0.01 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.51 2vas h PHE 317 Cb 0.62 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 2vas h PHE 317 CO 0.00 0.44 0.08 0.82 -2.23 0.00 0.00 178.31 177.43 2vas h ILE 318 N 0.52 0.98 -0.57 1.41 2.04 -1.38 -0.57 117.51 119.94 2vas h ILE 318 Ca 0.14 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2vas h ILE 318 Cb 0.07 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 2vas h ILE 318 CO -0.02 0.03 0.26 0.03 0.00 0.00 0.00 178.15 178.45 2vas h ARG 319 N 0.19 0.81 -0.46 2.37 3.08 -1.30 -0.62 114.38 118.44 2vas h ARG 319 Ca 0.08 -0.11 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 2vas h ARG 319 Cb 0.03 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 2vas h ARG 319 CO -0.07 0.64 -0.13 1.98 -1.07 0.00 0.00 179.97 181.33 2vas h MET 320 N 0.81 0.86 -0.22 0.04 4.05 -0.72 -1.59 114.93 118.15 2vas h MET 320 Ca 0.20 -0.30 -0.15 0.00 -0.28 0.00 0.00 59.70 59.17 2vas h MET 320 Cb 0.11 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 2vas h MET 320 CO -0.02 0.94 -0.47 0.00 0.23 0.00 0.00 176.91 177.59 2vas h THR 322 N 0.46 1.00 -0.17 0.00 2.02 -1.00 -2.14 112.91 113.07 2vas h THR 322 Ca 0.03 -0.08 -0.12 0.00 0.77 0.00 0.00 66.41 67.01 2vas h THR 322 Cb 0.99 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 2vas h THR 322 CO 0.09 0.04 -0.40 0.00 0.37 0.00 0.00 175.52 175.62 2vas h ALA 323 N 1.11 1.00 -0.16 6.16 0.00 -1.13 -3.16 119.26 123.09 2vas h ALA 323 Ca 0.09 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2vas h ALA 323 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2vas h ALA 323 CO -0.06 0.61 0.01 0.52 0.00 0.00 0.00 179.25 180.33 2vas h MET 324 N 0.31 0.28 -1.61 0.00 2.86 -0.89 -2.85 114.93 113.04 2vas h MET 324 Ca 0.03 -0.09 -0.28 0.00 -2.06 0.00 0.00 59.70 57.30 2vas h MET 324 Cb 0.85 -0.03 -0.12 0.00 0.06 0.00 0.00 31.60 32.36 2vas h MET 324 CO 0.07 0.49 0.35 1.63 1.06 0.00 0.00 176.91 180.51 2vas n LYS 325 N -4.75 1.70 0.00 1.72 5.02 -0.82 -1.31 118.16 119.73 2vas n LYS 325 Ca -0.05 -1.35 0.00 0.00 -2.02 0.00 0.00 58.31 54.89 2vas n LYS 325 Cb 0.21 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 2vas n LYS 325 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2vas n LYS 326 N 0.54 2.57 -0.04 1.97 4.81 -1.19 -4.66 118.16 122.16 2vas n LYS 326 Ca 0.26 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 57.83 2vas n LYS 326 Cb 0.57 -0.36 0.36 0.00 0.02 0.00 0.00 35.03 35.62 2vas n LYS 326 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 2vas n ILE 327 N -0.20 0.11 -0.67 3.15 -5.35 -1.08 -4.75 119.36 110.57 2vas n ILE 327 Ca 0.00 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.09 2vas n ILE 327 Cb 0.00 0.75 0.00 0.00 -1.74 0.00 0.00 39.64 38.65 2vas n ILE 327 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2vas n GLY 328 N 1.24 1.26 3.68 3.28 0.00 -1.18 -4.76 105.19 108.70 2vas n GLY 328 Ca 0.17 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 2vas n GLY 328 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2vas s LEU 329 N 0.00 4.20 0.66 0.99 2.96 -0.42 -5.02 118.68 122.04 2vas s LEU 329 Ca 0.00 1.19 -0.07 0.00 -0.22 0.00 0.00 54.13 55.03 2vas s LEU 329 Cb 0.00 -3.22 0.04 0.00 0.50 0.00 0.00 46.19 43.51 2vas s LEU 329 CO 0.00 -0.36 0.98 1.51 -1.32 0.00 0.00 176.35 177.16 2vas s ASP 330 N 1.11 5.14 0.54 3.68 1.47 -1.26 -4.21 116.67 123.14 2vas s ASP 330 Ca 0.38 0.60 0.29 0.00 1.18 0.00 0.00 52.55 55.00 2vas s ASP 330 Cb -0.17 -1.38 1.53 0.00 -0.34 0.00 0.00 42.92 42.57 2vas s ASP 330 CO 0.14 -1.39 2.10 0.44 0.68 0.00 0.00 175.17 177.14 2vas h ASP 331 N -0.45 0.00 -0.08 2.11 3.32 -1.98 -1.75 116.42 117.59 2vas h ASP 331 Ca -0.45 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.57 2vas h ASP 331 Cb 1.29 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.84 2vas h ASP 331 CO 0.61 0.10 -0.07 -0.08 -1.72 0.00 0.00 179.24 178.08 2vas h GLU 332 N 0.00 0.18 -0.26 3.56 4.81 -2.00 -2.22 114.58 118.65 2vas h GLU 332 Ca -0.00 -0.09 -0.14 0.00 -0.13 0.00 0.00 59.36 58.99 2vas h GLU 332 Cb 0.29 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2vas h GLU 332 CO 0.01 0.60 -0.42 1.49 -0.73 0.00 0.00 179.01 179.96 2vas h GLU 333 N -0.23 0.64 -0.78 1.92 4.81 -1.90 -2.51 114.58 116.53 2vas h GLU 333 Ca 0.01 -0.34 0.06 0.00 -0.13 0.00 0.00 59.36 58.97 2vas h GLU 333 Cb 0.56 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.89 2vas h GLU 333 CO 0.02 0.95 0.47 -0.22 -0.73 0.00 0.00 179.01 179.49 2vas h LYS 334 N 0.52 0.82 0.00 1.92 3.64 -1.34 -1.81 116.57 120.32 2vas h LYS 334 Ca 0.04 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.21 2vas h LYS 334 Cb 0.95 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.57 2vas h LYS 334 CO 0.09 0.54 -0.74 1.25 -2.27 0.00 0.00 179.45 178.32 2vas h LEU 335 N 0.84 0.00 -0.87 5.20 5.85 -1.33 -2.32 115.31 122.69 2vas h LEU 335 Ca 0.35 0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.08 2vas h LEU 335 Cb 0.20 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2vas h LEU 335 CO -0.19 0.74 0.57 0.44 -0.34 0.00 0.00 178.44 179.67 2vas h ASP 336 N 0.00 0.98 -0.04 1.25 3.32 -0.96 0.08 116.42 121.06 2vas h ASP 336 Ca -0.01 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 2vas h ASP 336 Cb 1.33 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 2vas h ASP 336 CO 0.10 0.71 0.00 -0.07 -1.72 0.00 0.00 179.24 178.26 2vas h LEU 337 N 1.16 0.06 -1.02 1.55 3.38 -1.22 -3.01 115.31 116.21 2vas h LEU 337 Ca 0.33 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 58.05 2vas h LEU 337 Cb -0.11 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.57 2vas h LEU 337 CO -0.08 0.33 0.66 -0.26 0.09 0.00 0.00 178.44 179.17 2vas h PHE 338 N -0.21 1.23 -0.27 1.13 0.05 -1.18 -1.96 116.94 115.74 2vas h PHE 338 Ca 0.01 0.03 0.03 0.00 3.82 0.00 0.00 57.97 61.86 2vas h PHE 338 Cb 0.29 -0.41 -0.03 0.00 2.00 0.00 0.00 35.95 37.80 2vas h PHE 338 CO 0.02 0.71 0.07 0.00 -0.18 0.00 0.00 178.31 178.93 2vas h ARG 339 N 1.27 0.18 -0.45 1.51 3.08 -0.99 0.15 114.38 119.13 2vas h ARG 339 Ca 0.40 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.41 2vas h ARG 339 Cb -0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 2vas h ARG 339 CO -0.12 0.12 0.18 0.28 -1.07 0.00 0.00 179.97 179.35 2vas h VAL 340 N 0.18 1.20 -0.27 2.04 2.07 -1.34 0.21 116.25 120.35 2vas h VAL 340 Ca 0.12 -0.63 0.05 0.00 0.82 0.00 0.00 66.70 67.06 2vas h VAL 340 Cb 0.11 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 2vas h VAL 340 CO -0.15 0.23 -0.01 0.58 0.02 0.00 0.00 177.57 178.25 2vas h VAL 341 N 0.58 0.80 -0.78 2.57 2.07 -1.12 -1.68 116.25 118.68 2vas h VAL 341 Ca 0.15 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.60 2vas h VAL 341 Cb 0.20 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 2vas h VAL 341 CO -0.01 0.01 0.33 0.00 0.02 0.00 0.00 177.57 177.92 2vas h ALA 342 N 1.24 1.01 -0.20 1.67 0.00 -0.61 -2.32 119.26 120.04 2vas h ALA 342 Ca 0.13 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2vas h ALA 342 Cb 0.17 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2vas h ALA 342 CO -0.22 0.62 -0.04 0.78 0.00 0.00 0.00 179.25 180.39 2vas h GLY 343 N 1.13 0.32 1.14 0.00 0.00 -0.25 -1.60 103.07 103.81 2vas h GLY 343 Ca 0.26 -0.17 -0.18 0.00 0.00 0.00 0.00 47.33 47.24 2vas h GLY 343 CO -0.02 0.16 -0.48 -2.08 0.00 0.00 0.00 176.54 174.11 2vas h VAL 344 N 0.29 1.27 -0.35 4.60 2.07 -1.00 -2.43 116.25 120.71 2vas h VAL 344 Ca 0.07 -1.66 0.02 0.00 0.82 0.00 0.00 66.70 65.94 2vas h VAL 344 Cb 0.26 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 2vas h VAL 344 CO 0.01 0.55 0.18 -0.07 0.02 0.00 0.00 177.57 178.26 2vas h LEU 345 N 0.72 0.28 -0.54 2.57 3.38 -0.83 -2.54 115.31 118.34 2vas h LEU 345 Ca 0.03 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 2vas h LEU 345 Cb 1.09 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 2vas h LEU 345 CO 0.11 0.20 -0.46 0.45 0.09 0.00 0.00 178.44 178.84 2vas h HIS 346 N 0.37 0.00 -0.42 1.13 3.86 -1.34 -2.58 115.15 116.17 2vas h HIS 346 Ca 0.14 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.29 2vas h HIS 346 Cb 0.04 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 2vas h HIS 346 CO -0.09 0.46 0.01 1.25 0.86 0.00 0.00 177.93 180.41 2vas h LEU 347 N 0.00 0.63 -1.55 2.43 5.85 -1.33 -2.87 115.31 118.47 2vas h LEU 347 Ca -0.00 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 2vas h LEU 347 Cb 1.13 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 2vas h LEU 347 CO 0.06 0.70 -0.20 1.23 -0.34 0.00 0.00 178.44 179.89 2vas h GLY 348 N 0.92 0.00 1.85 3.75 0.00 -1.04 -3.04 103.07 105.51 2vas h GLY 348 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2vas h GLY 348 CO 0.01 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.25 2vas n ASN 349 N -3.64 0.00 -4.59 0.19 3.02 -1.08 -4.63 115.26 104.52 2vas n ASN 349 Ca -0.01 0.29 -0.43 0.00 -0.03 0.00 0.00 54.58 54.40 2vas n ASN 349 Cb 0.33 -0.43 -0.02 0.00 -0.61 0.00 0.00 39.78 39.05 2vas n ASN 349 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2vas s ILE 350 N -2.85 3.79 0.15 2.41 1.01 -1.15 -4.40 121.20 120.16 2vas s ILE 350 Ca 0.18 0.77 0.02 0.00 0.00 0.00 0.00 60.65 61.63 2vas s ILE 350 Cb 0.19 -4.15 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 2vas s ILE 350 CO 0.48 -0.79 0.29 1.51 0.00 0.00 0.00 174.94 176.44 2vas s ASP 351 N 4.56 6.34 -0.64 3.58 -4.77 -1.26 -5.04 116.67 119.44 2vas s ASP 351 Ca 0.63 0.18 0.04 0.00 -3.30 0.00 0.00 52.55 50.10 2vas s ASP 351 Cb -0.14 -1.92 0.35 0.00 -1.09 0.00 0.00 42.92 40.12 2vas s ASP 351 CO 0.31 0.04 1.18 0.49 0.70 0.00 0.00 175.17 177.90 2vas n PHE 352 N -0.58 3.67 0.00 2.11 3.01 -1.26 -5.04 117.46 119.37 2vas n PHE 352 Ca -0.07 -3.51 0.00 0.00 1.01 0.00 0.00 57.45 54.89 2vas n PHE 352 Cb 0.54 -0.57 0.00 0.00 -0.01 0.00 0.00 39.48 39.44 2vas n PHE 352 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2vas n SER 368 N -0.28 0.00 -0.04 4.37 7.64 -1.26 -5.07 113.62 118.98 2vas n SER 368 Ca 0.36 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 60.11 2vas n SER 368 Cb 0.41 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.53 2vas n SER 368 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2vas h THR 369 N 0.00 1.40 0.00 0.44 2.02 -1.96 -2.51 112.91 112.30 2vas h THR 369 Ca 0.00 -1.44 -0.05 0.00 0.77 0.00 0.00 66.41 65.68 2vas h THR 369 Cb 0.00 2.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 2vas h THR 369 CO 0.00 0.41 -0.25 -0.61 0.37 0.00 0.00 175.52 175.44 2vas h GLN 370 N -0.19 0.00 -0.12 6.66 4.15 -2.00 -2.55 115.11 121.05 2vas h GLN 370 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.39 2vas h GLN 370 Cb 0.74 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.43 2vas h GLN 370 CO 0.04 0.25 -0.07 0.00 -1.93 0.00 0.00 178.83 177.12 2vas h ALA 371 N 1.75 0.17 -0.65 3.38 0.00 -1.86 -1.94 119.26 120.11 2vas h ALA 371 Ca -0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2vas h ALA 371 Cb 0.57 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 2vas h ALA 371 CO 0.03 -0.03 0.34 1.25 0.00 0.00 0.00 179.25 180.84 2vas h LEU 372 N -0.10 0.80 0.65 0.00 5.85 -1.36 -0.59 115.31 120.57 2vas h LEU 372 Ca 0.03 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 2vas h LEU 372 Cb 0.54 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 41.37 2vas h LEU 372 CO 0.02 0.66 -0.31 -0.08 -0.34 0.00 0.00 178.44 178.39 2vas h GLU 373 N 0.90 -0.85 -0.86 1.25 4.81 -1.41 -1.92 114.58 116.50 2vas h GLU 373 Ca 0.23 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 2vas h GLU 373 Cb 0.05 0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 2vas h GLU 373 CO -0.03 -0.54 0.55 1.88 -0.73 0.00 0.00 179.01 180.13 2vas h TYR 374 N -0.96 1.11 0.18 0.92 0.99 -1.19 -2.35 116.97 115.66 2vas h TYR 374 Ca -0.09 0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.64 2vas h TYR 374 Cb 0.70 -0.37 0.00 0.00 1.00 0.00 0.00 36.73 38.06 2vas h TYR 374 CO -0.02 0.72 -0.09 0.00 -0.00 0.00 0.00 178.16 178.77 2vas h ALA 376 N 0.30 1.28 -0.15 0.00 0.00 -1.22 -2.13 119.26 117.34 2vas h ALA 376 Ca -0.02 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 2vas h ALA 376 Cb 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2vas h ALA 376 CO 0.04 0.19 -0.41 1.49 0.00 0.00 0.00 179.25 180.56 2vas h GLU 377 N 0.00 0.54 0.00 0.00 4.81 -1.40 0.78 114.58 119.32 2vas h GLU 377 Ca -0.00 -0.38 -0.10 0.00 -0.13 0.00 0.00 59.36 58.75 2vas h GLU 377 Cb 0.40 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 2vas h GLU 377 CO 0.02 1.00 -0.46 -0.07 -0.73 0.00 0.00 179.01 178.77 2vas h LEU 378 N 0.18 0.00 -2.66 1.64 3.38 -1.18 -3.00 115.31 113.68 2vas h LEU 378 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2vas h LEU 378 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 2vas h LEU 378 CO 0.09 0.46 0.00 0.18 0.09 0.00 0.00 178.44 179.26 2vas n LEU 379 N -3.24 3.57 -3.60 1.67 4.77 -0.84 -4.68 117.00 114.65 2vas n LEU 379 Ca 0.02 -1.87 -0.23 0.00 -0.03 0.00 0.00 56.01 53.90 2vas n LEU 379 Cb 0.70 -0.37 0.07 0.00 -2.33 0.00 0.00 43.42 41.50 2vas n LEU 379 CO 0.40 0.86 0.19 0.61 -1.33 0.00 0.00 177.39 178.12 2vas n GLY 380 N 1.33 -0.49 3.65 -0.72 0.00 -0.84 -4.68 105.19 103.45 2vas n GLY 380 Ca 0.20 0.21 -0.24 0.00 0.00 0.00 0.00 46.02 46.19 2vas n GLY 380 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vas s LEU 381 N -7.06 3.22 -0.05 0.99 1.43 0.27 -2.07 118.68 115.41 2vas s LEU 381 Ca 0.43 -0.59 -0.30 0.00 -1.03 0.00 0.00 54.13 52.64 2vas s LEU 381 Cb -0.19 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.22 2vas s LEU 381 CO 0.75 0.02 1.23 -0.62 0.23 0.00 0.00 176.35 177.96 2vas s ASP 382 N -3.55 7.01 0.31 2.29 -1.08 -1.26 -4.47 116.67 115.92 2vas s ASP 382 Ca 0.31 1.85 0.07 0.00 -0.52 0.00 0.00 52.55 54.27 2vas s ASP 382 Cb -0.07 -2.56 0.81 0.00 -1.46 0.00 0.00 42.92 39.64 2vas s ASP 382 CO 0.20 -0.61 1.75 1.56 0.52 0.00 0.00 175.17 178.58 2vas h GLN 383 N 7.56 0.64 0.00 4.34 4.20 -1.90 0.05 115.11 129.99 2vas h GLN 383 Ca -0.34 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.26 2vas h GLN 383 Cb 1.16 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.79 2vas h GLN 383 CO 0.89 0.42 -0.30 0.22 -0.67 0.00 0.00 178.83 179.39 2vas h ASP 384 N 0.66 0.00 -0.02 1.46 3.58 -1.98 -2.28 116.42 117.84 2vas h ASP 384 Ca 0.61 0.00 -0.19 0.00 0.42 0.00 0.00 57.03 57.87 2vas h ASP 384 Cb 1.06 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.13 2vas h ASP 384 CO -0.43 0.30 -0.75 0.44 -2.88 0.00 0.00 179.24 175.92 2vas h ASP 385 N 0.00 0.69 -0.49 2.28 3.32 -1.45 -2.95 116.42 117.83 2vas h ASP 385 Ca -0.00 -0.73 -0.00 0.00 0.02 0.00 0.00 57.03 56.31 2vas h ASP 385 Cb 1.22 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.54 2vas h ASP 385 CO 0.04 1.33 0.31 0.25 -1.72 0.00 0.00 179.24 179.45 2vas h LEU 386 N 0.12 0.58 -0.33 1.55 5.85 -1.15 -2.31 115.31 119.61 2vas h LEU 386 Ca -0.09 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.61 2vas h LEU 386 Cb 1.43 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 2vas h LEU 386 CO 0.15 0.45 0.16 -0.09 -0.34 0.00 0.00 178.44 178.77 2vas h ARG 387 N 0.66 0.32 -0.07 1.25 2.43 -1.48 -1.19 114.38 116.30 2vas h ARG 387 Ca 0.18 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 2vas h ARG 387 Cb -0.03 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.44 2vas h ARG 387 CO -0.03 0.21 0.01 0.28 -1.51 0.00 0.00 179.97 178.93 2vas h VAL 388 N 0.33 1.20 -0.38 0.20 2.07 -1.48 -2.56 116.25 115.63 2vas h VAL 388 Ca 0.14 -0.61 -0.04 0.00 0.82 0.00 0.00 66.70 67.01 2vas h VAL 388 Cb 0.06 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 