#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qqv s GLN 6 N 0.00 1.82 0.00 1.20 -1.52 -1.26 -4.94 119.66 114.96 2qqv s GLN 6 Ca 0.00 -2.60 0.29 0.00 -1.95 0.00 0.00 55.36 51.10 2qqv s GLN 6 Cb 0.00 -2.90 1.24 0.00 -0.22 0.00 0.00 33.01 31.13 2qqv s GLN 6 CO 0.00 -1.20 1.90 -0.35 -0.25 0.00 0.00 175.29 175.40 2qqv n PRO 7 N 2.90 0.22 -0.03 2.91 -0.04 -1.26 -3.70 135.00 136.01 2qqv n PRO 7 Ca 0.12 -0.03 0.05 0.00 -0.04 0.00 0.00 63.50 63.60 2qqv n PRO 7 Cb 0.35 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.37 2qqv n PRO 7 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2qqv n TYR 8 N -1.36 0.07 -2.48 0.54 4.01 -1.26 -4.75 117.16 111.93 2qqv n TYR 8 Ca 0.10 -0.09 -0.41 0.00 -0.16 0.00 0.00 57.90 57.34 2qqv n TYR 8 Cb 0.30 -0.01 -0.04 0.00 -0.31 0.00 0.00 39.34 39.29 2qqv n TYR 8 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2qqv s ARG 9 N -0.85 4.55 0.36 -0.72 0.52 -1.24 -4.19 118.95 117.38 2qqv s ARG 9 Ca 0.13 1.75 -0.26 0.00 -0.52 0.00 0.00 55.73 56.83 2qqv s ARG 9 Cb 0.09 -3.28 -0.09 0.00 0.52 0.00 0.00 34.95 32.18 2qqv s ARG 9 CO 0.13 -0.01 1.05 0.95 0.02 0.00 0.00 175.30 177.44 2qqv s THR 10 N -0.00 3.69 0.04 0.02 -4.23 -1.26 -4.82 115.64 109.07 2qqv s THR 10 Ca 0.51 1.40 -0.15 0.00 -1.18 0.00 0.00 61.69 62.28 2qqv s THR 10 Cb -0.30 -3.78 -0.34 0.00 1.34 0.00 0.00 72.50 69.43 2qqv s THR 10 CO 0.34 0.11 1.04 1.23 -0.54 0.00 0.00 174.62 176.80 2qqv h GLY 11 N 2.89 0.63 0.00 3.99 0.00 -1.95 -3.41 103.07 105.23 2qqv h GLY 11 Ca -0.48 -1.53 0.00 0.00 0.00 0.00 0.00 47.33 45.33 2qqv h GLY 11 CO 0.64 1.34 0.00 1.97 0.00 0.00 0.00 176.54 180.48 2qqv n PHE 12 N -3.73 0.00 -3.22 5.60 1.16 -1.26 -1.61 117.46 114.40 2qqv n PHE 12 Ca -0.16 -0.06 -0.34 0.00 -1.87 0.00 0.00 57.45 55.03 2qqv n PHE 12 Cb 1.07 -0.01 -0.06 0.00 -1.61 0.00 0.00 39.48 38.88 2qqv n PHE 12 CO 0.00 0.00 0.00 -1.01 -1.87 0.00 0.00 176.76 173.88 2qqv s HIS 13 N -0.12 3.51 -0.13 2.97 3.76 -1.26 -4.82 115.29 119.20 2qqv s HIS 13 Ca 0.00 1.17 -0.29 0.00 -0.15 0.00 0.00 55.06 55.79 2qqv s HIS 13 Cb 0.00 -2.48 -0.02 0.00 1.11 0.00 0.00 32.58 31.19 2qqv s HIS 13 CO 0.00 0.26 1.34 0.12 -0.85 0.00 0.00 174.74 175.61 2qqv s PHE 14 N -1.72 2.70 -0.04 1.40 5.36 -1.22 -4.86 117.98 119.60 2qqv s PHE 14 Ca 0.46 0.86 -0.21 0.00 -0.96 0.00 0.00 56.93 57.08 2qqv s PHE 14 Cb -0.13 -3.58 0.04 0.00 -0.34 0.00 0.00 43.02 39.01 2qqv s PHE 14 CO 0.19 -2.12 0.47 1.14 -1.46 0.00 0.00 175.22 173.44 2qqv s GLN 15 N 3.49 0.81 0.80 10.12 -2.07 -1.26 -0.54 119.66 131.01 2qqv s GLN 15 Ca 0.59 0.06 -0.11 0.00 -1.82 0.00 0.00 55.36 54.07 2qqv s GLN 15 Cb -0.24 0.37 0.08 0.00 -1.09 0.00 0.00 33.01 32.13 2qqv s GLN 15 CO 0.18 -0.23 1.12 -2.14 -1.32 0.00 0.00 175.29 172.91 2qqv s PRO 16 N -1.13 1.91 0.51 9.60 0.02 -1.26 -4.46 135.00 140.18 2qqv s PRO 16 Ca -0.11 1.39 0.24 0.00 0.02 0.00 0.00 61.00 62.53 2qqv s PRO 16 Cb -0.03 -1.84 1.33 0.00 0.02 0.00 0.00 34.50 33.98 2qqv s PRO 16 CO 0.06 -1.94 1.98 -1.35 -0.33 0.00 0.00 177.00 175.42 2qqv h PRO 17 N -1.14 0.08 -3.30 5.54 0.11 -1.90 -3.45 132.00 127.94 2qqv h PRO 17 Ca -0.44 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 2qqv h PRO 17 Cb 1.25 -0.02 -0.10 0.00 0.11 0.00 0.00 31.00 32.24 2qqv h PRO 17 CO 0.48 0.05 0.03 -1.59 -0.21 0.00 0.00 178.00 176.76 2qqv s LYS 18 N -5.09 1.36 0.97 1.05 -2.85 -1.26 -5.04 119.74 108.88 2qqv s LYS 18 Ca -0.06 -0.85 0.00 0.00 -1.00 0.00 0.00 55.97 54.07 2qqv s LYS 18 Cb 0.20 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.49 2qqv s LYS 18 CO 0.74 -0.58 0.00 0.27 0.10 0.00 0.00 175.35 175.88 2qqv n ASN 19 N -0.34 -2.24 -4.68 0.03 0.23 0.55 -4.89 115.26 103.93 2qqv n ASN 19 Ca -0.10 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.52 2qqv n ASN 19 Cb 0.63 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.30 2qqv n ASN 19 CO 0.00 0.00 0.00 0.86 -0.93 0.00 0.00 177.26 177.19 2qqv s TRP 20 N 0.00 2.47 0.09 -2.53 -0.11 -0.56 -3.27 118.94 115.02 2qqv s TRP 20 Ca 0.00 0.45 0.08 0.00 1.22 0.00 0.00 56.10 57.85 2qqv s TRP 20 Cb 0.00 -3.86 -0.04 0.00 -1.50 0.00 0.00 33.47 28.07 2qqv s TRP 20 CO 0.00 -3.42 -0.15 1.41 -4.62 0.00 0.00 176.95 170.17 2qqv s MET 21 N 2.85 1.99 0.00 5.86 -2.45 0.14 -1.88 119.30 125.81 2qqv s MET 21 Ca 0.71 -1.06 0.00 0.00 -1.25 0.00 0.00 55.69 54.08 2qqv s MET 21 Cb -0.36 -2.21 0.00 0.00 1.25 0.00 0.00 34.83 33.51 2qqv s MET 21 CO 0.30 0.51 0.00 -1.71 1.05 0.00 0.00 175.02 175.17 2qqv n ASN 22 N 0.99 0.00 -4.74 1.11 5.15 0.05 -4.49 115.26 113.34 2qqv n ASN 22 Ca -0.15 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.45 2qqv n ASN 22 Cb 0.52 0.00 0.05 0.00 -0.53 0.00 0.00 39.78 39.82 2qqv n ASN 22 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2qqv s ASP 23 N 1.00 5.03 0.13 1.20 1.11 -1.26 -4.65 116.67 119.23 2qqv s ASP 23 Ca 0.00 2.65 -0.30 0.00 0.18 0.00 0.00 52.55 55.07 2qqv s ASP 23 Cb 0.00 -2.62 -0.07 0.00 1.07 0.00 0.00 42.92 41.30 2qqv s ASP 23 CO 0.00 -1.72 1.23 -2.16 1.18 0.00 0.00 175.17 173.70 2qqv s PRO 24 N -3.14 4.44 -0.05 8.23 0.04 -1.26 -2.14 135.00 141.12 2qqv s PRO 24 Ca 0.76 1.87 0.05 0.00 0.04 0.00 0.00 61.00 63.73 2qqv s PRO 24 Cb -0.38 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 30.86 2qqv s PRO 24 CO 0.42 -0.21 -0.19 -0.80 0.04 0.00 0.00 177.00 176.26 2qqv s ASN 25 N 0.64 3.59 -0.59 6.66 0.02 0.05 -4.85 114.94 120.45 2qqv s ASN 25 Ca 0.57 -0.34 -0.13 0.00 -1.02 0.00 0.00 52.86 51.94 2qqv s ASN 25 Cb -0.32 -0.78 0.02 0.00 0.02 0.00 0.00 41.25 40.19 2qqv s ASN 25 CO 0.33 0.30 0.35 0.61 0.02 0.00 0.00 177.10 178.72 2qqv n GLY 26 N 2.57 -0.54 3.78 0.66 0.00 -0.85 -2.12 105.19 108.69 2qqv n GLY 26 Ca -0.17 0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 2qqv n GLY 26 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qqv s PRO 27 N -5.49 4.04 0.16 1.61 0.04 -1.26 -4.45 135.00 129.65 2qqv s PRO 27 Ca 0.18 1.56 -0.24 0.00 0.04 0.00 0.00 61.00 62.54 2qqv s PRO 27 Cb -0.10 -2.48 0.07 0.00 0.04 0.00 0.00 34.50 32.03 2qqv s PRO 27 CO 0.52 -0.26 0.98 0.00 0.04 0.00 0.00 177.00 178.28 2qqv s MET 28 N -2.60 1.22 -0.12 4.56 0.23 -1.10 -4.56 119.30 116.94 2qqv s MET 28 Ca 0.60 -0.70 0.02 0.00 -1.03 0.00 0.00 55.69 54.58 2qqv s MET 28 Cb -0.23 0.40 0.01 0.00 -1.53 0.00 0.00 34.83 33.48 2qqv s MET 28 CO 0.29 -0.56 -0.17 -1.50 -2.03 0.00 0.00 175.02 171.04 2qqv s ILE 29 N -3.05 1.68 -0.03 3.16 2.07 -1.26 -1.41 121.20 122.36 2qqv s ILE 29 Ca 0.14 -0.75 0.02 0.00 -1.41 0.00 0.00 60.65 58.65 2qqv s ILE 29 Cb -0.01 -1.51 0.01 0.00 0.13 0.00 0.00 42.46 41.07 2qqv s ILE 29 CO 0.03 0.48 -0.07 -0.47 -1.91 0.00 0.00 174.94 172.99 2qqv s TYR 30 N 0.93 0.85 -1.63 3.50 5.04 -0.23 -4.85 117.35 120.97 2qqv s TYR 30 Ca -0.07 -0.22 -0.09 0.00 -2.44 0.00 0.00 57.07 54.25 2qqv s TYR 30 Cb -0.15 -0.64 0.08 0.00 0.35 0.00 0.00 41.96 41.60 2qqv s TYR 30 CO -0.02 -0.12 0.36 1.63 -1.34 0.00 0.00 175.55 176.07 2qqv n LYS 31 N 3.48 -1.75 -0.96 4.97 5.02 -1.26 -0.64 118.16 127.03 2qqv n LYS 31 Ca -0.20 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2qqv n LYS 31 Cb 0.54 -4.30 0.00 0.00 -0.02 0.00 0.00 35.03 31.24 2qqv n LYS 31 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qqv n GLY 32 N -1.90 0.62 3.37 0.72 0.00 -1.26 -5.02 105.19 101.72 2qqv n GLY 32 Ca -0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2qqv n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqv s ILE 33 N -2.64 2.83 0.12 -0.61 1.09 0.19 -4.90 121.20 117.28 2qqv s ILE 33 Ca 0.00 -0.77 -0.28 0.00 -1.10 0.00 0.00 60.65 58.51 2qqv s ILE 33 Cb 0.00 -2.14 -0.06 0.00 -1.06 0.00 0.00 42.46 39.20 2qqv s ILE 33 CO 0.00 0.55 0.88 -0.31 -0.10 0.00 0.00 174.94 175.96 2qqv s TYR 34 N -0.02 3.83 -0.06 3.97 2.02 -0.03 -1.06 117.35 126.00 2qqv s TYR 34 Ca -0.05 1.70 0.06 0.00 -0.37 0.00 0.00 57.07 58.41 2qqv s TYR 34 Cb -0.14 -2.94 -0.01 0.00 -0.40 0.00 0.00 41.96 38.47 2qqv s TYR 34 CO 0.04 0.30 -0.24 -1.01 -1.57 0.00 0.00 175.55 173.08 2qqv s HIS 35 N -0.33 2.33 -0.17 2.71 3.76 -0.50 -1.44 115.29 121.65 2qqv s HIS 35 Ca 0.42 -0.70 -0.03 0.00 -0.15 0.00 0.00 55.06 54.61 2qqv s HIS 35 Cb -0.23 -1.53 0.05 0.00 1.11 0.00 0.00 32.58 31.98 2qqv s HIS 35 CO 0.28 -0.21 0.04 -1.17 -0.85 0.00 0.00 174.74 172.82 2qqv s LEU 36 N -0.13 0.91 0.55 0.89 2.96 -0.65 -2.71 118.68 120.50 2qqv s LEU 36 Ca -0.04 -0.65 0.01 0.00 -0.22 0.00 0.00 54.13 53.23 2qqv s LEU 36 Cb -0.13 -0.50 0.03 0.00 0.50 0.00 0.00 46.19 46.09 2qqv s LEU 36 CO 0.04 -0.30 0.78 -0.36 -1.32 0.00 0.00 176.35 175.19 2qqv s PHE 37 N 1.94 2.89 -0.06 5.38 0.08 -0.90 -1.84 117.98 125.46 2qqv s PHE 37 Ca 0.01 0.03 -0.30 0.00 0.12 0.00 0.00 56.93 56.79 2qqv s PHE 37 Cb -0.16 -2.75 0.11 0.00 -0.57 0.00 0.00 43.02 39.65 2qqv s PHE 37 CO -0.08 -0.86 0.92 1.52 -0.10 0.00 0.00 175.22 176.62 2qqv s TYR 38 N -2.77 -0.36 0.00 0.36 1.13 -0.69 -0.77 117.35 114.26 2qqv s TYR 38 Ca 0.57 0.36 -0.30 0.00 -1.41 0.00 0.00 57.07 56.29 2qqv s TYR 38 Cb -0.10 0.51 -0.05 0.00 -1.10 0.00 0.00 41.96 41.21 2qqv s TYR 38 CO 0.39 -0.48 1.35 -0.65 -2.51 0.00 0.00 175.55 173.66 2qqv s GLN 39 N -2.45 4.30 -0.04 -3.49 -1.52 -0.91 -0.69 119.66 114.86 2qqv s GLN 39 Ca 0.03 1.91 -0.04 0.00 -1.95 0.00 0.00 55.36 55.31 2qqv s GLN 39 Cb -0.01 -3.54 0.01 0.00 -0.22 0.00 0.00 33.01 29.25 2qqv s GLN 39 CO -0.05 -0.53 0.11 -0.46 -0.25 0.00 0.00 175.29 174.11 2qqv s TRP 40 N 2.21 -0.10 -0.49 0.91 -0.00 -0.29 -0.77 118.94 120.42 2qqv s TRP 40 Ca 0.62 0.25 -0.17 0.00 -0.00 0.00 0.00 56.10 56.80 2qqv s TRP 40 Cb -0.30 0.03 0.07 0.00 -0.00 0.00 0.00 33.47 33.27 2qqv s TRP 40 CO 0.26 -0.07 0.48 1.21 -0.00 0.00 0.00 176.95 178.83 2qqv s ASN 41 N -0.06 6.17 0.00 5.86 3.84 -0.79 -1.31 114.94 128.66 2qqv s ASN 41 Ca -0.01 -1.20 0.09 0.00 0.21 0.00 0.00 52.86 51.94 2qqv s ASN 41 Cb -0.01 -2.22 0.52 0.00 -0.55 0.00 0.00 41.25 38.98 2qqv s ASN 41 CO 0.00 -0.74 0.98 -0.81 -2.79 0.00 0.00 177.10 173.74 2qqv n PRO 42 N 5.55 0.52 -2.06 0.43 -0.04 -1.26 -3.53 135.00 134.61 2qqv n PRO 42 Ca -0.10 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.32 2qqv n PRO 42 Cb 0.44 -1.26 0.05 0.00 -0.04 0.00 0.00 33.50 32.69 2qqv n PRO 42 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2qqv n LYS 43 N -0.76 0.87 -3.64 0.54 2.85 -1.26 -5.12 118.16 111.64 2qqv n LYS 43 Ca 0.07 -1.21 -0.03 0.00 -1.05 0.00 0.00 58.31 56.08 2qqv n LYS 43 Cb 0.03 0.39 -0.05 0.00 -0.65 0.00 0.00 35.03 34.75 2qqv n LYS 43 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2qqv s GLY 44 N -1.18 0.11 0.00 2.58 0.00 -1.23 -5.02 107.32 102.58 2qqv s GLY 44 Ca 0.07 2.91 0.24 0.00 0.00 0.00 0.00 44.72 47.93 2qqv s GLY 44 CO -0.08 1.32 1.63 0.00 0.00 0.00 0.00 173.10 175.97 2qqv n ALA 45 N 0.85 2.54 -2.38 3.20 0.00 -1.26 -1.49 120.51 121.97 2qqv n ALA 45 Ca -0.04 -0.49 -0.23 0.00 0.00 0.00 0.00 53.44 52.68 2qqv n ALA 45 Cb 0.58 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.85 2qqv n ALA 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2qqv s VAL 46 N -1.87 2.49 0.27 0.00 -7.23 -1.26 -4.39 120.40 108.41 2qqv s VAL 46 Ca 0.35 -1.58 -0.30 0.00 -1.81 0.00 0.00 61.98 58.63 2qqv s VAL 46 Cb 0.19 -3.00 -0.11 0.00 0.56 0.00 0.00 36.38 34.02 2qqv s VAL 46 CO 0.29 -0.02 1.53 0.86 -0.31 0.00 0.00 175.10 177.45 2qqv s TRP 47 N -2.54 2.87 0.00 2.82 -0.00 -1.26 -4.68 118.94 116.14 2qqv s TRP 47 Ca 0.43 0.88 0.00 0.00 -0.00 0.00 0.00 56.10 57.41 2qqv s TRP 47 Cb 0.01 -3.97 0.00 0.00 -0.00 0.00 0.00 33.47 29.51 2qqv s TRP 47 CO 0.24 -3.22 0.00 0.41 -0.00 0.00 0.00 176.95 174.39 2qqv n GLY 48 N 2.21 3.07 4.24 5.86 0.00 -1.26 -5.04 105.19 114.26 2qqv n GLY 48 Ca 0.08 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 2qqv n GLY 48 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qqv n ASN 49 N 0.00 0.73 -4.72 1.61 3.02 -1.26 -4.29 115.26 110.35 2qqv n ASN 49 Ca 0.00 -1.23 -0.42 0.00 -0.03 0.00 0.00 54.58 52.91 2qqv n ASN 49 Cb 0.00 -1.52 -0.03 0.00 -0.61 0.00 0.00 39.78 37.62 2qqv n ASN 49 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2qqv s ILE 50 N -4.30 3.91 0.19 2.41 1.10 -1.26 -4.38 121.20 118.86 2qqv s ILE 50 Ca 0.02 1.46 0.03 0.00 -0.51 0.00 0.00 60.65 61.64 2qqv s ILE 50 Cb -0.01 -3.93 -0.05 0.00 0.15 0.00 0.00 42.46 38.62 2qqv s ILE 50 CO 0.96 0.16 -0.01 0.68 -2.11 0.00 0.00 174.94 174.62 2qqv s VAL 51 N 0.60 0.85 -0.80 4.00 -7.23 -0.43 -3.17 120.40 114.22 2qqv s VAL 51 Ca 0.56 -2.01 -0.22 0.00 -1.81 0.00 0.00 61.98 58.50 2qqv s VAL 51 Cb -0.30 -2.15 0.08 0.00 0.56 0.00 0.00 36.38 34.57 2qqv s VAL 51 CO 0.32 -0.47 1.14 0.26 -0.31 0.00 0.00 175.10 176.03 2qqv s TRP 52 N -3.54 2.71 0.70 2.82 0.52 0.28 -1.14 118.94 121.29 2qqv s TRP 52 Ca 0.24 -0.75 -0.11 0.00 0.02 0.00 0.00 56.10 55.50 2qqv s TRP 52 Cb 0.05 -4.41 0.01 0.00 -1.15 0.00 0.00 33.47 27.98 2qqv s TRP 52 CO 0.05 -1.72 1.06 0.00 0.02 0.00 0.00 176.95 176.36 2qqv s ALA 53 N 4.09 2.65 -0.04 0.98 0.00 0.13 -1.26 121.76 128.31 2qqv s ALA 53 Ca 0.31 0.11 -0.01 0.00 0.00 0.00 0.00 51.96 52.37 2qqv s ALA 53 Cb -0.09 -3.18 0.03 0.00 0.00 0.00 0.00 23.12 19.87 2qqv s ALA 53 CO 0.02 -1.25 0.06 -1.58 0.00 0.00 0.00 175.76 173.01 2qqv s HIS 54 N -3.02 0.00 0.05 0.00 2.46 -1.25 -1.70 115.29 111.84 2qqv s HIS 54 Ca 0.58 0.25 0.00 0.00 0.47 0.00 0.00 55.06 56.36 2qqv s HIS 54 Cb -0.14 -0.30 -0.03 0.00 -0.13 0.00 0.00 32.58 31.97 2qqv s HIS 54 CO 0.55 -0.14 -0.05 -1.12 -2.47 0.00 0.00 174.74 171.51 2qqv s SER 55 N 1.52 0.63 0.10 9.88 0.01 -0.76 -0.98 113.70 124.11 2qqv s SER 55 Ca -0.04 -0.81 0.03 0.00 1.31 0.00 0.00 55.95 56.44 2qqv s SER 55 Cb -0.12 0.13 -0.04 0.00 0.21 0.00 0.00 66.02 66.19 2qqv s SER 55 CO -0.04 -0.43 -0.08 0.42 0.41 0.00 0.00 173.24 173.52 2qqv s THR 56 N -2.86 0.85 0.17 1.44 -4.23 -0.50 -1.64 115.64 108.88 2qqv s THR 56 Ca -0.00 -1.80 -0.12 