2vas h VAL 388 CO -0.10 0.17 0.08 0.28 0.02 0.00 0.00 177.57 178.01 2vas h SER 389 N -0.11 0.53 0.67 0.57 0.02 -1.35 0.13 113.55 114.00 2vas h SER 389 Ca 0.02 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2vas h SER 389 Cb 0.26 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2vas h SER 389 CO 0.00 0.54 -0.05 0.18 -1.14 0.00 0.00 176.83 176.37 2vas n LEU 390 N -4.32 0.10 0.00 5.07 4.77 -0.46 -4.13 117.00 118.03 2vas n LEU 390 Ca 0.02 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 2vas n LEU 390 Cb 0.20 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2vas n LEU 390 CO 0.38 0.02 0.07 1.07 -1.33 0.00 0.00 177.39 177.60 2vas n THR 391 N -1.31 0.00 -4.23 -5.08 5.66 -0.75 -4.59 114.28 103.99 2vas n THR 391 Ca 0.12 -0.28 -0.17 0.00 -3.05 0.00 0.00 64.05 60.67 2vas n THR 391 Cb 0.28 1.22 -0.14 0.00 -1.55 0.00 0.00 70.33 70.14 2vas n THR 391 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2vas s THR 392 N -0.28 0.58 0.01 1.09 2.01 0.37 -1.47 115.64 117.95 2vas s THR 392 Ca 0.00 -0.47 -0.21 0.00 0.31 0.00 0.00 61.69 61.32 2vas s THR 392 Cb 0.00 -0.52 -0.19 0.00 0.01 0.00 0.00 72.50 71.79 2vas s THR 392 CO 0.00 0.06 1.19 -0.09 -0.69 0.00 0.00 174.62 175.08 2vas h ARG 393 N 5.66 0.37 -7.05 4.92 2.43 -1.90 -3.44 114.38 115.36 2vas h ARG 393 Ca -0.31 -0.30 -0.55 0.00 -0.81 0.00 0.00 59.98 58.01 2vas h ARG 393 Cb 1.19 0.06 0.13 0.00 -0.42 0.00 0.00 29.97 30.93 2vas h ARG 393 CO 0.48 0.94 0.59 -1.25 -1.51 0.00 0.00 179.97 179.22 2vas s PRO 410 N -3.62 3.15 0.04 0.20 0.04 -1.26 -5.19 135.00 128.35 2vas s PRO 410 Ca -0.14 2.18 0.05 0.00 0.04 0.00 0.00 61.00 63.13 2vas s PRO 410 Cb 0.04 -2.24 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 2vas s PRO 410 CO 0.78 -1.16 -0.08 -0.51 0.04 0.00 0.00 177.00 176.07 2vas s LEU 411 N -3.55 3.13 1.12 -3.56 1.43 -0.55 -5.14 118.68 111.57 2vas s LEU 411 Ca 0.72 -0.23 -0.17 0.00 -1.03 0.00 0.00 54.13 53.42 2vas s LEU 411 Cb -0.39 -1.84 0.25 0.00 0.03 0.00 0.00 46.19 44.24 2vas s LEU 411 CO 0.46 0.24 1.14 -0.54 0.23 0.00 0.00 176.35 177.88 2vas s LYS 412 N -1.70 -0.55 0.13 1.70 1.02 -1.26 -4.81 119.74 114.28 2vas s LYS 412 Ca 0.19 -0.01 -0.18 0.00 0.02 0.00 0.00 55.97 55.99 2vas s LYS 412 Cb -0.11 -1.67 -0.04 0.00 -0.52 0.00 0.00 37.83 35.49 2vas s LYS 412 CO 0.10 -3.28 1.79 0.28 -0.92 0.00 0.00 175.35 173.32 2vas h VAL 413 N -2.27 1.07 -0.50 3.17 2.07 -2.00 -2.27 116.25 115.53 2vas h VAL 413 Ca -0.47 -0.14 -0.12 0.00 0.82 0.00 0.00 66.70 66.80 2vas h VAL 413 Cb 1.29 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2vas h VAL 413 CO 0.40 0.07 -0.16 -0.33 0.02 0.00 0.00 177.57 177.58 2vas h GLU 414 N 0.38 1.00 0.00 1.57 5.08 -1.99 -2.68 114.58 117.93 2vas h GLU 414 Ca 0.10 -0.40 -0.05 0.00 -1.00 0.00 0.00 59.36 58.01 2vas h GLU 414 Cb -0.04 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2vas h GLU 414 CO -0.02 1.08 -0.25 1.96 -1.00 0.00 0.00 179.01 180.78 2vas h GLN 415 N 0.86 0.00 0.00 2.33 4.20 -1.90 -1.90 115.11 118.71 2vas h GLN 415 Ca 0.12 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.62 2vas h GLN 415 Cb 0.73 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.48 2vas h GLN 415 CO 0.06 0.25 -1.16 0.00 -0.67 0.00 0.00 178.83 177.30 2vas h ALA 416 N 1.75 0.55 -0.44 3.87 0.00 -1.35 -3.01 119.26 120.63 2vas h ALA 416 Ca -0.00 -0.99 -0.09 0.00 0.00 0.00 0.00 54.91 53.83 2vas h ALA 416 Cb 0.60 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2vas h ALA 416 CO 0.03 1.22 -0.09 -0.91 0.00 0.00 0.00 179.25 179.50 2vas h ASN 417 N 0.00 0.76 -0.40 0.00 2.35 -1.12 -2.97 115.58 114.19 2vas h ASN 417 Ca -0.10 -0.22 -0.07 0.00 -0.55 0.00 0.00 56.30 55.36 2vas h ASN 417 Cb 1.76 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.91 2vas h ASN 417 CO 0.10 0.88 -0.03 0.78 -1.65 0.00 0.00 177.43 177.51 2vas h ASN 418 N 0.70 0.73 -0.78 5.81 2.35 -1.38 -2.35 115.58 120.65 2vas h ASN 418 Ca 0.12 -0.33 -0.04 0.00 -0.55 0.00 0.00 56.30 55.51 2vas h ASN 418 Cb 0.56 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 2vas h ASN 418 CO 0.03 0.88 0.34 0.00 -1.65 0.00 0.00 177.43 177.03 2vas h ALA 419 N 0.87 1.01 -0.14 -0.83 0.00 -1.54 0.60 119.26 119.23 2vas h ALA 419 Ca 0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2vas h ALA 419 Cb 0.53 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2vas h ALA 419 CO 0.03 0.61 -0.03 -0.09 0.00 0.00 0.00 179.25 179.77 2vas h ARG 420 N 1.12 0.27 -0.78 0.00 2.43 -1.53 -2.49 114.38 113.40 2vas h ARG 420 Ca 0.26 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 2vas h ARG 420 Cb 0.18 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.67 2vas h ARG 420 CO -0.03 0.55 0.41 -0.44 -1.51 0.00 0.00 179.97 178.95 2vas h ASP 421 N -0.03 0.98 -0.62 -3.80 3.32 -1.30 -1.29 116.42 113.69 2vas h ASP 421 Ca 0.04 -0.09 -0.07 0.00 0.02 0.00 0.00 57.03 56.92 2vas h ASP 421 Cb 0.44 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 2vas h ASP 421 CO 0.01 0.81 0.10 0.00 -1.72 0.00 0.00 179.24 178.44 2vas h ALA 422 N 1.35 0.82 -0.36 3.45 0.00 -0.83 -1.75 119.26 121.94 2vas h ALA 422 Ca 0.27 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2vas h ALA 422 Cb 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2vas h ALA 422 CO -0.04 0.57 -0.05 1.25 0.00 0.00 0.00 179.25 180.98 2vas h LEU 423 N 0.93 0.67 -0.22 0.00 5.85 -1.26 -1.98 115.31 119.29 2vas h LEU 423 Ca 0.19 -0.34 0.06 0.00 0.84 0.00 0.00 57.88 58.62 2vas h LEU 423 Cb 0.42 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.21 2vas h LEU 423 CO 0.01 0.85 -0.15 0.00 -0.34 0.00 0.00 178.44 178.81 2vas h ALA 424 N 0.84 0.01 -0.25 1.25 0.00 -1.05 -0.70 119.26 119.35 2vas h ALA 424 Ca 0.10 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2vas h ALA 424 Cb 0.54 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2vas h ALA 424 CO 0.03 -0.57 0.07 0.87 0.00 0.00 0.00 179.25 179.65 2vas h LYS 425 N -0.14 0.40 -0.68 0.00 1.57 -1.30 -0.68 116.57 115.74 2vas h LYS 425 Ca 0.13 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 2vas h LYS 425 Cb 0.33 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 2vas h LYS 425 CO -0.31 0.48 0.30 1.15 -0.57 0.00 0.00 179.45 180.50 2vas h THR 426 N 0.24 1.24 0.09 -0.16 2.02 -1.25 0.16 112.91 115.25 2vas h THR 426 Ca 0.08 -0.70 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 2vas h THR 426 Cb 0.25 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 2vas h THR 426 CO -0.00 0.29 -0.04 0.58 0.37 0.00 0.00 175.52 176.71 2vas h VAL 427 N 0.96 1.06 -0.37 3.16 2.07 -1.03 -1.77 116.25 120.32 2vas h VAL 427 Ca 0.23 -0.56 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 2vas h VAL 427 Cb 0.16 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 2vas h VAL 427 CO -0.02 0.14 0.23 0.22 0.02 0.00 0.00 177.57 178.15 2vas h TYR 428 N -0.37 0.48 0.04 1.57 3.20 -1.02 -0.67 116.97 120.19 2vas h TYR 428 Ca -0.01 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.88 2vas h TYR 428 Cb 0.32 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 2vas h TYR 428 CO 0.01 0.34 -0.18 1.03 -1.64 0.00 0.00 178.16 177.72 2vas h SER 429 N 0.49 -0.51 -0.18 -2.11 0.87 -0.70 -0.42 113.55 110.99 2vas h SER 429 Ca 0.13 0.07 0.05 0.00 -1.23 0.00 0.00 61.79 60.81 2vas h SER 429 Cb -0.01 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 2vas h SER 429 CO -0.03 -0.25 0.14 0.45 -0.53 0.00 0.00 176.83 176.62 2vas h HIS 430 N -0.31 0.00 -0.24 2.24 3.86 -1.20 -1.21 115.15 118.29 2vas h HIS 430 Ca 0.04 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.07 2vas h HIS 430 Cb 0.36 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.83 2vas h HIS 430 CO -0.21 0.00 -0.57 1.25 0.86 0.00 0.00 177.93 179.26 2vas h LEU 431 N 0.00 0.92 -0.71 2.43 5.85 -0.16 -2.56 115.31 121.08 2vas h LEU 431 Ca 0.08 -0.56 -0.02 0.00 0.84 0.00 0.00 57.88 58.23 2vas h LEU 431 Cb 0.37 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2vas h LEU 431 CO -0.00 1.32 0.38 0.15 -0.34 0.00 0.00 178.44 179.94 2vas h PHE 432 N 0.57 0.99 -0.48 1.25 3.04 -0.13 -1.51 116.94 120.67 2vas h PHE 432 Ca -0.00 -0.03 0.07 0.00 3.98 0.00 0.00 57.97 61.98 2vas h PHE 432 Cb 1.19 -0.31 -0.06 0.00 2.56 0.00 0.00 35.95 39.33 2vas h PHE 432 CO 0.08 0.71 0.16 -0.44 -2.02 0.00 0.00 178.31 176.80 2vas h ASP 433 N 0.98 0.16 -0.62 0.41 3.32 -1.28 -2.15 116.42 117.24 2vas h ASP 433 Ca 0.25 0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.39 2vas h ASP 433 Cb 0.06 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.62 2vas h ASP 433 CO -0.04 0.12 0.38 -0.74 -1.72 0.00 0.00 179.24 177.24 2vas h HIS 434 N 0.33 0.71 -0.13 4.55 -0.00 -1.11 -1.51 115.15 117.99 2vas h HIS 434 Ca 0.23 0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.64 2vas h HIS 434 Cb 0.25 -0.23 -0.02 0.00 -0.00 0.00 0.00 27.41 27.41 2vas h HIS 434 CO -0.17 0.40 0.00 0.28 -0.00 0.00 0.00 177.93 178.45 2vas h VAL 435 N 0.74 0.91 -0.48 5.26 2.07 -0.97 0.64 116.25 124.42 2vas h VAL 435 Ca 0.25 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.71 2vas h VAL 435 Cb 0.02 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 2vas h VAL 435 CO -0.10 0.01 0.14 0.58 0.02 0.00 0.00 177.57 178.21 2vas h VAL 436 N 0.04 1.23 -0.83 2.57 2.07 -1.22 -0.33 116.25 119.78 2vas h VAL 436 Ca 0.06 -0.78 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 2vas h VAL 436 Cb 0.07 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 2vas h VAL 436 CO -0.10 0.28 0.41 -1.13 0.02 0.00 0.00 177.57 177.05 2vas h ASN 437 N 0.64 1.07 -0.56 0.57 -0.73 -1.20 -1.66 115.58 113.71 2vas h ASN 437 Ca 0.15 -0.12 -0.04 0.00 1.87 0.00 0.00 56.30 58.16 2vas h ASN 437 Cb 0.29 -0.27 -0.03 0.00 0.27 0.00 0.00 38.32 38.58 2vas h ASN 437 CO -0.00 0.89 0.22 -0.09 -0.37 0.00 0.00 177.43 178.08 2vas h ARG 438 N 1.18 0.89 -0.22 6.67 9.65 -0.29 -1.47 114.38 130.78 2vas h ARG 438 Ca 0.29 -0.15 -0.11 0.00 -1.10 0.00 0.00 59.98 58.91 2vas h ARG 438 Cb 0.10 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.51 2vas h ARG 438 CO -0.04 0.74 -0.34 0.28 2.80 0.00 0.00 179.97 183.41 2vas h VAL 439 N 0.87 1.29 0.00 0.20 2.07 -0.77 -2.87 116.25 117.03 2vas h VAL 439 Ca 0.20 -1.43 -0.08 0.00 0.82 0.00 0.00 66.70 66.21 2vas h VAL 439 Cb 0.20 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2vas h VAL 439 CO -0.01 0.45 -0.38 0.78 0.02 0.00 0.00 177.57 178.42 2vas h ASN 440 N 0.40 0.00 0.89 0.57 2.35 -0.69 -2.76 115.58 116.34 2vas h ASN 440 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2vas h ASN 440 Cb 0.78 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.15 2vas h ASN 440 CO 0.06 0.38 0.00 0.00 -1.65 0.00 0.00 177.43 176.22 2vas n GLN 441 N -3.99 0.04 0.11 0.81 6.02 -0.61 -3.37 117.38 116.39 2vas n GLN 441 Ca -0.02 0.13 0.08 0.00 -0.01 0.00 0.00 57.00 57.18 2vas n GLN 441 Cb 0.42 -1.56 0.01 0.00 1.02 0.00 0.00 30.24 30.13 2vas n GLN 441 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2vas n PHE 443 N -2.83 1.87 -2.02 0.00 1.16 -1.22 -5.02 117.46 109.40 2vas n PHE 443 Ca -0.02 -3.64 -0.28 0.00 -1.87 0.00 0.00 57.45 51.64 2vas n PHE 443 Cb 0.63 -0.40 0.10 0.00 -1.61 0.00 0.00 39.48 38.20 2vas n PHE 443 CO 0.00 0.00 0.00 -1.25 -1.87 0.00 0.00 176.76 173.64 2vas s PRO 444 N -2.98 1.80 -0.18 3.97 0.04 -1.22 -2.03 135.00 134.40 2vas s PRO 444 Ca 0.42 -0.12 -0.17 0.00 0.04 0.00 0.00 61.00 61.16 2vas s PRO 444 Cb 0.35 -2.01 0.05 0.00 0.04 0.00 0.00 34.50 32.93 2vas s PRO 444 CO -0.09 -1.62 0.49 -0.59 0.04 0.00 0.00 177.00 175.23 2vas s PHE 445 N -3.52 -0.53 0.02 0.56 -0.12 -1.26 -4.71 117.98 108.41 2vas s PHE 445 Ca 0.64 1.29 -0.25 0.00 -0.05 0.00 0.00 56.93 58.55 2vas s PHE 445 Cb -0.10 0.19 -0.17 0.00 -0.63 0.00 0.00 43.02 42.31 2vas s PHE 445 CO 0.48 -0.27 1.33 0.93 -0.05 0.00 0.00 175.22 177.64 2vas h GLU 446 N 5.26 -0.32 -3.32 1.99 5.08 -1.99 -3.48 114.58 117.81 2vas h GLU 446 Ca -0.27 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.07 2vas h GLU 446 Cb 1.17 0.07 -0.12 0.00 0.50 0.00 0.00 28.75 30.38 2vas h GLU 446 CO 0.21 -0.02 -0.00 -0.08 -1.00 0.00 0.00 179.01 178.11 2vas s THR 447 N -4.87 0.05 0.11 1.13 -1.32 -1.26 -5.19 115.64 104.29 2vas s THR 447 Ca -0.15 -0.55 -0.13 0.00 -1.21 0.00 0.00 61.69 59.65 2vas s THR 447 Cb 0.03 -1.26 0.02 0.00 -1.51 0.00 0.00 72.50 69.78 2vas s THR 447 CO 0.58 -0.21 0.33 -0.94 -2.21 0.00 0.00 174.62 172.17 2vas s SER 448 N -2.82 -0.11 -0.21 8.08 1.04 -1.26 -4.90 113.70 113.52 2vas s SER 448 Ca 0.04 -0.43 -0.20 0.00 0.48 0.00 0.00 55.95 55.85 2vas s SER 448 Cb 0.01 0.43 -0.17 0.00 0.10 0.00 0.00 66.02 66.38 2vas s SER 448 CO -0.10 -0.81 0.12 -1.20 0.98 0.00 0.00 173.24 172.23 2vas n SER 449 N -0.16 1.86 -4.20 7.02 7.64 0.59 -4.99 113.62 121.38 2vas n SER 449 Ca -0.16 0.43 -0.12 0.00 1.01 0.00 0.00 58.87 60.04 2vas n SER 449 Cb 0.63 -0.94 -0.10 0.00 -1.01 0.00 0.00 64.21 62.79 2vas n SER 449 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2vas s TYR 450 N -2.37 1.08 0.19 1.43 1.51 -1.10 -4.92 117.35 113.17 2vas s TYR 450 Ca -0.28 -1.15 0.05 0.00 -1.01 0.00 0.00 57.07 54.67 2vas s TYR 450 Cb 0.06 -0.61 -0.05 0.00 -0.11 0.00 0.00 41.96 41.26 2vas s TYR 450 CO 0.54 -0.39 -0.08 -0.59 -1.11 0.00 0.00 175.55 173.93 2vas s PHE 451 N -3.87 1.48 -0.20 2.71 -0.12 -1.26 -0.04 117.98 116.67 2vas s PHE 451 Ca 0.26 -0.76 0.01 0.00 -0.05 0.00 0.00 56.93 56.39 2vas s PHE 451 Cb 0.07 -0.77 0.02 0.00 -0.63 0.00 0.00 43.02 41.71 2vas s PHE 451 CO 0.04 0.12 -0.17 0.42 -0.05 0.00 0.00 175.22 175.58 2vas s ILE 452 N -3.26 2.16 -0.08 -4.49 1.01 -0.46 -1.34 121.20 114.75 2vas s ILE 452 Ca 0.22 -1.03 0.01 0.00 0.00 0.00 0.00 60.65 59.86 2vas s ILE 452 Cb 0.03 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 2vas s ILE 452 CO 0.05 0.44 -0.11 -0.83 0.00 0.00 0.00 174.94 174.49 2vas s GLY 453 N 1.27 1.61 -0.20 6.18 0.00 0.36 -1.17 107.32 115.36 2vas s GLY 453 Ca 0.03 -0.92 -0.02 0.00 0.00 0.00 0.00 44.72 43.81 2vas s GLY 453 CO -0.11 -0.58 -0.09 0.14 0.00 0.00 0.00 173.10 172.46 2vas s VAL 454 N -0.50 3.02 -0.20 1.40 1.01 -0.47 -0.51 120.40 124.14 2vas s VAL 454 Ca 0.07 -0.62 -0.14 0.00 0.00 0.00 0.00 61.98 61.30 2vas s VAL 454 Cb -0.12 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 2vas s VAL 454 CO 0.02 0.46 0.30 -0.22 0.00 0.00 0.00 175.10 175.65 2vas s LEU 455 N 1.34 4.16 -0.38 3.92 2.96 -0.36 -1.48 118.68 128.84 2vas s LEU 455 Ca 0.04 0.38 0.01 0.00 -0.22 0.00 0.00 54.13 54.35 2vas s LEU 455 Cb -0.14 -2.35 0.12 0.00 0.50 0.00 0.00 46.19 44.32 2vas s LEU 455 CO -0.05 0.01 0.17 -0.62 -1.32 0.00 0.00 176.35 174.54 2vas s ASP 456 N 0.90 3.82 0.01 3.68 3.68 -0.05 -1.49 116.67 127.21 2vas s ASP 456 Ca 0.15 -2.19 -0.05 0.00 2.13 0.00 0.00 52.55 52.59 2vas s ASP 456 Cb -0.14 -0.96 -0.01 0.00 -1.45 0.00 0.00 42.92 40.36 2vas s ASP 456 CO 0.06 -0.33 0.08 -0.51 0.13 0.00 0.00 175.17 174.59 2vas s ILE 457 N 0.92 0.09 0.36 4.11 2.07 -1.26 -1.80 121.20 125.69 2vas s ILE 457 Ca 0.14 -0.78 -0.28 0.00 -1.41 0.00 0.00 60.65 58.32 2vas s ILE 457 Cb -0.21 -0.39 -0.10 0.00 0.13 0.00 0.00 42.46 41.88 2vas s ILE 457 CO -0.10 -0.43 1.40 0.00 -1.91 0.00 0.00 174.94 173.90 2vas s ALA 458 N -1.46 3.52 0.81 1.50 0.00 -1.26 -4.53 121.76 120.34 2vas s ALA 458 Ca -0.15 1.42 -0.02 0.00 0.00 0.00 0.00 51.96 53.21 2vas s ALA 458 Cb -0.08 -3.55 0.03 0.00 0.00 0.00 0.00 23.12 19.53 2vas s ALA 458 CO 0.01 -0.87 0.21 0.41 0.00 0.00 0.00 175.76 175.52 2vas n GLY 459 N 0.62 -0.53 3.76 0.00 0.00 -0.59 -4.88 105.19 103.56 2vas n GLY 459 Ca 0.01 -1.78 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 2vas n GLY 459 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vas s PHE 460 N -1.11 2.78 -0.02 1.61 0.40 -1.26 -4.87 