0.00 -1.18 0.00 0.00 61.69 58.59 2qqv s THR 56 Cb 0.00 -1.53 0.01 0.00 1.34 0.00 0.00 72.50 72.32 2qqv s THR 56 CO -0.05 -0.71 0.37 -0.55 -0.54 0.00 0.00 174.62 173.13 2qqv s SER 57 N -2.77 -0.07 0.00 3.99 0.15 -0.52 -0.49 113.70 114.00 2qqv s SER 57 Ca 0.09 -0.72 0.10 0.00 0.70 0.00 0.00 55.95 56.12 2qqv s SER 57 Cb 0.01 0.48 -0.07 0.00 -1.71 0.00 0.00 66.02 64.73 2qqv s SER 57 CO -0.02 -0.95 0.49 0.35 1.20 0.00 0.00 173.24 174.32 2qqv n THR 58 N -0.25 0.00 -0.79 6.45 -2.24 -1.26 -0.85 114.28 115.33 2qqv n THR 58 Ca -0.09 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 2qqv n THR 58 Cb 0.63 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.90 2qqv n THR 58 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2qqv n ASP 59 N -0.89 0.29 0.00 3.42 5.68 -1.26 -4.91 116.55 118.88 2qqv n ASP 59 Ca 0.03 -1.08 0.00 0.00 -0.50 0.00 0.00 54.79 53.24 2qqv n ASP 59 Cb 0.18 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.16 2qqv n ASP 59 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2qqv n LEU 60 N -0.04 0.76 -0.02 -2.12 4.77 -1.26 -4.77 117.00 114.31 2qqv n LEU 60 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 2qqv n LEU 60 Cb 0.29 -1.94 -0.02 0.00 -2.33 0.00 0.00 43.42 39.42 2qqv n LEU 60 CO 0.00 -0.73 -0.59 -0.38 -1.33 0.00 0.00 177.39 174.37 2qqv n ILE 61 N -2.22 0.56 -3.61 -0.08 2.08 -1.26 -4.79 119.36 110.04 2qqv n ILE 61 Ca 0.00 0.01 -0.36 0.00 0.56 0.00 0.00 62.75 62.96 2qqv n ILE 61 Cb 0.35 -1.63 -0.08 0.00 -0.75 0.00 0.00 39.64 37.53 2qqv n ILE 61 CO 0.00 0.00 0.00 0.20 0.56 0.00 0.00 176.55 177.31 2qqv s ASN 62 N -5.66 6.29 -0.04 4.38 0.01 -1.26 -4.74 114.94 113.92 2qqv s ASN 62 Ca -0.08 0.33 0.06 0.00 -0.71 0.00 0.00 52.86 52.46 2qqv s ASN 62 Cb 0.03 -2.14 -0.01 0.00 0.41 0.00 0.00 41.25 39.54 2qqv s ASN 62 CO 0.11 0.10 -0.22 0.26 -1.51 0.00 0.00 177.10 175.83 2qqv s TRP 63 N 0.67 2.09 -0.14 2.20 0.52 0.23 -4.46 118.94 120.06 2qqv s TRP 63 Ca 0.12 -0.51 -0.03 0.00 0.02 0.00 0.00 56.10 55.69 2qqv s TRP 63 Cb -0.13 -1.37 -0.03 0.00 -1.15 0.00 0.00 33.47 30.80 2qqv s TRP 63 CO 0.03 -0.12 -0.04 -0.51 0.02 0.00 0.00 176.95 176.33 2qqv s ASP 64 N -0.30 4.82 0.56 2.95 -0.00 0.36 -2.88 116.67 122.19 2qqv s ASP 64 Ca 0.02 -0.10 -0.17 0.00 -0.00 0.00 0.00 52.55 52.31 2qqv s ASP 64 Cb -0.11 -1.71 -0.05 0.00 -0.00 0.00 0.00 42.92 41.05 2qqv s ASP 64 CO 0.01 0.20 1.04 -2.16 -0.00 0.00 0.00 175.17 174.27 2qqv s PRO 65 N 0.16 3.50 0.01 8.23 0.04 -1.26 -1.41 135.00 144.28 2qqv s PRO 65 Ca -0.01 1.20 -0.11 0.00 0.04 0.00 0.00 61.00 62.11 2qqv s PRO 65 Cb -0.14 -2.06 0.01 0.00 0.04 0.00 0.00 34.50 32.35 2qqv s PRO 65 CO 0.03 -0.66 0.22 -1.01 0.04 0.00 0.00 177.00 175.62 2qqv s HIS 66 N -2.39 -0.03 0.52 0.56 3.76 -0.15 -4.91 115.29 112.65 2qqv s HIS 66 Ca 0.64 -0.04 -0.22 0.00 -0.15 0.00 0.00 55.06 55.28 2qqv s HIS 66 Cb -0.15 0.01 -0.06 0.00 1.11 0.00 0.00 32.58 33.49 2qqv s HIS 66 CO 0.33 -0.37 1.31 -0.35 -0.85 0.00 0.00 174.74 174.80 2qqv n PRO 67 N 1.13 1.68 -1.60 8.40 -0.04 -1.26 -3.94 135.00 139.37 2qqv n PRO 67 Ca -0.21 0.61 -0.52 0.00 -0.04 0.00 0.00 63.50 63.35 2qqv n PRO 67 Cb 0.57 -2.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.47 2qqv n PRO 67 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2qqv n PRO 68 N -0.78 1.26 0.01 0.54 -0.02 -1.26 -4.56 135.00 130.18 2qqv n PRO 68 Ca 0.10 0.46 -0.21 0.00 -2.02 0.00 0.00 63.50 61.83 2qqv n PRO 68 Cb 0.44 -2.11 -0.14 0.00 -0.02 0.00 0.00 33.50 31.66 2qqv n PRO 68 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qqv h ALA 69 N 4.84 0.11 -3.50 3.55 0.00 -1.46 -3.45 119.26 119.35 2qqv h ALA 69 Ca -0.47 -0.98 -0.67 0.00 0.00 0.00 0.00 54.91 52.79 2qqv h ALA 69 Cb 1.33 0.38 -0.36 0.00 0.00 0.00 0.00 17.79 19.14 2qqv h ALA 69 CO 0.80 0.68 -0.81 0.42 0.00 0.00 0.00 179.25 180.33 2qqv s ILE 70 N -2.45 2.23 0.04 0.00 1.01 -1.24 -4.49 121.20 116.31 2qqv s ILE 70 Ca -0.19 -1.31 -0.02 0.00 0.00 0.00 0.00 60.65 59.13 2qqv s ILE 70 Cb 0.03 -2.16 -0.03 0.00 0.01 0.00 0.00 42.46 40.32 2qqv s ILE 70 CO 0.77 0.20 0.02 0.72 0.00 0.00 0.00 174.94 176.65 2qqv s PHE 71 N 1.20 0.35 -0.01 3.97 -0.12 -1.26 -0.56 117.98 121.55 2qqv s PHE 71 Ca -0.03 -0.76 -0.33 0.00 -0.05 0.00 0.00 56.93 55.76 2qqv s PHE 71 Cb -0.17 -0.26 -0.11 0.00 -0.63 0.00 0.00 43.02 41.85 2qqv s PHE 71 CO -0.08 -0.34 1.89 -2.30 -0.05 0.00 0.00 175.22 174.34 2qqv n PRO 72 N 0.62 2.45 0.00 1.99 -0.02 -1.26 -4.74 135.00 134.03 2qqv n PRO 72 Ca -0.18 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2qqv n PRO 72 Cb 0.59 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 2qqv n PRO 72 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2qqv n SER 73 N 6.61 0.00 -3.75 2.55 3.41 -1.26 -4.98 113.62 116.20 2qqv n SER 73 Ca 0.21 -1.00 -0.10 0.00 -0.26 0.00 0.00 58.87 57.72 2qqv n SER 73 Cb 0.34 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.24 2qqv n SER 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qqv s ALA 74 N 0.00 -0.70 0.26 7.33 0.00 -1.26 -5.05 121.76 122.34 2qqv s ALA 74 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 51.96 51.64 2qqv s ALA 74 Cb 0.00 0.76 0.51 0.00 0.00 0.00 0.00 23.12 24.39 2qqv s ALA 74 CO 0.00 -0.68 1.76 -1.35 0.00 0.00 0.00 175.76 175.49 2qqv h PRO 75 N 2.38 0.58 0.00 0.00 0.11 -1.97 -0.73 132.00 132.37 2qqv h PRO 75 Ca -0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2qqv h PRO 75 Cb 1.25 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2qqv h PRO 75 CO 0.45 0.39 0.00 1.97 -0.21 0.00 0.00 178.00 180.60 2qqv n PHE 76 N -4.88 0.00 -2.08 0.65 1.16 -1.26 -3.39 117.46 107.66 2qqv n PHE 76 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.75 2qqv n PHE 76 Cb 0.42 -0.41 0.00 0.00 -1.61 0.00 0.00 39.48 37.89 2qqv n PHE 76 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 2qqv n ASP 77 N -1.41 0.12 0.02 5.98 3.85 -0.91 -3.81 116.55 120.40 2qqv n ASP 77 Ca 0.07 -1.87 0.07 0.00 -0.71 0.00 0.00 54.79 52.35 2qqv n ASP 77 Cb 0.20 -0.17 0.48 0.00 -1.35 0.00 0.00 41.12 40.27 2qqv n ASP 77 CO 0.00 0.00 0.00 -0.29 -1.01 0.00 0.00 177.20 175.90 2qqv h ILE 78 N 6.68 1.04 -0.59 2.12 6.09 -0.65 -2.47 117.51 129.72 2qqv h ILE 78 Ca -0.05 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 63.29 2qqv h ILE 78 Cb 1.42 0.56 0.00 0.00 0.47 0.00 0.00 36.82 39.28 2qqv h ILE 78 CO 0.01 0.08 0.00 0.59 -3.07 0.00 0.00 178.15 175.76 2qqv n ASN 79 N -4.48 3.99 0.00 2.19 3.02 0.29 -4.83 115.26 115.43 2qqv n ASN 79 Ca 0.04 -2.21 0.00 0.00 -0.03 0.00 0.00 54.58 52.38 2qqv n ASN 79 Cb 0.14 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 38.85 2qqv n ASN 79 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qqv n GLY 80 N 1.08 4.03 2.98 7.41 0.00 -0.93 -4.75 105.19 115.01 2qqv n GLY 80 Ca 0.22 -0.86 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 2qqv n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqv n TRP 82 N 2.87 -3.95 -0.70 0.00 7.02 0.12 -4.51 117.44 118.30 2qqv n TRP 82 Ca 0.10 -0.80 -0.31 0.00 -1.02 0.00 0.00 57.50 55.47 2qqv n TRP 82 Cb 0.34 -0.67 0.17 0.00 -2.42 0.00 0.00 31.31 28.74 2qqv n TRP 82 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 2qqv s SER 83 N -4.18 2.78 0.00 -0.99 0.01 -1.26 -3.82 113.70 106.23 2qqv s SER 83 Ca 0.49 2.11 0.00 0.00 1.31 0.00 0.00 55.95 59.86 2qqv s SER 83 Cb -0.01 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2qqv s SER 83 CO 0.35 -3.18 0.00 0.61 0.41 0.00 0.00 173.24 171.42 2qqv n GLY 84 N 0.21 0.93 3.18 3.44 0.00 -1.26 -2.43 105.19 109.25 2qqv n GLY 84 Ca 0.11 -0.85 -0.11 0.00 0.00 0.00 0.00 46.02 45.17 2qqv n GLY 84 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qqv s SER 85 N -0.81 0.43 -0.16 1.61 0.01 -0.65 -2.01 113.70 112.12 2qqv s SER 85 Ca 0.00 -1.24 -0.01 0.00 1.31 0.00 0.00 55.95 56.01 2qqv s SER 85 Cb 0.00 0.28 -0.01 0.00 0.21 0.00 0.00 66.02 66.51 2qqv s SER 85 CO 0.00 -0.73 -0.13 0.00 0.41 0.00 0.00 173.24 172.80 2qqv s ALA 86 N -4.01 2.59 -0.06 1.44 0.00 -1.26 -1.73 121.76 118.73 2qqv s ALA 86 Ca 0.27 -1.04 -0.04 0.00 0.00 0.00 0.00 51.96 51.15 2qqv s ALA 86 Cb 0.07 -1.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 2qqv s ALA 86 CO 0.04 -0.06 0.12 0.99 0.00 0.00 0.00 175.76 176.86 2qqv s THR 87 N 0.85 5.20 -0.40 0.00 2.01 0.15 -4.78 115.64 118.66 2qqv s THR 87 Ca -0.04 -0.06 -0.08 0.00 0.31 0.00 0.00 61.69 61.82 2qqv s THR 87 Cb -0.15 -3.33 0.07 0.00 0.01 0.00 0.00 72.50 69.10 2qqv s THR 87 CO -0.00 0.48 0.22 -0.63 -0.69 0.00 0.00 174.62 174.01 2qqv s ILE 88 N -1.13 4.07 0.65 1.82 1.01 -1.26 -0.59 121.20 125.77 2qqv s ILE 88 Ca 0.20 -1.39 -0.18 0.00 0.00 0.00 0.00 60.65 59.28 2qqv s ILE 88 Cb -0.12 -3.47 -0.01 0.00 0.01 0.00 0.00 42.46 38.86 2qqv s ILE 88 CO 0.10 -0.45 1.29 -0.76 0.00 0.00 0.00 174.94 175.12 2qqv s LEU 89 N 1.40 3.58 0.57 2.97 2.01 0.14 -4.84 118.68 124.50 2qqv s LEU 89 Ca 0.02 2.62 0.27 0.00 0.01 0.00 0.00 54.13 57.05 2qqv s LEU 89 Cb -0.22 -4.62 1.46 0.00 0.01 0.00 0.00 46.19 42.82 2qqv s LEU 89 CO 0.02 -2.00 1.80 1.55 1.01 0.00 0.00 176.35 178.73 2qqv h PRO 90 N 0.56 0.00 -0.57 1.29 0.13 -1.99 0.37 132.00 131.79 2qqv h PRO 90 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2qqv h PRO 90 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2qqv h PRO 90 CO 0.53 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.57 2qqv n ASN 91 N -2.68 2.95 0.00 1.44 6.94 -1.26 -4.92 115.26 117.73 2qqv n ASN 91 Ca -0.02 -2.23 0.00 0.00 -0.02 0.00 0.00 54.58 52.31 2qqv n ASN 91 Cb 0.32 -0.43 0.00 0.00 -2.36 0.00 0.00 39.78 37.32 2qqv n ASN 91 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2qqv n GLY 92 N 0.86 3.17 3.71 4.83 0.00 0.13 -5.02 105.19 112.87 2qqv n GLY 92 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2qqv n GLY 92 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qqv s LYS 93 N -0.43 4.16 -0.01 1.61 2.47 -1.24 -4.71 119.74 121.58 2qqv s LYS 93 Ca 0.00 2.52 -0.10 0.00 -1.56 0.00 0.00 55.97 56.83 2qqv s LYS 93 Cb 0.00 -3.19 -0.05 0.00 -1.46 0.00 0.00 37.83 33.13 2qqv s LYS 93 CO 0.00 -0.72 0.32 -1.25 0.16 0.00 0.00 175.35 173.86 2qqv s PRO 94 N 1.43 3.71 0.06 4.03 0.04 -1.26 0.23 135.00 143.24 2qqv s PRO 94 Ca 0.74 0.14 0.04 0.00 0.04 0.00 0.00 61.00 61.96 2qqv s PRO 94 Cb -0.47 -3.14 -0.03 0.00 0.04 0.00 0.00 34.50 30.90 2qqv s PRO 94 CO 0.32 0.68 -0.11 0.14 0.04 0.00 0.00 177.00 178.07 2qqv s VAL 95 N -1.18 0.82 -0.14 -0.36 -7.23 0.24 -4.40 120.40 108.15 2qqv s VAL 95 Ca 0.24 -1.28 -0.00 0.00 -1.81 0.00 0.00 61.98 59.13 2qqv s VAL 95 Cb -0.14 -0.93 -0.01 0.00 0.56 0.00 0.00 36.38 35.85 2qqv s VAL 95 CO 0.13 -0.37 -0.13 -0.63 -0.31 0.00 0.00 175.10 173.80 2qqv s ILE 96 N -1.57 3.02 -0.23 -0.62 1.01 -0.11 -0.68 121.20 122.02 2qqv s ILE 96 Ca -0.04 -0.66 -0.08 0.00 0.00 0.00 0.00 60.65 59.87 2qqv s ILE 96 Cb -0.08 -2.28 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 2qqv s ILE 96 CO 0.01 0.51 0.07 -0.76 0.00 0.00 0.00 174.94 174.78 2qqv s LEU 97 N 0.53 3.60 0.12 2.97 1.43 -0.71 -0.91 118.68 125.72 2qqv s LEU 97 Ca -0.08 -0.10 0.02 0.00 -1.03 0.00 0.00 54.13 52.94 2qqv s LEU 97 Cb -0.16 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 2qqv s LEU 97 CO 0.04 0.04 -0.04 -0.72 0.23 0.00 0.00 176.35 175.89 2qqv s TYR 98 N 1.19 1.01 -0.20 0.29 -0.85 -0.31 -1.64 117.35 116.83 2qqv s TYR 98 Ca 0.05 -0.95 -0.17 0.00 -0.52 0.00 0.00 57.07 55.48 2qqv s TYR 98 Cb -0.14 -0.57 -0.04 0.00 0.38 0.00 0.00 41.96 41.59 2qqv s TYR 98 CO 0.04 -0.17 0.44 0.99 -1.52 0.00 0.00 175.55 175.33 2qqv s THR 99 N -3.63 5.17 0.18 -3.49 2.01 -1.02 -0.29 115.64 114.57 2qqv s THR 99 Ca 0.16 0.80 0.08 0.00 0.31 0.00 0.00 61.69 63.04 2qqv s THR 99 Cb 0.05 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 2qqv s THR 99 CO -0.02 0.23 -0.06 -0.83 -0.69 0.00 0.00 174.62 173.25 2qqv s GLY 100 N 1.08 1.73 -0.27 4.40 0.00 0.44 0.15 107.32 114.84 2qqv s GLY 100 Ca 0.21 -1.45 -0.08 0.00 0.00 0.00 0.00 44.72 43.40 2qqv s GLY 100 CO 0.09 -1.47 0.11 -0.42 0.00 0.00 0.00 173.10 171.41 2qqv s ILE 101 N -1.74 4.53 0.84 0.90 -1.09 -0.81 -1.37 121.20 122.46 2qqv s ILE 101 Ca 0.26 -0.19 -0.07 0.00 -2.23 0.00 0.00 60.65 58.41 2qqv s ILE 101 Cb -0.09 -3.18 0.17 0.00 -1.58 0.00 0.00 42.46 37.78 2qqv s ILE 101 CO 0.16 0.25 1.15 1.51 -1.23 0.00 0.00 174.94 176.78 2qqv s ASP 102 N 1.64 3.73 0.36 3.58 1.47 -0.95 -0.55 116.67 125.94 2qqv s ASP 102 Ca 0.06 -0.13 0.20 0.00 1.18 0.00 0.00 52.55 53.86 2qqv s ASP 102 Cb -0.16 -0.06 1.09 0.00 -0.34 0.00 0.00 42.92 43.45 2qqv s ASP 102 CO 0.05 -2.30 1.57 -0.65 0.68 0.00 0.00 175.17 174.53 2qqv h PRO 103 N -1.05 0.00 -0.47 2.11 0.11 -1.93 0.97 132.00 131.74 2qqv h PRO 103 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2qqv h PRO 103 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2qqv h PRO 103 CO 0.38 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.80 2qqv n LYS 104 N -2.25 2.91 -3.58 1.05 5.02 -1.26 -4.98 118.16 115.07 2qqv n LYS 104 Ca -0.01 -2.34 -0.23 0.00 -2.02 0.00 0.00 58.31 53.71 2qqv n LYS 104 Cb 0.16 -1.44 0.08 0.00 -0.02 0.00 0.00 35.03 33.81 2qqv n LYS 104 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2qqv n ASN 105 N 0.81 -5.19 -4.82 4.39 3.02 0.34 -5.02 115.26 108.78 2qqv n ASN 105 Ca 0.17 -0.58 -0.34 0.00 -0.03 0.00 0.00 54.58 53.80 2qqv n ASN 105 Cb 0.55 -4.98 -0.06 0.00 -0.61 0.00 0.00 39.78 34.67 2qqv n ASN 105 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2qqv s GLN 106 N -6.10 3.23 -0.45 3.52 -0.21 -1.26 -4.80 119.66 113.60 2qqv s GLN 106 Ca 0.44 -0.37 -0.24 0.00 0.02 0.00 0.00 55.36 55.21 2qqv s GLN 106 Cb -0.20 -2.98 0.02 0.00 1.00 0.00 0.00 33.01 30.86 2qqv s GLN 106 CO 0.74 0.68 0.84 -0.65 -2.12 0.00 0.00 175.29 174.78 2qqv s GLN 107 N -1.60 3.49 0.16 2.91 -0.21 -0.72 -2.23 119.66 121.46 2qqv s GLN 107 Ca 0.22 0.04 0.09 0.00 0.02 0.00 0.00 55.36 55.73 2qqv s GLN 107 Cb -0.12 -3.92 -0.04 0.00 1.00 0.00 0.00 33.01 29.93 2qqv s GLN 107 CO 0.13 -1.13 -0.19 0.14 -2.12 0.00 0.00 175.29 172.11 2qqv s VAL 108 N 3.45 1.86 -0.27 1.09 -7.23 -0.47 -4.54 120.40 114.29 2qqv s VAL 108 Ca 0.33 -1.90 -0.12 0.00 -1.81 0.00 0.00 61.98 58.47 2qqv s VAL 108 Cb -0.11 -1.85 -0.05 0.00 0.56 0.00 0.00 36.38 34.93 2qqv s VAL 108 CO 0.23 -0.28 0.25 -1.10 -0.31 0.00 0.00 175.10 173.90 2qqv s GLN 109 N -2.72 3.99 -0.03 4.82 1.11 0.18 -0.42 119.66 126.59 2qqv s GLN 109 Ca 0.15 -0.18 0.06 0.00 0.01 0.00 0.00 55.36 55.40 2qqv s GLN 109 Cb -0.06 -3.64 -0.02 0.00 -1.01 0.00 0.00 33.01 28.27 2qqv s GLN 109 CO 0.07 -0.18 -0.20 -0.80 0.01 0.00 0.00 175.29 174.18 2qqv s ASN 110 N 1.64 3.58 0.07 5.90 0.01 0.61 -1.12 114.94 125.62 2qqv s ASN 110 Ca 0.10 -0.34 -0.08 0.00 -0.71 0.00 0.00 52.86 51.83 2qqv s ASN 110 Cb -0.16 -0.60 -0.05 0.00 0.41 0.00 0.00 41.25 40.85 2qqv s ASN 110 CO 0.10 0.33 0.35 -0.51 -1.51 0.00 0.00 177.10 175.85 2qqv s ILE 111 N -0.70 5.18 -0.05 0.60 2.07 -1.26 -1.17 121.20 125.88 2qqv s ILE 111 Ca 0.11 0.26 -0.05 0.00 -1.41 0.00 0.00 60.65 59.55 2qqv s ILE 111 Cb -0.10 -3.61 0.01 0.00 0.13 0.00 0.00 42.46 38.89 2qqv s ILE 111 CO 0.00 0.26 0.15 0.00 -1.91 0.00 0.00 174.94 173.44 2qqv s ALA 112 N -1.42 -0.37 0.07 1.50 0.00 -0.09 -3.66 121.76 117.80 2qqv s ALA 112 Ca 0.33 0.36 0.02 0.00 0.00 0.00 0.00 51.96 52.67 2qqv s ALA 112 Cb -0.13 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 2qqv s ALA 112 CO 0.19 -0.09 -0.07 -1.83 0.00 0.00 0.00 175.76 173.97 2qqv s GLU 113 N -0.08 0.69 0.60 0.00 -1.05 -0.59 -0.93 118.70 117.33 2qqv s GLU 113 Ca -0.02 -1.09 -0.19 0.00 -0.15 0.00 0.00 54.97 53.52 2qqv s GLU 113 Cb -0.02 -0.19 -0.03 0.00 -0.44 0.00 0.00 34.13 33.45 2qqv s GLU 113 CO 0.00 -0.00 1.28 -2.14 0.95 0.00 0.00 175.26 175.35 2qqv s PRO 114 N -2.95 2.86 0.03 -4.83 0.02 -1.26 -0.26 135.00 128.60 2qqv s PRO 114 Ca 0.03 2.03 0.01 0.00 0.02 0.00 0.00 61.00 63.09 2qqv s PRO 114 Cb -0.01 -1.99 -0.26 0.00 0.02 0.00 0.00 34.50 32.27 2qqv s PRO 114 CO -0.03 -1.35 0.94 -0.22 -0.33 0.00 0.00 177.00 176.01 2qqv h LYS 115 N 0.92 0.16 -3.00 5.54 3.64 -1.57 -3.43 116.57 118.83 2qqv h LYS 115 Ca -0.51 -0.28 -0.58 0.00 -1.27 0.00 0.00 60.65 58.02 2qqv h LYS 115 Cb 1.31 0.10 -0.40 0.00 -0.41 0.00 0.00 32.23 32.84 2qqv h LYS 115 CO 0.55 1.01 -0.78 1.21 -2.27 0.00 0.00 179.45 179.17 2qqv s ASN 116 N -6.81 3.55 0.16 4.20 3.84 -1.26 -5.00 114.94 113.62 2qqv s ASN 116 Ca -0.06 -1.92 0.13 0.00 0.21 0.00 0.00 52.86 51.23 2qqv s ASN 116 Cb 0.08 -0.66 0.66 0.00 -0.55 0.00 0.00 41.25 40.78 2qqv s ASN 116 CO 0.84 -0.36 1.40 0.18 -2.79 0.00 0.00 177.10 176.38 2qqv n LEU 117 N 4.45 0.31 0.15 3.21 4.32 -1.26 -1.27 117.00 126.91 2qqv n LEU 117 Ca 0.03 0.63 0.11 0.00 -0.02 0.00 0.00 56.01 56.76 2qqv n LEU 117 Cb 0.39 -0.65 0.07 0.00 -1.62 0.00 0.00 43.42 41.62 2qqv n LEU 117 CO 0.13 -0.67 0.37 0.28 -1.22 0.00 0.00 177.39 176.28 2qqv h SER 118 N 0.00 0.00 -3.31 -1.43 0.02 -2.00 -3.43 113.55 103.40 2qqv h SER 118 Ca 0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 2qqv h SER 118 Cb 0.07 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.55 2qqv h SER 118 CO 0.00 0.04 1.03 -0.62 -1.14 0.00 0.00 176.83 176.13 2qqv s ASP 119 N -5.79 6.46 0.01 3.07 2.15 -0.39 -4.89 116.67 117.29 2qqv s ASP 119 Ca 0.03 0.87 0.23 0.00 0.43 0.00 0.00 52.55 54.11 2qqv s ASP 119 Cb 0.07 -2.54 0.97 0.00 -0.30 0.00 0.00 42.92 41.12 2qqv s ASP 119 CO 0.74 -1.33 1.73 -2.65 -0.17 0.00 0.00 175.17 173.49 2qqv n PRO 120 N 7.86 0.01 0.00 4.34 -0.02 -1.26 -2.04 135.00 143.89 2qqv n PRO 120 Ca 0.15 0.12 0.12 0.00 -2.02 0.00 0.00 63.50 61.87 2qqv n PRO 120 Cb 0.48 -1.51 0.15 0.00 -0.02 0.00 0.00 33.50 32.59 2qqv n PRO 120 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2qqv n TYR 121 N -1.53 0.00 -3.90 6.00 0.53 -1.26 -4.86 117.16 112.14 2qqv n TYR 121 Ca 0.05 0.00 -0.35 0.00 -1.02 0.00 0.00 57.90 56.59 2qqv n TYR 121 Cb 0.27 -0.05 0.01 0.00 -1.03 0.00 0.00 39.34 38.54 2qqv n TYR 121 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 2qqv n LEU 122 N -0.27 -1.28 -0.02 7.72 4.77 -0.87 -4.90 117.00 122.15 2qqv n LEU 122 Ca 0.10 -1.11 -0.13 0.00 -0.03 0.00 0.00 56.01 54.85 2qqv n LEU 122 Cb 0.42 -1.70 -0.10 0.00 -2.33 0.00 0.00 43.42 39.72 2qqv n LEU 122 CO 0.27 0.56 0.63 -0.09 -1.33 0.00 0.00 177.39 177.43 2qqv h ARG 123 N -1.43 0.04 -5.93 3.23 2.43 -1.91 -3.45 114.38 107.36 2qqv h ARG 123 Ca -0.66 -0.02 -0.68 0.00 -0.81 0.00 0.00 59.98 57.81 2qqv h ARG 123 Cb 1.39 0.00 -0.25 0.00 -0.42 0.00 0.00 29.97 30.69 2qqv h ARG 123 CO 0.44 0.52 -0.77 -1.21 -1.51 0.00 0.00 179.97 177.44 2qqv s GLU 124 N -4.24 2.84 -0.02 0.20 2.02 -1.26 -4.68 118.70 113.55 2qqv s GLU 124 Ca -0.16 -0.70 0.07 0.00 0.02 0.00 0.00 54.97 54.20 2qqv s GLU 124 Cb 0.02 -2.47 -0.02 0.00 0.10 0.00 0.00 34.13 31.77 2qqv s GLU 124 CO 0.68 0.46 -0.24 -1.58 0.02 0.00 0.00 175.26 174.60 2qqv s TRP 125 N -0.30 2.21 -0.09 1.61 0.52 -1.26 -1.38 118.94 120.25 2qqv s TRP 125 Ca 0.02 -0.46 -0.02 0.00 0.02 0.00 0.00 56.10 55.66 2qqv s TRP 125 Cb -0.13 -1.43 -0.03 0.00 -1.15 0.00 0.00 33.47 30.73 2qqv s TRP 125 CO 0.03 -0.07 0.01 -1.59 0.02 0.00 0.00 176.95 175.35 2qqv s LYS 126 N -0.50 3.02 -0.13 4.98 -2.85 0.64 -4.88 119.74 120.03 2qqv s LYS 126 Ca 0.07 -0.40 -0.05 0.00 -1.00 0.00 0.00 55.97 54.60 2qqv s LYS 126 Cb -0.10 -2.81 -0.04 0.00 -2.06 0.00 0.00 37.83 32.82 2qqv s LYS 126 CO -0.00 0.69 0.05 0.15 0.10 0.00 0.00 175.35 176.35 2qqv s LYS 127 N -0.85 3.43 0.07 1.78 1.02 -1.26 -1.54 119.74 122.38 2qqv s LYS 127 Ca 0.13 -0.32 -0.31 0.00 0.02 0.00 0.00 55.97 55.49 2qqv s LYS 127 Cb -0.11 -3.03 -0.07 0.00 -0.52 0.00 0.00 37.83 34.10 2qqv s LYS 127 CO 0.02 0.57 1.36 0.45 -0.92 0.00 0.00 175.35 176.83 2qqv s SER 128 N -0.49 6.88 0.00 2.83 0.15 -1.24 -4.88 113.70 116.95 2qqv s SER 128 Ca 0.10 2.20 0.08 0.00 0.70 0.00 0.00 55.95 59.02 2qqv s SER 128 Cb -0.12 -2.58 0.47 0.00 -1.71 0.00 0.00 66.02 62.09 2qqv s SER 128 CO 0.02 -0.64 0.91 -0.81 1.20 0.00 0.00 173.24 173.93 2qqv n PRO 129 N 4.41 0.26 0.00 5.44 -0.04 -1.26 -1.28 135.00 142.53 2qqv n PRO 129 Ca 0.12 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.71 2qqv n PRO 129 Cb 0.44 -1.47 0.42 0.00 -0.04 0.00 0.00 33.50 32.85 2qqv n PRO 129 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2qqv n LEU 130 N -0.97 0.92 -4.77 1.53 4.77 -1.26 -4.93 117.00 112.30 2qqv n LEU 130 Ca 0.06 -0.21 -0.39 0.00 -0.03 0.00 0.00 56.01 55.44 2qqv n LEU 130 Cb 0.03 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 40.97 2qqv n LEU 130 CO 0.04 0.17 0.92 0.20 -1.33 0.00 0.00 177.39 177.40 2qqv s ASN 131 N -2.50 6.37 0.25 -1.43 0.01 -0.41 -4.20 114.94 113.03 2qqv s ASN 131 Ca 0.25 2.56 -0.29 0.00 -0.71 0.00 0.00 52.86 54.67 2qqv s ASN 131 Cb 0.19 -2.63 -0.09 0.00 0.41 0.00 0.00 41.25 39.13 2qqv s ASN 131 CO 0.51 -0.80 0.93 -2.16 -1.51 0.00 0.00 177.10 174.08 2qqv s PRO 132 N -2.25 4.79 0.15 -0.60 0.04 -1.26 -4.78 135.00 131.09 2qqv s PRO 132 Ca 0.57 1.44 0.07 0.00 0.04 0.00 0.00 61.00 63.12 2qqv s PRO 132 Cb -0.36 -3.18 -0.10 0.00 0.04 0.00 0.00 34.50 30.90 2qqv s PRO 132 CO 0.46 0.47 1.34 -0.07 0.04 0.00 0.00 177.00 179.24 2qqv h LEU 133 N 3.96 0.04 -7.62 -3.56 4.07 -1.29 -3.44 115.31 107.47 2qqv h LEU 133 Ca -0.45 -0.04 -0.43 0.00 0.08 0.00 0.00 57.88 57.03 2qqv h LEU 133 Cb 1.20 -0.01 -0.36 0.00 1.08 0.00 0.00 40.66 42.56 2qqv h LEU 133 CO 0.67 0.95 -0.77 -0.04 -1.08 0.00 0.00 178.44 178.17 2qqv s MET 134 N -2.90 0.81 -0.04 1.13 -1.94 -1.10 -4.53 119.30 110.73 2qqv s MET 134 Ca 0.00 -0.03 -0.10 0.00 -1.71 0.00 0.00 55.69 53.85 2qqv s MET 134 Cb 0.10 -0.98 0.02 0.00 2.01 0.00 0.00 34.83 35.98 2qqv s MET 134 CO 0.81 -0.20 0.23 0.00 -0.01 0.00 0.00 175.02 175.86 2qqv s ALA 135 N 1.46 -0.58 0.62 3.03 0.00 -1.26 0.49 121.76 125.53 2qqv s ALA 135 Ca -0.02 0.33 -0.17 0.00 0.00 0.00 0.00 51.96 52.09 2qqv s ALA 135 Cb -0.13 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 2qqv s ALA 135 CO -0.03 -0.19 1.14 -1.25 0.00 0.00 0.00 175.76 175.43 2qqv s PRO 136 N -0.78 2.95 0.10 0.00 0.04 -1.26 -5.02 135.00 131.02 2qqv s PRO 136 Ca -0.09 1.57 -0.03 0.00 0.04 0.00 0.00 61.00 62.49 2qqv s PRO 136 Cb -0.05 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.55 2qqv s PRO 136 CO 0.02 -1.17 0.20 -0.40 0.04 0.00 0.00 177.00 175.69 2qqv n ASP 137 N -1.94 -0.57 0.15 6.66 3.85 -1.26 -5.02 116.55 118.42 2qqv n ASP 137 Ca 0.12 -1.42 0.02 0.00 -0.71 0.00 0.00 54.79 52.79 2qqv n ASP 137 Cb 0.51 0.95 0.21 0.00 -1.35 0.00 0.00 41.12 41.45 2qqv n ASP 137 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2qqv h ALA 138 N 1.96 0.92 0.14 2.12 0.00 -1.96 -2.75 119.26 119.69 2qqv h ALA 138 Ca -0.08 -0.48 -0.34 0.00 0.00 0.00 0.00 54.91 54.00 2qqv h ALA 138 Cb 0.32 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2qqv h ALA 138 CO 0.11 0.66 -1.77 -0.24 0.00 0.00 0.00 179.25 178.01 2qqv h VAL 139 N 0.00 0.89 0.00 0.00 3.04 -2.00 -3.36 116.25 114.82 2qqv h VAL 139 Ca -0.01 -2.54 -0.10 0.00 -1.01 0.00 0.00 66.70 63.04 2qqv h VAL 139 Cb 1.07 2.66 -0.01 0.00 -2.01 0.00 0.00 31.29 33.00 2qqv h VAL 139 CO 0.07 0.83 -0.47 -0.55 -1.01 0.00 0.00 177.57 176.44 2qqv h ASN 140 N 0.08 0.00 -1.51 3.17 7.08 -1.96 -3.47 115.58 118.97 2qqv h ASN 140 Ca -0.34 0.00 -0.31 0.00 -3.08 0.00 0.00 56.30 52.57 2qqv h ASN 140 Cb 2.06 0.00 -0.06 0.00 -2.08 0.00 0.00 38.32 38.23 2qqv h ASN 140 CO 0.14 0.47 -0.34 0.61 -2.08 0.00 0.00 177.43 176.23 2qqv n GLY 141 N 0.73 0.56 3.74 9.14 0.00 -1.04 -4.98 105.19 113.34 2qqv n GLY 141 Ca 0.01 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 2qqv n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqv s ILE 142 N -2.67 4.07 -0.30 -0.61 1.01 -1.26 -4.96 121.20 116.47 2qqv s ILE 142 Ca 0.00 1.78 -0.28 0.00 0.00 0.00 0.00 60.65 62.16 2qqv s ILE 142 Cb 0.00 -4.14 -0.05 0.00 0.01 0.00 0.00 42.46 38.28 2qqv s ILE 142 CO 0.00 0.31 2.19 0.21 0.00 0.00 0.00 174.94 177.65 2qqv s ASN 143 N -0.16 5.29 0.58 3.58 3.84 -1.26 -4.61 114.94 122.20 2qqv s ASN 143 Ca 0.48 1.59 0.27 0.00 0.21 0.00 0.00 52.86 55.41 2qqv s ASN 143 Cb -0.27 -2.51 1.72 0.00 -0.55 0.00 0.00 41.25 39.64 2qqv s ASN 143 CO 0.33 -2.14 2.23 0.00 -2.79 0.00 0.00 177.10 174.73 2qqv h ALA 144 N 15.72 1.63 -0.01 1.71 0.00 -1.94 -1.76 119.26 134.62 2qqv h ALA 144 Ca -0.36 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2qqv h ALA 144 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2qqv h ALA 144 CO 1.02 -0.02 -0.17 0.45 0.00 0.00 0.00 179.25 180.53 2qqv n SER 145 N -3.97 1.61 -3.24 0.00 2.88 -1.26 -1.75 113.62 107.89 2qqv n SER 145 Ca -0.03 -1.34 -0.22 0.00 -1.33 0.00 0.00 58.87 55.95 2qqv n SER 145 Cb 0.10 0.13 -0.07 0.00 -0.75 0.00 0.00 64.21 63.61 2qqv n SER 145 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2qqv n SER 146 N -0.01 -0.99 -2.83 -3.46 7.64 -0.66 -4.96 113.62 108.36 2qqv n SER 146 Ca 0.14 -2.53 -0.10 0.00 1.01 0.00 0.00 58.87 57.39 2qqv n SER 146 Cb 0.40 -0.10 0.02 0.00 -1.01 0.00 0.00 64.21 63.53 2qqv n SER 146 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 2qqv n PHE 147 N 2.64 -2.98 -4.22 1.43 7.35 -1.24 -3.61 117.46 116.83 2qqv n PHE 147 Ca 0.26 -1.97 -0.13 0.00 -0.76 0.00 0.00 57.45 54.85 2qqv n PHE 147 Cb 0.50 1.27 -0.10 0.00 0.35 0.00 0.00 39.48 41.51 2qqv n PHE 147 CO 0.00 0.00 0.00 -0.98 -0.76 0.00 0.00 176.76 175.02 2qqv s ARG 148 N 0.46 1.29 -0.48 -4.13 1.70 -0.74 -4.42 118.95 112.63 2qqv s ARG 148 Ca 0.32 -1.70 -0.00 0.00 -0.47 0.00 0.00 55.73 53.88 2qqv s ARG 148 Cb 0.18 0.27 -0.01 0.00 -0.57 0.00 0.00 34.95 34.83 2qqv s ARG 148 CO -0.20 -0.43 0.45 -0.25 -1.08 0.00 0.00 175.30 173.79 2qqv n ASP 149 N -0.48 -5.52 -4.76 -2.89 8.00 -1.26 -1.97 116.55 107.66 2qqv n ASP 149 Ca 0.03 -0.09 -0.40 0.00 0.71 0.00 0.00 54.79 55.04 2qqv n ASP 149 Cb 0.65 -3.65 -0.03 0.00 -0.02 0.00 0.00 41.12 38.07 2qqv n ASP 149 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2qqv s PRO 150 N -3.10 4.44 0.87 -0.24 0.04 -1.26 -3.93 135.00 131.82 2qqv s PRO 150 Ca 0.03 1.85 -0.10 0.00 0.04 0.00 0.00 61.00 62.82 2qqv s PRO 150 Cb -0.00 -3.02 0.17 0.00 0.04 0.00 0.00 34.50 31.69 2qqv s PRO 150 CO 0.46 0.02 1.20 0.95 0.04 0.00 0.00 177.00 179.67 2qqv s THR 151 N -1.25 2.05 0.24 1.26 -4.23 -0.89 -3.11 115.64 109.71 2qqv s THR 151 Ca 0.49 -0.21 -0.30 0.00 -1.18 0.00 0.00 61.69 60.48 2qqv s THR 151 Cb -0.32 -2.83 -0.10 0.00 1.34 0.00 0.00 72.50 70.58 2qqv s THR 151 CO 0.41 0.00 1.51 -0.89 -0.54 0.00 0.00 174.62 175.11 2qqv s THR 152 N -3.62 2.50 0.07 3.99 2.01 -1.26 -4.68 115.64 114.66 2qqv s THR 152 Ca 0.71 0.40 -0.17 0.00 0.31 0.00 0.00 61.69 62.94 2qqv s THR 152 Cb -0.04 -3.26 -0.06 0.00 0.01 0.00 0.00 72.50 69.14 2qqv s THR 152 CO 0.50 0.06 0.52 0.00 -0.69 0.00 0.00 174.62 175.01 2qqv s ALA 153 N 0.28 3.61 0.08 7.40 0.00 -1.26 -4.82 121.76 127.06 2qqv s ALA 153 Ca 0.63 -0.07 0.09 0.00 0.00 0.00 0.00 51.96 52.61 2qqv s ALA 153 Cb -0.44 -2.54 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 2qqv s ALA 153 CO 0.41 0.43 -0.22 1.67 0.00 0.00 0.00 175.76 178.06 2qqv s TRP 154 N -1.19 2.45 -0.25 0.00 -2.14 -0.34 -4.88 118.94 112.58 2qqv s TRP 154 Ca 0.30 -0.32 -0.10 0.00 2.66 0.00 0.00 56.10 58.64 2qqv s TRP 154 Cb -0.18 -1.37 -0.05 0.00 -3.10 0.00 0.00 33.47 28.78 2qqv s TRP 154 CO 0.18 0.29 0.16 -1.17 -2.66 0.00 0.00 176.95 173.75 2qqv s LEU 155 N -1.74 4.05 0.00 -4.66 2.96 -1.26 0.04 118.68 118.06 2qqv s LEU 155 Ca 0.15 0.05 -0.13 0.00 -0.22 0.00 0.00 54.13 53.98 2qqv s LEU 155 Cb -0.10 -2.10 0.20 0.00 0.50 0.00 0.00 46.19 44.68 2qqv s LEU 155 CO 0.06 0.02 1.19 0.61 -1.32 0.00 0.00 176.35 176.92 2qqv n GLY 156 N 4.57 -1.11 0.00 