117.98 115.51 2vas s PHE 460 Ca 0.13 1.00 -0.19 0.00 -0.60 0.00 0.00 56.93 57.27 2vas s PHE 460 Cb -0.00 -3.97 0.03 0.00 0.51 0.00 0.00 43.02 39.59 2vas s PHE 460 CO 0.09 -3.07 0.40 -2.00 0.70 0.00 0.00 175.22 171.34 2vas s GLU 461 N -1.06 0.77 0.13 0.44 2.12 -1.26 -4.74 118.70 115.09 2vas s GLU 461 Ca 0.58 -0.08 -0.30 0.00 0.36 0.00 0.00 54.97 55.53 2vas s GLU 461 Cb -0.45 0.35 -0.07 0.00 0.26 0.00 0.00 34.13 34.22 2vas s GLU 461 CO 0.52 -0.22 1.07 -0.47 -0.54 0.00 0.00 175.26 175.62 2vas s TYR 462 N -1.31 3.63 -0.00 5.30 6.14 -1.26 -5.05 117.35 124.80 2vas s TYR 462 Ca -0.13 1.61 0.01 0.00 0.64 0.00 0.00 57.07 59.20 2vas s TYR 462 Cb -0.04 -3.23 -0.00 0.00 0.42 0.00 0.00 41.96 39.11 2vas s TYR 462 CO 0.06 -0.46 -0.03 -0.06 0.64 0.00 0.00 175.55 175.69 2vas s PHE 463 N 0.11 0.27 0.05 4.97 0.40 -1.26 -5.04 117.98 117.48 2vas s PHE 463 Ca 0.50 -0.05 0.18 0.00 -0.60 0.00 0.00 56.93 56.96 2vas s PHE 463 Cb -0.27 -0.17 0.48 0.00 0.51 0.00 0.00 43.02 43.56 2vas s PHE 463 CO 0.32 -0.01 1.64 1.05 0.70 0.00 0.00 175.22 178.92 2vas h GLU 464 N 6.09 0.00 -4.68 0.44 4.11 -2.00 -3.40 114.58 115.14 2vas h GLU 464 Ca -0.26 0.00 -0.61 0.00 0.07 0.00 0.00 59.36 58.56 2vas h GLU 464 Cb 1.20 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 30.09 2vas h GLU 464 CO 0.51 0.41 -0.83 -1.01 0.07 0.00 0.00 179.01 178.16 2vas s HIS 465 N -3.37 2.26 -0.35 2.06 3.76 -1.26 -5.11 115.29 113.29 2vas s HIS 465 Ca 0.02 -1.33 -0.13 0.00 -0.15 0.00 0.00 55.06 53.47 2vas s HIS 465 Cb 0.10 -1.63 -0.01 0.00 1.11 0.00 0.00 32.58 32.15 2vas s HIS 465 CO 0.70 -0.70 0.23 -0.80 -0.85 0.00 0.00 174.74 173.33 2vas s ASN 466 N 1.45 5.96 0.00 1.40 -0.87 -1.26 -5.02 114.94 116.61 2vas s ASN 466 Ca 0.04 -0.55 0.00 0.00 -1.57 0.00 0.00 52.86 50.77 2vas s ASN 466 Cb -0.13 -2.11 0.00 0.00 -0.02 0.00 0.00 41.25 38.98 2vas s ASN 466 CO -0.10 -0.27 0.00 -0.24 -2.57 0.00 0.00 177.10 173.91 2vas n SER 467 N 5.09 1.37 -0.18 -1.22 2.88 -1.26 -1.27 113.62 119.02 2vas n SER 467 Ca -0.12 -0.08 -0.00 0.00 -1.33 0.00 0.00 58.87 57.33 2vas n SER 467 Cb 0.49 0.00 0.24 0.00 -0.75 0.00 0.00 64.21 64.19 2vas n SER 467 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 2vas h PHE 468 N 0.05 0.90 -0.48 0.66 3.57 -1.90 -1.51 116.94 118.23 2vas h PHE 468 Ca 0.00 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.52 2vas h PHE 468 Cb 0.00 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 38.41 2vas h PHE 468 CO 0.00 0.61 0.27 0.93 -2.23 0.00 0.00 178.31 177.89 2vas h GLU 469 N 0.94 0.53 -0.55 1.11 3.07 -1.97 -1.84 114.58 115.86 2vas h GLU 469 Ca 0.24 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 59.03 2vas h GLU 469 Cb -0.02 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.75 2vas h GLU 469 CO -0.04 0.35 0.18 1.96 -1.40 0.00 0.00 179.01 180.05 2vas h GLN 470 N 0.54 0.85 -0.68 2.33 7.50 -1.85 -2.78 115.11 121.03 2vas h GLN 470 Ca 0.20 -0.18 0.05 0.00 0.50 0.00 0.00 58.65 59.22 2vas h GLN 470 Cb 0.05 -0.12 -0.05 0.00 0.05 0.00 0.00 27.48 27.40 2vas h GLN 470 CO -0.11 0.77 0.40 0.35 -1.50 0.00 0.00 178.83 178.74 2vas h PHE 471 N 0.76 0.73 -0.51 2.96 3.57 -0.90 -0.94 116.94 122.62 2vas h PHE 471 Ca 0.18 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.63 2vas h PHE 471 Cb 0.27 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 2vas h PHE 471 CO 0.02 0.37 0.03 0.00 -2.23 0.00 0.00 178.31 176.50 2vas h ILE 473 N 0.75 1.34 -0.54 0.00 2.04 -1.32 -2.03 117.51 117.75 2vas h ILE 473 Ca 0.15 -2.28 -0.02 0.00 1.00 0.00 0.00 64.86 63.70 2vas h ILE 473 Cb 0.47 2.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.83 2vas h ILE 473 CO 0.02 0.69 0.25 0.78 0.00 0.00 0.00 178.15 179.89 2vas h ASN 474 N 0.33 0.72 -0.23 1.72 2.35 -1.21 -0.12 115.58 119.13 2vas h ASN 474 Ca -0.08 -0.14 0.03 0.00 -0.55 0.00 0.00 56.30 55.56 2vas h ASN 474 Cb 1.55 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 39.70 2vas h ASN 474 CO 0.17 0.66 0.03 0.22 -1.65 0.00 0.00 177.43 176.86 2vas h TYR 475 N 0.73 0.04 -0.39 1.19 3.20 -1.43 -0.95 116.97 119.37 2vas h TYR 475 Ca 0.19 0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.15 2vas h TYR 475 Cb 0.14 0.02 -0.08 0.00 1.54 0.00 0.00 36.73 38.34 2vas h TYR 475 CO -0.00 -0.00 -0.19 0.00 -1.64 0.00 0.00 178.16 176.33 2vas h ASN 477 N -0.12 0.00 -0.37 0.00 2.35 -0.57 -1.67 115.58 115.19 2vas h ASN 477 Ca 0.19 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.97 2vas h ASN 477 Cb 0.42 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.76 2vas h ASN 477 CO -0.47 0.26 0.19 -0.33 -1.65 0.00 0.00 177.43 175.43 2vas h GLU 478 N 0.00 0.37 -0.09 0.81 4.39 -0.91 0.30 114.58 119.44 2vas h GLU 478 Ca -0.00 -0.02 -0.13 0.00 0.34 0.00 0.00 59.36 59.54 2vas h GLU 478 Cb 0.52 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 2vas h GLU 478 CO 0.03 0.24 -0.53 0.87 -1.16 0.00 0.00 179.01 178.47 2vas h LYS 479 N 0.38 0.26 -0.10 2.33 1.57 -1.26 -1.97 116.57 117.78 2vas h LYS 479 Ca 0.16 -0.16 -0.21 0.00 -1.87 0.00 0.00 60.65 58.57 2vas h LYS 479 Cb 0.06 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.39 2vas h LYS 479 CO -0.11 0.73 -0.77 -0.07 -0.57 0.00 0.00 179.45 178.66 2vas h LEU 480 N 0.21 0.69 -0.85 2.94 3.38 -1.18 -2.72 115.31 117.78 2vas h LEU 480 Ca 0.00 -0.46 -0.12 0.00 0.09 0.00 0.00 57.88 57.40 2vas h LEU 480 Cb 1.01 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2vas h LEU 480 CO 0.08 1.23 -0.43 -0.61 0.09 0.00 0.00 178.44 178.80 2vas h GLN 481 N 0.39 0.31 -0.31 1.13 5.75 -0.88 -1.76 115.11 119.73 2vas h GLN 481 Ca -0.05 -0.16 -0.01 0.00 -0.15 0.00 0.00 58.65 58.29 2vas h GLN 481 Cb 1.37 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.91 2vas h GLN 481 CO 0.14 0.69 0.16 0.37 -2.65 0.00 0.00 178.83 177.54 2vas h GLN 482 N 0.26 0.45 -0.42 1.69 4.15 -1.29 -0.42 115.11 119.52 2vas h GLN 482 Ca 0.02 -0.06 0.06 0.00 0.77 0.00 0.00 58.65 59.44 2vas h GLN 482 Cb 0.87 -0.08 -0.05 0.00 0.21 0.00 0.00 27.48 28.43 2vas h GLN 482 CO 0.07 0.40 0.14 0.35 -1.93 0.00 0.00 178.83 177.86 2vas h PHE 483 N 0.38 0.24 -0.25 3.99 3.57 -1.39 -1.58 116.94 121.90 2vas h PHE 483 Ca 0.11 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.66 2vas h PHE 483 Cb 0.09 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 2vas h PHE 483 CO -0.02 0.08 0.09 0.35 -2.23 0.00 0.00 178.31 176.57 2vas h PHE 484 N 0.29 0.16 -0.17 0.41 -0.00 -1.13 -1.19 116.94 115.31 2vas h PHE 484 Ca 0.20 0.01 0.03 0.00 -0.00 0.00 0.00 57.97 58.21 2vas h PHE 484 Cb 0.20 -0.03 -0.03 0.00 -0.00 0.00 0.00 35.95 36.09 2vas h PHE 484 CO -0.16 0.08 -0.02 -0.91 -0.00 0.00 0.00 178.31 177.30 2vas h ASN 485 N 0.20 -0.10 -0.60 0.41 -0.26 -0.92 -1.50 115.58 112.81 2vas h ASN 485 Ca 0.11 0.04 0.05 0.00 -0.56 0.00 0.00 56.30 55.94 2vas h ASN 485 Cb 0.07 0.08 -0.05 0.00 -1.06 0.00 0.00 38.32 37.36 2vas h ASN 485 CO -0.11 -0.03 0.33 -0.33 -1.06 0.00 0.00 177.43 176.24 2vas h GLU 486 N 0.03 0.61 -0.13 0.81 5.08 -1.07 -1.47 114.58 118.43 2vas h GLU 486 Ca 0.08 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.21 2vas h GLU 486 Cb 0.11 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 2vas h GLU 486 CO -0.15 0.40 -0.70 0.00 -1.00 0.00 0.00 179.01 177.57 2vas h ARG 487 N 0.63 0.56 -0.33 2.33 2.47 -1.14 -2.25 114.38 116.65 2vas h ARG 487 Ca 0.26 -0.43 -0.18 0.00 -1.26 0.00 0.00 59.98 58.38 2vas h ARG 487 Cb 0.14 0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 28.54 2vas h ARG 487 CO -0.16 1.06 -0.48 0.82 0.56 0.00 0.00 179.97 181.76 2vas h ILE 488 N 0.40 1.27 -0.21 2.04 1.08 -1.15 -2.31 117.51 118.62 2vas h ILE 488 Ca -0.03 -1.66 0.02 0.00 -0.39 0.00 0.00 64.86 62.81 2vas h ILE 488 Cb 1.28 1.53 -0.02 0.00 -3.07 0.00 0.00 36.82 36.54 2vas h ILE 488 CO 0.13 0.55 0.06 0.25 -0.69 0.00 0.00 178.15 178.45 2vas h LEU 489 N 0.70 0.05 -0.50 1.44 5.85 -1.25 -2.15 115.31 119.45 2vas h LEU 489 Ca 0.03 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.82 2vas h LEU 489 Cb 1.08 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 2vas h LEU 489 CO 0.11 0.06 0.25 0.50 -0.34 0.00 0.00 178.44 179.02 2vas h LYS 490 N 0.15 0.47 -0.46 1.25 3.64 -1.36 -0.83 116.57 119.42 2vas h LYS 490 Ca 0.09 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.48 2vas h LYS 490 Cb 0.07 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 2vas h LYS 490 CO -0.11 0.31 0.23 0.93 -2.27 0.00 0.00 179.45 178.54 2vas h GLU 491 N 0.48 0.45 -0.45 1.90 5.08 -1.20 0.25 114.58 121.08 2vas h GLU 491 Ca 0.22 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.45 2vas h GLU 491 Cb 0.14 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2vas h GLU 491 CO -0.16 0.30 -0.12 0.93 -1.00 0.00 0.00 179.01 178.95 2vas h GLU 492 N 0.46 0.83 -0.42 2.33 4.39 -0.98 0.81 114.58 122.00 2vas h GLU 492 Ca 0.20 -0.29 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 2vas h GLU 492 Cb 0.11 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 2vas h GLU 492 CO -0.14 0.91 0.01 1.96 -1.16 0.00 0.00 179.01 180.59 2vas h GLN 493 N 0.75 0.73 -0.49 2.33 4.20 -1.01 -2.58 115.11 119.04 2vas h GLN 493 Ca 0.12 -0.23 -0.06 0.00 0.06 0.00 0.00 58.65 58.55 2vas h GLN 493 Cb 0.62 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 2vas h GLN 493 CO 0.04 0.80 0.07 1.49 -0.67 0.00 0.00 178.83 180.57 2vas h GLU 494 N 0.57 0.77 0.08 1.46 4.57 -0.70 -3.00 114.58 118.33 2vas h GLU 494 Ca 0.12 -0.17 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2vas h GLU 494 Cb 0.47 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.95 2vas h GLU 494 CO 0.02 0.73 -0.04 1.25 -1.18 0.00 0.00 179.01 179.79 2vas h LEU 495 N 0.73 -0.10 -0.35 1.64 5.85 -0.77 -2.55 115.31 119.77 2vas h LEU 495 Ca 0.16 -0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.73 2vas h LEU 495 Cb 0.34 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 2vas h LEU 495 CO 0.01 0.14 0.10 1.88 -0.34 0.00 0.00 178.44 180.22 2vas h TYR 496 N -0.34 0.17 -0.23 1.25 -1.99 -1.39 -1.57 116.97 112.86 2vas h TYR 496 Ca -0.01 0.02 -0.19 0.00 2.00 0.00 0.00 58.73 60.55 2vas h TYR 496 Cb 0.29 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 38.99 2vas h TYR 496 CO 0.00 0.05 -0.60 -0.56 -0.00 0.00 0.00 178.16 177.05 2vas h GLN 497 N 0.23 0.77 -0.22 4.88 3.07 -1.59 0.79 115.11 123.05 2vas h GLN 497 Ca 0.16 -0.52 -0.04 0.00 0.09 0.00 0.00 58.65 58.34 2vas h GLN 497 Cb 0.16 0.07 -0.01 0.00 0.08 0.00 0.00 27.48 27.78 2vas h GLN 497 CO -0.19 1.14 -0.04 -0.22 0.09 0.00 0.00 178.83 179.61 2vas h LYS 498 N 0.57 0.33 0.00 0.06 3.64 -1.31 -2.70 116.57 117.17 2vas h LYS 498 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2vas h LYS 498 Cb 1.20 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2vas h LYS 498 CO 0.13 0.40 -0.75 0.39 -2.27 0.00 0.00 179.45 177.34 2vas n GLU 499 N -4.31 0.06 0.00 1.90 -0.58 -0.61 -4.72 120.64 112.38 2vas n GLU 499 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2vas n GLU 499 Cb 0.23 -1.52 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 2vas n GLU 499 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2vas n GLY 500 N 1.47 1.08 0.30 0.62 0.00 -0.53 -3.04 105.19 105.09 2vas n GLY 500 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.20 2vas n GLY 500 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2vas n LEU 501 N 0.00 1.04 0.00 0.99 4.77 0.27 -4.98 117.00 119.09 2vas n LEU 501 Ca 0.00 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 2vas n LEU 501 Cb 0.00 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 2vas n LEU 501 CO 0.00 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 2vas n GLY 502 N 1.23 0.20 3.70 -0.72 0.00 -1.23 -4.82 105.19 103.54 2vas n GLY 502 Ca 0.17 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.82 2vas n GLY 502 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vas s VAL 503 N 0.00 4.86 -0.22 1.61 1.01 -1.26 -3.70 120.40 122.70 2vas s VAL 503 Ca 0.00 1.98 -0.23 0.00 0.00 0.00 0.00 61.98 63.73 2vas s VAL 503 Cb 0.00 -4.29 -0.01 0.00 0.00 0.00 0.00 36.38 32.08 2vas s VAL 503 CO 0.00 0.11 0.74 0.21 0.00 0.00 0.00 175.10 176.17 2vas s ASN 504 N 1.03 6.76 -0.02 3.32 3.84 -1.26 -4.97 114.94 123.64 2vas s ASN 504 Ca 0.49 0.94 0.18 0.00 0.21 0.00 0.00 52.86 54.68 2vas s ASN 504 Cb -0.20 -2.40 0.55 0.00 -0.55 0.00 0.00 41.25 38.65 2vas s ASN 504 CO 0.23 -0.41 1.45 -0.62 -2.79 0.00 0.00 177.10 174.96 2vas n GLU 505 N 5.62 2.57 -1.89 0.43 -0.58 -1.26 -4.95 120.64 120.57 2vas n GLU 505 Ca 0.03 -2.21 -0.34 0.00 -0.42 0.00 0.00 57.16 54.21 2vas n GLU 505 Cb 0.48 -1.53 0.04 0.00 -0.57 0.00 0.00 31.44 29.86 2vas n GLU 505 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2vas s VAL 506 N -1.31 3.11 0.14 2.62 -7.23 -1.26 -5.07 120.40 111.40 2vas s VAL 506 Ca 0.41 0.58 -0.16 0.00 -1.81 0.00 0.00 61.98 61.00 2vas s VAL 506 Cb 0.22 -3.13 0.03 0.00 0.56 0.00 0.00 36.38 34.06 2vas s VAL 506 CO 0.26 -0.26 0.41 -1.38 -0.31 0.00 0.00 175.10 173.82 2vas s HIS 507 N -2.10 -0.13 0.32 2.82 -3.43 -1.26 -5.11 115.29 106.40 2vas s HIS 507 Ca 0.70 -0.20 0.09 0.00 -0.80 0.00 0.00 55.06 54.86 2vas s HIS 507 Cb -0.23 0.26 -0.05 0.00 -1.43 0.00 0.00 32.58 31.13 2vas s HIS 507 CO 0.37 -0.74 -0.02 1.52 -2.00 0.00 0.00 174.74 173.86 2vas s TYR 508 N -3.83 2.53 -0.25 0.38 1.13 -1.26 -4.79 117.35 111.26 2vas s TYR 508 Ca 0.05 -0.39 -0.21 0.00 -1.41 0.00 0.00 57.07 55.11 2vas s TYR 508 Cb 0.01 -1.38 -0.02 0.00 -1.10 0.00 0.00 41.96 39.48 2vas s TYR 508 CO -0.09 0.53 0.64 0.54 -2.51 0.00 0.00 175.55 174.66 2vas s VAL 509 N -2.49 4.98 0.63 -3.49 0.11 -1.26 -5.04 120.40 113.84 2vas s VAL 509 Ca 0.34 1.16 -0.17 0.00 -2.93 0.00 0.00 61.98 60.37 2vas s VAL 509 Cb -0.02 -3.94 -0.01 0.00 -1.53 0.00 0.00 36.38 30.88 2vas s VAL 509 CO 0.19 0.04 1.16 -0.62 -3.33 0.00 0.00 175.10 172.53 2vas s ASP 510 N 1.43 5.08 -0.23 3.54 2.15 -1.26 -4.96 116.67 122.42 2vas s ASP 510 Ca 0.27 2.21 0.13 0.00 0.43 0.00 0.00 52.55 55.59 2vas s ASP 510 Cb -0.16 -2.58 0.46 0.00 -0.30 0.00 0.00 42.92 40.35 2vas s ASP 510 CO 0.09 -1.66 1.36 -0.46 -0.17 0.00 0.00 175.17 174.33 2vas n ASN 511 N -2.01 2.60 0.16 -0.34 6.94 -1.26 -4.75 115.26 116.60 2vas n ASN 511 Ca 0.12 -3.53 0.04 0.00 -0.02 0.00 0.00 54.58 51.19 2vas n ASN 511 Cb 0.51 -0.56 0.43 0.00 -2.36 0.00 0.00 39.78 37.80 2vas n ASN 511 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 2vas h GLN 512 N 1.00 0.14 -0.40 -3.83 5.75 -1.96 -2.05 115.11 113.76 2vas h GLN 512 Ca 0.10 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.50 2vas h GLN 512 Cb 1.38 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.89 2vas h GLN 512 CO 0.21 0.30 -0.03 0.38 -2.65 0.00 0.00 178.83 177.04 2vas h ASP 513 N 0.14 0.63 -0.05 -0.69 2.03 -1.99 0.20 116.42 116.69 2vas h ASP 513 Ca 0.03 -0.15 -0.24 0.00 -0.73 0.00 0.00 57.03 55.94 2vas h ASP 513 Cb 0.36 -0.17 0.01 0.00 -0.83 0.00 0.00 39.33 38.70 2vas h ASP 513 CO 0.02 0.72 -0.87 0.00 -1.03 0.00 0.00 179.24 178.08 2vas h ILE 515 N 0.46 1.05 -0.51 0.00 2.04 -1.09 -3.02 117.51 116.44 2vas h ILE 515 Ca -0.08 -0.22 -0.08 0.00 1.00 0.00 0.00 64.86 65.49 2vas h ILE 515 Cb 1.51 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 2vas h ILE 515 CO 0.17 0.12 0.03 0.44 0.00 0.00 0.00 178.15 178.91 2vas h ASP 516 N 0.64 0.87 -0.99 1.72 3.32 -0.59 -1.09 116.42 120.29 2vas h ASP 516 Ca 0.22 -0.29 0.22 0.00 0.02 0.00 0.00 57.03 57.20 2vas h ASP 516 Cb 0.04 -0.23 -0.12 0.00 0.22 0.00 0.00 39.33 39.24 2vas h ASP 516 CO -0.10 0.95 0.59 0.25 -1.72 0.00 0.00 179.24 179.20 2vas h LEU 517 N 0.76 0.69 0.08 1.55 5.85 -1.23 -1.43 115.31 121.57 2vas h LEU 517 Ca 0.15 0.12 -0.21 0.00 0.84 0.00 0.00 57.88 58.78 2vas h LEU 517 Cb 0.49 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 2vas h LEU 517 CO 0.02 0.16 -1.08 0.40 -0.34 0.00 0.00 178.44 177.60 2vas h ILE 518 N 0.63 1.20 0.00 4.05 2.04 -1.39 -0.90 117.51 123.13 2vas h ILE 518 Ca 0.61 -2.37 0.00 0.00 1.00 0.00 0.00 64.86 64.10 2vas h ILE 518 Cb 1.09 2.80 0.00 0.00 -0.74 0.00 0.00 36.82 39.97 2vas h ILE 518 CO -0.45 0.62 -0.52 -1.84 0.00 0.00 0.00 178.15 175.97 2vas n GLU 519 N -4.15 3.51 -1.73 2.37 0.28 -0.43 -1.60 120.64 118.89 2vas n GLU 519 Ca -0.22 -0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.35 2vas n GLU 519 Cb 0.78 -0.99 -0.01 0.00 1.43 0.00 0.00 31.44 32.66 2vas n GLU 519 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2vas n ALA 520 N -1.26 1.75 -1.79 -1.84 0.00 -0.55 -4.83 120.51 111.99 2vas n ALA 520 Ca 0.02 0.36 -0.41 0.00 0.00 0.00 0.00 53.44 53.40 2vas n ALA 520 Cb 0.16 -2.33 -0.01 0.00 0.00 0.00 0.00 19.45 17.28 2vas n ALA 520 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2vas s ARG 521 N -1.83 4.17 0.00 0.00 0.52 -1.26 -0.33 118.95 120.22 2vas s ARG 521 Ca 0.56 2.48 0.00 0.00 -0.52 0.00 0.00 55.73 58.25 2vas s ARG 521 Cb -0.53 -3.01 0.00 0.00 0.52 0.00 0.00 34.95 31.92 2vas s ARG 521 CO 0.62 -0.48 0.00 1.28 0.02 0.00 0.00 175.30 176.73 2vas n LEU 522 N 1.13 0.00 -0.00 2.53 4.77 -1.26 -4.34 117.00 119.82 2vas n LEU 522 Ca 0.03 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.08 2vas n LEU 522 Cb 0.39 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.40 2vas n LEU 522 CO 0.63 0.00 -0.05 1.33 -1.33 0.00 0.00 177.39 177.97 2vas n VAL 523 N 0.00 0.00 -1.78 4.08 0.24 -1.24 -4.51 118.33 115.11 2vas n VAL 523 Ca 0.00 -0.14 -0.32 0.00 -2.04 0.00 0.00 64.34 61.83 2vas n VAL 523 Cb 0.00 0.99 0.04 0.00 -1.47 0.00 0.00 33.84 33.40 2vas n VAL 523 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2vas s GLY 524 N -2.46 2.03 0.25 7.63 0.00 0.55 -4.86 107.32 110.46 2vas s GLY 524 Ca 0.06 0.40 -0.03 0.00 0.00 0.00 0.00 44.72 45.14 2vas s GLY 524 CO 0.63 0.73 1.78 -2.22 0.00 0.00 0.00 173.10 174.02 2vas h ILE 525 N -0.04 0.81 -0.46 0.90 2.04 -0.93 -0.96 117.51 118.85 2vas h ILE 525 Ca -0.46 -0.23 0.03 0.00 1.00 0.00 0.00 64.86 65.20 2vas h ILE 525 Cb 1.23 0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 2vas h ILE 525 CO 0.55 0.12 0.26 -0.07 0.00 0.00 0.00 178.15 179.01 2vas h LEU 526 N 0.67 0.40 -0.65 1.44 3.38 -1.58 0.11 115.31 119.08 2vas h LEU 526 Ca 0.42 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.27 2vas h LEU 526 Cb 0.51 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2vas h LEU 526 CO -0.31 0.29 -0.33 0.44 0.09 0.00 0.00 178.44 178.61 2vas h ASP 527 N 0.52 0.72 -0.79 -0.43 3.45 -1.73 -1.91 116.42 116.24 2vas h ASP 527 Ca 0.19 -0.29 -0.04 0.00 0.43 0.00 0.00 57.03 57.32 2vas h ASP 527 Cb 0.05 -0.20 -0.04 0.00 -0.56 0.00 0.00 39.33 38.59 2vas h ASP 527 CO -0.11 0.99 0.36 0.40 -1.57 0.00 0.00 179.24 179.31 2vas h ILE 528 N 0.58 1.25 -0.11 0.35 2.04 -0.79 -1.67 117.51 119.17 2vas h ILE 528 Ca 0.06 -0.75 -0.00 0.00 1.00 0.00 0.00 64.86 65.17 2vas h ILE 528 Cb 0.84 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 2vas h ILE 528 CO 0.07 0.31 0.06 0.25 0.00 0.00 0.00 178.15 178.84 2vas h LEU 529 N 1.13 0.14 -0.67 1.44 5.85 -0.65 -2.89 115.31 119.66 2vas h LEU 529 Ca 0.27 -0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.98 2vas h LEU 529 Cb 0.16 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.08 2vas h LEU 529 CO -0.03 0.20 0.32 0.44 -0.34 0.00 0.00 178.44 179.02 2vas h ASP 530 N 0.07 0.40 -0.94 1.25 5.19 -1.12 -1.61 116.42 119.65 2vas h ASP 530 Ca 0.04 0.06 0.14 0.00 -0.62 0.00 0.00 57.03 56.65 2vas h ASP 530 Cb 0.09 -0.00 -0.09 0.00 0.18 0.00 0.00 39.33 39.51 2vas h ASP 530 CO -0.01 0.23 0.56 -0.33 -3.12 0.00 0.00 179.24 176.58 2vas h GLU 531 N 0.55 0.79 -0.29 3.56 5.08 -1.19 -2.27 114.58 120.80 2vas h GLU 531 Ca 0.33 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.58 2vas h GLU 531 Cb 0.35 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2vas h GLU 531 CO -0.27 0.52 -0.05 1.49 -1.00 0.00 0.00 179.01 179.70 2vas h GLU 532 N 0.81 0.55 -0.31 2.33 4.57 -1.11 -2.87 114.58 118.55 2vas h GLU 532 Ca 0.50 -0.20 0.09 0.00 -1.18 0.00 0.00 59.36 58.57 2vas h GLU 532 Cb 0.63 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 2vas h GLU 532 CO -0.32 0.74 0.29 -0.91 -1.18 0.00 0.00 179.01 177.62 2vas h ASN 533 N 0.32 0.00 0.20 1.04 4.21 -0.83 -2.28 115.58 118.24 2vas h ASN 533 Ca 0.08 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.59 2vas h ASN 533 Cb 0.52 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.72 2vas h ASN 533 CO 0.03 0.00 -0.31 0.54 -1.29 0.00 0.00 177.43 176.40 2vas n ARG 534 N -4.00 0.86 -1.54 0.81 1.74 -0.98 -4.89 116.66 108.65 2vas n ARG 534 Ca 0.05 -0.55 -0.32 0.00 -0.77 0.00 0.00 57.85 56.26 2vas n ARG 534 Cb 0.45 -1.49 0.06 0.00 -1.02 0.00 0.00 32.46 30.46 2vas n ARG 534 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2vas s LEU 535 N -2.52 3.21 0.15 0.55 1.43 -0.86 -4.96 118.68 115.68 2vas s LEU 535 Ca 0.23 1.87 -0.18 0.00 -1.03 0.00 0.00 54.13 55.01 2vas s LEU 535 Cb 0.19 -4.53 0.04 0.00 0.03 0.00 0.00 46.19 41.92 2vas s LEU 535 CO 0.54 -1.76 1.70 -0.65 0.23 0.00 0.00 176.35 176.41 2vas h PRO 536 N -0.54 0.04 -3.29 1.29 0.11 -1.93 -3.33 132.00 124.35 2vas h PRO 536 Ca -0.45 -0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.01 2vas h PRO 536 Cb 1.23 -0.01 -0.40 0.00 0.11 0.00 0.00 31.00 31.94 2vas h PRO 536 CO 0.53 0.02 -0.51 -0.65 -0.21 0.00 0.00 178.00 177.19 2vas s GLN 537 N -6.20 2.40 0.37 1.05 -1.52 -1.26 -5.10 119.66 109.39 2vas s GLN 537 Ca -0.13 -2.96 -0.28 0.00 -1.95 0.00 0.00 55.36 50.03 2vas s GLN 537 Cb 0.12 -3.50 -0.11 0.00 -0.22 0.00 0.00 33.01 29.31 2vas s GLN 537 CO 0.70 -1.20 1.46 -2.14 -0.25 0.00 0.00 175.29 173.86 2vas s PRO 538 N -0.83 4.15 -0.07 2.91 0.02 -1.25 -5.03 135.00 134.89 2vas s PRO 538 Ca 0.21 2.52 -0.03 0.00 0.02 0.00 0.00 61.00 63.72 2vas s PRO 538 Cb -0.15 -2.99 0.04 0.00 0.02 0.00 0.00 34.50 31.43 2vas s PRO 538 CO -0.08 -0.48 0.15 0.45 -0.33 0.00 0.00 177.00 176.70 2vas s SER 539 N -0.17 0.43 0.31 2.53 0.15 -1.26 -5.03 113.70 110.65 2vas s SER 539 Ca 0.53 0.30 0.07 0.00 0.70 0.00 0.00 55.95 57.55 2vas s SER 539 Cb -0.45 0.22 0.77 0.00 -1.71 0.00 0.00 66.02 64.85 2vas s SER 539 CO 0.61 -0.21 1.76 0.44 1.20 0.00 0.00 173.24 177.04 2vas h ASP 540 N 7.93 0.74 0.64 5.45 3.32 -1.95 -1.43 116.42 131.12 2vas h ASP 540 Ca -0.25 0.11 -0.23 0.00 0.02 0.00 0.00 57.03 56.68 2vas h ASP 540 Cb 1.12 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.65 2vas h ASP 540 CO 0.25 0.22 -1.04 1.56 -1.72 0.00 0.00 179.24 178.52 2vas h GLN 541 N 0.71 0.22 -0.32 3.56 4.20 -1.93 -1.97 115.11 119.56 2vas h GLN 541 Ca 0.60 -0.30 -0.05 0.00 0.06 0.00 0.00 58.65 58.95 2vas h GLN 541 Cb 0.99 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.86 2vas h GLN 541 CO -0.41 1.08 0.00 1.25 -0.67 0.00 0.00 178.83 180.08 2vas h HIS 542 N 0.09 0.62 -0.42 2.96 2.76 -1.81 -2.23 115.15 117.14 2vas h HIS 542 Ca -0.08 -0.11 0.07 0.00 -2.20 0.00 0.00 60.37 58.05 2vas h HIS 542 Cb 1.73 -0.16 -0.06 0.00 1.55 0.00 0.00 27.41 30.47 2vas h HIS 542 CO 0.04 0.69 0.08 0.35 -1.30 0.00 0.00 177.93 177.79 2vas h PHE 543 N 0.38 0.13 -0.52 5.26 3.04 -1.26 -1.60 116.94 122.37 2vas h PHE 543 Ca 0.09 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 62.00 2vas h PHE 543 Cb 0.44 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.94 2vas h PHE 543 CO 0.04 0.01 0.06 1.15 -2.02 0.00 0.00 178.31 177.55 2vas h THR 544 N 0.21 1.26 -0.76 4.41 2.02 -1.30 -2.21 112.91 116.53 2vas h THR 544 Ca 0.20 -0.99 -0.02 0.00 0.77 0.00 0.00 66.41 66.38 2vas h THR 544 Cb 0.25 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 2vas h THR 544 CO -0.27 0.35 0.40 0.28 0.37 0.00 0.00 175.52 176.65 2vas h SER 545 N 0.76 0.96 -0.35 4.18 0.02 -1.31 -1.46 113.55 116.34 2vas h SER 545 Ca 0.16 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 2vas h SER 545 Cb 0.44 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 2vas h SER 545 CO 0.01 0.78 0.17 0.00 -1.14 0.00 0.00 176.83 176.66 2vas h ALA 546 N 1.37 0.45 -0.19 3.77 0.00 -0.99 0.14 119.26 123.81 2vas h ALA 546 Ca 0.27 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.11 2vas h ALA 546 Cb 0.05 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2vas h ALA 546 CO -0.04 0.02 -0.00 0.28 0.00 0.00 0.00 179.25 179.51 2vas h VAL 547 N 0.43 0.87 -0.47 0.00 2.07 -1.20 0.56 116.25 118.50 2vas h VAL 547 Ca 0.12 -0.02 -0.06 0.00 0.82 0.00 0.00 66.70 67.56 2vas h VAL 547 Cb 0.12 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2vas h VAL 547 CO -0.01 0.01 0.05 0.45 0.02 0.00 0.00 177.57 178.09 2vas h HIS 548 N 0.06 0.77 -0.07 1.57 3.86 -0.98 -0.28 115.15 120.08 2vas h HIS 548 Ca 0.09 -0.08 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 2vas h HIS 548 Cb 0.11 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 28.36 2vas h HIS 548 CO -0.17 0.69 -0.03 0.37 0.86 0.00 0.00 177.93 179.65 2vas h GLN 549 N 0.70 0.14 -0.50 2.45 5.75 -0.47 -0.39 115.11 122.79 2vas h GLN 549 Ca 0.15 -0.06 -0.10 0.00 -0.15 0.00 0.00 58.65 58.48 2vas h GLN 549 Cb 0.36 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 2vas h GLN 549 CO 0.01 0.50 -0.10 -0.22 -2.65 0.00 0.00 178.83 176.37 2vas h LYS 550 N -0.22 0.93 -0.28 1.69 1.63 -0.72 -3.28 116.57 116.31 2vas h LYS 550 Ca 0.02 -0.32 -0.12 0.00 -0.85 0.00 0.00 60.65 59.38 2vas h LYS 550 Cb 0.46 -0.07 -0.07 0.00 -0.60 0.00 0.00 32.23 31.95 2vas h LYS 550 CO 0.01 0.98 -0.10 0.72 -3.45 0.00 0.00 179.45 177.61 2vas n HIS 551 N -4.15 0.88 -0.32 1.91 8.25 -0.13 -4.80 115.22 116.86 2vas n HIS 551 Ca 0.02 -1.42 0.14 0.00 -0.26 0.00 0.00 57.72 56.20 2vas n HIS 551 Cb 0.38 -0.41 0.27 0.00 1.12 0.00 0.00 29.99 31.35 2vas n HIS 551 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 2vas n LYS 552 N -1.04 -0.07 -0.51 -0.41 2.85 -0.16 -1.55 118.16 117.27 2vas n LYS 552 Ca 0.28 1.38 0.04 0.00 -1.05 0.00 0.00 58.31 58.96 2vas n LYS 552 Cb 0.95 -2.19 0.21 0.00 -0.65 0.00 0.00 35.03 33.35 2vas n LYS 552 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2vas n ASP 553 N -5.35 2.83 -4.75 -5.58 9.92 -1.26 -4.99 116.55 107.37 2vas n ASP 553 Ca 0.22 -3.40 -0.41 0.00 -0.53 0.00 0.00 54.79 50.67 2vas n ASP 553 Cb 0.71 -0.55 -0.03 0.00 -0.64 0.00 0.00 41.12 40.60 2vas n ASP 553 CO 0.00 0.00 0.00 -2.28 0.13 0.00 0.00 177.20 175.05 2vas s HIS 554 N -3.03 3.39 0.43 1.24 2.46 -0.60 -4.95 115.29 114.23 2vas s HIS 554 Ca 0.40 1.46 0.10 0.00 0.47 0.00 0.00 55.06 57.49 2vas s HIS 554 Cb 0.35 -3.45 0.95 0.00 -0.13 0.00 0.00 32.58 30.31 2vas s HIS 554 CO 0.03 -1.23 2.06 0.35 -2.47 0.00 0.00 174.74 173.47 2vas h PHE 555 N 4.66 0.42 -0.00 3.88 3.04 -1.94 -3.00 116.94 124.00 2vas h PHE 555 Ca -0.46 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.50 2vas h PHE 555 Cb 1.21 -0.14 0.00 0.00 2.56 0.00 0.00 35.95 39.58 2vas h PHE 555 CO 0.60 0.25 -0.52 0.54 -2.02 0.00 0.00 178.31 177.17 2vas n ARG 556 N -4.48 0.06 -4.67 1.11 5.12 -1.26 -4.88 116.66 107.66 2vas n ARG 556 Ca 0.03 -0.04 -0.34 0.00 -1.93 0.00 0.00 57.85 55.58 2vas n ARG 556 Cb 0.12 -1.50 -0.12 0.00 -1.16 0.00 0.00 32.46 29.80 2vas n ARG 556 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2vas s LEU 557 N -2.96 3.06 0.25 0.55 2.96 -1.14 -0.21 118.68 121.19 2vas s LEU 557 Ca 0.12 -0.08 -0.03 0.00 -0.22 0.00 0.00 54.13 53.92 2vas s LEU 557 Cb 0.18 -1.66 -0.02 0.00 0.50 0.00 0.00 46.19 45.18 2vas s LEU 557 CO 0.70 0.34 0.28 -0.94 -1.32 0.00 0.00 176.35 175.41 2vas s SER 558 N -0.67 0.37 0.08 3.68 1.04 -0.05 -4.73 113.70 113.42 2vas s SER 558 Ca 0.10 -1.33 -0.21 0.00 0.48 0.00 0.00 55.95 54.99 2vas s SER 558 Cb -0.11 0.49 -0.07 0.00 0.10 0.00 0.00 66.02 66.43 2vas s SER 558 CO 0.01 -1.01 0.64 -0.51 0.98 0.00 0.00 173.24 173.36 2vas s ILE 559 N -3.89 4.66 0.45 -1.02 1.10 -1.26 -0.46 121.20 120.79 2vas s ILE 559 Ca 0.34 1.38 0.19 0.00 -0.51 0.00 0.00 60.65 62.04 2vas s ILE 559 Cb 0.03 -3.98 0.37 0.00 0.15 0.00 0.00 42.46 39.04 2vas s ILE 559 CO 0.14 0.52 1.93 -0.65 -2.11 0.00 0.00 174.94 174.76 2vas h PRO 560 N 4.71 0.30 0.00 3.50 0.11 -1.83 -2.43 132.00 136.36 2vas h PRO 560 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2vas h PRO 560 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2vas h PRO 560 CO 0.65 0.20 0.00 2.89 -0.21 0.00 0.00 178.00 181.53 2vas n ARG 561 N -4.45 0.40 0.11 1.05 1.85 -1.26 -1.64 116.66 112.72 2vas n ARG 561 Ca 0.14 0.06 0.12 0.00 -1.00 0.00 0.00 57.85 57.18 2vas n ARG 561 Cb 0.59 -1.50 0.26 0.00 -1.05 0.00 0.00 32.46 30.76 2vas n ARG 561 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 2vas h LYS 562 N 0.00 0.00 -6.70 2.89 1.57 -1.80 -3.47 116.57 109.06 2vas h LYS 562 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 2vas h LYS 562 Cb 0.08 0.00 0.19 0.00 0.08 0.00 0.00 32.23 32.58 2vas h LYS 562 CO 0.00 0.00 -0.35 0.45 -0.57 0.00 0.00 179.45 178.98 2vas n SER 563 N -2.38 -1.08 0.10 0.86 2.88 -0.65 -4.92 113.62 108.43 2vas n SER 563 Ca 0.04 0.57 0.12 0.00 -1.33 0.00 0.00 58.87 58.28 2vas n SER 563 Cb 0.46 -1.24 0.22 0.00 -0.75 0.00 0.00 64.21 62.90 2vas n SER 563 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2vas h LYS 564 N -0.48 0.00 -5.71 -1.46 1.57 -1.92 -3.45 116.57 105.11 2vas h LYS 564 Ca -0.45 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 57.74 2vas h LYS 564 Cb 1.34 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.56 2vas h LYS 564 CO 0.42 0.00 0.10 -0.51 -0.57 0.00 0.00 179.45 178.89 2vas s LEU 565 N -4.75 4.18 0.23 2.94 1.43 -1.26 -4.98 118.68 116.46 2vas s LEU 565 Ca 0.07 0.87 -0.08 0.00 -1.03 0.00 0.00 54.13 53.97 2vas s LEU 565 Cb 0.11 -2.90 0.21 0.00 0.03 0.00 0.00 46.19 43.65 2vas s LEU 565 CO 0.68 -0.23 1.88 0.00 0.23 0.00 0.00 176.35 178.91 2vas h ALA 566 N 7.33 1.14 -0.94 4.21 0.00 -1.99 -2.24 119.26 126.77 2vas h ALA 566 Ca -0.33 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.59 2vas h ALA 566 Cb 1.15 -0.36 -0.08 0.00 0.00 0.00 0.00 17.79 18.50 2vas h ALA 566 CO 0.77 0.59 0.58 0.97 0.00 0.00 0.00 179.25 182.16 2vas h ILE 567 N 1.23 0.95 0.00 0.00 6.09 -1.99 -2.08 117.51 121.70 2vas h ILE 567 Ca 0.32 -0.33 -0.12 0.00 -1.37 0.00 0.00 64.86 63.36 2vas h ILE 567 Cb -0.07 -0.10 -0.02 0.00 0.47 0.00 0.00 36.82 37.11 2vas h ILE 567 CO -0.06 0.18 -0.57 0.45 -3.07 0.00 0.00 178.15 175.08 2vas h HIS 568 N 0.96 0.00 0.00 2.19 3.86 -1.75 -3.18 115.15 117.22 2vas h HIS 568 Ca 0.45 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.60 2vas h HIS 568 Cb 0.39 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 2vas h HIS 568 CO -0.02 0.57 -0.31 0.00 0.86 0.00 0.00 177.93 179.02 2vas h ARG 569 N 0.00 0.00 0.00 2.45 3.08 -0.94 -2.58 114.38 116.39 2vas h ARG 569 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2vas h ARG 569 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.06 2vas h ARG 569 CO 0.07 0.31 0.00 0.09 -1.07 0.00 0.00 179.97 179.38 2vas n ASN 570 N -3.51 0.07 -4.67 7.04 3.02 -1.04 -4.52 115.26 111.65 2vas n ASN 570 Ca -0.00 0.51 -0.43 0.00 -0.03 0.00 0.00 54.58 54.63 2vas n ASN 570 Cb 0.47 -0.53 -0.02 0.00 -0.61 0.00 0.00 39.78 39.08 2vas n ASN 570 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2vas s ILE 571 N -3.03 4.72 0.74 2.41 1.01 -0.97 -5.04 121.20 121.04 2vas s ILE 571 Ca 0.09 2.02 -0.11 0.00 0.00 0.00 0.00 60.65 62.65 2vas s ILE 571 Cb 0.12 -4.31 0.04 0.00 0.01 0.00 0.00 42.46 38.32 2vas s ILE 571 CO 0.35 -0.11 1.09 -0.13 0.00 0.00 0.00 174.94 176.14 2vas s ARG 572 N 2.79 2.47 0.32 2.79 0.52 -1.26 -4.33 118.95 122.24 2vas s ARG 572 Ca 0.45 1.15 0.07 0.00 -0.52 0.00 0.00 