7.98 0.00 -0.39 -4.83 105.19 111.41 2qqv n GLY 156 Ca -0.15 -1.76 0.13 0.00 0.00 0.00 0.00 46.02 44.24 2qqv n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqv n GLN 157 N -3.48 0.23 -1.05 1.61 -0.00 -1.26 -2.75 117.38 110.67 2qqv n GLN 157 Ca 0.16 0.04 -0.14 0.00 -0.00 0.00 0.00 57.00 57.06 2qqv n GLN 157 Cb 0.54 -1.50 0.22 0.00 -0.00 0.00 0.00 30.24 29.50 2qqv n GLN 157 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 2qqv n ASP 158 N -1.37 3.78 -1.30 2.61 5.75 -1.26 -4.94 116.55 119.81 2qqv n ASP 158 Ca 0.10 -3.52 -0.15 0.00 -0.01 0.00 0.00 54.79 51.22 2qqv n ASP 158 Cb 0.25 -0.76 -0.06 0.00 -1.03 0.00 0.00 41.12 39.52 2qqv n ASP 158 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2qqv n LYS 159 N -0.86 -1.45 -4.49 0.11 5.02 -1.11 -4.97 118.16 110.42 2qqv n LYS 159 Ca 0.48 0.91 -0.34 0.00 -2.02 0.00 0.00 58.31 57.34 2qqv n LYS 159 Cb 1.44 -5.20 -0.11 0.00 -0.02 0.00 0.00 35.03 31.14 2qqv n LYS 159 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2qqv s LYS 160 N -3.19 3.10 0.28 1.97 1.02 -1.26 -4.74 119.74 116.91 2qqv s LYS 160 Ca 0.00 -0.50 -0.29 0.00 0.02 0.00 0.00 55.97 55.20 2qqv s LYS 160 Cb 0.00 -2.74 -0.09 0.00 -0.52 0.00 0.00 37.83 34.47 2qqv s LYS 160 CO 0.00 0.54 1.05 -1.58 -0.92 0.00 0.00 175.35 174.45 2qqv s TRP 161 N -0.47 3.65 -0.02 3.18 0.52 0.40 -1.27 118.94 124.93 2qqv s TRP 161 Ca 0.07 1.75 0.06 0.00 0.02 0.00 0.00 56.10 58.00 2qqv s TRP 161 Cb -0.12 -3.19 -0.01 0.00 -1.15 0.00 0.00 33.47 28.99 2qqv s TRP 161 CO 0.02 -0.31 -0.20 1.03 0.02 0.00 0.00 176.95 177.51 2qqv s ARG 162 N -1.50 1.70 -0.06 4.98 1.81 0.11 -1.59 118.95 124.40 2qqv s ARG 162 Ca 0.45 -0.72 -0.10 0.00 -1.72 0.00 0.00 55.73 53.64 2qqv s ARG 162 Cb -0.29 -1.62 0.02 0.00 -0.45 0.00 0.00 34.95 32.61 2qqv s ARG 162 CO 0.37 0.42 0.24 0.54 -0.68 0.00 0.00 175.30 176.19 2qqv s VAL 163 N -0.42 0.03 0.07 3.52 0.11 -0.99 -1.20 120.40 121.52 2qqv s VAL 163 Ca 0.06 -0.24 0.06 0.00 -2.93 0.00 0.00 61.98 58.93 2qqv s VAL 163 Cb -0.08 -0.42 -0.04 0.00 -1.53 0.00 0.00 36.38 34.31 2qqv s VAL 163 CO -0.00 -0.13 -0.10 0.27 -3.33 0.00 0.00 175.10 171.80 2qqv s ILE 164 N -0.47 3.36 -0.08 7.04 -4.36 -1.26 -0.31 121.20 125.11 2qqv s ILE 164 Ca -0.06 -1.12 0.02 0.00 -0.26 0.00 0.00 60.65 59.23 2qqv s ILE 164 Cb -0.04 -2.52 0.01 0.00 1.25 0.00 0.00 42.46 41.17 2qqv s ILE 164 CO 0.01 0.22 -0.15 -0.63 0.24 0.00 0.00 174.94 174.64 2qqv s ILE 165 N -1.11 1.37 0.24 8.37 1.09 -0.24 -2.09 121.20 128.83 2qqv s ILE 165 Ca 0.19 -0.60 -0.30 0.00 -1.10 0.00 0.00 60.65 58.84 2qqv s ILE 165 Cb -0.11 -1.24 -0.09 0.00 -1.06 0.00 0.00 42.46 39.96 2qqv s ILE 165 CO 0.11 0.41 1.27 -0.83 -0.10 0.00 0.00 174.94 175.80 2qqv s GLY 166 N 0.72 2.66 0.00 6.18 0.00 -0.83 -2.21 107.32 113.84 2qqv s GLY 166 Ca -0.13 1.10 -0.00 0.00 0.00 0.00 0.00 44.72 45.69 2qqv s GLY 166 CO 0.03 1.95 0.00 -1.26 0.00 0.00 0.00 173.10 173.83 2qqv n SER 167 N 2.06 -0.01 -3.53 1.64 2.88 -0.91 -1.79 113.62 113.96 2qqv n SER 167 Ca 0.04 -1.01 -0.15 0.00 -1.33 0.00 0.00 58.87 56.42 2qqv n SER 167 Cb 0.43 0.02 -0.05 0.00 -0.75 0.00 0.00 64.21 63.86 2qqv n SER 167 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2qqv s LYS 168 N -2.00 0.92 -0.18 -1.46 -2.85 -1.24 -2.50 119.74 110.43 2qqv s LYS 168 Ca 0.00 0.16 -0.04 0.00 -1.00 0.00 0.00 55.97 55.09 2qqv s LYS 168 Cb -0.00 0.43 0.06 0.00 -2.06 0.00 0.00 37.83 36.26 2qqv s LYS 168 CO 0.00 -0.30 0.08 0.96 0.10 0.00 0.00 175.35 176.19 2qqv s ILE 169 N -1.39 0.05 -0.69 3.79 -4.36 -0.38 -4.48 121.20 113.74 2qqv s ILE 169 Ca -0.07 -0.28 -0.08 0.00 -0.26 0.00 0.00 60.65 59.97 2qqv s ILE 169 Cb -0.00 -0.69 0.01 0.00 1.25 0.00 0.00 42.46 43.02 2qqv s ILE 169 CO 0.05 -0.28 0.65 1.41 0.24 0.00 0.00 174.94 177.00 2qqv n HIS 170 N 5.23 -2.69 -1.00 1.37 8.25 -1.26 -2.41 115.22 122.70 2qqv n HIS 170 Ca -0.07 1.07 -0.02 0.00 -0.26 0.00 0.00 57.72 58.44 2qqv n HIS 170 Cb 0.48 -3.32 -0.01 0.00 1.12 0.00 0.00 29.99 28.27 2qqv n HIS 170 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2qqv n ARG 171 N -1.64 -1.94 -3.77 -0.41 1.74 -1.26 -4.90 116.66 104.47 2qqv n ARG 171 Ca -0.11 0.54 -0.37 0.00 -0.77 0.00 0.00 57.85 57.14 2qqv n ARG 171 Cb 0.59 -4.92 -0.13 0.00 -1.02 0.00 0.00 32.46 26.98 2qqv n ARG 171 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2qqv s ARG 172 N -2.06 3.31 0.16 5.56 3.52 -1.01 -1.12 118.95 127.31 2qqv s ARG 172 Ca 0.00 -0.70 -0.27 0.00 -0.13 0.00 0.00 55.73 54.63 2qqv s ARG 172 Cb 0.00 -3.32 -0.08 0.00 -1.56 0.00 0.00 34.95 29.99 2qqv s ARG 172 CO 0.00 -0.33 0.83 0.20 -0.81 0.00 0.00 175.30 175.18 2qqv s GLY 173 N 1.54 2.96 -0.03 8.12 0.00 -0.48 -1.25 107.32 118.17 2qqv s GLY 173 Ca 0.04 0.43 -0.14 0.00 0.00 0.00 0.00 44.72 45.04 2qqv s GLY 173 CO 0.02 1.01 0.31 0.48 0.00 0.00 0.00 173.10 174.93 2qqv s LEU 174 N -0.93 0.84 -0.60 0.66 0.05 -1.17 -0.55 118.68 116.98 2qqv s LEU 174 Ca 0.38 0.15 -0.11 0.00 0.05 0.00 0.00 54.13 54.60 2qqv s LEU 174 Cb -0.23 1.26 0.15 0.00 -2.05 0.00 0.00 46.19 45.32 2qqv s LEU 174 CO 0.27 -0.41 0.50 0.00 -0.55 0.00 0.00 176.35 176.16 2qqv s ALA 175 N -1.17 3.66 -0.15 1.48 0.00 -0.70 -2.15 121.76 122.73 2qqv s ALA 175 Ca -0.12 -2.86 -0.29 0.00 0.00 0.00 0.00 51.96 48.68 2qqv s ALA 175 Cb -0.05 -3.07 -0.03 0.00 0.00 0.00 0.00 23.12 19.97 2qqv s ALA 175 CO 0.04 -2.06 1.47 0.42 0.00 0.00 0.00 175.76 175.63 2qqv s ILE 176 N 0.86 3.91 -0.01 0.00 1.01 -0.94 -1.76 121.20 124.28 2qqv s ILE 176 Ca 0.10 1.09 -0.13 0.00 0.00 0.00 0.00 60.65 61.71 2qqv s ILE 176 Cb -0.22 -3.76 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 2qqv s ILE 176 CO -0.03 -0.16 0.36 0.28 0.00 0.00 0.00 174.94 175.39 2qqv s THR 177 N 4.08 5.11 0.18 2.92 -1.32 -1.26 -1.08 115.64 124.27 2qqv s THR 177 Ca 0.65 0.68 0.11 0.00 -1.21 0.00 0.00 61.69 61.92 2qqv s THR 177 Cb -0.26 -3.65 -0.04 0.00 -1.51 0.00 0.00 72.50 67.03 2qqv s THR 177 CO 0.23 0.54 -0.25 -0.31 -2.21 0.00 0.00 174.62 172.63 2qqv s TYR 178 N -1.12 2.28 0.02 9.09 1.51 0.57 -1.60 117.35 128.10 2qqv s TYR 178 Ca 0.24 -0.37 0.08 0.00 -1.01 0.00 0.00 57.07 56.01 2qqv s TYR 178 Cb -0.16 -1.16 -0.02 0.00 -0.11 0.00 0.00 41.96 40.51 2qqv s TYR 178 CO 0.13 0.45 -0.23 0.95 -1.11 0.00 0.00 175.55 175.75 2qqv s THR 179 N -1.53 1.80 -0.01 -0.71 -4.23 0.68 -2.35 115.64 109.30 2qqv s THR 179 Ca 0.19 -1.14 -0.16 0.00 -1.18 0.00 0.00 61.69 59.39 2qqv s THR 179 Cb -0.08 -1.54 0.03 0.00 1.34 0.00 0.00 72.50 72.25 2qqv s THR 179 CO 0.09 0.36 0.35 -0.55 -0.54 0.00 0.00 174.62 174.32 2qqv s SER 180 N -0.93 -0.23 0.00 3.99 0.15 -0.62 -0.91 113.70 115.15 2qqv s SER 180 Ca 0.09 0.10 0.03 0.00 0.70 0.00 0.00 55.95 56.87 2qqv s SER 180 Cb -0.09 0.35 0.07 0.00 -1.71 0.00 0.00 66.02 64.63 2qqv s SER 180 CO 0.01 -0.50 0.93 2.29 1.20 0.00 0.00 173.24 177.17 2qqv n LYS 181 N 1.10 1.92 0.00 5.44 0.00 -1.26 0.15 118.16 125.51 2qqv n LYS 181 Ca -0.21 -1.37 0.00 0.00 -0.00 0.00 0.00 58.31 56.74 2qqv n LYS 181 Cb 0.57 -1.07 0.00 0.00 -0.00 0.00 0.00 35.03 34.53 2qqv n LYS 181 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2qqv n ASP 182 N -0.11 0.00 -2.78 -5.58 3.85 -1.26 -4.96 116.55 105.72 2qqv n ASP 182 Ca 0.03 -0.43 -0.19 0.00 -0.71 0.00 0.00 54.79 53.50 2qqv n ASP 182 Cb 0.23 0.00 0.05 0.00 -1.35 0.00 0.00 41.12 40.05 2qqv n ASP 182 CO 0.00 0.00 0.00 0.33 -1.01 0.00 0.00 177.20 176.52 2qqv n PHE 183 N 0.00 -2.05 0.00 2.11 7.35 -1.26 -4.82 117.46 118.79 2qqv n PHE 183 Ca 0.00 0.67 0.00 0.00 -0.76 0.00 0.00 57.45 57.36 2qqv n PHE 183 Cb 0.11 -4.07 0.00 0.00 0.35 0.00 0.00 39.48 35.87 2qqv n PHE 183 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 2qqv n LEU 184 N -3.80 0.00 -4.24 -2.13 -0.00 -1.26 -5.03 117.00 100.54 2qqv n LEU 184 Ca -0.03 0.00 -0.38 0.00 -0.00 0.00 0.00 56.01 55.60 2qqv n LEU 184 Cb 0.56 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.87 2qqv n LEU 184 CO 0.47 0.00 -0.21 -0.75 -0.00 0.00 0.00 177.39 176.89 2qqv s LYS 185 N -1.00 2.51 -0.24 1.96 2.47 -1.26 -4.94 119.74 119.23 2qqv s LYS 185 Ca 0.00 -1.35 -0.06 0.00 -1.56 0.00 0.00 55.97 53.00 2qqv s LYS 185 Cb 0.00 -3.53 -0.01 0.00 -1.46 0.00 0.00 37.83 32.82 2qqv s LYS 185 CO 0.00 -0.79 0.02 -1.58 0.16 0.00 0.00 175.35 173.16 2qqv s TRP 186 N 1.36 3.04 -0.10 4.03 0.52 -1.26 -4.43 118.94 122.09 2qqv s TRP 186 Ca 0.01 -0.74 -0.03 0.00 0.02 0.00 0.00 56.10 55.36 2qqv s TRP 186 Cb -0.21 -2.18 -0.03 0.00 -1.15 0.00 0.00 33.47 29.89 2qqv s TRP 186 CO 0.01 -0.48 0.03 -1.21 0.02 0.00 0.00 176.95 175.33 2qqv s GLU 187 N 1.54 3.19 0.01 4.98 2.02 -0.08 -4.91 118.70 125.44 2qqv s GLU 187 Ca 0.06 -0.36 -0.30 0.00 0.02 0.00 0.00 54.97 54.39 2qqv s GLU 187 Cb -0.15 -2.91 -0.05 0.00 0.10 0.00 0.00 34.13 31.11 2qqv s GLU 187 CO 0.00 0.65 1.34 0.21 0.02 0.00 0.00 175.26 177.49 2qqv s LYS 188 N -0.73 4.31 0.35 1.61 2.20 -1.26 -0.23 119.74 125.99 2qqv s LYS 188 Ca 0.12 1.91 -0.28 0.00 -0.36 0.00 0.00 55.97 57.36 2qqv s LYS 188 Cb -0.12 -3.51 -0.10 0.00 -1.51 0.00 0.00 37.83 32.60 2qqv s LYS 188 CO 0.02 -0.50 1.28 -1.12 -0.36 0.00 0.00 175.35 174.67 2qqv s SER 189 N 1.64 6.70 0.33 1.43 0.01 -0.63 -4.91 113.70 118.27 2qqv s SER 189 Ca 0.62 2.63 0.08 0.00 1.31 0.00 0.00 55.95 60.59 2qqv s SER 189 Cb -0.31 -2.64 0.79 0.00 0.21 0.00 0.00 66.02 64.07 2qqv s SER 189 CO 0.26 -0.58 1.82 -0.65 0.41 0.00 0.00 173.24 174.50 2qqv h PRO 190 N 3.21 0.70 -6.25 12.44 0.11 -1.95 -3.42 132.00 136.85 2qqv h PRO 190 Ca -0.49 -0.04 -0.59 0.00 0.11 0.00 0.00 66.00 64.99 2qqv h PRO 190 Cb 1.23 -0.16 -0.23 0.00 0.11 0.00 0.00 31.00 31.95 2qqv h PRO 190 CO 0.65 0.46 -0.84 -1.21 -0.21 0.00 0.00 178.00 176.85 2qqv s GLU 191 N -5.76 1.28 0.76 1.05 2.02 -1.26 -5.13 118.70 111.67 2qqv s GLU 191 Ca -0.10 -1.10 -0.12 0.00 0.02 0.00 0.00 54.97 53.67 2qqv s GLU 191 Cb 0.24 -1.52 0.06 0.00 0.10 0.00 0.00 34.13 33.01 2qqv s GLU 191 CO 0.80 0.37 1.11 -1.25 0.02 0.00 0.00 175.26 176.31 2qqv s PRO 192 N -1.63 2.18 0.18 0.39 0.04 -1.26 -4.60 135.00 130.31 2qqv s PRO 192 Ca 0.08 1.33 -0.12 0.00 0.04 0.00 0.00 61.00 62.33 2qqv s PRO 192 Cb -0.10 -1.88 0.09 0.00 0.04 0.00 0.00 34.50 32.66 2qqv s PRO 192 CO 0.03 -1.72 1.77 1.25 0.04 0.00 0.00 177.00 178.37 2qqv h LEU 193 N -0.90 0.83 -7.47 -3.56 5.85 -1.56 -3.46 115.31 105.04 2qqv h LEU 193 Ca -0.45 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.15 2qqv h LEU 193 Cb 1.25 -0.21 -0.09 0.00 0.37 0.00 0.00 40.66 41.97 2qqv h LEU 193 CO 0.50 0.73 0.17 -2.28 -0.34 0.00 0.00 178.44 177.22 2qqv s HIS 194 N -5.71 -0.33 0.15 1.25 2.46 -1.26 -0.93 115.29 110.93 2qqv s HIS 194 Ca -0.13 0.01 -0.16 0.00 0.47 0.00 0.00 55.06 55.25 2qqv s HIS 194 Cb 0.13 0.56 0.03 0.00 -0.13 0.00 0.00 32.58 33.17 2qqv s HIS 194 CO 0.79 -0.98 0.43 1.52 -2.47 0.00 0.00 174.74 174.03 2qqv s TYR 195 N -3.83 -0.12 -0.16 3.88 -0.85 -1.26 -1.73 117.35 113.28 2qqv s TYR 195 Ca 0.06 -0.21 -0.07 0.00 -0.52 0.00 0.00 57.07 56.33 2qqv s TYR 195 Cb -0.02 0.27 0.07 0.00 0.38 0.00 0.00 41.96 42.66 2qqv s TYR 195 CO -0.05 -0.77 0.35 0.34 -1.52 0.00 0.00 175.55 173.90 2qqv s ASP 196 N -2.84 -0.15 0.18 -0.18 2.15 0.29 -4.96 116.67 111.16 2qqv s ASP 196 Ca 0.06 0.81 -0.30 0.00 0.43 0.00 0.00 52.55 53.55 2qqv s ASP 196 Cb 0.01 0.92 -0.08 0.00 -0.30 0.00 0.00 42.92 43.48 2qqv s ASP 196 CO -0.08 -0.22 1.01 -1.81 -0.17 0.00 0.00 175.17 173.90 2qqv s ASP 197 N 2.11 7.45 0.00 -0.34 -0.00 -1.26 -1.39 116.67 123.25 2qqv s ASP 197 Ca -0.04 1.96 0.00 0.00 -0.00 0.00 0.00 52.55 54.48 2qqv s ASP 197 Cb -0.11 -2.60 0.00 0.00 -0.00 0.00 0.00 42.92 40.21 2qqv s ASP 197 CO -0.11 -0.05 0.00 0.61 -0.00 0.00 0.00 175.17 175.62 2qqv n GLY 198 N 1.88 3.03 3.77 0.21 0.00 -0.27 -4.97 105.19 108.83 2qqv n GLY 198 Ca 0.01 -0.81 -0.40 0.00 0.00 0.00 0.00 46.02 44.82 2qqv n GLY 198 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qqv s SER 199 N 0.00 6.71 0.00 1.61 1.04 -1.25 -4.87 113.70 116.94 2qqv s SER 199 Ca 0.00 2.66 0.00 0.00 0.48 0.00 0.00 55.95 59.09 2qqv s SER 199 Cb 0.00 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.47 2qqv s SER 199 CO 0.00 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.25 2qqv n GLY 200 N 0.78 -0.29 3.74 7.32 0.00 -1.26 -2.61 105.19 112.88 2qqv n GLY 200 Ca 0.01 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 2qqv n GLY 200 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2qqv s MET 201 N 0.00 4.28 -1.15 1.61 1.75 -1.26 -3.08 119.30 121.45 2qqv s MET 201 Ca 0.00 2.27 -0.08 0.00 -1.25 0.00 0.00 55.69 56.64 2qqv s MET 201 Cb 0.00 -3.13 0.25 0.00 2.84 0.00 0.00 34.83 34.80 2qqv s MET 201 CO 0.00 -0.42 1.48 0.91 -0.65 0.00 0.00 175.02 176.34 2qqv n TRP 202 N 2.55 3.45 -1.71 4.11 7.02 -1.04 -2.87 117.44 128.94 2qqv n TRP 202 Ca 0.07 -3.03 -0.29 0.00 -1.02 0.00 0.00 57.50 53.23 2qqv n TRP 202 Cb 0.40 -1.63 0.10 0.00 -2.42 0.00 0.00 31.31 27.77 2qqv n TRP 202 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2qqv s ALA 203 N -1.22 2.31 -0.43 6.99 0.00 -0.36 -3.60 121.76 125.45 2qqv s ALA 203 Ca 0.34 -0.50 -0.04 0.00 0.00 0.00 0.00 51.96 51.77 2qqv s ALA 203 Cb 0.01 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 20.12 2qqv s ALA 203 CO 0.03 -1.83 0.29 0.00 0.00 0.00 0.00 175.76 174.25 2qqv s PRO 205 N -4.00 2.52 -0.20 0.00 0.04 -1.26 -3.58 135.00 128.52 2qqv s PRO 205 Ca 0.05 0.79 -0.18 0.00 0.04 0.00 0.00 61.00 61.69 2qqv s PRO 205 Cb -0.03 -1.96 0.05 0.00 0.04 0.00 0.00 34.50 32.61 2qqv s PRO 205 CO 0.44 -1.35 0.53 0.34 0.04 0.00 0.00 177.00 176.99 2qqv s ASP 206 N -3.86 -0.56 -0.08 6.66 -1.08 0.07 -4.71 116.67 113.10 2qqv s ASP 206 Ca 0.59 1.07 -0.03 0.00 -0.52 0.00 0.00 52.55 53.67 2qqv s ASP 206 Cb -0.14 1.08 0.04 0.00 -1.46 0.00 0.00 42.92 42.44 2qqv s ASP 206 CO 0.55 -0.19 0.10 0.12 0.52 0.00 0.00 175.17 176.27 2qqv s PHE 207 N 0.35 -0.01 -0.06 -5.34 