55.73 56.88 2vas s ARG 572 Cb -0.16 -1.92 0.78 0.00 0.52 0.00 0.00 34.95 34.16 2vas s ARG 572 CO 0.10 -1.48 1.80 -0.44 0.02 0.00 0.00 175.30 175.30 2vas h ASP 573 N -0.90 0.74 -0.52 0.23 3.45 -1.96 -0.34 116.42 117.11 2vas h ASP 573 Ca -0.44 0.08 0.00 0.00 0.43 0.00 0.00 57.03 57.10 2vas h ASP 573 Cb 1.23 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.94 2vas h ASP 573 CO 0.53 0.29 0.00 -0.90 -1.57 0.00 0.00 179.24 177.58 2vas n ASP 574 N -4.70 3.12 -0.34 6.45 3.85 -1.26 -3.79 116.55 119.88 2vas n ASP 574 Ca 0.22 -2.10 0.05 0.00 -0.71 0.00 0.00 54.79 52.25 2vas n ASP 574 Cb 0.57 -0.40 0.02 0.00 -1.35 0.00 0.00 41.12 39.96 2vas n ASP 574 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2vas n GLU 575 N 0.99 1.17 0.00 0.11 1.02 -0.15 -4.19 120.64 119.59 2vas n GLU 575 Ca 0.18 -0.90 0.00 0.00 -0.02 0.00 0.00 57.16 56.42 2vas n GLU 575 Cb 0.53 -1.15 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 2vas n GLU 575 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2vas n GLY 576 N 0.72 -0.61 3.32 0.62 0.00 -1.17 -1.49 105.19 106.57 2vas n GLY 576 Ca 0.05 -0.96 -0.11 0.00 0.00 0.00 0.00 46.02 44.99 2vas n GLY 576 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2vas s PHE 577 N -2.00 -0.22 -0.15 1.61 -0.12 -0.80 -4.57 117.98 111.73 2vas s PHE 577 Ca 0.00 0.02 -0.07 0.00 -0.05 0.00 0.00 56.93 56.83 2vas s PHE 577 Cb 0.00 0.23 -0.04 0.00 -0.63 0.00 0.00 43.02 42.58 2vas s PHE 577 CO 0.00 -0.64 0.10 0.42 -0.05 0.00 0.00 175.22 175.05 2vas s ILE 578 N -3.22 5.11 -0.12 -4.49 1.01 0.40 -0.56 121.20 119.32 2vas s ILE 578 Ca -0.01 0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.74 2vas s ILE 578 Cb 0.01 -3.26 -0.00 0.00 0.01 0.00 0.00 42.46 39.22 2vas s ILE 578 CO -0.08 0.54 -0.20 -0.63 0.00 0.00 0.00 174.94 174.57 2vas s ILE 579 N -0.33 2.34 -1.20 2.92 1.01 -0.48 -0.87 121.20 124.59 2vas s ILE 579 Ca 0.10 -0.90 -0.20 0.00 0.00 0.00 0.00 60.65 59.65 2vas s ILE 579 Cb -0.12 -1.94 0.06 0.00 0.01 0.00 0.00 42.46 40.47 2vas s ILE 579 CO 0.01 0.54 1.65 -0.13 0.00 0.00 0.00 174.94 177.02 2vas s ARG 580 N 0.53 3.79 0.83 2.79 0.52 0.71 -1.51 118.95 126.61 2vas s ARG 580 Ca -0.13 -1.66 -0.12 0.00 -0.52 0.00 0.00 55.73 53.31 2vas s ARG 580 Cb -0.17 -5.46 0.09 0.00 0.52 0.00 0.00 34.95 29.93 2vas s ARG 580 CO 0.05 -2.31 1.10 -1.01 0.02 0.00 0.00 175.30 173.15 2vas s HIS 581 N 4.78 2.72 0.26 -0.53 3.76 -0.85 -4.92 115.29 120.51 2vas s HIS 581 Ca 0.52 1.09 -0.03 0.00 -0.15 0.00 0.00 55.06 56.50 2vas s HIS 581 Cb 0.02 -3.18 0.56 0.00 1.11 0.00 0.00 32.58 31.09 2vas s HIS 581 CO 0.02 -1.96 1.64 0.35 -0.85 0.00 0.00 174.74 173.95 2vas h PHE 582 N -1.22 0.15 -0.01 1.40 3.57 -1.96 -1.86 116.94 117.01 2vas h PHE 582 Ca -0.48 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.07 2vas h PHE 582 Cb 1.28 0.06 0.00 0.00 2.79 0.00 0.00 35.95 40.08 2vas h PHE 582 CO 0.42 -0.21 -0.17 0.00 -2.23 0.00 0.00 178.31 176.12 2vas n ALA 583 N -2.82 2.91 0.00 2.41 0.00 -1.26 -5.02 120.51 116.73 2vas n ALA 583 Ca 0.17 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.15 2vas n ALA 583 Cb 0.56 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.92 2vas n ALA 583 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vas n GLY 584 N 1.29 3.33 3.74 0.00 0.00 -0.70 -4.82 105.19 108.03 2vas n GLY 584 Ca 0.14 -1.68 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 2vas n GLY 584 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vas s ALA 585 N -2.00 3.55 -0.08 4.61 0.00 -1.26 -2.01 121.76 124.58 2vas s ALA 585 Ca 0.00 1.16 0.04 0.00 0.00 0.00 0.00 51.96 53.16 2vas s ALA 585 Cb 0.00 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.62 2vas s ALA 585 CO 0.00 -0.59 -0.21 0.08 0.00 0.00 0.00 175.76 175.04 2vas s VAL 586 N 0.10 1.80 -0.37 0.00 1.01 -0.57 -4.93 120.40 117.44 2vas s VAL 586 Ca 0.57 -0.88 -0.15 0.00 0.00 0.00 0.00 61.98 61.52 2vas s VAL 586 Cb -0.38 -1.56 0.00 0.00 0.00 0.00 0.00 36.38 34.45 2vas s VAL 586 CO 0.39 0.50 0.32 0.00 0.00 0.00 0.00 175.10 176.32 2vas s TYR 588 N 1.86 3.51 -0.20 0.00 1.51 0.28 -4.20 117.35 120.10 2vas s TYR 588 Ca 0.08 0.82 -0.18 0.00 -1.01 0.00 0.00 57.07 56.78 2vas s TYR 588 Cb -0.18 -2.49 -0.03 0.00 -0.11 0.00 0.00 41.96 39.15 2vas s TYR 588 CO 0.11 0.20 0.49 -1.21 -1.11 0.00 0.00 175.55 174.03 2vas s GLU 589 N 0.54 4.18 0.00 -0.62 2.02 -0.39 -1.91 118.70 122.51 2vas s GLU 589 Ca 0.24 0.36 0.28 0.00 0.02 0.00 0.00 54.97 55.86 2vas s GLU 589 Cb -0.15 -3.56 1.00 0.00 0.10 0.00 0.00 34.13 31.52 2vas s GLU 589 CO 0.09 -0.14 1.71 0.25 0.02 0.00 0.00 175.26 177.19 2vas n THR 590 N 4.54 0.00 -1.69 3.63 -2.24 -0.56 -4.49 114.28 113.48 2vas n THR 590 Ca -0.06 -0.16 -0.44 0.00 -2.27 0.00 0.00 64.05 61.12 2vas n THR 590 Cb 0.50 0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 69.02 2vas n THR 590 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2vas n THR 591 N -0.40 0.74 -0.94 4.28 5.66 -1.26 -1.51 114.28 120.84 2vas n THR 591 Ca 0.16 -0.18 0.00 0.00 -3.05 0.00 0.00 64.05 60.97 2vas n THR 591 Cb 0.33 -1.59 0.00 0.00 -1.55 0.00 0.00 70.33 67.52 2vas n THR 591 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2vas n GLN 592 N 2.40 -0.02 -0.24 1.09 6.02 -1.26 -4.89 117.38 120.49 2vas n GLN 592 Ca 0.12 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 57.09 2vas n GLN 592 Cb 0.32 -2.77 0.08 0.00 1.02 0.00 0.00 30.24 28.89 2vas n GLN 592 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 2vas h PHE 593 N 0.00 0.76 -0.07 1.08 -1.00 -1.61 0.11 116.94 116.21 2vas h PHE 593 Ca 0.00 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.77 2vas h PHE 593 Cb 0.01 -0.24 -0.00 0.00 3.61 0.00 0.00 35.95 39.32 2vas h PHE 593 CO 0.00 0.41 -0.09 0.28 -1.61 0.00 0.00 178.31 177.31 2vas h VAL 594 N 0.78 1.39 -0.20 -0.55 2.07 -1.91 -1.20 116.25 116.63 2vas h VAL 594 Ca 0.28 -1.30 0.04 0.00 0.82 0.00 0.00 66.70 66.54 2vas h VAL 594 Cb 0.08 2.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 2vas h VAL 594 CO -0.13 0.36 -0.05 -0.08 0.02 0.00 0.00 177.57 177.69 2vas h GLU 595 N -0.27 -0.00 0.00 1.57 4.81 -1.93 -2.94 114.58 115.81 2vas h GLU 595 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2vas h GLU 595 Cb 0.62 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.00 2vas h GLU 595 CO 0.02 -0.00 0.00 0.87 -0.73 0.00 0.00 179.01 179.17 2vas h LYS 596 N -0.00 0.00 -0.00 1.92 1.57 -0.64 -2.80 116.57 116.61 2vas h LYS 596 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2vas h LYS 596 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2vas h LYS 596 CO -0.21 0.00 -0.23 -1.71 -0.57 0.00 0.00 179.45 176.73 2vas n ASN 597 N -2.45 0.42 -4.15 0.86 5.15 -0.46 -4.74 115.26 109.88 2vas n ASN 597 Ca 0.02 -0.23 -0.34 0.00 -0.60 0.00 0.00 54.58 53.44 2vas n ASN 597 Cb 0.27 -0.05 -0.15 0.00 -0.53 0.00 0.00 39.78 39.32 2vas n ASN 597 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2vas s ASN 598 N -2.78 4.11 -0.25 1.20 2.47 -1.06 -0.84 114.94 117.79 2vas s ASN 598 Ca 0.19 -0.96 0.12 0.00 0.42 0.00 0.00 52.86 52.63 2vas s ASN 598 Cb 0.19 -1.60 0.54 0.00 -1.45 0.00 0.00 41.25 38.93 2vas s ASN 598 CO 0.57 -0.12 1.49 -0.90 -3.72 0.00 0.00 177.10 174.42 2vas n ASP 599 N 4.60 3.32 -4.71 -4.21 3.85 -0.98 -4.96 116.55 113.47 2vas n ASP 599 Ca -0.17 -3.40 -0.41 0.00 -0.71 0.00 0.00 54.79 50.11 2vas n ASP 599 Cb 0.46 -0.62 -0.04 0.00 -1.35 0.00 0.00 41.12 39.58 2vas n ASP 599 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2vas s ALA 600 N -3.05 3.31 0.43 2.12 0.00 -1.26 -4.91 121.76 118.39 2vas s ALA 600 Ca 0.45 0.27 -0.23 0.00 0.00 0.00 0.00 51.96 52.44 2vas s ALA 600 Cb 0.38 -3.15 -0.08 0.00 0.00 0.00 0.00 23.12 20.28 2vas s ALA 600 CO 0.05 -0.25 1.12 -1.17 0.00 0.00 0.00 175.76 175.51 2vas s LEU 601 N 1.12 4.07 0.55 0.00 2.96 -1.26 -4.92 118.68 121.20 2vas s LEU 601 Ca 0.43 2.20 -0.22 0.00 -0.22 0.00 0.00 54.13 56.32 2vas s LEU 601 Cb -0.19 -4.21 -0.05 0.00 0.50 0.00 0.00 46.19 42.24 2vas s LEU 601 CO 0.21 -0.74 1.36 -2.28 -1.32 0.00 0.00 176.35 173.58 2vas s HIS 602 N -1.59 2.26 0.31 5.38 5.65 -1.26 -4.65 115.29 121.39 2vas s HIS 602 Ca 0.61 1.37 0.04 0.00 0.25 0.00 0.00 55.06 57.34 2vas s HIS 602 Cb -0.26 -3.81 0.66 0.00 -1.18 0.00 0.00 32.58 27.99 2vas s HIS 602 CO 0.32 -2.93 1.85 1.98 -0.65 0.00 0.00 174.74 175.30 2vas h MET 603 N 1.42 0.85 -0.43 2.88 4.05 -1.96 0.44 114.93 122.17 2vas h MET 603 Ca -0.51 -0.05 -0.08 0.00 -0.28 0.00 0.00 59.70 58.78 2vas h MET 603 Cb 1.30 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 31.89 2vas h MET 603 CO 0.57 0.56 -0.07 0.66 0.23 0.00 0.00 176.91 178.86 2vas h SER 604 N 0.88 0.73 0.79 1.39 4.64 -1.99 0.14 113.55 120.12 2vas h SER 604 Ca 0.48 -0.20 -0.20 0.00 -0.47 0.00 0.00 61.79 61.40 2vas h SER 604 Cb 0.58 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.46 2vas h SER 604 CO -0.25 0.84 -0.94 -0.07 -0.87 0.00 0.00 176.83 175.54 2vas h LEU 605 N 0.69 0.12 -0.31 5.97 3.38 -1.48 -2.97 115.31 120.71 2vas h LEU 605 Ca 0.12 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 2vas h LEU 605 Cb 0.52 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2vas h LEU 605 CO 0.03 0.99 -0.21 -0.08 0.09 0.00 0.00 178.44 179.26 2vas h GLU 606 N 0.04 0.69 -0.05 1.13 4.81 0.17 -2.92 114.58 118.44 2vas h GLU 606 Ca -0.03 -0.33 -0.00 0.00 -0.13 0.00 0.00 59.36 58.86 2vas h GLU 606 Cb 1.63 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 31.00 2vas h GLU 606 CO 0.13 0.93 0.02 0.77 -0.73 0.00 0.00 179.01 180.13 2vas h SER 607 N 0.44 0.07 -0.68 1.04 0.02 -0.84 -2.62 113.55 110.99 2vas h SER 607 Ca 0.06 -0.20 0.10 0.00 -0.84 0.00 0.00 61.79 60.91 2vas h SER 607 Cb 0.76 -0.02 -0.12 0.00 0.14 0.00 0.00 62.40 63.16 2vas h SER 607 CO 0.06 0.25 -0.43 0.25 -1.14 0.00 0.00 176.83 175.82 2vas h LEU 608 N -0.11 -1.51 -0.38 5.07 5.85 -1.54 -2.22 115.31 120.47 2vas h LEU 608 Ca 0.02 0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.95 2vas h LEU 608 Cb 0.21 0.71 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 2vas h LEU 608 CO -0.00 -0.32 -0.24 -0.29 -0.34 0.00 0.00 178.44 177.25 2vas h ILE 609 N -0.17 0.46 -0.22 4.05 6.09 -1.54 -3.20 117.51 122.98 2vas h ILE 609 Ca 0.21 -1.46 -0.14 0.00 -1.37 0.00 0.00 64.86 62.10 2vas h ILE 609 Cb 0.55 2.07 -0.01 0.00 0.47 0.00 0.00 36.82 39.90 2vas h ILE 609 CO -0.76 0.24 -0.45 0.00 -3.07 0.00 0.00 178.15 174.11 2vas n GLU 611 N -4.00 1.97 -2.44 0.00 1.02 -0.96 -4.75 120.64 111.48 2vas n GLU 611 Ca -0.02 -1.93 -0.35 0.00 -0.02 0.00 0.00 57.16 54.83 2vas n GLU 611 Cb 0.54 -1.76 -0.02 0.00 -0.02 0.00 0.00 31.44 30.18 2vas n GLU 611 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2vas s SER 612 N -0.28 6.25 0.19 1.62 0.15 -1.22 -4.95 113.70 115.45 2vas s SER 612 Ca 0.38 2.06 0.26 0.00 0.70 0.00 0.00 55.95 59.35 2vas s SER 612 Cb 0.30 -2.58 0.88 0.00 -1.71 0.00 0.00 66.02 62.92 2vas s SER 612 CO 0.00 -0.85 1.78 0.54 1.20 0.00 0.00 173.24 175.91 2vas n ARG 613 N -0.82 0.22 -3.25 5.44 5.12 -0.88 -4.70 116.66 117.78 2vas n ARG 613 Ca 0.09 0.22 -0.38 0.00 -1.93 0.00 0.00 57.85 55.85 2vas n ARG 613 Cb 0.51 -1.77 -0.06 0.00 -1.16 0.00 0.00 32.46 29.98 2vas n ARG 613 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2vas s ASP 614 N -4.28 6.79 0.10 0.55 1.01 -1.26 -4.98 116.67 114.59 2vas s ASP 614 Ca 0.10 0.94 -0.18 0.00 0.71 0.00 0.00 52.55 54.12 2vas s ASP 614 Cb 0.13 -2.32 -0.06 0.00 1.01 0.00 0.00 42.92 41.67 2vas s ASP 614 CO 0.55 -0.00 1.57 0.50 0.21 0.00 0.00 175.17 178.00 2vas h LYS 615 N 6.53 0.48 -0.39 8.23 3.64 -2.00 -2.77 116.57 130.30 2vas h LYS 615 Ca -0.42 -0.13 0.08 0.00 -1.27 0.00 0.00 60.65 58.91 2vas h LYS 615 Cb 1.19 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.88 2vas h LYS 615 CO 0.74 0.60 -0.09 0.35 -2.27 0.00 0.00 179.45 178.78 2vas h PHE 616 N 0.30 -0.20 -0.84 1.91 3.57 -1.97 -1.17 116.94 118.54 2vas h PHE 616 Ca 0.09 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 2vas h PHE 616 Cb 0.35 0.15 -0.04 0.00 2.79 0.00 0.00 35.95 39.20 2vas h PHE 616 CO 0.02 -0.16 0.42 0.82 -2.23 0.00 0.00 178.31 177.19 2vas h ILE 617 N 0.00 1.25 -0.18 1.41 5.03 -1.94 -2.35 117.51 120.74 2vas h ILE 617 Ca 0.19 -0.68 -0.06 0.00 -0.12 0.00 0.00 64.86 64.19 2vas h ILE 617 Cb 0.28 0.16 -0.01 0.00 -3.03 0.00 0.00 36.82 34.21 2vas h ILE 617 CO -0.39 0.30 -0.15 0.03 -0.68 0.00 0.00 178.15 177.25 2vas h ARG 618 N 1.18 0.30 0.00 2.37 3.08 -1.14 -2.98 114.38 117.19 2vas h ARG 618 Ca 0.29 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2vas h ARG 618 Cb 0.08 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2vas h ARG 618 CO -0.04 0.45 0.00 0.93 -1.07 0.00 0.00 179.97 180.24 2vas h GLU 619 N 0.28 0.00 0.00 0.04 5.08 -0.72 -2.64 114.58 116.62 2vas h GLU 619 Ca 0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2vas h GLU 619 Cb 0.44 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 2vas h GLU 619 CO 0.03 0.00 -0.02 -0.07 -1.00 0.00 0.00 179.01 177.95 2vas h LEU 620 N 0.00 0.00 -3.00 1.33 3.38 -1.28 -3.09 115.31 112.65 2vas h LEU 620 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vas h LEU 620 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2vas h LEU 620 CO 0.00 0.02 0.00 0.49 0.09 0.00 0.00 178.44 179.04 2vas n PHE 621 N -3.12 0.17 -2.80 1.13 3.01 -1.05 -4.92 117.46 109.88 2vas n PHE 621 Ca 0.00 -0.62 -0.43 0.00 1.01 0.00 0.00 57.45 57.41 2vas n PHE 621 Cb 0.30 -0.08 0.01 0.00 -0.01 0.00 0.00 39.48 39.69 2vas n PHE 621 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2vas n GLU 622 N -0.46 4.30 0.00 -1.08 2.13 -1.02 -5.09 120.64 119.42 2vas n GLU 622 Ca 0.07 -4.28 0.00 0.00 0.66 0.00 0.00 57.16 53.61 2vas n GLU 622 Cb 0.41 -2.62 0.00 0.00 0.27 0.00 0.00 31.44 29.50 2vas n GLU 622 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2vas n SER 639 N 1.93 0.00 -3.67 4.31 3.41 -1.26 -5.11 113.62 113.24 2vas n SER 639 Ca 0.31 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.83 2vas n SER 639 Cb 0.34 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.19 2vas n SER 639 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2vas s PHE 640 N -0.64 -0.78 -0.25 7.33 5.36 -1.26 -4.84 117.98 122.90 2vas s PHE 640 Ca 0.00 1.52 0.02 0.00 -0.96 0.00 0.00 56.93 57.51 2vas s PHE 640 Cb 0.00 0.33 0.06 0.00 -0.34 0.00 0.00 43.02 43.07 2vas s PHE 640 CO 0.00 -0.46 -0.06 0.42 -1.46 0.00 0.00 175.22 173.66 2vas s ILE 641 N 2.27 1.80 -0.15 3.12 1.01 -1.26 -4.96 121.20 123.04 2vas s ILE 641 Ca -0.04 -1.47 -0.29 0.00 0.00 0.00 0.00 60.65 58.85 2vas s ILE 641 Cb -0.11 -2.04 -0.05 0.00 0.01 0.00 0.00 42.46 40.27 2vas s ILE 641 CO -0.13 -0.13 1.86 -0.55 0.00 0.00 0.00 174.94 175.99 2vas s SER 642 N 1.25 6.17 0.22 3.58 0.15 -1.26 -2.32 113.70 121.49 2vas s SER 642 Ca -0.05 1.99 -0.06 0.00 0.70 0.00 0.00 55.95 58.52 2vas s SER 642 Cb -0.19 -2.53 0.18 0.00 -1.71 0.00 0.00 66.02 61.77 2vas s SER 642 CO -0.06 -1.37 1.72 0.58 1.20 0.00 0.00 173.24 175.31 2vas h VAL 643 N 6.25 1.26 -0.06 4.45 2.07 -1.30 -2.08 116.25 126.83 2vas h VAL 643 Ca -0.40 -1.00 -0.04 0.00 0.82 0.00 0.00 66.70 66.08 2vas h VAL 643 Cb 1.20 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 2vas h VAL 643 CO 0.97 0.37 -0.13 1.23 0.02 0.00 0.00 177.57 180.04 2vas h GLY 644 N 1.04 0.21 2.00 2.17 0.00 -1.91 -2.44 103.07 104.15 2vas h GLY 644 Ca 0.20 -0.26 -0.07 0.00 0.00 0.00 0.00 47.33 47.20 2vas h GLY 644 CO 0.01 0.23 -0.33 3.43 0.00 0.00 0.00 176.54 179.87 2vas h ASN 645 N -0.31 0.00 -0.34 0.19 2.35 -1.91 -0.46 115.58 115.10 2vas h ASN 645 Ca 0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 2vas h ASN 645 Cb 0.72 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.08 2vas h ASN 645 CO 0.03 0.33 0.12 0.50 -1.65 0.00 0.00 177.43 176.77 2vas h LYS 646 N 0.00 0.52 -0.36 0.81 3.64 -1.36 -2.25 116.57 117.57 2vas h LYS 646 Ca -0.00 -0.10 -0.11 0.00 -1.27 0.00 0.00 60.65 59.16 2vas h LYS 646 Cb 0.74 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2vas h LYS 646 CO 0.04 0.53 -0.24 0.35 -2.27 0.00 0.00 179.45 177.86 2vas h PHE 647 N 0.40 0.82 -0.70 1.91 3.04 -1.20 -2.18 116.94 119.02 2vas h PHE 647 Ca 0.11 -0.19 0.03 0.00 3.98 0.00 0.00 57.97 61.91 2vas h PHE 647 Cb 0.21 -0.19 -0.05 0.00 2.56 0.00 0.00 35.95 38.48 2vas h PHE 647 CO 0.00 0.89 0.44 -0.22 -2.02 0.00 0.00 178.31 177.40 2vas h LYS 648 N 0.63 0.82 -0.33 1.11 3.64 -1.00 0.82 116.57 122.26 2vas h LYS 648 Ca 0.09 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2vas h LYS 648 Cb 0.74 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 2vas h LYS 648 CO 0.06 0.54 0.14 1.15 -2.27 0.00 0.00 179.45 179.07 2vas h THR 649 N 0.85 1.17 -0.68 1.00 2.02 -1.25 -1.74 112.91 114.29 2vas h THR 649 Ca 0.29 -0.52 -0.03 0.00 0.77 0.00 0.00 66.41 66.92 2vas h THR 649 Cb 0.04 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.33 2vas h THR 649 CO -0.12 0.18 0.31 1.56 0.37 0.00 0.00 175.52 177.82 2vas h GLN 650 N 0.38 0.99 -0.44 6.66 4.20 -0.95 -2.50 115.11 123.46 2vas h GLN 650 Ca 0.11 -0.16 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 2vas h GLN 650 Cb 0.16 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 2vas h GLN 650 CO -0.01 0.80 -0.03 1.25 -0.67 0.00 0.00 178.83 180.17 2vas h LEU 651 N 0.95 0.78 -0.89 1.46 6.46 -0.76 -1.67 115.31 121.63 2vas h LEU 651 Ca 0.23 -0.32 -0.02 0.00 -0.12 0.00 0.00 57.88 57.65 2vas h LEU 651 Cb 0.15 -0.21 -0.04 0.00 -0.73 0.00 0.00 40.66 39.83 2vas h LEU 651 CO -0.03 0.91 0.50 0.78 -0.62 0.00 0.00 178.44 179.99 2vas h ASN 652 N 0.62 1.11 -0.71 1.25 2.35 -1.22 -0.36 115.58 118.63 2vas h ASN 652 Ca 0.12 -0.10 -0.06 0.00 -0.55 0.00 0.00 56.30 55.71 2vas h ASN 652 Cb 0.53 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.59 2vas h ASN 652 CO 0.03 0.89 0.21 -0.07 -1.65 0.00 0.00 177.43 176.83 2vas h LEU 653 N 1.25 1.05 -0.47 1.61 3.38 -1.37 -0.65 115.31 120.11 2vas h LEU 653 Ca 0.32 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2vas h LEU 653 Cb 0.02 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2vas h LEU 653 CO -0.05 0.99 0.22 0.25 0.09 0.00 0.00 178.44 179.94 2vas h LEU 654 N 1.06 0.61 -0.84 1.67 5.85 -0.87 -1.71 115.31 121.09 2vas h LEU 654 Ca 0.23 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.73 2vas h LEU 654 Cb 0.33 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2vas h LEU 654 CO -0.00 0.57 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.58 2vas h LEU 655 N 0.61 0.82 -0.13 2.25 3.38 -1.00 0.13 115.31 121.37 2vas h LEU 655 Ca 0.16 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 57.96 2vas h LEU 655 Cb 0.12 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.59 2vas h LEU 655 CO -0.02 0.90 -0.37 0.44 0.09 0.00 0.00 178.44 179.48 2vas h ASP 656 N 0.78 -1.16 0.23 -0.43 3.45 -0.89 0.13 116.42 118.54 2vas h ASP 656 Ca 0.15 0.16 0.00 0.00 0.43 0.00 0.00 57.03 57.77 2vas h ASP 656 Cb 0.50 0.48 -0.04 0.00 -0.56 0.00 0.00 39.33 39.71 2vas h ASP 656 CO 0.02 -0.40 -0.49 0.11 -1.57 0.00 0.00 179.24 176.92 2vas h LYS 657 N -0.45 -0.76 -1.00 3.56 1.57 -0.95 -2.90 116.57 115.64 2vas h LYS 657 Ca 0.09 0.05 0.15 0.00 -1.87 0.00 0.00 60.65 59.07 2vas h LYS 657 Cb 0.59 0.17 -0.10 0.00 0.08 0.00 0.00 32.23 32.98 2vas h LYS 657 CO -0.38 -0.51 0.61 -0.07 -0.57 0.00 0.00 179.45 178.54 2vas h LEU 658 N -0.79 0.85 -2.08 2.94 3.38 -0.57 0.11 115.31 119.14 2vas h LEU 658 Ca -0.02 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2vas h LEU 658 Cb 0.75 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2vas h LEU 658 CO -0.20 0.38 0.00 0.03 0.09 0.00 0.00 178.44 178.74 2vas h ARG 659 N 0.87 0.00 -0.14 1.13 3.08 -0.64 -2.14 114.38 116.55 2vas h ARG 659 Ca 0.53 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.58 2vas h ARG 659 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.74 2vas h ARG 659 CO -0.32 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 177.45 2vas n SER 660 N -3.08 1.74 -4.74 7.04 3.41 0.37 -4.95 113.62 113.43 2vas n SER 660 Ca -0.01 -1.68 -0.24 0.00 -0.26 0.00 0.00 58.87 56.68 2vas n SER 660 Cb 0.21 -0.08 -0.07 0.00 -0.26 0.00 0.00 64.21 64.00 2vas n SER 660 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2vas s THR 661 N -1.83 2.39 -0.04 6.66 -4.23 -0.81 -4.55 115.64 113.23 2vas s THR 661 Ca 0.34 -1.70 -0.16 0.00 -1.18 0.00 0.00 61.69 58.99 2vas s THR 661 Cb 0.19 -2.99 -0.05 0.00 1.34 0.00 0.00 72.50 70.99 2vas s THR 661 CO 0.28 -0.03 0.43 -0.83 -0.54 0.00 0.00 174.62 173.94 2vas s GLY 662 N -3.90 2.45 -0.08 3.99 0.00 -0.74 -4.91 107.32 104.14 2vas s GLY 662 Ca 0.41 -0.21 0.03 0.00 0.00 0.00 0.00 44.72 44.94 2vas s GLY 662 CO 0.23 0.36 -0.17 0.00 0.00 0.00 0.00 173.10 173.51 2vas s ALA 663 N -0.49 2.50 0.26 3.20 0.00 -1.26 -0.94 121.76 125.03 2vas s ALA 663 Ca 0.24 -0.97 0.11 0.00 0.00 0.00 0.00 51.96 51.34 2vas s ALA 663 Cb -0.16 -0.96 -0.05 0.00 0.00 0.00 0.00 23.12 21.95 2vas s ALA 663 CO 0.12 0.41 -0.12 -1.12 0.00 0.00 0.00 175.76 175.05 2vas s SER 664 N -0.19 3.98 -0.06 0.00 0.01 -0.38 -5.00 113.70 112.05 2vas s SER 664 Ca -0.01 -0.83 0.01 0.00 1.31 0.00 0.00 55.95 56.42 2vas s SER 664 Cb -0.13 -0.53 0.02 0.00 0.21 0.00 0.00 66.02 65.59 2vas s SER 664 CO 0.03 0.04 -0.05 -0.36 0.41 0.00 0.00 173.24 173.31 2vas s PHE 665 N -2.28 0.92 -0.19 2.43 0.08 -1.26 -0.74 117.98 116.94 2vas s PHE 665 Ca 0.29 -0.31 -0.02 0.00 0.12 0.00 0.00 56.93 57.02 2vas s PHE 665 Cb -0.06 -0.82 -0.00 0.00 -0.57 0.00 0.00 43.02 41.57 2vas s PHE 665 CO 0.16 -0.27 -0.10 0.42 -0.10 0.00 0.00 175.22 175.33 2vas s ILE 666 N 1.19 2.97 -0.38 0.64 1.01 -0.56 -1.55 121.20 124.52 2vas s ILE 666 Ca -0.06 -0.65 -0.10 0.00 0.00 0.00 0.00 60.65 59.84 2vas s ILE 666 Cb -0.14 -2.30 0.03 0.00 0.01 0.00 0.00 42.46 40.06 2vas s ILE 666 CO -0.01 0.48 0.20 -0.13 0.00 0.00 0.00 174.94 175.47 2vas s ARG 667 N 1.12 2.77 0.04 2.79 1.81 0.17 -1.95 118.95 125.70 2vas s ARG 667 Ca 0.01 -1.13 -0.21 0.00 -1.72 0.00 0.00 55.73 52.67 2vas s ARG 667 Cb -0.14 -3.71 -0.06 0.00 -0.45 0.00 0.00 34.95 30.59 2vas s ARG 667 CO -0.03 -0.72 0.62 0.00 -0.68 0.00 0.00 175.30 174.49 2vas s ILE 669 N -0.50 1.68 -0.37 0.00 -1.09 0.15 -4.41 121.20 116.66 2vas s ILE 669 Ca 0.32 -0.77 -0.21 0.00 -2.23 0.00 0.00 60.65 57.75 2vas s ILE 669 Cb -0.19 -1.50 0.01 0.00 -1.58 0.00 0.00 42.46 39.20 2vas s ILE 669 CO 0.19 0.48 0.67 -0.75 -1.23 0.00 0.00 174.94 174.30 2vas s LYS 670 N 0.73 3.62 0.49 2.79 2.20 -1.26 -0.57 119.74 127.75 2vas s LYS 670 Ca -0.11 0.03 0.28 0.00 -0.36 0.00 0.00 55.97 55.81 2vas s LYS 670 Cb -0.16 -3.84 0.98 0.00 -1.51 0.00 0.00 37.83 33.31 2vas s LYS 670 CO 0.02 -0.81 1.84 -1.00 -0.36 0.00 0.00 175.35 175.04 2vas h PRO 671 N 8.55 0.00 -2.64 4.03 0.13 -1.87 -3.43 132.00 136.77 2vas h PRO 671 Ca -0.26 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.99 2vas h PRO 671 Cb 1.10 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.18 2vas h PRO 671 CO 0.86 0.08 0.39 0.54 -0.23 0.00 0.00 178.00 179.64 2vas s ASN 672 N -5.96 -0.17 -0.13 1.44 2.20 -1.26 -0.83 114.94 110.23 2vas s ASN 672 Ca 0.02 -0.58 0.15 0.00 -0.94 0.00 0.00 52.86 51.52 2vas s ASN 672 Cb 0.08 0.61 0.68 0.00 -2.00 0.00 0.00 41.25 40.62 2vas s ASN 672 CO 0.60 -1.14 1.57 0.18 -2.94 0.00 0.00 177.10 175.37 2vas n LEU 673 N -0.50 4.60 0.00 3.54 4.77 -1.26 -4.38 117.00 123.77 2vas n LEU 673 Ca -0.05 -2.32 0.00 0.00 -0.03 0.00 0.00 56.01 53.60 2vas n LEU 673 Cb 0.60 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2vas n LEU 673 CO 0.16 0.70 0.22 0.29 -1.33 0.00 0.00 177.39 177.43 2vas n LYS 674 N 0.90 -0.80 -2.83 3.23 5.02 -1.26 -5.01 118.16 117.41 2vas n LYS 674 Ca 0.24 -0.44 -0.22 0.00 -2.02 0.00 0.00 58.31 55.87 2vas n LYS 674 Cb 0.89 -0.93 0.02 0.00 -0.02 0.00 0.00 35.03 35.00 2vas n LYS 674 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2vas n MET 675 N -0.01 -3.95 -4.24 1.97 2.81 -1.26 -5.00 117.12 107.43 2vas n MET 675 Ca 0.00 0.95 -0.28 0.00 -1.81 0.00 0.00 57.70 56.56 2vas n MET 675 Cb 0.04 -5.75 -0.09 0.00 -0.71 0.00 0.00 33.22 26.71 2vas n MET 675 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2vas s THR 676 N -3.14 3.43 0.48 2.03 -4.23 -1.26 -4.95 115.64 108.00 2vas s THR 676 Ca 0.21 -1.46 -0.03 0.00 -1.18 0.00 0.00 61.69 59.23 2vas s THR 676 Cb -0.09 -2.68 -0.01 0.00 1.34 0.00 0.00 72.50 71.05 2vas s THR 676 CO 0.26 -0.05 0.74 -0.94 -0.54 0.00 0.00 174.62 174.10 2vas s SER 677 N -2.69 5.96 -1.55 3.99 1.04 -1.26 -4.41 113.70 114.78 2vas s SER 677 Ca 0.25 0.60 -0.12 0.00 0.48 0.00 0.00 55.95 57.15 2vas s SER 677 Cb -0.10 -1.85 0.09 0.00 0.10 0.00 0.00 66.02 64.27 2vas s SER 677 CO 0.16 -0.70 0.85 1.41 0.98 0.00 0.00 173.24 175.93 2vas n HIS 678 N -2.22 -2.05 -3.46 5.02 8.25 -1.26 -4.95 115.22 114.55 2vas n HIS 678 Ca 0.01 0.86 -0.28 0.00 -0.26 0.00 0.00 57.72 58.04 2vas n HIS 678 Cb 0.57 -3.72 -0.12 0.00 1.12 0.00 0.00 29.99 27.84 2vas n HIS 678 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2vas s HIS 679 N -3.40 0.60 -0.49 4.41 5.04 -1.26 -5.10 115.29 115.09 2vas s HIS 679 Ca 0.55 -1.48 -0.22 0.00 -1.54 0.00 0.00 55.06 52.38 2vas s HIS 679 Cb -0.29 -0.87 0.04 0.00 0.04 0.00 0.00 32.58 31.50 2vas s HIS 679 CO 0.86 -0.84 0.74 0.12 -2.34 0.00 0.00 174.74 173.28 2vas s PHE 680 N 1.22 2.98 -0.70 3.88 5.36 -1.26 -4.17 117.98 125.29 2vas s PHE 680 Ca 0.17 -0.13 -0.20 0.00 -0.96 0.00 0.00 56.93 55.80 2vas s PHE 680 Cb -0.22 -3.63 0.10 0.00 -0.34 0.00 0.00 43.02 38.93 2vas s PHE 680 CO -0.04 -1.05 0.91 -1.21 -1.46 0.00 0.00 175.22 172.38 2vas s GLU 681 N 3.13 3.21 0.15 10.12 0.41 -0.01 -4.98 118.70 130.72 2vas s GLU 681 Ca 0.24 -1.25 -0.20 0.00 -0.41 0.00 0.00 54.97 53.35 2vas s GLU 681 Cb -0.15 -4.40 0.03 0.00 -1.78 0.00 0.00 34.13 27.83 2vas s GLU 681 CO 0.18 -1.71 1.66 0.78 -0.49 0.00 0.00 175.26 175.69 2vas h GLY 682 N 10.60 0.05 1.17 -1.39 0.00 -1.73 -1.16 103.07 110.61 2vas h GLY 682 Ca -0.18 0.18 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2vas h GLY 682 CO 1.13 -0.15 0.29 0.00 0.00 0.00 0.00 176.54 177.80 2vas h ALA 683 N 1.06 1.16 -0.33 3.60 0.00 -1.44 0.16 119.26 123.49 2vas h ALA 683 Ca 0.14 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2vas h ALA 683 Cb 0.32 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2vas h ALA 683 CO -0.32 0.61 0.05 1.96 0.00 0.00 0.00 179.25 181.54 2vas h GLN 684 N 1.04 0.54 -0.29 0.00 4.20 -1.75 -1.37 115.11 117.48 2vas h GLN 684 Ca 0.24 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 2vas h GLN 684 Cb 0.19 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2vas h GLN 684 CO -0.02 0.63 0.05 0.82 -0.67 0.00 0.00 178.83 179.64 2vas h ILE 685 N 0.37 1.23 -0.46 2.54 2.04 -1.00 -2.30 117.51 119.92 2vas h ILE 685 Ca 0.10 -0.80 0.07 0.00 1.00 0.00 0.00 64.86 65.23 2vas h ILE 685 Cb 0.36 1.19 -0.06 0.00 -0.74 0.00 0.00 36.82 37.57 2vas h ILE 685 CO 0.01 0.26 0.10 0.25 0.00 0.00 0.00 178.15 178.77 2vas h LEU 686 N 0.31 0.03 -1.12 1.44 5.85 -0.66 0.26 115.31 121.43 2vas h LEU 686 Ca 0.09 0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.96 2vas h LEU 686 Cb 0.34 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 2vas h LEU 686 CO 0.01 0.05 0.60 -1.28 -0.34 0.00 0.00 178.44 177.48 2vas h SER 687 N 0.25 0.91 -0.40 1.25 0.87 -1.14 -2.30 113.55 112.98 2vas h SER 687 Ca 0.23 0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 60.66 2vas h SER 687 Cb 0.28 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 2vas h SER 687 CO -0.28 0.56 -0.30 1.56 -0.53 0.00 0.00 176.83 177.84 2vas h GLN 688 N 1.02 0.91 -0.25 2.24 4.20 -0.72 -1.62 115.11 120.90 2vas h GLN 688 Ca 0.41 -0.45 0.07 0.00 0.06 0.00 0.00 58.65 58.75 2vas h GLN 688 Cb 0.27 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 2vas h GLN 688 CO -0.17 1.10 0.21 -0.07 -0.67 0.00 0.00 178.83 179.23 2vas h LEU 689 N 0.73 0.00 0.05 1.46 3.38 -0.51 -0.79 115.31 119.64 2vas h LEU 689 Ca 0.08 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 2vas h LEU 689 Cb 0.89 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.64 2vas h LEU 689 CO 0.08 0.00 -0.42 1.56 0.09 0.00 0.00 178.44 179.75 2vas h GLN 690 N 0.00 0.11 0.00 1.13 4.20 -1.16 -1.83 115.11 117.57 2vas h GLN 690 Ca 0.12 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.64 2vas h GLN 690 Cb 0.54 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.39 2vas h GLN 690 CO -0.00 1.09 0.00 0.00 -0.67 0.00 0.00 178.83 179.25 2vas n SER 692 N -2.86 1.68 0.00 0.00 3.41 -0.34 -4.49 113.62 111.02 2vas n SER 692 Ca -0.00 -1.33 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 2vas n SER 692 Cb 0.20 0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 2vas n SER 692 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vas n GLY 693 N 1.34 0.75 0.23 5.00 0.00 -1.01 -4.97 105.19 106.54 2vas n GLY 693 Ca 0.12 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.30 2vas n GLY 693 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2vas h MET 694 N 2.76 0.00 0.05 1.61 2.86 -1.54 -1.99 114.93 118.68 2vas h MET 694 Ca 0.00 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 2vas h MET 694 Cb 0.00 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.67 2vas h MET 694 CO 0.00 0.00 -0.29 0.28 1.06 0.00 0.00 176.91 177.96 2vas h VAL 695 N 0.00 1.68 -0.93 -2.22 2.07 -1.82 -2.71 116.25 112.32 2vas h VAL 695 Ca 0.00 -2.35 0.14 0.00 0.82 0.00 0.00 66.70 65.30 2vas h VAL 695 Cb 0.51 3.25 -0.08 0.00 -1.52 0.00 0.00 31.29 33.46 2vas h VAL 695 CO 0.00 0.63 0.59 -1.28 0.02 0.00 0.00 177.57 177.54 2vas h SER 696 N -0.74 0.75 -0.46 0.57 0.87 -1.90 -2.56 113.55 110.08 2vas h SER 696 Ca -0.05 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 2vas h SER 696 Cb 1.20 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 63.04 2vas h SER 696 CO 0.05 0.38 0.23 0.58 -0.53 0.00 0.00 176.83 177.55 2vas h VAL 697 N 0.79 1.18 -0.42 2.23 2.07 -1.40 -2.81 116.25 117.89 2vas h VAL 697 Ca 0.47 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 67.43 2vas h VAL 697 Cb 0.65 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2vas h VAL 697 CO -0.23 0.19 -0.03 -0.07 0.02 0.00 0.00 177.57 177.45 2vas h LEU 698 N 0.60 0.66 -1.26 2.57 3.38 -1.12 -1.72 115.31 118.42 2vas h LEU 698 Ca 0.16 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2vas h LEU 698 Cb 0.09 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2vas h LEU 698 CO -0.02 0.75 0.28 0.44 0.09 0.00 0.00 178.44 179.98 2vas h ASP 699 N 0.65 0.71 0.62 -0.43 5.19 -1.36 -0.92 116.42 120.87 2vas h ASP 699 Ca 0.13 -0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 2vas h ASP 699 Cb 0.45 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.78 2vas h ASP 699 CO 0.02 0.59 0.00 0.18 -3.12 0.00 0.00 179.24 176.92 2vas n LEU 700 N -4.37 0.00 -0.69 1.55 4.77 -0.67 -2.56 117.00 115.03 2vas n LEU 700 Ca 0.05 0.49 0.07 0.00 -0.03 0.00 0.00 56.01 56.60 2vas n LEU 700 Cb 0.12 -0.49 0.11 0.00 -2.33 0.00 0.00 43.42 40.83 2vas n LEU 700 CO 0.37 -0.19 0.55 0.23 -1.33 0.00 0.00 177.39 177.03 2vas n MET 701 N -1.49 1.67 -2.59 3.23 2.81 -0.39 -4.51 117.12 115.84 2vas n MET 701 Ca 0.05 -1.68 -0.41 0.00 -1.81 0.00 0.00 57.70 53.84 2vas n MET 701 Cb 0.21 -1.31 0.01 0.00 -0.71 0.00 0.00 33.22 31.42 2vas n MET 701 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2vas n GLN 702 N 0.85 5.12 0.00 0.03 1.13 -0.97 -4.49 117.38 119.04 2vas n GLN 702 Ca 0.11 -4.43 0.00 0.00 -1.94 0.00 0.00 57.00 