5.36 -1.26 -0.81 117.98 116.21 2qqv s PHE 207 Ca -0.01 0.30 -0.21 0.00 -0.96 0.00 0.00 56.93 56.05 2qqv s PHE 207 Cb -0.04 -0.43 0.04 0.00 -0.34 0.00 0.00 43.02 42.25 2qqv s PHE 207 CO -0.00 -0.27 0.47 -0.59 -1.46 0.00 0.00 175.22 173.37 2qqv s PHE 208 N 2.21 -0.41 0.43 10.12 -0.12 -1.01 -4.95 117.98 124.24 2qqv s PHE 208 Ca 0.04 0.76 -0.08 0.00 -0.05 0.00 0.00 56.93 57.60 2qqv s PHE 208 Cb -0.13 0.22 -0.05 0.00 -0.63 0.00 0.00 43.02 42.43 2qqv s PHE 208 CO -0.05 -0.44 0.76 -1.25 -0.05 0.00 0.00 175.22 174.19 2qqv s PRO 209 N -0.99 3.68 -0.01 1.99 0.04 -1.26 -1.06 135.00 137.39 2qqv s PRO 209 Ca -0.10 0.35 -0.05 0.00 0.04 0.00 0.00 61.00 61.24 2qqv s PRO 209 Cb -0.03 -2.40 0.00 0.00 0.04 0.00 0.00 34.50 32.11 2qqv s PRO 209 CO 0.06 -0.09 0.10 0.14 0.04 0.00 0.00 177.00 177.24 2qqv s VAL 210 N -2.50 0.06 0.40 -0.36 -7.23 0.99 -4.41 120.40 107.35 2qqv s VAL 210 Ca 0.49 -0.51 -0.24 0.00 -1.81 0.00 0.00 61.98 59.91 2qqv s VAL 210 Cb -0.10 -0.31 -0.09 0.00 0.56 0.00 0.00 36.38 36.44 2qqv s VAL 210 CO 0.36 -0.28 1.10 0.42 -0.31 0.00 0.00 175.10 176.39 2qqv s THR 211 N -0.93 3.46 0.22 5.32 -4.23 -1.26 -0.51 115.64 117.71 2qqv s THR 211 Ca -0.10 1.16 -0.05 0.00 -1.18 0.00 0.00 61.69 61.52 2qqv s THR 211 Cb -0.06 -3.62 0.07 0.00 1.34 0.00 0.00 72.50 70.23 2qqv s THR 211 CO 0.01 0.05 1.67 -0.09 -0.54 0.00 0.00 174.62 175.72 2qqv h ARG 212 N 2.54 0.89 -3.97 3.99 9.65 -1.72 -3.42 114.38 122.35 2qqv h ARG 212 Ca -0.48 -0.29 -0.51 0.00 -1.10 0.00 0.00 59.98 57.59 2qqv h ARG 212 Cb 1.22 -0.08 -0.38 0.00 -1.39 0.00 0.00 29.97 29.35 2qqv h ARG 212 CO 0.62 0.93 -0.78 -0.06 2.80 0.00 0.00 179.97 183.48 2qqv s PHE 213 N -4.87 1.26 0.00 2.20 0.40 -1.26 -4.67 117.98 111.04 2qqv s PHE 213 Ca -0.10 -0.70 0.00 0.00 -0.60 0.00 0.00 56.93 55.53 2qqv s PHE 213 Cb 0.14 -1.11 0.00 0.00 0.51 0.00 0.00 43.02 42.56 2qqv s PHE 213 CO 0.84 -0.51 0.00 0.41 0.70 0.00 0.00 175.22 176.66 2qqv n GLY 214 N 4.99 3.99 0.07 4.36 0.00 -1.26 -4.98 105.19 112.37 2qqv n GLY 214 Ca -0.10 -1.28 0.11 0.00 0.00 0.00 0.00 46.02 44.75 2qqv n GLY 214 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qqv n SER 215 N 0.00 0.51 -4.78 1.61 7.64 -1.26 -4.39 113.62 112.96 2qqv n SER 215 Ca 0.00 0.18 -0.37 0.00 1.01 0.00 0.00 58.87 59.70 2qqv n SER 215 Cb 0.00 1.06 -0.03 0.00 -1.01 0.00 0.00 64.21 64.23 2qqv n SER 215 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2qqv s ASN 216 N -4.99 6.63 0.70 6.43 0.02 -1.26 -4.69 114.94 117.77 2qqv s ASN 216 Ca -0.03 2.13 -0.11 0.00 -1.02 0.00 0.00 52.86 53.82 2qqv s ASN 216 Cb 0.11 -2.59 0.01 0.00 0.02 0.00 0.00 41.25 38.80 2qqv s ASN 216 CO 0.84 -0.58 1.06 -0.83 0.02 0.00 0.00 177.10 177.60 2qqv s GLY 217 N -1.47 1.66 -0.05 0.66 0.00 0.15 -4.66 107.32 103.62 2qqv s GLY 217 Ca 0.58 0.05 0.06 0.00 0.00 0.00 0.00 44.72 45.41 2qqv s GLY 217 CO 0.30 0.36 -0.24 0.14 0.00 0.00 0.00 173.10 173.67 2qqv s VAL 218 N -3.06 2.19 0.44 1.40 1.01 -1.26 -4.66 120.40 116.46 2qqv s VAL 218 Ca 0.58 -1.03 -0.26 0.00 0.00 0.00 0.00 61.98 61.27 2qqv s VAL 218 Cb -0.14 -1.79 -0.09 0.00 0.00 0.00 0.00 36.38 34.36 2qqv s VAL 218 CO 0.55 0.57 1.45 -0.70 0.00 0.00 0.00 175.10 176.97 2qqv s GLU 219 N -0.34 3.74 0.21 2.72 -6.30 -1.26 -4.78 118.70 112.69 2qqv s GLU 219 Ca 0.02 2.46 -0.10 0.00 -2.50 0.00 0.00 54.97 54.85 2qqv s GLU 219 Cb -0.12 -2.70 0.15 0.00 0.00 0.00 0.00 34.13 31.45 2qqv s GLU 219 CO 0.02 -0.79 1.88 1.15 0.02 0.00 0.00 175.26 177.54 2qqv h THR 220 N 2.41 1.19 0.00 -1.70 2.02 -1.96 -2.65 112.91 112.22 2qqv h THR 220 Ca -0.51 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.31 2qqv h THR 220 Cb 1.26 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2qqv h THR 220 CO 0.62 0.19 0.00 0.28 0.37 0.00 0.00 175.52 176.97 2qqv h SER 221 N 1.02 0.00 -2.97 4.18 0.02 -1.89 -3.43 113.55 110.47 2qqv h SER 221 Ca 0.27 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.65 2qqv h SER 221 Cb -0.11 0.00 0.10 0.00 0.14 0.00 0.00 62.40 62.53 2qqv h SER 221 CO -0.06 0.00 0.51 -0.24 -1.14 0.00 0.00 176.83 175.90 2qqv n SER 222 N -2.66 2.61 -0.21 3.07 2.88 -1.00 -4.73 113.62 113.57 2qqv n SER 222 Ca 0.04 1.18 0.11 0.00 -1.33 0.00 0.00 58.87 58.86 2qqv n SER 222 Cb 0.41 -1.44 -0.04 0.00 -0.75 0.00 0.00 64.21 62.39 2qqv n SER 222 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2qqv n PHE 223 N 0.96 0.00 -0.12 0.66 3.01 -1.26 -5.00 117.46 115.71 2qqv n PHE 223 Ca 0.08 0.00 0.02 0.00 1.01 0.00 0.00 57.45 58.56 2qqv n PHE 223 Cb 0.34 -0.01 -0.01 0.00 -0.01 0.00 0.00 39.48 39.79 2qqv n PHE 223 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qqv n GLY 224 N 1.46 -1.93 3.79 1.37 0.00 -1.26 -4.93 105.19 103.69 2qqv n GLY 224 Ca 0.06 -1.47 -0.30 0.00 0.00 0.00 0.00 46.02 44.32 2qqv n GLY 224 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qqv s GLU 225 N -2.00 1.78 0.27 1.61 8.01 -1.26 -4.93 118.70 122.18 2qqv s GLU 225 Ca 0.00 0.59 0.22 0.00 0.01 0.00 0.00 54.97 55.79 2qqv s GLU 225 Cb 0.00 -1.89 1.02 0.00 -4.31 0.00 0.00 34.13 28.96 2qqv s GLU 225 CO 0.00 -1.82 1.66 -0.35 0.01 0.00 0.00 175.26 174.76 2qqv n PRO 226 N -3.56 0.16 -0.08 0.39 -0.04 -1.26 -2.91 135.00 127.70 2qqv n PRO 226 Ca 0.07 0.51 -0.07 0.00 -0.04 0.00 0.00 63.50 63.97 2qqv n PRO 226 Cb 0.57 -1.89 -0.12 0.00 -0.04 0.00 0.00 33.50 32.01 2qqv n PRO 226 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2qqv n ASN 227 N -2.21 1.12 -4.70 3.54 0.23 -1.26 -4.97 115.26 107.02 2qqv n ASN 227 Ca 0.01 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.63 2qqv n ASN 227 Cb 0.14 0.90 -0.03 0.00 -2.08 0.00 0.00 39.78 38.71 2qqv n ASN 227 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 2qqv s GLU 228 N -2.39 4.47 -0.24 -3.83 2.12 -1.15 -5.04 118.70 112.64 2qqv s GLU 228 Ca -0.08 1.50 -0.09 0.00 0.36 0.00 0.00 54.97 56.66 2qqv s GLU 228 Cb 0.05 -3.48 -0.04 0.00 0.26 0.00 0.00 34.13 30.91 2qqv s GLU 228 CO 0.64 -0.22 0.13 -1.50 -0.54 0.00 0.00 175.26 173.78 2qqv s ILE 229 N 1.49 4.97 0.13 -3.70 2.07 -1.26 -4.27 121.20 120.62 2qqv s ILE 229 Ca 0.52 0.05 0.08 0.00 -1.41 0.00 0.00 60.65 59.89 2qqv s ILE 229 Cb -0.22 -3.32 -0.04 0.00 0.13 0.00 0.00 42.46 39.01 2qqv s ILE 229 CO 0.24 0.34 -0.12 -0.76 -1.91 0.00 0.00 174.94 172.74 2qqv s LEU 230 N 1.26 2.94 0.19 8.50 1.43 -1.26 -1.84 118.68 129.89 2qqv s LEU 230 Ca 0.06 -0.48 0.05 0.00 -1.03 0.00 0.00 54.13 52.73 2qqv s LEU 230 Cb -0.14 -1.72 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 2qqv s LEU 230 CO 0.05 0.16 -0.07 -0.54 0.23 0.00 0.00 176.35 176.18 2qqv s LYS 231 N -2.36 1.22 0.08 1.70 1.02 0.33 -4.91 119.74 116.82 2qqv s LYS 231 Ca 0.21 -1.57 0.09 0.00 0.02 0.00 0.00 55.97 54.73 2qqv s LYS 231 Cb -0.10 -0.72 -0.03 0.00 -0.52 0.00 0.00 37.83 36.45 2qqv s LYS 231 CO 0.13 0.03 -0.24 -1.01 -0.92 0.00 0.00 175.35 173.34 2qqv s HIS 232 N -3.29 2.39 -0.19 3.18 3.76 0.51 -0.01 115.29 121.64 2qqv s HIS 232 Ca 0.22 -0.36 0.00 0.00 -0.15 0.00 0.00 55.06 54.78 2qqv s HIS 232 Cb 0.03 -1.36 0.02 0.00 1.11 0.00 0.00 32.58 32.38 2qqv s HIS 232 CO 0.05 0.24 -0.18 0.08 -0.85 0.00 0.00 174.74 174.08 2qqv s VAL 233 N -0.94 2.24 -0.24 -0.90 1.01 -0.23 -0.13 120.40 121.21 2qqv s VAL 233 Ca 0.14 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.11 2qqv s VAL 233 Cb -0.10 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 2qqv s VAL 233 CO 0.05 0.51 0.14 -0.22 0.00 0.00 0.00 175.10 175.57 2qqv s LEU 234 N 1.31 3.97 -0.01 3.92 2.96 -1.03 -2.41 118.68 127.40 2qqv s LEU 234 Ca 0.05 0.05 0.06 0.00 -0.22 0.00 0.00 54.13 54.07 2qqv s LEU 234 Cb -0.13 -2.06 -0.03 0.00 0.50 0.00 0.00 46.19 44.47 2qqv s LEU 234 CO -0.11 0.05 -0.20 -0.75 -1.32 0.00 0.00 176.35 174.02 2qqv s LYS 235 N 1.13 2.19 0.03 1.98 2.36 0.01 -1.98 119.74 125.47 2qqv s LYS 235 Ca 0.07 -0.89 -0.00 0.00 -2.55 0.00 0.00 55.97 52.60 2qqv s LYS 235 Cb -0.14 -2.18 -0.03 0.00 -1.05 0.00 0.00 37.83 34.43 2qqv s LYS 235 CO 0.05 0.57 -0.03 0.96 1.55 0.00 0.00 175.35 178.45 2qqv s ILE 236 N -0.75 0.15 -0.39 5.43 -4.36 -0.03 -0.75 121.20 120.48 2qqv s ILE 236 Ca 0.12 -1.16 -0.08 0.00 -0.26 0.00 0.00 60.65 59.27 2qqv s ILE 236 Cb -0.10 -0.61 0.07 0.00 1.25 0.00 0.00 42.46 43.06 2qqv s ILE 236 CO 0.01 -0.64 0.21 -0.44 0.24 0.00 0.00 174.94 174.33 2qqv s SER 237 N -1.86 5.52 -0.29 4.36 0.01 0.73 -1.08 113.70 121.08 2qqv s SER 237 Ca -0.10 -1.41 -0.29 0.00 1.31 0.00 0.00 55.95 55.46 2qqv s SER 237 Cb -0.05 -1.94 -0.00 0.00 0.21 0.00 0.00 66.02 64.24 2qqv s SER 237 CO -0.03 -0.47 1.30 -0.76 0.41 0.00 0.00 173.24 173.69 2qqv s LEU 238 N 1.40 3.90 0.36 2.44 1.02 -0.69 -1.22 118.68 125.90 2qqv s LEU 238 Ca 0.02 1.24 0.15 0.00 0.02 0.00 0.00 54.13 55.56 2qqv s LEU 238 Cb -0.22 -3.54 0.69 0.00 0.02 0.00 0.00 46.19 43.14 2qqv s LEU 238 CO 0.02 -1.06 1.78 -0.78 0.02 0.00 0.00 176.35 176.32 2qqv h ASP 239 N 9.24 0.00 -0.27 2.29 -0.00 -1.84 0.15 116.42 125.99 2qqv h ASP 239 Ca -0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 57.03 56.75 2qqv h ASP 239 Cb 1.10 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.42 2qqv h ASP 239 CO 1.03 0.41 0.09 0.44 -0.00 0.00 0.00 179.24 181.20 2qqv h ASP 240 N 0.00 0.39 0.24 2.28 3.45 -1.91 -3.29 116.42 117.58 2qqv h ASP 240 Ca -0.00 -0.20 0.00 0.00 0.43 0.00 0.00 57.03 57.26 2qqv h ASP 240 Cb 0.79 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.46 2qqv h ASP 240 CO 0.05 0.48 -1.22 0.35 -1.57 0.00 0.00 179.24 177.33 2qqv n THR 241 N -4.74 0.09 -3.47 0.35 -2.24 -1.15 -4.99 114.28 98.13 2qqv n THR 241 Ca -0.03 -0.24 -0.23 0.00 -2.27 0.00 0.00 64.05 61.28 2qqv n THR 241 Cb 0.16 0.36 0.07 0.00 -2.10 0.00 0.00 70.33 68.82 2qqv n THR 241 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qqv n LYS 242 N -1.91 -7.29 -4.28 -0.78 4.76 0.53 -5.03 118.16 104.16 2qqv n LYS 242 Ca 0.01 0.83 -0.15 0.00 -2.87 0.00 0.00 58.31 56.13 2qqv n LYS 242 Cb 0.44 -5.80 -0.10 0.00 -1.84 0.00 0.00 35.03 27.73 2qqv n LYS 242 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2qqv s HIS 243 N -3.29 1.37 -0.23 2.13 3.76 -1.19 -4.80 115.29 113.04 2qqv s HIS 243 Ca 0.53 -0.80 -0.07 0.00 -0.15 0.00 0.00 55.06 54.56 2qqv s HIS 243 Cb -0.23 -0.73 -0.03 0.00 1.11 0.00 0.00 32.58 32.70 2qqv s HIS 243 CO 0.65 0.06 0.07 -0.51 -0.85 0.00 0.00 174.74 174.16 2qqv s ASP 244 N -3.22 5.32 0.16 1.40 -0.00 -1.25 -1.70 116.67 117.39 2qqv s ASP 244 Ca 0.21 -0.10 0.11 0.00 -0.00 0.00 0.00 52.55 52.76 2qqv s ASP 244 Cb 0.03 -1.94 -0.04 0.00 -0.00 0.00 0.00 42.92 40.97 2qqv s ASP 244 CO 0.03 0.04 -0.25 -0.31 -0.00 0.00 0.00 175.17 174.69 2qqv s TYR 245 N 1.17 2.27 0.05 4.23 1.51 -0.24 -3.49 117.35 122.84 2qqv s TYR 245 Ca 0.05 -0.37 0.01 0.00 -1.01 0.00 0.00 57.07 55.74 2qqv s TYR 245 Cb -0.14 -1.17 -0.03 0.00 -0.11 0.00 0.00 41.96 40.51 2qqv s TYR 245 CO 0.03 0.42 -0.05 1.52 -1.11 0.00 0.00 175.55 176.37 2qqv s TYR 246 N -1.44 0.54 0.13 2.71 -0.85 -0.35 -0.85 117.35 117.24 2qqv s TYR 246 Ca 0.17 -0.73 0.06 0.00 -0.52 0.00 0.00 57.07 56.05 2qqv s TYR 246 Cb -0.09 -0.35 -0.04 0.00 0.38 0.00 0.00 41.96 41.86 2qqv s TYR 246 CO 0.08 -0.21 -0.14 0.95 -1.52 0.00 0.00 175.55 174.72 2qqv s THR 247 N -2.48 1.34 -0.11 -3.49 -4.23 -0.84 -3.58 115.64 102.25 2qqv s THR 247 Ca -0.04 -1.78 -0.02 0.00 -1.18 0.00 0.00 61.69 58.68 2qqv s THR 247 Cb -0.03 -1.59 -0.03 0.00 1.34 0.00 0.00 72.50 72.20 2qqv s THR 247 CO -0.04 -0.46 -0.05 -0.63 -0.54 0.00 0.00 174.62 172.91 2qqv s ILE 248 N -2.29 3.83 0.00 2.99 1.01 -1.26 -2.47 121.20 123.01 2qqv s ILE 248 Ca 0.10 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.35 2qqv s ILE 248 Cb -0.04 -2.63 0.00 0.00 0.01 0.00 0.00 42.46 39.80 2qqv s ILE 248 CO 0.03 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.13 2qqv n GLY 249 N 2.86 2.72 3.36 6.18 0.00 0.81 -0.56 105.19 120.55 2qqv n GLY 249 Ca -0.18 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 44.89 2qqv n GLY 249 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qqv s THR 250 N -2.28 2.33 -0.59 2.61 -4.23 0.32 -0.37 115.64 113.43 2qqv s THR 250 Ca 0.00 -1.01 -0.18 0.00 -1.18 0.00 0.00 61.69 59.32 2qqv s THR 250 Cb 0.00 -1.84 0.12 0.00 1.34 0.00 0.00 72.50 72.12 2qqv s THR 250 CO 0.00 0.58 0.64 -0.47 -0.54 0.00 0.00 174.62 174.83 2qqv s TYR 251 N -0.65 3.12 -0.67 3.99 5.04 -1.26 -1.27 117.35 125.65 2qqv s TYR 251 Ca 0.10 -1.14 -0.27 0.00 -2.44 0.00 0.00 57.07 53.33 2qqv s TYR 251 Cb -0.10 -3.94 -0.01 0.00 0.35 0.00 0.00 41.96 38.27 2qqv s TYR 251 CO -0.00 -1.19 1.68 0.34 -1.34 0.00 0.00 175.55 175.04 2qqv s ASP 252 N 3.56 5.55 0.50 4.32 -1.08 -0.90 -4.84 116.67 123.77 2qqv s ASP 252 Ca 0.09 0.04 0.29 0.00 -0.52 0.00 0.00 52.55 52.46 2qqv s ASP 252 Cb -0.25 -2.54 1.01 0.00 -1.46 0.00 0.00 42.92 39.68 2qqv s ASP 252 CO 0.04 -2.22 1.85 0.03 0.52 0.00 0.00 175.17 175.40 2qqv h ARG 253 N 13.29 0.00 0.37 4.34 3.08 -1.95 0.10 114.38 133.61 2qqv h ARG 253 Ca -0.25 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.78 2qqv h ARG 253 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.17 2qqv h ARG 253 CO 1.24 0.03 -0.18 0.28 -1.07 0.00 0.00 179.97 180.28 2qqv h VAL 254 N 0.00 0.00 0.00 2.04 2.07 -1.96 -3.30 116.25 115.10 2qqv h VAL 254 Ca -0.00 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2qqv h VAL 254 Cb 0.69 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2qqv h VAL 254 CO 0.00 0.00 0.00 1.17 0.02 0.00 0.00 177.57 178.76 2qqv n LYS 255 N -5.08 0.12 -3.64 1.57 4.81 -1.22 -4.93 118.16 109.79 2qqv n LYS 255 Ca -0.06 0.18 -0.22 0.00 -0.87 0.00 0.00 58.31 57.34 2qqv n LYS 255 Cb 0.20 -1.67 0.06 0.00 0.02 0.00 0.00 35.03 33.64 2qqv n LYS 255 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2qqv n ASP 256 N -1.88 -3.04 -4.20 3.14 2.03 0.33 -5.02 116.55 107.89 2qqv n ASP 256 Ca 0.05 -0.70 -0.19 0.00 0.52 0.00 0.00 