50.74 2vas n GLN 702 Cb 0.41 -2.52 0.00 0.00 0.11 0.00 0.00 30.24 28.25 2vas n GLN 702 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2vas n GLY 703 N 0.52 -1.14 0.42 1.08 0.00 -1.26 -4.90 105.19 99.91 2vas n GLY 703 Ca 0.46 -1.65 0.23 0.00 0.00 0.00 0.00 46.02 45.06 2vas n GLY 703 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2vas h GLY 704 N -0.02 0.68 -7.22 -0.02 0.00 -1.95 -3.17 103.07 91.35 2vas h GLY 704 Ca 0.00 -0.13 -0.64 0.00 0.00 0.00 0.00 47.33 46.55 2vas h GLY 704 CO 0.00 -0.03 -0.51 -1.36 0.00 0.00 0.00 176.54 174.64 2vas s PHE 705 N -5.30 3.50 -1.82 5.60 0.40 -1.26 -4.30 117.98 114.80 2vas s PHE 705 Ca -0.07 -3.22 0.21 0.00 -0.60 0.00 0.00 56.93 53.25 2vas s PHE 705 Cb 0.23 -2.84 1.21 0.00 0.51 0.00 0.00 43.02 42.13 2vas s PHE 705 CO 0.78 -0.64 1.66 -0.35 0.70 0.00 0.00 175.22 177.38 2vas n PRO 706 N 2.41 0.55 -4.61 0.24 -0.04 -1.20 -4.67 135.00 127.68 2vas n PRO 706 Ca 0.15 0.03 -0.25 0.00 -0.04 0.00 0.00 63.50 63.40 2vas n PRO 706 Cb 0.35 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.17 2vas n PRO 706 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2vas s SER 707 N -2.18 2.31 -0.23 3.54 0.01 -1.21 -4.77 113.70 111.18 2vas s SER 707 Ca 0.28 -0.50 -0.21 0.00 1.31 0.00 0.00 55.95 56.84 2vas s SER 707 Cb 0.15 -0.19 0.06 0.00 0.21 0.00 0.00 66.02 66.24 2vas s SER 707 CO 0.27 0.14 0.61 0.00 0.41 0.00 0.00 173.24 174.68 2vas s ARG 708 N -1.11 0.71 -0.12 12.44 1.70 -1.26 -1.15 118.95 130.17 2vas s ARG 708 Ca 0.06 0.86 -0.15 0.00 -0.47 0.00 0.00 55.73 56.03 2vas s ARG 708 Cb -0.08 0.34 0.04 0.00 -0.57 0.00 0.00 34.95 34.68 2vas s ARG 708 CO 0.01 -0.09 0.41 0.00 -1.08 0.00 0.00 175.30 174.56 2vas s ALA 709 N 0.36 -1.02 0.66 7.88 0.00 -0.86 -4.34 121.76 124.44 2vas s ALA 709 Ca -0.00 1.01 -0.13 0.00 0.00 0.00 0.00 51.96 52.83 2vas s ALA 709 Cb -0.04 -0.49 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 2vas s ALA 709 CO 0.00 -0.22 1.07 -1.54 0.00 0.00 0.00 175.76 175.07 2vas s SER 710 N -0.18 5.43 0.37 0.00 1.04 -1.26 -0.64 113.70 118.46 2vas s SER 710 Ca -0.03 1.76 0.10 0.00 0.48 0.00 0.00 55.95 58.26 2vas s SER 710 Cb -0.03 -2.52 0.86 0.00 0.10 0.00 0.00 66.02 64.43 2vas s SER 710 CO 0.02 -1.41 1.90 -0.26 0.98 0.00 0.00 173.24 174.47 2vas h PHE 711 N -0.20 0.72 -0.57 5.02 0.04 -1.88 -1.35 116.94 118.72 2vas h PHE 711 Ca -0.45 0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.26 2vas h PHE 711 Cb 1.22 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 39.12 2vas h PHE 711 CO 0.59 0.29 0.06 0.45 -0.60 0.00 0.00 178.31 179.10 2vas h HIS 712 N 0.63 1.04 0.08 -0.55 3.86 -1.87 -1.18 115.15 117.16 2vas h HIS 712 Ca 0.40 -0.16 -0.27 0.00 -1.16 0.00 0.00 60.37 59.19 2vas h HIS 712 Cb 0.67 -0.28 0.01 0.00 1.06 0.00 0.00 27.41 28.87 2vas h HIS 712 CO -0.00 0.92 -1.14 1.49 0.86 0.00 0.00 177.93 180.06 2vas h GLU 713 N 0.86 0.46 -0.78 2.45 4.81 -1.74 -1.34 114.58 119.30 2vas h GLU 713 Ca 0.17 -0.60 -0.00 0.00 -0.13 0.00 0.00 59.36 58.79 2vas h GLU 713 Cb 0.47 0.20 -0.04 0.00 0.63 0.00 0.00 28.75 30.00 2vas h GLU 713 CO 0.02 1.24 0.47 -0.07 -0.73 0.00 0.00 179.01 179.94 2vas h LEU 714 N 0.21 0.93 0.11 1.64 3.38 -1.28 0.23 115.31 120.53 2vas h LEU 714 Ca -0.14 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 57.79 2vas h LEU 714 Cb 1.81 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 42.29 2vas h LEU 714 CO 0.20 0.72 -0.26 0.22 0.09 0.00 0.00 178.44 179.42 2vas h TYR 715 N 1.07 -0.69 -0.86 1.13 3.20 -1.19 0.29 116.97 119.92 2vas h TYR 715 Ca 0.28 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.16 2vas h TYR 715 Cb -0.04 0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.47 2vas h TYR 715 CO -0.01 -0.36 0.53 -0.91 -1.64 0.00 0.00 178.16 175.78 2vas h ASN 716 N -0.46 1.02 -0.35 -2.11 2.35 -0.98 -2.16 115.58 112.89 2vas h ASN 716 Ca 0.03 -0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.67 2vas h ASN 716 Cb 0.49 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 2vas h ASN 716 CO -0.15 0.78 -0.00 0.24 -1.65 0.00 0.00 177.43 176.64 2vas h MET 717 N 1.18 0.62 -0.05 0.81 2.86 -0.28 -3.39 114.93 116.68 2vas h MET 717 Ca 0.31 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2vas h MET 717 Cb -0.07 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.54 2vas h MET 717 CO -0.06 0.73 0.00 0.66 1.06 0.00 0.00 176.91 179.30 2vas n TYR 718 N -4.51 0.06 0.20 -0.22 4.01 0.07 -4.67 117.16 112.10 2vas n TYR 718 Ca -0.02 -0.12 0.05 0.00 -0.16 0.00 0.00 57.90 57.65 2vas n TYR 718 Cb 0.27 -0.01 0.44 0.00 -0.31 0.00 0.00 39.34 39.73 2vas n TYR 718 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 2vas h LYS 719 N 1.09 0.00 0.00 -0.72 2.10 -1.58 -2.77 116.57 114.69 2vas h LYS 719 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2vas h LYS 719 Cb 0.33 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.66 2vas h LYS 719 CO 0.00 0.31 -0.01 1.57 -2.00 0.00 0.00 179.45 179.32 2vas h LYS 720 N 0.00 0.00 0.00 0.07 2.10 -1.85 -2.31 116.57 114.58 2vas h LYS 720 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2vas h LYS 720 Cb 0.60 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 2vas h LYS 720 CO 0.04 0.01 -0.69 0.66 -2.00 0.00 0.00 179.45 177.47 2vas n TYR 721 N -3.26 0.13 -3.90 0.07 4.02 -1.05 -4.94 117.16 108.23 2vas n TYR 721 Ca -0.03 0.04 -0.21 0.00 -0.01 0.00 0.00 57.90 57.69 2vas n TYR 721 Cb 0.11 -0.31 -0.03 0.00 -0.02 0.00 0.00 39.34 39.08 2vas n TYR 721 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 2vas s MET 722 N -3.06 3.02 0.50 -0.72 -1.94 -0.87 -4.91 119.30 111.31 2vas s MET 722 Ca 0.08 -1.04 -0.23 0.00 -1.71 0.00 0.00 55.69 52.79 2vas s MET 722 Cb 0.16 -2.66 -0.06 0.00 2.01 0.00 0.00 34.83 34.29 2vas s MET 722 CO 0.74 0.27 1.30 -2.14 -0.01 0.00 0.00 175.02 175.19 2vas s PRO 723 N -3.97 3.42 0.56 2.03 0.02 -1.26 -4.79 135.00 131.02 2vas s PRO 723 Ca 0.37 2.09 0.30 0.00 0.02 0.00 0.00 61.00 63.78 2vas s PRO 723 Cb -0.08 -2.36 1.46 0.00 0.02 0.00 0.00 34.50 33.54 2vas s PRO 723 CO 0.27 -0.92 1.88 -0.44 -0.33 0.00 0.00 177.00 177.47 2vas h ASP 724 N 1.78 0.00 -0.26 2.53 3.45 -1.97 0.79 116.42 122.73 2vas h ASP 724 Ca -0.50 0.00 0.05 0.00 0.43 0.00 0.00 57.03 57.01 2vas h ASP 724 Cb 1.28 0.00 -0.08 0.00 -0.56 0.00 0.00 39.33 39.97 2vas h ASP 724 CO 0.59 0.00 -0.44 0.50 -1.57 0.00 0.00 179.24 178.31 2vas h LYS 725 N 0.00 -0.41 -0.23 3.56 1.63 -2.01 -2.46 116.57 116.66 2vas h LYS 725 Ca 0.31 0.03 -0.13 0.00 -0.85 0.00 0.00 60.65 60.01 2vas h LYS 725 Cb 1.44 0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 33.15 2vas h LYS 725 CO -0.00 -0.27 -0.40 1.25 -3.45 0.00 0.00 179.45 176.58 2vas h LEU 726 N -0.42 0.56 -1.40 5.20 5.85 -1.21 -3.00 115.31 120.89 2vas h LEU 726 Ca 0.10 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.57 2vas h LEU 726 Cb 0.61 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.49 2vas h LEU 726 CO -0.49 0.90 0.00 0.00 -0.34 0.00 0.00 178.44 178.51 2vas h ALA 727 N 1.13 1.00 0.00 1.25 0.00 -1.21 -2.86 119.26 118.57 2vas h ALA 727 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2vas h ALA 727 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2vas h ALA 727 CO 0.08 0.00 -0.52 0.00 0.00 0.00 0.00 179.25 178.81 2vas h ARG 728 N 0.00 0.00 -7.11 0.00 3.08 -1.30 -3.44 114.38 105.61 2vas h ARG 728 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 2vas h ARG 728 Cb 0.19 0.00 0.15 0.00 0.08 0.00 0.00 29.97 30.39 2vas h ARG 728 CO 0.00 0.00 0.50 -0.51 -1.07 0.00 0.00 179.97 178.89 2vas s LEU 729 N -5.28 3.57 -0.35 3.04 1.43 -1.08 -5.01 118.68 114.99 2vas s LEU 729 Ca 0.04 2.56 -0.08 0.00 -1.03 0.00 0.00 54.13 55.62 2vas s LEU 729 Cb 0.09 -4.61 0.01 0.00 0.03 0.00 0.00 46.19 41.71 2vas s LEU 729 CO 0.72 -1.96 0.43 -0.67 0.23 0.00 0.00 176.35 175.10 2vas n ASP 730 N -1.93 -6.09 -0.35 2.29 2.03 -1.26 -4.86 116.55 106.38 2vas n ASP 730 Ca 0.15 0.27 0.22 0.00 0.52 0.00 0.00 54.79 55.95 2vas n ASP 730 Cb 0.49 -4.03 0.46 0.00 -0.72 0.00 0.00 41.12 37.32 2vas n ASP 730 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2vas h PRO 731 N 1.12 0.41 0.28 -0.67 0.11 -1.95 0.31 132.00 131.62 2vas h PRO 731 Ca 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 2vas h PRO 731 Cb 0.77 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.78 2vas h PRO 731 CO 0.15 0.27 -0.13 -0.09 -0.21 0.00 0.00 178.00 177.99 2vas h ARG 732 N 0.43 -0.36 -0.51 1.05 2.43 -1.95 -2.40 114.38 113.06 2vas h ARG 732 Ca 0.67 0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.77 2vas h ARG 732 Cb 1.53 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 31.14 2vas h ARG 732 CO -0.46 -0.07 -0.07 1.25 -1.51 0.00 0.00 179.97 179.11 2vas h LEU 733 N -0.66 0.91 -0.75 3.80 5.85 -1.71 -2.05 115.31 120.70 2vas h LEU 733 Ca -0.04 -0.27 0.16 0.00 0.84 0.00 0.00 57.88 58.57 2vas h LEU 733 Cb 0.46 -0.24 -0.14 0.00 0.37 0.00 0.00 40.66 41.11 2vas h LEU 733 CO 0.06 1.00 -0.08 0.15 -0.34 0.00 0.00 178.44 179.24 2vas h PHE 734 N 0.83 -0.20 -0.26 1.25 3.57 -0.48 0.13 116.94 121.78 2vas h PHE 734 Ca 0.14 0.06 -0.18 0.00 3.53 0.00 0.00 57.97 61.53 2vas h PHE 734 Cb 0.59 0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.54 2vas h PHE 734 CO 0.04 -0.28 -0.53 0.00 -2.23 0.00 0.00 178.31 175.31 2vas h LYS 736 N 0.58 0.73 0.03 0.00 1.57 -1.09 -1.65 116.57 116.74 2vas h LYS 736 Ca 0.01 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2vas h LYS 736 Cb 1.14 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.35 2vas h LYS 736 CO 0.12 0.70 -0.01 0.00 -0.57 0.00 0.00 179.45 179.68 2vas h ALA 737 N 1.38 -0.04 -0.55 3.86 0.00 -0.58 -1.12 119.26 122.21 2vas h ALA 737 Ca 0.15 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.03 2vas h ALA 737 Cb 0.33 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 2vas h ALA 737 CO 0.01 -0.43 0.25 1.25 0.00 0.00 0.00 179.25 180.33 2vas h LEU 738 N -0.21 0.33 0.00 0.00 5.85 -0.84 0.37 115.31 120.81 2vas h LEU 738 Ca -0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2vas h LEU 738 Cb 0.20 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2vas h LEU 738 CO 0.01 0.22 -0.21 0.49 -0.34 0.00 0.00 178.44 178.60 2vas n PHE 739 N -4.92 0.57 0.00 1.25 3.01 -0.64 -1.25 117.46 115.48 2vas n PHE 739 Ca 0.06 0.17 -0.17 0.00 1.01 0.00 0.00 57.45 58.51 2vas n PHE 739 Cb 0.19 -0.72 -0.12 0.00 -0.01 0.00 0.00 39.48 38.82 2vas n PHE 739 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 2vas h LYS 740 N 0.00 0.31 -0.03 -1.08 1.63 -0.70 -2.94 116.57 113.77 2vas h LYS 740 Ca 0.00 -0.37 -0.16 0.00 -0.85 0.00 0.00 60.65 59.27 2vas h LYS 740 Cb 0.67 0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 32.40 2vas h LYS 740 CO 0.00 1.08 -0.69 0.00 -3.45 0.00 0.00 179.45 176.39 2vas h ALA 741 N 0.24 0.79 0.00 5.00 0.00 -0.79 -2.96 119.26 121.54 2vas h ALA 741 Ca -0.07 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.22 2vas h ALA 741 Cb 1.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2vas h ALA 741 CO 0.10 0.82 -0.56 -0.07 0.00 0.00 0.00 179.25 179.54 2vas h LEU 742 N 0.09 0.00 -1.14 0.00 3.38 -1.35 -3.45 115.31 112.84 2vas h LEU 742 Ca -0.01 -0.02 -0.28 0.00 0.09 0.00 0.00 57.88 57.65 2vas h LEU 742 Cb 1.23 0.00 0.11 0.00 0.09 0.00 0.00 40.66 42.09 2vas h LEU 742 CO 0.10 0.01 -0.52 0.61 0.09 0.00 0.00 178.44 178.73 2vas n GLY 743 N 1.18 -0.16 3.69 0.83 0.00 -1.12 -4.95 105.19 104.67 2vas n GLY 743 Ca 0.02 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2vas n GLY 743 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vas s LEU 744 N -5.54 4.29 0.21 0.99 1.43 -1.17 -4.96 118.68 113.92 2vas s LEU 744 Ca 0.31 1.62 -0.30 0.00 -1.03 0.00 0.00 54.13 54.73 2vas s LEU 744 Cb -0.14 -3.56 -0.16 0.00 0.03 0.00 0.00 46.19 42.36 2vas s LEU 744 CO 0.54 -0.41 0.83 -3.20 0.23 0.00 0.00 176.35 174.34 2vas n ASN 745 N 4.67 0.11 0.14 2.29 5.15 -1.26 -4.81 115.26 121.54 2vas n ASN 745 Ca 0.08 1.15 0.12 0.00 -0.60 0.00 0.00 54.58 55.33 2vas n ASN 745 Cb 0.49 -1.10 0.50 0.00 -0.53 0.00 0.00 39.78 39.14 2vas n ASN 745 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 2vas n GLU 746 N 1.09 0.21 -0.04 1.20 0.28 -1.26 -1.96 120.64 120.15 2vas n GLU 746 Ca 0.15 0.43 -0.18 0.00 -0.16 0.00 0.00 57.16 57.40 2vas n GLU 746 Cb 0.26 -1.89 -0.13 0.00 1.43 0.00 0.00 31.44 31.10 2vas n GLU 746 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 2vas h ILE 747 N 0.00 1.43 -0.06 3.84 2.04 -2.01 -3.40 117.51 119.35 2vas h ILE 747 Ca 0.00 -2.36 -0.17 0.00 1.00 0.00 0.00 64.86 63.33 2vas h ILE 747 Cb 0.37 3.00 -0.01 0.00 -0.74 0.00 0.00 36.82 39.44 2vas h ILE 747 CO 0.00 0.58 -0.70 0.44 0.00 0.00 0.00 178.15 178.48 2vas h ASP 748 N -0.76 0.32 -3.46 1.72 5.19 -1.90 -3.43 116.42 114.10 2vas h ASP 748 Ca -0.15 -0.21 -0.59 0.00 -0.62 0.00 0.00 57.03 55.47 2vas h ASP 748 Cb 1.32 -0.09 -0.38 0.00 0.18 0.00 0.00 39.33 40.35 2vas h ASP 748 CO -0.00 0.92 -0.79 -0.31 -3.12 0.00 0.00 179.24 175.93 2vas s TYR 749 N -3.60 2.06 -0.32 4.55 1.51 -0.83 -1.62 117.35 119.10 2vas s TYR 749 Ca -0.04 -1.42 -0.11 0.00 -1.01 0.00 0.00 57.07 54.49 2vas s TYR 749 Cb 0.11 -1.46 -0.01 0.00 -0.11 0.00 0.00 41.96 40.49 2vas s TYR 749 CO 0.82 -0.70 0.19 0.15 -1.11 0.00 0.00 175.55 174.89 2vas s LYS 750 N 1.51 3.40 -0.21 -0.62 3.01 0.17 -4.42 119.74 122.59 2vas s LYS 750 Ca -0.02 -0.69 -0.29 0.00 -1.01 0.00 0.00 55.97 53.96 2vas s LYS 750 Cb -0.17 -3.66 -0.00 0.00 -1.01 0.00 0.00 37.83 32.99 2vas s LYS 750 CO -0.07 -0.42 1.16 0.12 0.51 0.00 0.00 175.35 176.64 2vas s PHE 751 N 1.66 3.08 0.00 3.18 5.36 -1.26 -0.98 117.98 129.01 2vas s PHE 751 Ca 0.05 1.22 0.00 0.00 -0.96 0.00 0.00 56.93 57.24 2vas s PHE 751 Cb -0.17 -3.42 0.00 0.00 -0.34 0.00 0.00 43.02 39.09 2vas s PHE 751 CO 0.08 -1.11 0.00 0.41 -1.46 0.00 0.00 175.22 173.14 2vas n GLY 752 N 3.52 2.39 0.15 13.12 0.00 0.94 -5.00 105.19 120.31 2vas n GLY 752 Ca 0.13 -2.10 -0.12 0.00 0.00 0.00 0.00 46.02 43.93 2vas n GLY 752 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2vas h LEU 753 N 0.00 0.49 -0.23 0.99 3.38 -1.82 -3.39 115.31 114.73 2vas h LEU 753 Ca 0.00 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2vas h LEU 753 Cb 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2vas h LEU 753 CO 0.00 1.17 0.00 0.35 0.09 0.00 0.00 178.44 180.05 2vas n THR 754 N -3.74 0.00 -3.96 0.22 -2.24 -1.26 -5.10 114.28 98.20 2vas n THR 754 Ca -0.06 -0.15 -0.09 0.00 -2.27 0.00 0.00 64.05 61.48 2vas n THR 754 Cb 0.82 1.53 -0.09 0.00 -2.10 0.00 0.00 70.33 70.48 2vas n THR 754 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2vas s LYS 755 N -0.07 0.60 -0.20 -0.78 1.02 -1.26 -3.23 119.74 115.82 2vas s LYS 755 Ca 0.00 -0.87 -0.11 0.00 0.02 0.00 0.00 55.97 55.01 2vas s LYS 755 Cb 0.00 0.23 -0.05 0.00 -0.52 0.00 0.00 37.83 37.49 2vas s LYS 755 CO 0.00 -0.15 0.19 0.08 -0.92 0.00 0.00 175.35 174.55 2vas s VAL 756 N -2.95 5.36 -0.15 3.17 1.01 0.19 -0.04 120.40 126.99 2vas s VAL 756 Ca -0.02 0.31 -0.04 0.00 0.00 0.00 0.00 61.98 62.23 2vas s VAL 756 Cb 0.01 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 2vas s VAL 756 CO -0.06 0.40 -0.03 -0.36 0.00 0.00 0.00 175.10 175.05 2vas s PHE 757 N 0.56 3.04 -0.09 5.22 0.08 -0.15 -2.03 117.98 124.60 2vas s PHE 757 Ca 0.11 -0.25 0.01 0.00 0.12 0.00 0.00 56.93 56.92 2vas s PHE 757 Cb -0.12 -1.95 -0.02 0.00 -0.57 0.00 0.00 43.02 40.36 2vas s PHE 757 CO 0.01 0.01 -0.11 -0.06 -0.10 0.00 0.00 175.22 174.97 2vas s PHE 758 N 0.27 2.83 1.09 0.36 0.08 -0.30 -0.66 117.98 121.66 2vas s PHE 758 Ca -0.03 -0.27 -0.12 0.00 0.12 0.00 0.00 56.93 56.63 2vas s PHE 758 Cb -0.14 -1.75 0.24 0.00 -0.57 0.00 0.00 43.02 40.80 2vas s PHE 758 CO 0.03 0.08 1.06 1.03 -0.10 0.00 0.00 175.22 177.31 2vas s ARG 759 N -0.30 -0.35 0.06 0.44 1.81 -0.64 -3.22 118.95 116.75 2vas s ARG 759 Ca 0.03 0.89 -0.30 0.00 -1.72 0.00 0.00 55.73 54.63 2vas s ARG 759 Cb -0.13 -1.62 -0.09 0.00 -0.45 0.00 0.00 34.95 32.66 2vas s ARG 759 CO 0.03 -3.36 1.92 -2.14 -0.68 0.00 0.00 175.30 171.07 2vas s PRO 760 N -4.59 4.14 0.00 3.54 0.02 -1.26 -1.57 135.00 135.28 2vas s PRO 760 Ca 0.67 2.60 0.00 0.00 0.02 0.00 0.00 61.00 64.29 2vas s PRO 760 Cb -0.23 -4.00 0.00 0.00 0.02 0.00 0.00 34.50 30.28 2vas s PRO 760 CO 0.62 -0.92 0.00 0.41 -0.33 0.00 0.00 177.00 176.78 2vas n GLY 761 N 4.45 1.70 0.11 0.52 0.00 -1.26 -4.92 105.19 105.78 2vas n GLY 761 Ca 0.19 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.16 2vas n GLY 761 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vas h LYS 762 N 2.89 0.05 -0.39 1.61 1.79 -1.62 -2.30 116.57 118.59 2vas h LYS 762 Ca 0.00 -0.05 -0.09 0.00 -2.18 0.00 0.00 60.65 58.33 2vas h LYS 762 Cb 0.00 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 2vas h LYS 762 CO 0.00 0.83 -0.14 0.35 -1.08 0.00 0.00 179.45 179.41 2vas h PHE 763 N 0.03 0.78 -0.61 -1.35 3.57 -1.88 0.31 116.94 117.79 2vas h PHE 763 Ca -0.02 -0.15 -0.06 0.00 3.53 0.00 0.00 57.97 61.28 2vas h PHE 763 Cb 1.42 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.94 2vas h PHE 763 CO 0.01 0.81 0.13 0.00 -2.23 0.00 0.00 178.31 177.03 2vas h ALA 764 N 1.21 0.80 -0.40 2.41 0.00 -1.76 -0.81 119.26 120.72 2vas h ALA 764 Ca 0.11 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2vas h ALA 764 Cb 0.60 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2vas h ALA 764 CO 0.04 0.53 0.24 0.93 0.00 0.00 0.00 179.25 180.99 2vas h GLU 765 N 0.89 0.54 -0.22 0.00 5.08 -1.14 -2.38 114.58 117.35 2vas h GLU 765 Ca 0.19 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2vas h GLU 765 Cb 0.38 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2vas h GLU 765 CO 0.01 0.40 0.13 0.35 -1.00 0.00 0.00 179.01 178.90 2vas h PHE 766 N 0.52 0.25 -0.94 4.33 3.57 -0.77 -1.85 116.94 122.06 2vas h PHE 766 Ca 0.14 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.75 2vas h PHE 766 Cb -0.00 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.58 2vas h PHE 766 CO -0.04 0.16 0.60 0.22 -2.23 0.00 0.00 178.31 177.02 2vas h ASP 767 N 0.28 0.87 0.03 0.41 3.58 -1.07 -1.05 116.42 119.47 2vas h ASP 767 Ca 0.08 0.03 -0.24 0.00 0.42 0.00 0.00 57.03 57.32 2vas h ASP 767 Cb -0.02 -0.15 0.01 0.00 1.72 0.00 0.00 39.33 40.89 2vas h ASP 767 CO -0.03 0.50 -0.90 -0.61 -2.88 0.00 0.00 179.24 175.32 2vas h GLN 768 N 0.96 0.65 -0.27 0.28 5.75 -1.15 -2.84 115.11 118.50 2vas h GLN 768 Ca 0.44 -0.62 0.00 0.00 -0.15 0.00 0.00 58.65 58.32 2vas h GLN 768 Cb 0.40 0.16 -0.01 0.00 1.07 0.00 0.00 27.48 29.10 2vas h GLN 768 CO -0.20 1.23 0.18 0.82 -2.65 0.00 0.00 178.83 178.20 2vas h ILE 769 N 0.41 1.07 -0.03 2.39 2.04 -1.00 -2.37 117.51 120.03 2vas h ILE 769 Ca -0.08 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.64 2vas h ILE 769 Cb 1.54 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.30 2vas h ILE 769 CO 0.17 0.07 0.04 0.24 0.00 0.00 0.00 178.15 178.68 2vas h MET 770 N 0.36 0.00 -0.36 2.37 2.86 -1.17 -1.99 114.93 117.00 2vas h MET 770 Ca 0.10 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 2vas h MET 770 Cb -0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.63 2vas h MET 770 CO -0.02 0.00 0.00 1.63 1.06 0.00 0.00 176.91 179.58 2vas n LYS 771 N -3.75 2.35 -0.66 1.72 5.02 -0.96 -4.90 118.16 116.99 2vas n LYS 771 Ca -0.02 -2.16 -0.09 0.00 -2.02 0.00 0.00 58.31 54.01 2vas n LYS 771 Cb 0.13 -1.45 0.06 0.00 -0.02 0.00 0.00 35.03 33.75 2vas n LYS 771 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2vas n SER 772 N 1.29 0.06 -4.52 4.39 3.41 -0.75 -4.89 113.62 112.61 2vas n SER 772 Ca 0.17 -1.17 -0.63 0.00 -0.26 0.00 0.00 58.87 56.98 2vas n SER 772 Cb 0.55 -0.32 -0.11 0.00 -0.26 0.00 0.00 64.21 64.07 2vas n SER 772 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2vas n ASP 773 N -3.26 1.13 -0.11 4.04 4.64 -1.26 -4.83 116.55 116.89 2vas n ASP 773 Ca 0.05 0.93 0.12 0.00 -1.38 0.00 0.00 54.79 54.52 2vas n ASP 773 Cb 0.19 -0.92 0.48 0.00 -1.04 0.00 0.00 41.12 39.83 2vas n ASP 773 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 2vas h PRO 774 N 7.16 0.44 -0.12 -0.67 0.11 -1.93 -2.75 132.00 134.25 2vas h PRO 774 Ca -0.29 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.70 2vas h PRO 774 Cb 1.39 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2vas h PRO 774 CO 1.03 0.29 -0.28 -0.44 -0.21 0.00 0.00 178.00 178.38 2vas h ASP 775 N 0.45 0.46 -0.80 -2.05 5.19 -1.97 -1.22 116.42 116.49 2vas h ASP 775 Ca 0.30 -0.58 0.12 0.00 -0.62 0.00 0.00 57.03 56.26 2vas h ASP 775 Cb 0.57 -0.13 -0.08 0.00 0.18 0.00 0.00 39.33 39.87 2vas h ASP 775 CO -0.09 0.95 0.41 -0.74 -3.12 0.00 0.00 179.24 176.65 2vas h HIS 776 N -0.01 0.73 -0.49 4.55 2.76 -1.90 -0.19 115.15 120.60 2vas h HIS 776 Ca -0.00 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.19 2vas h HIS 776 Cb 0.89 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.62 2vas h HIS 776 CO 0.11 0.22 0.27 -0.07 -1.30 0.00 0.00 177.93 177.15 2vas h LEU 777 N 0.64 0.61 -0.86 0.26 4.07 -1.39 -1.82 115.31 116.82 2vas h LEU 777 Ca 0.42 -0.09 0.05 0.00 0.08 0.00 0.00 57.88 58.34 2vas h LEU 777 Cb 0.52 -0.15 -0.06 0.00 1.08 0.00 0.00 40.66 42.04 2vas h LEU 777 CO -0.32 0.52 0.54 0.00 -1.08 0.00 0.00 178.44 178.11 2vas h ALA 778 N 1.11 1.16 -0.07 1.53 0.00 -0.30 -2.28 119.26 120.42 2vas h ALA 778 Ca 0.17 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2vas h ALA 778 Cb 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2vas h ALA 778 CO -0.03 0.33 -0.30 0.93 0.00 0.00 0.00 179.25 180.19 2vas h GLU 779 N 1.02 0.12 -0.17 0.00 4.39 -0.76 -2.47 114.58 116.71 2vas h GLU 779 Ca 0.36 -0.04 -0.13 0.00 0.34 0.00 0.00 59.36 59.89 2vas h GLU 779 Cb 0.10 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2vas h GLU 779 CO -0.15 0.42 -0.44 -0.07 -1.16 0.00 0.00 179.01 177.60 2vas h LEU 780 N 0.11 0.45 -0.10 1.33 3.38 -0.77 -2.74 115.31 116.97 2vas h LEU 780 Ca 0.02 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2vas h LEU 780 Cb 0.59 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2vas h LEU 780 CO 0.04 0.83 0.03 0.58 0.09 0.00 0.00 178.44 180.01 2vas h VAL 781 N 0.34 1.19 -0.88 1.22 2.07 -1.27 -3.20 116.25 115.71 2vas h VAL 781 Ca 0.02 -0.59 0.15 0.00 0.82 0.00 0.00 66.70 67.11 2vas h VAL 781 Cb 0.92 1.40 -0.10 0.00 -1.52 0.00 0.00 31.29 31.99 2vas h VAL 781 CO 0.08 0.17 0.47 0.50 0.02 0.00 0.00 177.57 178.81 2vas h LYS 782 N -0.04 0.64 0.00 1.57 3.11 -1.33 0.14 116.57 120.66 2vas h LYS 782 Ca 0.03 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.83 2vas h LYS 782 Cb 0.24 -0.14 0.00 0.00 -1.00 0.00 0.00 32.23 31.33 2vas h LYS 782 CO 0.00 0.42 0.00 0.54 -2.81 0.00 0.00 179.45 177.60 2vas n ARG 783 N -4.85 0.20 -0.29 1.90 1.74 -1.05 -2.40 116.66 111.91 2vas n ARG 783 Ca 0.18 0.44 0.08 0.00 -0.77 0.00 0.00 57.85 57.78 2vas n ARG 783 Cb 0.45 -1.89 0.23 0.00 -1.02 0.00 0.00 32.46 30.24 2vas n ARG 783 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2vas n VAL 784 N -2.27 1.13 -0.09 1.55 0.31 0.03 -4.75 118.33 114.25 2vas n VAL 784 Ca 0.02 -1.06 -0.08 0.00 -0.01 0.00 0.00 64.34 63.21 2vas n VAL 784 Cb 0.22 0.43 -0.01 0.00 -0.91 0.00 0.00 33.84 33.58 2vas n VAL 784 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 2vas h ASN 785 N 2.98 0.27 0.17 4.52 -1.24 -1.35 -2.52 115.58 118.41 2vas h ASN 785 Ca 0.00 0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.01 2vas h ASN 785 Cb 0.91 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.92 2vas h ASN 785 CO 0.03 0.20 -0.08 -0.74 -1.29 0.00 0.00 177.43 175.55 2vas h HIS 786 N 0.36 -0.22 -0.85 0.67 2.76 -1.85 -1.83 115.15 114.19 2vas h HIS 786 Ca 0.12 -0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.39 2vas h HIS 786 Cb 0.01 0.07 -0.06 0.00 1.55 0.00 0.00 27.41 28.98 2vas h HIS 786 CO -0.08 -0.06 0.55 2.35 -1.30 0.00 0.00 177.93 179.39 2vas h TRP 787 N -0.33 0.86 0.12 5.26 7.01 -1.91 -2.11 115.95 124.85 2vas h TRP 787 Ca -0.02 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 60.99 2vas h TRP 787 Cb 0.26 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 27.04 2vas h TRP 787 CO -0.04 0.39 -0.06 1.25 -2.79 0.00 0.00 178.44 177.19 2vas h LEU 788 N 0.79 -0.14 -0.59 0.65 5.85 -1.08 -1.81 115.31 118.99 2vas h LEU 788 Ca 0.39 -0.25 0.09 0.00 0.84 0.00 0.00 57.88 58.96 2vas h LEU 788 Cb 0.46 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.46 2vas h LEU 788 CO -0.16 0.18 0.21 0.40 -0.34 0.00 0.00 178.44 178.73 2vas h ILE 789 N -0.47 0.77 -0.66 4.05 5.03 -1.14 -0.64 117.51 124.45 2vas h ILE 789 Ca -0.02 -0.13 -0.04 0.00 -0.12 0.00 0.00 64.86 64.56 2vas h ILE 789 Cb 0.38 0.35 -0.03 0.00 -3.03 0.00 0.00 36.82 34.49 2vas h ILE 789 CO 0.03 0.07 0.27 0.00 -0.68 0.00 0.00 178.15 177.84 2vas h SER 791 N 0.95 1.03 -0.63 0.00 0.02 -0.71 0.24 113.55 114.47 2vas h SER 791 Ca 0.23 -0.35 -0.04 0.00 -0.84 0.00 0.00 61.79 60.78 2vas h SER 791 Cb 0.17 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 2vas h SER 791 CO -0.02 1.14 0.23 0.03 -1.14 0.00 0.00 176.83 177.07 2vas h ARG 792 N 0.90 0.96 0.16 3.45 3.08 -0.83 -0.62 114.38 121.48 2vas h ARG 792 Ca 0.14 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2vas h ARG 792 Cb 0.68 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 2vas h ARG 792 CO 0.05 0.83 -0.13 -1.49 -1.07 0.00 0.00 179.97 178.16 2vas h TRP 793 N 0.89 -0.33 -0.43 3.04 4.06 -1.08 -3.10 115.95 119.01 2vas h TRP 793 Ca 0.21 -0.00 -0.08 0.00 2.06 0.00 0.00 58.89 61.08 2vas h TRP 793 Cb 0.25 0.12 -0.02 0.00 -1.00 0.00 0.00 29.16 28.51 2vas h TRP 793 CO 0.02 -0.20 -0.05 0.87 -3.56 0.00 0.00 178.44 175.52 2vas h LYS 794 N -0.30 0.72 -0.66 0.49 1.57 -0.77 -1.36 116.57 116.25 2vas h LYS 794 Ca -0.00 -0.20 0.05 0.00 -1.87 0.00 0.00 60.65 58.62 2vas h LYS 794 Cb 0.27 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.45 2vas h LYS 794 CO -0.01 0.76 0.38 -0.22 -0.57 0.00 0.00 179.45 179.79 2vas h LYS 795 N 0.67 0.69 0.07 3.15 3.64 -1.09 -0.89 116.57 122.80 2vas h LYS 795 Ca 0.13 -0.04 -0.26 0.00 -1.27 0.00 0.00 60.65 59.21 2vas h LYS 795 Cb 0.48 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2vas h LYS 795 CO 0.02 0.46 -1.24 -0.39 -2.27 0.00 0.00 179.45 176.03 2vas h VAL 796 N 0.71 1.47 0.06 2.00 -1.51 -1.40 -2.57 116.25 115.01 2vas h VAL 796 Ca 0.29 -3.12 -0.00 0.00 -1.23 0.00 0.00 66.70 62.64 2vas h VAL 796 Cb 0.15 2.84 0.00 0.00 -2.13 0.00 0.00 31.29 32.14 2vas h VAL 796 CO -0.16 0.88 -0.03 1.56 -1.23 0.00 0.00 177.57 178.59 2vas h GLN 797 N 0.04 -0.08 -0.14 5.19 4.20 -1.15 -1.68 115.11 121.48 2vas h GLN 797 Ca -0.12 0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.52 2vas h GLN 797 Cb 1.91 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.70 2vas h GLN 797 CO 0.16 0.17 -0.24 -1.49 -0.67 0.00 0.00 178.83 176.76 2vas h TRP 798 N -0.33 0.27 -0.33 2.96 4.06 -1.28 -1.83 115.95 119.47 2vas h TRP 798 Ca -0.01 -0.05 -0.09 0.00 2.06 0.00 0.00 58.89 60.80 2vas h TRP 798 Cb 0.29 -0.07 -0.02 0.00 -1.00 0.00 0.00 29.16 28.36 2vas h TRP 798 CO 0.01 0.47 -0.17 0.00 -3.56 0.00 0.00 178.44 175.19 2vas h SER 800 N 0.55 0.77 -0.29 0.00 4.64 -1.00 -1.73 113.55 116.49 2vas h SER 800 Ca 0.09 -0.59 0.07 0.00 -0.47 0.00 0.00 61.79 60.89 2vas h SER 800 Cb 0.60 -0.22 -0.07 0.00 -0.31 0.00 0.00 62.40 62.39 2vas h SER 800 CO 0.04 1.23 -0.22 0.25 -0.87 0.00 0.00 176.83 177.26 2vas h LEU 801 N 0.35 -0.71 -0.54 5.97 5.85 -1.28 -1.48 115.31 123.47 2vas h LEU 801 Ca -0.02 0.14 0.11 0.00 0.84 0.00 0.00 57.88 58.95 2vas h LEU 801 Cb 1.16 0.35 -0.10 0.00 0.37 0.00 0.00 40.66 42.43 2vas h LEU 801 CO 0.11 -0.25 -0.16 0.28 -0.34 0.00 0.00 178.44 178.08 2vas h SER 802 N -0.20 -0.57 -0.88 1.25 0.02 -0.50 0.30 113.55 112.97 2vas h SER 802 Ca 0.15 0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 61.26 2vas h SER 802 Cb 0.44 0.36 -0.04 0.00 0.14 0.00 0.00 62.40 63.29 2vas h SER 802 CO -0.41 -0.20 0.49 0.58 -1.14 0.00 0.00 176.83 176.16 2vas h VAL 803 N -0.03 1.25 0.08 2.27 2.07 -1.10 0.02 116.25 120.82 2vas h VAL 803 Ca 0.26 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 2vas h VAL 803 Cb 0.42 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2vas h VAL 803 CO -0.57 0.28 -0.04 0.40 0.02 0.00 0.00 177.57 177.66 2vas h ILE 804 N 1.23 1.11 -0.98 4.57 2.04 -0.11 0.53 117.51 125.90 2vas h ILE 804 Ca 0.31 -0.72 0.20 0.00 1.00 0.00 0.00 64.86 65.65 2vas h ILE 804 Cb 0.01 1.57 -0.10 0.00 -0.74 0.00 0.00 36.82 37.57 2vas h ILE 804 CO -0.05 0.18 0.62 0.11 0.00 0.00 0.00 178.15 179.00 2vas h LYS 805 N -0.44 0.64 -0.03 2.37 1.57 -0.26 -0.55 116.57 119.87 2vas h LYS 805 Ca -0.01 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.57 2vas h LYS 805 Cb 0.37 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2vas h LYS 805 CO 0.02 0.42 -0.72 -0.07 -0.57 0.00 0.00 179.45 178.53 2vas h LEU 806 N 0.66 0.22 -0.41 2.94 3.38 -0.78 -2.68 115.31 118.63 2vas h LEU 806 Ca 0.55 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 58.29 2vas h LEU 806 Cb 1.00 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 2vas h LEU 806 CO -0.32 0.86 -0.07 0.50 0.09 0.00 0.00 178.44 179.51 2vas h LYS 807 N 0.12 0.78 -0.47 1.13 3.64 0.42 -2.95 116.57 119.24 2vas h LYS 807 Ca -0.02 -0.28 -0.09 0.00 -1.27 0.00 0.00 60.65 58.99 2vas h LYS 807 Cb 1.27 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.02 2vas h LYS 807 CO 0.11 0.89 -0.07 -0.91 -2.27 0.00 0.00 179.45 177.19 2vas h ASN 808 N 0.60 0.82 -0.84 4.20 2.35 -1.18 -2.78 115.58 118.74 2vas h ASN 808 Ca 0.11 -0.23 0.08 0.00 -0.55 0.00 0.00 56.30 55.70 2vas h ASN 808 Cb 0.58 -0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.68 2vas h ASN 808 CO 0.03 0.92 0.54 0.11 -1.65 0.00 0.00 177.43 177.39 2vas h LYS 809 N 0.76 0.86 -0.47 0.81 1.57 -1.41 1.61 116.57 120.30 2vas h LYS 809 Ca 0.13 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 2vas h LYS 809 Cb 0.56 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 2vas h LYS 809 CO 0.03 0.57 0.09 0.82 -0.57 0.00 0.00 179.45 180.39 2vas h ILE 810 N 0.88 1.24 -0.02 1.86 2.04 -1.33 -0.96 117.51 121.23 2vas h ILE 810 Ca 0.37 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 2vas h ILE 810 Cb 0.29 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 37.29 2vas h ILE 810 CO -0.14 0.31 -0.02 0.50 0.00 0.00 0.00 178.15 178.80 2vas h LYS 811 N 0.63 0.05 -0.86 2.37 3.64 -1.14 -2.42 116.57 118.84 2vas h LYS 811 Ca 0.14 -0.03 0.15 0.00 -1.27 0.00 0.00 60.65 59.65 2vas h LYS 811 Cb 0.36 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.12 2vas h LYS 811 CO 0.01 0.53 0.56 -0.92 -2.27 0.00 0.00 179.45 177.36 2vas h TYR 812 N -0.44 0.73 0.00 1.91 5.03 0.24 0.11 116.97 124.54 2vas h TYR 812 Ca 0.00 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.33 2vas h TYR 812 Cb 0.52 -0.23 0.00 0.00 1.55 0.00 0.00 36.73 38.58 2vas h TYR 812 CO 0.10 0.26 -0.44 0.07 -1.32 0.00 0.00 178.16 176.83 2vas h ARG 813 N 0.61 0.00 0.21 1.82 -0.00 -1.23 -3.35 114.38 112.44 2vas h ARG 813 Ca 0.43 0.00 -0.33 0.00 -0.00 0.00 0.00 59.98 60.09 2vas h ARG 813 Cb 0.78 0.00 0.02 0.00 -0.00 0.00 0.00 29.97 30.77 2vas h ARG 813 CO -0.18 0.00 -1.50 0.00 -0.00 0.00 0.00 179.97 178.28 2vas h ALA 814 N 2.30 -0.01 0.00 0.08 0.00 -0.30 -3.51 119.26 117.82 2vas h ALA 814 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 53.96 2vas h ALA 814 Cb 0.85 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2vas h ALA 814 CO 0.00 0.86 0.00 -0.85 0.00 0.00 0.00 179.25 179.26