54.79 54.47 2qqv n ASP 256 Cb 0.33 -4.53 -0.12 0.00 -0.72 0.00 0.00 41.12 36.08 2qqv n ASP 256 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2qqv s LYS 257 N -5.97 0.90 -0.23 -0.67 1.02 -1.02 -4.43 119.74 109.34 2qqv s LYS 257 Ca 0.23 -1.03 -0.14 0.00 0.02 0.00 0.00 55.97 55.04 2qqv s LYS 257 Cb -0.11 -0.92 -0.04 0.00 -0.52 0.00 0.00 37.83 36.24 2qqv s LYS 257 CO 0.78 0.20 0.34 0.12 -0.92 0.00 0.00 175.35 175.87 2qqv s PHE 258 N -1.40 3.33 -0.32 3.18 5.36 -0.10 -2.13 117.98 125.90 2qqv s PHE 258 Ca 0.01 0.47 -0.04 0.00 -0.96 0.00 0.00 56.93 56.42 2qqv s PHE 258 Cb -0.09 -2.48 0.05 0.00 -0.34 0.00 0.00 43.02 40.16 2qqv s PHE 258 CO 0.03 -0.05 0.05 0.08 -1.46 0.00 0.00 175.22 173.87 2qqv s VAL 259 N 1.45 3.34 0.54 3.12 1.01 -0.40 -4.78 120.40 124.68 2qqv s VAL 259 Ca 0.15 -1.30 -0.20 0.00 0.00 0.00 0.00 61.98 60.63 2qqv s VAL 259 Cb -0.15 -2.92 -0.06 0.00 0.00 0.00 0.00 36.38 33.26 2qqv s VAL 259 CO 0.08 -0.16 1.16 -2.84 0.00 0.00 0.00 175.10 173.34 2qqv s PRO 260 N 1.31 3.32 0.88 2.72 0.02 -1.26 -0.52 135.00 141.47 2qqv s PRO 260 Ca -0.03 1.72 -0.13 0.00 0.02 0.00 0.00 61.00 62.58 2qqv s PRO 260 Cb -0.20 -2.06 0.07 0.00 0.02 0.00 0.00 34.50 32.33 2qqv s PRO 260 CO 0.00 -0.90 0.80 -0.25 -0.33 0.00 0.00 177.00 176.33 2qqv n ASP 261 N -1.22 -0.61 -4.63 2.53 9.92 0.27 -4.84 116.55 117.97 2qqv n ASP 261 Ca 0.11 0.44 -0.44 0.00 -0.53 0.00 0.00 54.79 54.38 2qqv n ASP 261 Cb 0.50 -1.35 -0.04 0.00 -0.64 0.00 0.00 41.12 39.59 2qqv n ASP 261 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2qqv n ASN 262 N -2.44 3.65 0.00 -2.24 5.15 -1.26 -2.06 115.26 116.05 2qqv n ASN 262 Ca 0.10 0.68 0.00 0.00 -0.60 0.00 0.00 54.58 54.76 2qqv n ASN 262 Cb 0.52 -1.49 0.00 0.00 -0.53 0.00 0.00 39.78 38.28 2qqv n ASN 262 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2qqv n GLY 263 N 5.00 1.80 3.82 8.20 0.00 -1.26 -5.10 105.19 117.65 2qqv n GLY 263 Ca 0.25 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 2qqv n GLY 263 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qqv s PHE 264 N -0.59 3.26 -0.08 1.61 0.40 -0.88 -5.08 117.98 116.61 2qqv s PHE 264 Ca 0.00 1.57 -0.04 0.00 -0.60 0.00 0.00 56.93 57.86 2qqv s PHE 264 Cb 0.00 -2.89 0.04 0.00 0.51 0.00 0.00 43.02 40.68 2qqv s PHE 264 CO 0.00 -0.35 0.19 0.21 0.70 0.00 0.00 175.22 175.96 2qqv s LYS 265 N -3.40 0.14 -1.30 0.44 2.20 -1.26 -4.85 119.74 111.71 2qqv s LYS 265 Ca 0.63 0.43 -0.14 0.00 -0.36 0.00 0.00 55.97 56.52 2qqv s LYS 265 Cb -0.11 -0.14 -0.03 0.00 -1.51 0.00 0.00 37.83 36.04 2qqv s LYS 265 CO 0.19 -0.16 2.29 -1.33 -0.36 0.00 0.00 175.35 175.98 2qqv n MET 266 N 4.15 2.66 0.00 4.03 2.81 -1.26 -3.94 117.12 125.57 2qqv n MET 266 Ca -0.25 -2.27 0.00 0.00 -1.81 0.00 0.00 57.70 53.36 2qqv n MET 266 Cb 0.53 -3.05 0.00 0.00 -0.71 0.00 0.00 33.22 29.98 2qqv n MET 266 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2qqv n ASP 267 N 5.77 0.00 0.00 7.83 3.85 -1.26 -4.74 116.55 128.00 2qqv n ASP 267 Ca 0.56 0.00 0.04 0.00 -0.71 0.00 0.00 54.79 54.68 2qqv n ASP 267 Cb 0.34 0.00 0.25 0.00 -1.35 0.00 0.00 41.12 40.36 2qqv n ASP 267 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2qqv n GLY 268 N 0.00 -0.69 0.66 6.12 0.00 -1.26 -2.66 105.19 107.35 2qqv n GLY 268 Ca 0.00 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.04 2qqv n GLY 268 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qqv n THR 269 N -0.69 0.46 -2.60 2.61 -2.24 -1.26 -5.01 114.28 105.55 2qqv n THR 269 Ca 0.06 -0.73 -0.30 0.00 -2.27 0.00 0.00 64.05 60.81 2qqv n THR 269 Cb 0.03 0.92 -0.02 0.00 -2.10 0.00 0.00 70.33 69.16 2qqv n THR 269 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qqv s ALA 270 N -1.07 3.26 0.50 6.98 0.00 -1.09 -4.89 121.76 125.44 2qqv s ALA 270 Ca 0.22 -0.13 -0.21 0.00 0.00 0.00 0.00 51.96 51.83 2qqv s ALA 270 Cb 0.13 -2.84 -0.08 0.00 0.00 0.00 0.00 23.12 20.33 2qqv s ALA 270 CO 0.18 -0.19 0.94 -2.30 0.00 0.00 0.00 175.76 174.39 2qqv n PRO 271 N -1.65 1.11 -4.09 0.00 -0.02 -1.23 -4.75 135.00 124.35 2qqv n PRO 271 Ca 0.04 0.41 -0.27 0.00 -2.02 0.00 0.00 63.50 61.66 2qqv n PRO 271 Cb 0.54 -2.05 -0.06 0.00 -0.02 0.00 0.00 33.50 31.91 2qqv n PRO 271 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qqv s ARG 272 N -2.29 2.84 0.03 -0.52 0.52 -1.26 -1.21 118.95 117.07 2qqv s ARG 272 Ca 0.68 -0.87 -0.25 0.00 -0.52 0.00 0.00 55.73 54.77 2qqv s ARG 272 Cb -0.49 -2.63 -0.17 0.00 0.52 0.00 0.00 34.95 32.18 2qqv s ARG 272 CO 0.53 0.49 1.44 1.88 0.02 0.00 0.00 175.30 179.66 2qqv h TYR 273 N 2.58 -0.19 -3.49 -0.53 0.05 -1.93 -3.45 116.97 110.00 2qqv h TYR 273 Ca -0.47 -0.00 -0.39 0.00 0.05 0.00 0.00 58.73 57.91 2qqv h TYR 273 Cb 1.19 0.06 -0.34 0.00 1.01 0.00 0.00 36.73 38.66 2qqv h TYR 273 CO 0.59 0.08 -0.77 0.34 -1.05 0.00 0.00 178.16 177.36 2qqv s ASP 274 N -5.24 0.78 -0.15 3.88 -1.08 -1.26 -4.32 116.67 109.29 2qqv s ASP 274 Ca -0.15 -0.10 0.10 0.00 -0.52 0.00 0.00 52.55 51.88 2qqv s ASP 274 Cb 0.03 -0.38 0.55 0.00 -1.46 0.00 0.00 42.92 41.67 2qqv s ASP 274 CO 0.63 -0.06 1.35 -1.22 0.52 0.00 0.00 175.17 176.39 2qqv n TYR 275 N 3.99 1.38 0.00 -5.34 4.01 0.22 -4.76 117.16 116.66 2qqv n TYR 275 Ca -0.25 -0.48 0.00 0.00 -0.16 0.00 0.00 57.90 57.00 2qqv n TYR 275 Cb 0.51 -0.36 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 2qqv n TYR 275 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qqv n GLY 276 N 0.48 4.96 3.55 2.72 0.00 -1.26 -4.15 105.19 111.50 2qqv n GLY 276 Ca 0.19 -1.43 -0.43 0.00 0.00 0.00 0.00 46.02 44.35 2qqv n GLY 276 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qqv s LYS 277 N 4.91 3.46 -0.30 1.61 2.47 0.12 -4.85 119.74 127.16 2qqv s LYS 277 Ca 0.00 0.03 -0.09 0.00 -1.56 0.00 0.00 55.97 54.35 2qqv s LYS 277 Cb 0.00 -4.00 0.17 0.00 -1.46 0.00 0.00 37.83 32.54 2qqv s LYS 277 CO 0.00 -1.46 0.81 -0.47 0.16 0.00 0.00 175.35 174.39 2qqv s TYR 278 N 4.20 -1.07 0.07 4.03 5.04 -1.26 -4.63 117.35 123.72 2qqv s TYR 278 Ca 0.37 1.44 -0.06 0.00 -2.44 0.00 0.00 57.07 56.38 2qqv s TYR 278 Cb -0.10 0.49 -0.01 0.00 0.35 0.00 0.00 41.96 42.68 2qqv s TYR 278 CO 0.23 -0.56 0.11 -0.47 -1.34 0.00 0.00 175.55 173.53 2qqv s TYR 279 N 2.78 0.26 -1.28 4.97 5.04 -0.09 -3.95 117.35 125.08 2qqv s TYR 279 Ca 0.04 -0.70 -0.00 0.00 -2.44 0.00 0.00 57.07 53.97 2qqv s TYR 279 Cb -0.11 -0.17 -0.00 0.00 0.35 0.00 0.00 41.96 42.03 2qqv s TYR 279 CO -0.17 -0.47 0.75 0.00 -1.34 0.00 0.00 175.55 174.32 2qqv n ALA 280 N 0.14 -2.03 -1.77 3.97 0.00 -1.26 -1.46 120.51 118.10 2qqv n ALA 280 Ca -0.15 -0.15 -0.37 0.00 0.00 0.00 0.00 53.44 52.76 2qqv n ALA 280 Cb 0.61 -2.06 -0.02 0.00 0.00 0.00 0.00 19.45 17.99 2qqv n ALA 280 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2qqv s SER 281 N -4.35 6.36 -0.05 0.00 0.01 -1.26 -4.39 113.70 110.01 2qqv s SER 281 Ca 0.01 2.31 -0.08 0.00 1.31 0.00 0.00 55.95 59.50 2qqv s SER 281 Cb -0.00 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.64 2qqv s SER 281 CO 0.80 -0.79 0.19 -0.75 0.41 0.00 0.00 173.24 173.10 2qqv s LYS 282 N -2.52 0.32 0.24 12.44 2.20 -0.67 -4.90 119.74 126.85 2qqv s LYS 282 Ca 0.60 0.10 0.10 0.00 -0.36 0.00 0.00 55.97 56.42 2qqv s LYS 282 Cb -0.29 0.14 -0.04 0.00 -1.51 0.00 0.00 37.83 36.13 2qqv s LYS 282 CO 0.36 -0.06 -0.09 0.95 -0.36 0.00 0.00 175.35 176.15 2qqv s THR 283 N -0.31 3.07 0.03 3.43 -4.23 -1.26 -0.71 115.64 115.66 2qqv s THR 283 Ca -0.04 -1.95 -0.09 0.00 -1.18 0.00 0.00 61.69 58.43 2qqv s THR 283 Cb -0.03 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.23 2qqv s THR 283 CO 0.01 -0.28 0.18 0.72 -0.54 0.00 0.00 174.62 174.71 2qqv s PHE 284 N -2.12 0.05 -0.15 3.99 -0.12 -0.81 -4.90 117.98 113.92 2qqv s PHE 284 Ca 0.28 -0.22 -0.25 0.00 -0.05 0.00 0.00 56.93 56.69 2qqv s PHE 284 Cb -0.07 -0.04 -0.02 0.00 -0.63 0.00 0.00 43.02 42.26 2qqv s PHE 284 CO 0.17 -0.39 0.80 0.12 -0.05 0.00 0.00 175.22 175.87 2qqv s PHE 285 N -2.19 3.45 -0.78 3.49 5.36 -1.26 -1.95 117.98 124.09 2qqv s PHE 285 Ca -0.08 1.24 -0.13 0.00 -0.96 0.00 0.00 56.93 57.00 2qqv s PHE 285 Cb -0.03 -2.97 0.21 0.00 -0.34 0.00 0.00 43.02 39.89 2qqv s PHE 285 CO -0.02 -0.18 0.71 0.34 -1.46 0.00 0.00 175.22 174.61 2qqv s ASP 286 N 1.11 6.53 0.35 6.13 2.15 -0.39 -4.62 116.67 127.93 2qqv s ASP 286 Ca 0.38 -2.65 0.26 0.00 0.43 0.00 0.00 52.55 50.96 2qqv s ASP 286 Cb -0.17 -2.16 1.26 0.00 -0.30 0.00 0.00 42.92 41.55 2qqv s ASP 286 CO 0.14 -0.57 1.78 0.77 -0.17 0.00 0.00 175.17 177.12 2qqv h SER 287 N 7.76 0.00 -0.09 -0.34 4.64 -1.95 0.14 113.55 123.71 2qqv h SER 287 Ca 0.06 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.37 2qqv h SER 287 Cb 1.03 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2qqv h SER 287 CO 0.77 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 176.72 2qqv h ALA 288 N 2.09 0.12 -0.17 5.18 0.00 -1.95 -3.35 119.26 121.17 2qqv h ALA 288 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2qqv h ALA 288 Cb 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2qqv h ALA 288 CO 0.00 -0.18 0.00 1.63 0.00 0.00 0.00 179.25 180.70 2qqv n LYS 289 N -4.82 2.75 -3.90 0.00 4.01 -0.97 -5.01 118.16 110.23 2qqv n LYS 289 Ca -0.06 -2.01 -0.30 0.00 -0.51 0.00 0.00 58.31 55.42 2qqv n LYS 289 Cb 0.21 -1.27 0.00 0.00 -0.51 0.00 0.00 35.03 33.46 2qqv n LYS 289 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2qqv n ASN 290 N -0.20 -2.38 -4.01 4.39 4.13 -0.00 -4.88 115.26 112.31 2qqv n ASN 290 Ca 0.09 -1.06 -0.09 0.00 1.68 0.00 0.00 54.58 55.20 2qqv n ASN 290 Cb 0.45 -2.92 -0.11 0.00 -1.54 0.00 0.00 39.78 35.66 2qqv n ASN 290 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qqv s ARG 291 N -6.51 0.38 -0.20 3.52 1.70 -1.15 0.31 118.95 117.01 2qqv s ARG 291 Ca 0.22 -0.74 -0.11 0.00 -0.47 0.00 0.00 55.73 54.62 2qqv s ARG 291 Cb -0.09 0.12 -0.05 0.00 -0.57 0.00 0.00 34.95 34.36 2qqv s ARG 291 CO 0.90 -0.06 0.20 0.50 -1.08 0.00 0.00 175.30 175.75 2qqv s ARG 292 N -1.98 4.18 -0.13 3.89 3.52 -1.26 -1.27 118.95 125.90 2qqv s ARG 292 Ca -0.11 -0.12 -0.02 0.00 -0.13 0.00 0.00 55.73 55.35 2qqv s ARG 292 Cb -0.06 -3.45 -0.03 0.00 -1.56 0.00 0.00 34.95 29.85 2qqv s ARG 292 CO -0.03 0.21 -0.06 0.42 -0.81 0.00 0.00 175.30 175.03 2qqv s ILE 293 N 0.59 3.69 -0.22 4.11 -1.09 -0.82 -1.08 121.20 126.39 2qqv s ILE 293 Ca 0.11 -0.44 -0.06 0.00 -2.23 0.00 0.00 60.65 58.03 2qqv s ILE 293 Cb -0.12 -2.58 -0.03 0.00 -1.58 0.00 0.00 42.46 38.15 2qqv s ILE 293 CO 0.01 0.52 0.03 -0.22 -1.23 0.00 0.00 174.94 174.06 2qqv s LEU 294 N 0.08 3.36 -0.13 2.97 2.96 0.10 -1.93 118.68 126.10 2qqv s LEU 294 Ca -0.02 -0.19 -0.06 0.00 -0.22 0.00 0.00 54.13 53.65 2qqv s LEU 294 Cb -0.14 -1.87 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 2qqv s LEU 294 CO 0.03 0.03 0.08 0.26 -1.32 0.00 0.00 176.35 175.44 2qqv s TRP 295 N 1.20 3.39 0.02 5.38 0.52 0.11 -1.90 118.94 127.66 2qqv s TRP 295 Ca 0.04 0.32 0.02 0.00 0.02 0.00 0.00 56.10 56.50 2qqv s TRP 295 Cb -0.14 -1.94 -0.01 0.00 -1.15 0.00 0.00 33.47 30.22 2qqv s TRP 295 CO 0.02 0.51 -0.07 0.20 0.02 0.00 0.00 176.95 177.63 2qqv s GLY 296 N -0.58 0.39 -0.22 0.98 0.00 -1.26 -1.67 107.32 104.96 2qqv s GLY 296 Ca 0.11 -0.50 -0.11 0.00 0.00 0.00 0.00 44.72 44.23 2qqv s GLY 296 CO 0.02 -0.51 0.17 0.86 0.00 0.00 0.00 173.10 173.65 2qqv s TRP 297 N -0.75 3.37 -0.27 1.90 -0.00 -0.53 -1.86 118.94 120.79 2qqv s TRP 297 Ca -0.04 0.32 -0.02 0.00 -0.00 0.00 0.00 56.10 56.36 2qqv s TRP 297 Cb -0.06 -2.25 0.04 0.00 -0.00 0.00 0.00 33.47 31.20 2qqv s TRP 297 CO 0.00 0.16 -0.03 0.99 -0.00 0.00 0.00 176.95 178.07 2qqv s THR 298 N 0.76 2.91 0.90 5.86 2.01 -0.84 -0.91 115.64 126.33 2qqv s THR 298 Ca 0.09 -1.22 -0.12 0.00 0.31 0.00 0.00 61.69 60.75 2qqv s THR 298 Cb -0.13 -2.58 0.17 0.00 0.01 0.00 0.00 72.50 69.97 2qqv s THR 298 CO 0.02 0.04 1.24 0.54 -0.69 0.00 0.00 174.62 175.77 2qqv s ASN 299 N 1.28 3.51 0.18 3.53 4.22 -1.26 -2.04 114.94 124.36 2qqv s ASN 299 Ca -0.03 0.19 -0.30 0.00 -2.14 0.00 0.00 52.86 50.58 2qqv s ASN 299 Cb -0.18 -0.35 -0.07 0.00 1.28 0.00 0.00 41.25 41.93 2qqv s ASN 299 CO -0.03 -2.47 1.00 -0.70 -2.04 0.00 0.00 177.10 172.87 2qqv s GLU 300 N -5.70 4.71 0.00 3.55 2.56 -1.26 -4.86 118.70 117.71 2qqv s GLU 300 Ca 0.71 1.56 0.24 0.00 0.00 0.00 0.00 54.97 57.48 2qqv s GLU 300 Cb -0.05 -3.31 0.31 0.00 2.00 0.00 0.00 34.13 33.08 2qqv s GLU 300 CO 0.51 0.27 1.28 0.43 -0.56 0.00 0.00 175.26 177.18 2qqv n SER 301 N 2.17 0.88 -4.89 -1.70 7.64 -1.26 -4.94 113.62 111.53 2qqv n SER 301 Ca 0.01 -0.69 -0.30 0.00 1.01 0.00 0.00 58.87 58.90 2qqv n SER 301 Cb 0.47 0.45 0.03 0.00 -1.01 0.00 0.00 64.21 64.15 2qqv n SER 301 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2qqv s SER 302 N -2.86 5.84 0.74 6.43 1.04 -1.26 -0.68 113.70 122.96 2qqv s SER 302 Ca 0.13 1.15 -0.15 0.00 0.48 0.00 0.00 55.95 57.56 2qqv s SER 302 Cb 0.17 -2.13 0.04 0.00 0.10 0.00 0.00 66.02 64.21 2qqv s SER 302 CO 0.70 -1.05 1.25 -0.94 0.98 0.00 0.00 173.24 174.18 2qqv s SER 303 N -4.26 4.01 0.34 7.02 1.04 -1.25 -4.88 113.70 115.72 2qqv s SER 303 Ca 0.55 2.48 0.04 0.00 0.48 0.00 0.00 55.95 59.50 2qqv s SER 303 Cb -0.11 -2.60 0.62 0.00 0.10 0.00 0.00 66.02 64.03 2qqv s SER 303 CO 0.51 -2.39 1.91 0.58 0.98 0.00 0.00 173.24 174.82 2qqv h VAL 304 N -0.29 1.18 -0.69 5.02 2.07 -1.96 -2.12 116.25 119.46 2qqv h VAL 304 Ca -0.48 -0.65 0.08 0.00 0.82 0.00 0.00 66.70 66.47 2qqv h VAL 304 Cb 1.31 0.77 -0.07 0.00 -1.52 0.00 0.00 31.29 31.79 2qqv h VAL 304 CO 0.49 0.24 0.35 -0.08 0.02 0.00 0.00 177.57 178.59 2qqv h GLU 305 N 0.59 0.59 -0.23 1.57 4.81 -2.00 -1.88 114.58 118.02 2qqv h GLU 305 Ca 0.14 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.26 2qqv h GLU 305 Cb 0.22 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 2qqv h GLU 305 CO -0.00 0.39 -0.15 -0.44 -0.73 0.00 0.00 179.01 178.07 2qqv h ASP 306 N 0.61 0.37 -0.13 1.04 3.32 -1.75 -2.32 116.42 117.55 2qqv h ASP 306 Ca 0.33 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 2qqv h ASP 306 Cb 0.32 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 2qqv h ASP 306 CO -0.25 0.55 0.00 0.44 -1.72 0.00 0.00 179.24 178.27 2qqv h ASP 307 N 0.36 0.22 0.53 6.45 5.19 -1.08 -1.04 116.42 127.05 2qqv h ASP 307 Ca 0.07 -0.30 -0.09 0.00 -0.62 0.00 0.00 57.03 56.09 2qqv h ASP 307 Cb 0.48 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.92 2qqv h ASP 307 CO 0.03 0.46 -0.42 -0.37 -3.12 0.00 0.00 179.24 175.82 2qqv h VAL 308 N -0.03 1.19 -0.39 -1.35 -1.51 -1.46 0.12 116.25 112.82 2qqv h VAL 308 Ca 0.04 -1.50 -0.09 0.00 -1.23 0.00 0.00 66.70 63.91 2qqv h VAL 308 Cb 0.35 1.84 -0.01 0.00 -2.13 0.00 0.00 31.29 31.33 2qqv h VAL 308 CO 0.01 0.41 -0.12 -0.08 -1.23 0.00 0.00 177.57 176.56 2qqv h GLU 309 N 0.00 0.76 0.00 5.19 4.22 -1.23 -2.99 114.58 120.53 2qqv h GLU 309 Ca -0.00 -0.30 0.00 0.00 0.08 0.00 0.00 59.36 59.13 2qqv h GLU 309 Cb 0.80 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2qqv h GLU 309 CO 0.05 0.91 -0.40 1.57 -2.18 0.00 0.00 179.01 178.97 2qqv h LYS 310 N 0.56 0.00 0.00 1.92 2.10 -1.10 -3.48 116.57 116.57 2qqv h LYS 310 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.74 2qqv h LYS 310 Cb 0.65 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 2qqv h LYS 310 CO 0.04 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 177.90 2qqv n GLY 311 N 1.22 0.44 3.38 0.07 0.00 0.38 -4.98 105.19 105.70 2qqv n GLY 311 Ca 0.03 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 2qqv n GLY 311 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2qqv s TRP 312 N -2.00 -0.40 -0.23 1.61 1.48 -1.00 -0.33 118.94 118.07 2qqv s TRP 312 Ca 0.00 0.33 -0.12 0.00 -1.06 0.00 0.00 56.10 55.25 2qqv s TRP 312 Cb 0.00 0.37 0.07 0.00 -1.16 0.00 0.00 33.47 32.75 2qqv s TRP 312 CO 0.00 -0.69 0.55 0.45 -4.06 0.00 0.00 176.95 173.20 2qqv s SER 313 N -2.28 -0.73 0.00 -2.66 0.15 -1.20 -4.71 113.70 102.26 2qqv s SER 313 Ca -0.02 1.22 0.00 0.00 0.70 0.00 0.00 55.95 57.84 2qqv s SER 313 Cb -0.00 1.15 0.00 0.00 -1.71 0.00 0.00 66.02 65.46 2qqv s SER 313 CO -0.06 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.77 2qqv n GLY 314 N 4.39 0.67 3.56 9.45 0.00 -1.26 0.24 105.19 122.24 2qqv n GLY 314 Ca -0.21 -1.20 -0.26 0.00 0.00 0.00 0.00 46.02 44.35 2qqv n GLY 314 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qqv s ILE 315 N -0.06 2.16 -0.14 -0.61 -0.00 -0.86 -4.46 121.20 117.23 2qqv s ILE 315 Ca 0.00 -2.16 -0.03 0.00 -0.00 0.00 0.00 60.65 58.46 2qqv s ILE 315 Cb 0.00 -2.72 -0.03 0.00 -0.00 0.00 0.00 42.46 39.71 2qqv s ILE 315 CO 0.00 -0.16 -0.03 -1.58 -0.00 0.00 0.00 174.94 173.17 2qqv s GLN 316 N -3.64 3.49 0.58 0.37 2.00 0.30 -1.98 119.66 120.78 2qqv s GLN 316 Ca 0.33 -0.50 -0.20 0.00 -2.00 0.00 0.00 55.36 52.99 2qqv s GLN 316 Cb 0.04 -2.88 -0.03 0.00 0.80 0.00 0.00 33.01 30.94 2qqv s GLN 316 CO 0.17 0.36 1.33 0.95 -0.50 0.00 0.00 175.29 177.59 2qqv s THR 317 N 0.05 2.09 0.13 -0.34 -4.23 -0.77 -3.41 115.64 109.15 2qqv s THR 317 Ca 0.01 0.06 -0.31 0.00 -1.18 0.00 0.00 61.69 60.26 2qqv s THR 317 Cb -0.13 -3.03 -0.10 0.00 1.34 0.00 0.00 72.50 70.58 2qqv s THR 317 CO 0.03 -0.01 1.80 -0.51 -0.54 0.00 0.00 174.62 175.39 2qqv s ILE 318 N -1.35 2.53 0.46 2.99 -1.16 -1.26 -4.64 121.20 118.77 2qqv s ILE 318 Ca 0.76 0.09 -0.23 0.00 -0.51 0.00 0.00 60.65 60.76 2qqv s ILE 318 Cb -0.39 -3.06 -0.09 0.00 0.61 0.00 0.00 42.46 39.53 2qqv s ILE 318 CO 0.44 0.00 0.98 -2.65 -2.81 0.00 0.00 174.94 170.90 2qqv n PRO 319 N 5.49 1.24 -4.66 3.50 -0.02 -1.26 -4.82 135.00 134.46 2qqv n PRO 319 Ca 0.17 0.45 -0.32 0.00 -2.02 0.00 0.00 63.50 61.78 2qqv n PRO 319 Cb 0.38 -2.05 -0.12 0.00 -0.02 0.00 0.00 33.50 31.69 2qqv n PRO 319 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qqv s ARG 320 N -2.15 2.43 0.10 -0.52 3.00 -0.80 -1.21 118.95 119.81 2qqv s ARG 320 Ca 0.66 -0.76 -0.26 0.00 0.00 0.00 0.00 55.73 55.36 2qqv s ARG 320 Cb -0.52 -2.39 -0.06 0.00 0.00 0.00 0.00 34.95 31.97 2qqv s ARG 320 CO 0.55 0.60 0.80 0.21 0.00 0.00 0.00 175.30 177.45 2qqv s LYS 321 N -1.16 4.55 -0.01 3.54 2.20 0.15 0.01 119.74 129.02 2qqv s LYS 321 Ca 0.14 1.15 0.07 0.00 -0.36 0.00 0.00 55.97 56.97 2qqv s LYS 321 Cb -0.11 -3.33 -0.02 0.00 -1.51 0.00 0.00 37.83 32.87 2qqv s LYS 321 CO 0.04 0.38 -0.22 0.96 -0.36 0.00 0.00 175.35 176.15 2qqv s ILE 322 N -0.46 1.75 0.31 5.43 -4.36 -0.24 -1.32 121.20 122.32 2qqv s ILE 322 Ca 0.39 -0.97 -0.06 0.00 -0.26 0.00 0.00 60.65 59.75 2qqv s ILE 322 Cb -0.22 -1.46 0.00 0.00 1.25 0.00 0.00 42.46 42.03 2qqv s ILE 322 CO 0.25 0.48 0.47 -1.66 0.24 0.00 0.00 174.94 174.72 2qqv s TRP 323 N -0.54 0.83 -0.07 1.37 -2.14 -0.84 -4.27 118.94 113.29 2qqv s TRP 323 Ca 0.09 -1.12 -0.15 0.00 2.66 0.00 0.00 56.10 57.57 2qqv s TRP 323 Cb -0.09 0.00 -0.05 0.00 -3.10 0.00 0.00 33.47 30.24 2qqv s TRP 323 CO -0.01 -1.08 0.40 -1.17 -2.66 0.00 0.00 176.95 172.43 2qqv s LEU 324 N -3.16 4.37 0.52 -4.66 1.98 -1.26 -0.58 118.68 115.89 2qqv s LEU 324 Ca 0.28 0.82 -0.21 0.00 -2.89 0.00 0.00 54.13 52.13 2qqv s LEU 324 Cb -0.00 -2.57 -0.06 0.00 0.66 0.00 0.00 46.19 44.22 2qqv s LEU 324 CO 0.16 0.19 1.18 -0.62 -1.89 0.00 0.00 176.35 175.37 2qqv s ASP 325 N -0.26 5.72 0.28 3.68 2.15 -0.56 -4.66 116.67 123.02 2qqv s ASP 325 Ca 0.23 2.33 0.01 0.00 0.43 0.00 0.00 52.55 55.55 2qqv s ASP 325 Cb -0.15 -2.60 0.61 0.00 -0.30 0.00 0.00 42.92 40.47 2qqv s ASP 325 CO 0.10 -1.23 1.77 -0.09 -0.17 0.00 0.00 175.17 175.56 2qqv h ARG 326 N 1.47 0.66 0.00 4.34 2.43 -1.89 0.85 114.38 122.24 2qqv h ARG 326 Ca -0.50 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.63 2qqv h ARG 326 Cb 1.27 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 2qqv h ARG 326 CO 0.58 0.44 0.00 -1.13 -1.51 0.00 0.00 179.97 178.34 2qqv n SER 327 N -4.83 0.00 0.00 -3.80 3.41 -1.26 -4.87 113.62 102.27 2qqv n SER 327 Ca 0.19 0.34 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 2qqv n SER 327 Cb 0.48 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 2qqv n SER 327 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qqv n GLY 328 N 0.05 0.33 0.08 5.00 0.00 0.29 -4.87 105.19 106.08 2qqv n GLY 328 Ca 0.05 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.00 2qqv n GLY 328 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qqv h LYS 329 N 0.78 0.00 -3.61 1.61 1.79 -1.90 -3.48 116.57 111.76 2qqv h LYS 329 Ca 0.00 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.41 2qqv h LYS 329 Cb 0.35 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 30.90 2qqv h LYS 329 CO 0.00 0.60 -0.13 1.14 -1.08 0.00 0.00 179.45 179.99 2qqv s GLN 330 N -2.65 1.39 0.25 3.15 -2.07 -1.26 -4.96 119.66 113.51 2qqv s GLN 330 Ca -0.03 -1.11 -0.08 0.00 -1.82 0.00 0.00 55.36 52.32 2qqv s GLN 330 Cb 0.08 0.46 -0.06 0.00 -1.09 0.00 0.00 33.01 32.40 2qqv s GLN 330 CO 0.82 -0.56 0.55 -0.51 -1.32 0.00 0.00 175.29 174.26 2qqv s LEU 331 N -2.96 4.13 -0.06 2.60 1.43 -1.26 -1.49 118.68 121.06 2qqv s LEU 331 Ca 0.17 0.85 0.03 0.00 -1.03 0.00 0.00 54.13 54.15 2qqv s LEU 331 Cb 0.00 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 2qqv s LEU 331 CO 0.03 -0.11 -0.13 -0.63 0.23 0.00 0.00 176.35 175.73 2qqv s ILE 332 N -1.90 3.13 0.04 -0.59 1.01 0.26 -4.84 121.20 118.31 2qqv s ILE 332 Ca 0.46 -0.69 0.08 0.00 0.00 0.00 0.00 60.65 60.51 2qqv s ILE 332 Cb -0.11 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 2qqv s ILE 332 CO 0.24 0.58 -0.24 -1.10 0.00 0.00 0.00 174.94 174.43 2qqv s GLN 333 N -0.58 1.63 -0.13 2.79 -0.21 -0.91 -1.98 119.66 120.27 2qqv s GLN 333 Ca 0.08 -1.02 -0.07 0.00 0.02 0.00 0.00 55.36 54.37 2qqv s GLN 333 Cb -0.11 -1.77 0.05 0.00 1.00 0.00 0.00 33.01 32.17 2qqv s GLN 333 CO 0.01 0.46 0.31 -0.46 -2.12 0.00 0.00 175.29 173.49 2qqv s TRP 334 N -0.79 -0.42 0.11 0.91 -0.11 -0.43 -4.16 118.94 114.05 2qqv s TRP 334 Ca 0.10 0.96 -0.36 0.00 1.22 0.00 0.00 56.10 58.02 2qqv s TRP 334 Cb -0.09 0.13 -0.16 0.00 -1.50 0.00 0.00 33.47 31.85 2qqv s TRP 334 CO 0.02 -0.26 1.40 -2.30 -4.62 0.00 0.00 176.95 171.19 2qqv n PRO 335 N 4.07 1.46 -1.52 5.86 -0.02 -1.26 0.32 135.00 143.91 2qqv n PRO 335 Ca -0.23 0.53 -0.49 0.00 -2.02 0.00 0.00 63.50 61.29 2qqv n PRO 335 Cb 0.54 -2.20 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 2qqv n PRO 335 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2qqv n VAL 336 N 2.72 1.36 0.33 -1.45 0.24 -0.35 -4.75 118.33 116.44 2qqv n VAL 336 Ca 0.18 -0.34 0.22 0.00 -2.04 0.00 0.00 64.34 62.35 2qqv n VAL 336 Cb 0.22 -0.55 1.11 0.00 -1.47 0.00 0.00 33.84 33.15 2qqv n VAL 336 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 2qqv h ARG 337 N 2.33 0.00 -0.04 7.34 2.47 -1.92 -2.42 114.38 122.14 2qqv h ARG 337 Ca -0.39 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.34 2qqv h ARG 337 Cb 1.38 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.70 2qqv h ARG 337 CO 0.64 0.00 0.03 0.93 0.56 0.00 0.00 179.97 182.13 2qqv h GLU 338 N 0.00 0.00 0.00 0.04 3.07 -1.87 -1.79 114.58 114.02 2qqv h GLU 338 Ca -0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 2qqv h GLU 338 Cb 0.11 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.02 2qqv h GLU 338 CO 0.00 0.00 -0.08 -0.24 -1.40 0.00 0.00 179.01 177.29 2qqv h VAL 339 N 0.00 0.51 0.00 3.13 3.04 -1.76 -2.31 116.25 118.86 2qqv h VAL 339 Ca 0.02 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.32 2qqv h VAL 339 Cb 0.08 1.26 0.00 0.00 -2.01 0.00 0.00 31.29 30.62 2qqv h VAL 339 CO -0.00 0.08 0.00 -0.62 -1.01 0.00 0.00 177.57 176.02 2qqv n GLU 340 N -3.63 0.13 0.20 4.17 1.02 -0.67 -2.04 120.64 119.82 2qqv n GLU 340 Ca -0.02 0.38 0.07 0.00 -0.02 0.00 0.00 57.16 57.57 2qqv n GLU 340 Cb 0.20 -1.76 0.42 0.00 -0.02 0.00 0.00 31.44 30.27 2qqv n GLU 340 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qqv h ARG 341 N 0.00 0.00 0.00 3.49 3.08 -1.58 -3.03 114.38 116.34 2qqv h ARG 341 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qqv h ARG 341 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2qqv h ARG 341 CO 0.00 0.31 0.00 1.28 -1.07 0.00 0.00 179.97 180.49 2qqv n LEU 342 N -3.56 0.15 -4.73 3.04 4.77 -0.86 -4.82 117.00 110.98 2qqv n LEU 342 Ca -0.00 0.53 -0.42 0.00 -0.03 0.00 0.00 56.01 56.09 2qqv n LEU 342 Cb 0.45 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 2qqv n LEU 342 CO 0.35 -0.23 1.09 -0.13 -1.33 0.00 0.00 177.39 177.15 2qqv s ARG 343 N -3.05 4.29 0.46 3.23 0.52 -1.15 0.14 118.95 123.40 2qqv s ARG 343 Ca 0.09 2.22 -0.25 0.00 -0.52 0.00 0.00 55.73 57.27 2qqv s ARG 343 Cb 0.12 -3.16 -0.08 0.00 0.52 0.00 0.00 34.95 32.35 2qqv s ARG 343 CO 0.37 -0.42 1.43 0.99 0.02 0.00 0.00 175.30 177.69 2qqv s THR 344 N 0.43 2.02 0.32 0.02 2.01 0.27 -4.89 115.64 115.82 2qqv s THR 344 Ca 0.62 0.01 0.07 0.00 0.31 0.00 0.00 61.69 62.70 2qqv s THR 344 Cb -0.40 -3.01 0.31 0.00 0.01 0.00 0.00 72.50 69.41 2qqv s THR 344 CO 0.38 0.00 1.81 0.11 -0.69 0.00 0.00 174.62 176.23 2qqv h LYS 345 N 2.21 0.73 -6.77 4.92 1.79 -1.93 -3.40 116.57 114.12 2qqv h LYS 345 Ca -0.51 -0.04 -0.51 0.00 -2.18 0.00 0.00 60.65 57.41 2qqv h LYS 345 Cb 1.27 -0.16 0.02 0.00 -1.58 0.00 0.00 32.23 31.78 2qqv h LYS 345 CO 0.61 0.48 0.52 -1.14 -1.08 0.00 0.00 179.45 178.83 2qqv s GLN 346 N -5.79 4.57 -0.10 3.15 2.00 -1.26 -5.05 119.66 117.17 2qqv s GLN 346 Ca -0.11 1.87 -0.04 0.00 -2.00 0.00 0.00 55.36 55.08 2qqv s GLN 346 Cb 0.24 -3.19 0.05 0.00 0.80 0.00 0.00 33.01 30.91 2qqv s GLN 346 CO 0.80 0.08 0.18 0.54 -0.50 0.00 0.00 175.29 176.39 2qqv s VAL 347 N -0.82 -0.28 -0.03 1.34 0.11 -1.26 -4.47 120.40 114.98 2qqv s VAL 347 Ca 0.47 0.29 -0.30 0.00 -2.93 0.00 0.00 61.98 59.51 2qqv s VAL 347 Cb -0.33 -0.36 -0.03 0.00 -1.53 0.00 0.00 36.38 34.13 2qqv s VAL 347 CO 0.41 0.10 1.14 -0.75 -3.33 0.00 0.00 175.10 172.66 2qqv s LYS 348 N 2.31 4.41 -0.06 1.54 2.47 -0.67 -4.94 119.74 124.80 2qqv s LYS 348 Ca 0.03 1.61 0.02 0.00 -1.56 0.00 0.00 55.97 56.07 2qqv s LYS 348 Cb -0.12 -3.50 0.02 0.00 -1.46 0.00 0.00 37.83 32.76 2qqv s LYS 348 CO -0.07 -0.33 -0.11 1.21 0.16 0.00 0.00 175.35 176.21 2qqv s ASN 349 N 1.27 1.66 -0.02 1.43 3.84 -1.26 -0.83 114.94 121.02 2qqv s ASN 349 Ca 0.55 -0.27 0.03 0.00 0.21 0.00 0.00 52.86 53.38 2qqv s ASN 349 Cb -0.24 -0.77 -0.00 0.00 -0.55 0.00 0.00 41.25 39.69 2qqv s ASN 349 CO 0.23 0.01 -0.11 -0.76 -2.79 0.00 0.00 177.10 173.68 2qqv s LEU 350 N 0.75 1.92 -0.00 3.21 1.43 0.50 -5.01 118.68 121.47 2qqv s LEU 350 Ca -0.13 -0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 52.63 2qqv s LEU 350 Cb -0.15 -0.63 0.02 0.00 0.03 0.00 0.00 46.19 45.45 2qqv s LEU 350 CO 0.03 0.12 0.25 0.00 0.23 0.00 0.00 176.35 176.97 2qqv s ARG 351 N -0.06 0.62 -1.16 1.70 1.70 -1.26 0.51 118.95 120.99 2qqv s ARG 351 Ca 0.01 -0.29 -0.14 0.00 -0.47 0.00 0.00 55.73 54.84 2qqv s ARG 351 Cb -0.07 0.27 -0.02 0.00 -0.57 0.00 0.00 34.95 34.56 2qqv s ARG 351 CO 0.00 -0.16 0.78 0.09 -1.08 0.00 0.00 175.30 174.93 2qqv n ASN 352 N 1.28 -4.68 -4.38 -2.89 3.02 -0.59 -4.98 115.26 102.04 2qqv n ASN 352 Ca -0.22 -0.93 -0.31 0.00 -0.03 0.00 0.00 54.58 53.09 2qqv n ASN 352 Cb 0.56 -3.80 -0.15 0.00 -0.61 0.00 0.00 39.78 35.79 2qqv n ASN 352 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2qqv s LYS 353 N -5.72 2.20 -0.37 3.52 -0.14 -1.03 -4.99 119.74 113.21 2qqv s LYS 353 Ca 0.38 -0.88 -0.07 0.00 -1.36 0.00 0.00 55.97 54.04 2qqv s LYS 353 Cb -0.12 -2.16 0.06 0.00 -1.68 0.00 0.00 37.83 33.93 2qqv s LYS 353 CO 0.83 0.57 0.17 0.14 -0.76 0.00 0.00 175.35 176.31 2qqv s VAL 354 N -0.71 3.92 -0.56 3.17 -7.23 -1.26 -1.17 120.40 116.57 2qqv s VAL 354 Ca 0.11 -1.30 -0.26 0.00 -1.81 0.00 0.00 61.98 58.72 2qqv s VAL 354 Cb -0.10 -3.33 0.04 0.00 0.56 0.00 0.00 36.38 33.55 2qqv s VAL 354 CO 0.01 -0.35 1.03 -0.76 -0.31 0.00 0.00 175.10 174.72 2qqv s LEU 355 N 1.39 3.86 0.83 1.32 1.43 -1.07 -5.00 118.68 121.44 2qqv s LEU 355 Ca 0.01 -0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 52.83 2qqv s LEU 355 Cb -0.21 -2.97 0.11 0.00 0.03 0.00 0.00 46.19 43.15 2qqv s LEU 355 CO 0.02 -1.32 1.18 -1.59 0.23 0.00 0.00 176.35 174.88 2qqv s LYS 356 N 4.32 1.66 -0.21 1.70 -2.85 -1.26 -2.21 119.74 120.88 2qqv s LYS 356 Ca 0.35 -0.12 -0.39 0.00 -1.00 0.00 0.00 55.97 54.82 2qqv s LYS 356 Cb -0.11 -1.97 -0.15 0.00 -2.06 0.00 0.00 37.83 33.54 2qqv s LYS 356 CO 0.22 -1.74 1.74 0.45 0.10 0.00 0.00 175.35 176.12 2qqv n SER 357 N -3.35 2.55 -2.19 0.03 2.88 -1.26 -2.54 113.62 109.73 2qqv n SER 357 Ca 0.10 1.06 -0.08 0.00 -1.33 0.00 0.00 58.87 58.62 2qqv n SER 357 Cb 0.60 -1.19 0.04 0.00 -0.75 0.00 0.00 64.21 62.91 2qqv n SER 357 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qqv n GLY 358 N 4.11 0.03 3.25 0.46 0.00 -0.21 -4.99 105.19 107.84 2qqv n GLY 358 Ca 0.25 -0.14 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 2qqv n GLY 358 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qqv s SER 359 N -3.56 1.58 0.05 1.61 1.04 -0.52 -5.00 113.70 108.89 2qqv s SER 359 Ca 0.04 -1.08 0.01 0.00 0.48 0.00 0.00 55.95 55.40 2qqv s SER 359 Cb -0.01 0.03 -0.03 0.00 0.10 0.00 0.00 66.02 66.12 2qqv s SER 359 CO 0.35 -0.43 -0.05 -0.13 0.98 0.00 0.00 173.24 173.96 2qqv s ARG 360 N -3.81 0.53 -0.18 4.02 0.52 -1.26 -1.90 118.95 116.87 2qqv s ARG 360 Ca 0.19 -0.92 -0.05 0.00 -0.52 0.00 0.00 55.73 54.43 2qqv s ARG 360 Cb 0.04 -0.03 0.06 0.00 0.52 0.00 0.00 34.95 35.54 2qqv s ARG 360 CO 0.02 -0.03 0.09 -1.17 0.02 0.00 0.00 175.30 174.22 2qqv s LEU 361 N -2.12 0.44 0.22 2.53 0.20 0.74 -4.98 118.68 115.71 2qqv s LEU 361 Ca -0.04 -0.68 -0.30 0.00 0.69 0.00 0.00 54.13 53.80 2qqv s LEU 361 Cb -0.03 -0.28 -0.08 0.00 -0.43 0.00 0.00 46.19 45.36 2qqv s LEU 361 CO -0.03 -0.35 1.10 -0.70 -0.29 0.00 0.00 176.35 176.07 2qqv s GLU 362 N 2.11 4.61 -0.50 1.98 2.12 -1.26 -1.23 118.70 126.53 2qqv s GLU 362 Ca 0.02 1.75 -0.19 0.00 0.36 0.00 0.00 54.97 56.92 2qqv s GLU 362 Cb -0.16 -3.24 0.06 0.00 0.26 0.00 0.00 34.13 31.05 2qqv s GLU 362 CO -0.11 0.13 0.59 0.08 -0.54 0.00 0.00 175.26 175.42 2qqv s VAL 363 N -0.58 4.93 0.43 3.70 1.01 0.00 -4.97 120.40 124.91 2qqv s VAL 363 Ca 0.48 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.77 2qqv s VAL 363 Cb -0.30 -4.28 -0.06 0.00 0.00 0.00 0.00 36.38 31.74 2qqv s VAL 363 CO 0.37 -0.78 0.79 -0.31 0.00 0.00 0.00 175.10 175.16 2qqv s TYR 364 N 2.49 3.49 -0.33 5.22 1.51 -1.26 -4.53 117.35 123.93 2qqv s TYR 364 Ca 0.13 1.03 -0.01 0.00 -1.01 0.00 0.00 57.07 57.21 2qqv s TYR 364 Cb -0.20 -2.44 0.00 0.00 -0.11 0.00 0.00 41.96 39.21 2qqv s TYR 364 CO 0.11 -0.16 0.19 0.41 -1.11 0.00 0.00 175.55 174.99 2qqv n GLY 365 N -1.50 0.49 2.96 0.71 0.00 -1.26 -4.89 105.19 101.71 2qqv n GLY 365 Ca 0.02 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 2qqv n GLY 365 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qqv s VAL 366 N -2.82 0.06 -0.77 1.61 -7.23 -1.26 -4.75 120.40 105.23 2qqv s VAL 366 Ca 0.09 -0.52 -0.25 0.00 -1.81 0.00 0.00 61.98 59.49 2qqv s VAL 366 Cb -0.04 -0.20 -0.04 0.00 0.56 0.00 0.00 36.38 36.66 2qqv s VAL 366 CO 0.11 -0.29 1.95 0.42 -0.31 0.00 0.00 175.10 176.99 2qqv s THR 367 N -0.86 3.38 -0.78 5.32 -4.23 -1.26 -4.83 115.64 112.37 2qqv s THR 367 Ca -0.09 -0.13 0.19 0.00 -1.18 0.00 0.00 61.69 60.48 2qqv s THR 367 Cb -0.06 -3.91 0.18 0.00 1.34 0.00 0.00 72.50 70.06 2qqv s THR 367 CO -0.00 -0.86 1.60 0.00 -0.54 0.00 0.00 174.62 174.81 2qqv n ALA 368 N 13.79 1.73 1.04 3.99 0.00 -1.26 -1.91 120.51 137.88 2qqv n ALA 368 Ca 0.33 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.88 2qqv n ALA 368 Cb 0.49 -1.32 0.04 0.00 0.00 0.00 0.00 19.45 18.66 2qqv n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qqv n ALA 369 N -1.62 3.70 -3.23 0.00 0.00 -1.26 -4.49 120.51 113.62 2qqv n ALA 369 Ca 0.03 -0.59 -0.15 0.00 0.00 0.00 0.00 53.44 52.73 2qqv n ALA 369 Cb 0.21 -0.85 -0.06 0.00 0.00 0.00 0.00 19.45 18.75 2qqv n ALA 369 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2qqv s GLN 370 N -2.59 0.82 0.23 0.00 0.74 -0.80 0.43 119.66 118.48 2qqv s GLN 370 Ca 0.17 -1.18 -0.16 0.00 0.05 0.00 0.00 55.36 54.25 2qqv s GLN 370 Cb 0.18 -0.69 0.01 0.00 1.10 0.00 0.00 33.01 33.61 2qqv s GLN 370 CO 0.62 -1.27 0.52 0.00 -0.55 0.00 0.00 175.29 174.61 2qqv s ALA 371 N 0.99 -0.65 -0.08 1.58 0.00 -0.48 -1.32 121.76 121.80 2qqv s ALA 371 Ca 0.24 -0.54 0.02 0.00 0.00 0.00 0.00 51.96 51.69 2qqv s ALA 371 Cb -0.07 0.93 0.01 0.00 0.00 0.00 0.00 23.12 24.00 2qqv s ALA 371 CO -0.07 -0.85 -0.15 0.34 0.00 0.00 0.00 175.76 175.03 2qqv s ASP 372 N -2.94 2.16 -0.03 0.00 2.15 0.43 -0.61 116.67 117.83 2qqv s ASP 372 Ca 0.15 -0.37 0.01 0.00 0.43 0.00 0.00 52.55 52.77 2qqv s ASP 372 Cb -0.01 -0.99 0.02 0.00 -0.30 0.00 0.00 42.92 41.64 2qqv s ASP 372 CO 0.03 0.05 -0.03 0.54 -0.17 0.00 0.00 175.17 175.59 2qqv s VAL 373 N 0.69 0.41 -0.09 1.11 0.11 -0.77 0.34 120.40 122.20 2qqv s VAL 373 Ca -0.13 -0.09 0.02 0.00 -2.93 0.00 0.00 61.98 58.85 2qqv s VAL 373 Cb -0.16 -0.44 0.01 0.00 -1.53 0.00 0.00 36.38 34.27 2qqv s VAL 373 CO 0.03 0.18 -0.15 -1.61 -3.33 0.00 0.00 175.10 170.23 2qqv s GLU 374 N 0.72 2.07 0.03 1.54 2.02 -0.32 -1.47 118.70 123.29 2qqv s GLU 374 Ca -0.09 -0.52 0.08 0.00 0.02 0.00 0.00 54.97 54.46 2qqv s GLU 374 Cb -0.12 -1.73 -0.02 0.00 0.10 0.00 0.00 34.13 32.36 2qqv s GLU 374 CO -0.00 -0.01 -0.23 0.08 0.02 0.00 0.00 175.26 175.11 2qqv s VAL 375 N 0.83 1.88 -0.20 2.63 1.01 -0.05 -1.53 120.40 124.97 2qqv s VAL 375 Ca -0.11 -1.21 0.01 0.00 0.00 0.00 0.00 61.98 60.67 2qqv s VAL 375 Cb -0.15 -1.60 0.03 0.00 0.00 0.00 0.00 36.38 34.65 2qqv s VAL 375 CO 0.01 0.34 -0.17 -0.76 0.00 0.00 0.00 175.10 174.53 2qqv s LEU 376 N -1.03 2.44 -0.20 3.92 1.43 -0.10 -2.12 118.68 123.02 2qqv s LEU 376 Ca 0.09 -0.77 -0.08 0.00 -1.03 0.00 0.00 54.13 52.34 2qqv s LEU 376 Cb -0.09 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 2qqv s LEU 376 CO 0.01 -0.04 0.08 -0.36 0.23 0.00 0.00 176.35 176.27 2qqv s PHE 377 N 1.27 3.25 -0.20 0.29 0.40 -0.40 -0.67 117.98 121.91 2qqv s PHE 377 Ca 0.02 0.05 -0.05 0.00 -0.60 0.00 0.00 56.93 56.36 2qqv s PHE 377 Cb -0.14 -2.13 -0.02 0.00 0.51 0.00 0.00 43.02 41.24 2qqv s PHE 377 CO -0.11 0.09 -0.02 0.21 0.70 0.00 0.00 175.22 176.10 2qqv s LYS 378 N 0.60 3.54 0.01 0.44 2.47 0.81 -0.10 119.74 127.51 2qqv s LYS 378 Ca 0.04 -0.56 -0.20 0.00 -1.56 0.00 0.00 55.97 53.69 2qqv s LYS 378 Cb -0.13 -3.05 -0.06 0.00 -1.46 0.00 0.00 37.83 33.14 2qqv s LYS 378 CO 0.01 -0.05 0.58 0.08 0.16 0.00 0.00 175.35 176.14 2qqv s VAL 379 N 1.13 4.88 -0.03 4.02 1.01 -1.26 -1.35 120.40 128.80 2qqv s VAL 379 Ca 0.02 1.22 -0.03 0.00 0.00 0.00 0.00 61.98 63.20 2qqv s VAL 379 Cb -0.14 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 2qqv s VAL 379 CO 0.01 0.45 0.25 0.03 0.00 0.00 0.00 175.10 175.84 2qqv h ARG 380 N 5.39 -0.10 -4.61 2.72 3.08 -1.96 -3.45 114.38 115.44 2qqv h ARG 380 Ca -0.46 0.01 -0.63 0.00 0.07 0.00 0.00 59.98 58.96 2qqv h ARG 380 Cb 1.20 0.02 -0.37 0.00 0.08 0.00 0.00 29.97 30.90 2qqv h ARG 380 CO 0.68 -0.07 -0.80 0.34 -1.07 0.00 0.00 179.97 179.05 2qqv s ASP 381 N -3.71 3.86 0.48 7.04 2.15 -1.26 -5.01 116.67 120.21 2qqv s ASP 381 Ca -0.02 -1.13 0.27 0.00 0.43 0.00 0.00 52.55 52.11 2qqv s ASP 381 Cb 0.00 -1.32 0.98 0.00 -0.30 0.00 0.00 42.92 42.28 2qqv s ASP 381 CO 0.05 -0.18 1.84 -0.07 -0.17 0.00 0.00 175.17 176.63 2qqv h LEU 382 N 7.90 0.00 -0.20 -1.34 3.38 -1.96 -2.86 115.31 120.23 2qqv h LEU 382 Ca -0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2qqv h LEU 382 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2qqv h LEU 382 CO 0.46 0.12 0.00 -1.84 0.09 0.00 0.00 178.44 177.26 2qqv n GLU 383 N -3.22 1.14 0.04 1.13 0.28 -1.26 -2.63 120.64 116.11 2qqv n GLU 383 Ca 0.01 -0.20 0.13 0.00 -0.16 0.00 0.00 57.16 56.94 2qqv n GLU 383 Cb 0.41 -1.39 0.36 0.00 1.43 0.00 0.00 31.44 32.25 2qqv n GLU 383 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2qqv n LYS 384 N -0.66 0.13 -2.12 3.44 4.76 -1.08 -4.90 118.16 117.73 2qqv n LYS 384 Ca 0.18 0.06 -0.41 0.00 -2.87 0.00 0.00 58.31 55.27 2qqv n LYS 384 Cb 0.13 -1.61 -0.02 0.00 -1.84 0.00 0.00 35.03 31.70 2qqv n LYS 384 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qqv s ALA 385 N -3.06 3.51 0.60 7.82 0.00 -1.08 -4.48 121.76 125.06 2qqv s ALA 385 Ca 0.10 1.25 -0.17 0.00 0.00 0.00 0.00 51.96 53.15 2qqv s ALA 385 Cb 0.16 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.77 2qqv s ALA 385 CO 0.64 -0.63 1.10 -0.51 0.00 0.00 0.00 175.76 176.36 2qqv s ASP 386 N -0.37 5.52 -0.03 0.00 1.11 -1.26 -4.60 116.67 117.04 2qqv s ASP 386 Ca 0.50 1.99 -0.22 0.00 0.18 0.00 0.00 52.55 55.01 2qqv s ASP 386 Cb -0.40 -2.55 -0.05 0.00 1.07 0.00 0.00 42.92 40.99 2qqv s ASP 386 CO 0.51 -1.35 0.63 -0.69 1.18 0.00 0.00 175.17 175.45 2qqv s VAL 387 N -2.20 4.96 0.25 -1.27 1.01 -1.26 -0.38 120.40 121.51 2qqv s VAL 387 Ca 0.68 1.32 -0.31 0.00 0.00 0.00 0.00 61.98 63.67 2qqv s VAL 387 Cb -0.20 -3.97 -0.12 0.00 0.00 0.00 0.00 36.38 32.09 2qqv s VAL 387 CO 0.35 0.35 1.64 0.00 0.00 0.00 0.00 175.10 177.44 2qqv n ILE 388 N 3.16 0.60 -1.98 2.22 3.06 -0.56 -4.83 119.36 121.02 2qqv n ILE 388 Ca -0.05 -0.15 -0.41 0.00 -2.50 0.00 0.00 62.75 59.64 2qqv n ILE 388 Cb 0.51 -1.94 -0.02 0.00 0.54 0.00 0.00 39.64 38.73 2qqv n ILE 388 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 2qqv s GLU 389 N 0.18 4.25 0.14 9.51 2.56 -1.26 -4.85 118.70 129.23 2qqv s GLU 389 Ca 0.69 2.33 -0.27 0.00 0.00 0.00 0.00 54.97 57.72 2qqv s GLU 389 Cb -0.51 -3.11 -0.06 0.00 2.00 0.00 0.00 34.13 32.45 2qqv s GLU 389 CO 0.42 -0.46 1.39 -2.30 -0.56 0.00 0.00 175.26 173.75 2qqv n PRO 390 N 2.46 -0.38 -1.18 4.30 -0.01 -1.26 -2.10 135.00 136.83 2qqv n PRO 390 Ca 0.07 1.36 -0.27 0.00 -0.01 0.00 0.00 63.50 64.66 2qqv n PRO 390 Cb 0.40 -2.00 0.05 0.00 -0.01 0.00 0.00 33.50 31.94 2qqv n PRO 390 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 175.50 174.36 2qqv n SER 391 N -5.04 7.12 -4.24 2.55 3.41 -1.26 -4.80 113.62 111.36 2qqv n SER 391 Ca 0.02 -3.45 -0.42 0.00 -0.26 0.00 0.00 58.87 54.75 2qqv n SER 391 Cb 0.23 -1.03 -0.07 0.00 -0.26 0.00 0.00 64.21 63.08 2qqv n SER 391 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 2qqv s TRP 392 N -2.87 3.44 0.00 7.33 0.52 -0.89 -4.84 118.94 121.62 2qqv s TRP 392 Ca 0.50 -1.86 0.00 0.00 0.02 0.00 0.00 56.10 54.76 2qqv s TRP 392 Cb 0.39 -3.58 0.00 0.00 -1.15 0.00 0.00 33.47 29.13 2qqv s TRP 392 CO -0.04 -0.99 0.00 0.25 0.02 0.00 0.00 176.95 176.20 2qqv n THR 393 N 4.71 0.00 -2.98 2.01 -2.24 -1.26 -4.96 114.28 109.56 2qqv n THR 393 Ca -0.05 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.31 2qqv n THR 393 Cb 0.41 -0.78 -0.05 0.00 -2.10 0.00 0.00 70.33 67.81 2qqv n THR 393 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qqv s ASP 394 N -3.39 6.47 0.47 3.42 3.68 -1.26 -4.94 116.67 121.12 2qqv s ASP 394 Ca 0.00 0.12 0.20 0.00 2.13 0.00 0.00 52.55 55.00 2qqv s ASP 394 Cb 0.00 -2.38 1.15 0.00 -1.45 0.00 0.00 42.92 40.24 2qqv s ASP 394 CO 0.00 -0.80 2.00 1.55 0.13 0.00 0.00 175.17 178.05 2qqv h PRO 395 N 8.70 0.00 -0.06 4.34 0.13 -1.93 -2.30 132.00 140.88 2qqv h PRO 395 Ca -0.25 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.74 2qqv h PRO 395 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 2qqv h PRO 395 CO 0.92 0.19 -0.59 0.37 -0.23 0.00 0.00 178.00 178.67 2qqv h GLN 396 N 0.00 0.19 -0.02 0.86 4.15 -1.92 -3.14 115.11 115.22 2qqv h GLN 396 Ca -0.00 -0.12 -0.13 0.00 0.77 0.00 0.00 58.65 59.16 2qqv h GLN 396 Cb 0.40 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.09 2qqv h GLN 396 CO 0.02 0.72 -0.61 -0.07 -1.93 0.00 0.00 178.83 176.97 2qqv h LEU 397 N 0.14 0.10 -0.34 -2.39 4.07 -1.79 -3.05 115.31 112.04 2qqv h LEU 397 Ca -0.00 -0.06 -0.03 0.00 0.08 0.00 0.00 57.88 57.87 2qqv h LEU 397 Cb 1.07 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.77 2qqv h LEU 397 CO 0.09 0.68 0.10 0.40 -1.08 0.00 0.00 178.44 178.62 2qqv h ILE 398 N 0.06 1.21 0.00 1.22 1.08 -1.47 -1.66 117.51 117.95 2qqv h ILE 398 Ca -0.01 -0.70 -0.04 0.00 -0.39 0.00 0.00 64.86 63.73 2qqv h ILE 398 Cb 1.09 1.04 -0.01 0.00 -3.07 0.00 0.00 36.82 35.87 2qqv h ILE 398 CO 0.08 0.24 -0.17 0.00 -0.69 0.00 0.00 178.15 177.61 2qqv n SER 400 N -3.41 0.52 -0.08 0.00 3.41 -1.16 -4.17 113.62 108.73 2qqv n SER 400 Ca -0.00 0.21 -0.09 0.00 -0.26 0.00 0.00 58.87 58.73 2qqv n SER 400 Cb 0.36 0.40 0.07 0.00 -0.26 0.00 0.00 64.21 64.78 2qqv n SER 400 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2qqv h LYS 401 N 0.00 0.76 -3.83 4.33 1.57 -1.23 -3.40 116.57 114.77 2qqv h LYS 401 Ca -0.42 -0.34 -0.59 0.00 -1.87 0.00 0.00 60.65 57.43 2qqv h LYS 401 Cb 2.12 -0.02 -0.40 0.00 0.08 0.00 0.00 32.23 34.02 2qqv h LYS 401 CO 0.05 0.96 -0.76 0.00 -0.57 0.00 0.00 179.45 179.14 2qqv s MET 402 N -4.48 0.95 0.40 3.15 0.23 -0.95 -5.08 119.30 113.52 2qqv s MET 402 Ca -0.09 -1.09 -0.07 0.00 -1.03 0.00 0.00 55.69 53.41 2qqv s MET 402 Cb 0.12 -2.26 0.10 0.00 -1.53 0.00 0.00 34.83 31.26 2qqv s MET 402 CO 0.84 -0.88 0.42 0.27 -2.03 0.00 0.00 175.02 173.64 2qqv n ASN 403 N 4.77 -0.85 0.34 -1.18 0.23 -1.26 -4.66 115.26 112.65 2qqv n ASN 403 Ca -0.04 -0.90 0.22 0.00 -0.53 0.00 0.00 54.58 53.34 2qqv n ASN 403 Cb 0.43 -0.35 1.19 0.00 -2.08 0.00 0.00 39.78 38.97 2qqv n ASN 403 CO 0.00 0.00 0.00 -0.37 -0.93 0.00 0.00 177.26 175.96 2qqv h VAL 404 N -1.68 0.00 0.00 3.53 -1.51 -2.01 -2.10 116.25 112.48 2qqv h VAL 404 Ca -0.15 0.00 -0.14 0.00 -1.23 0.00 0.00 66.70 65.18 2qqv h VAL 404 Cb 0.43 0.97 -0.02 0.00 -2.13 0.00 0.00 31.29 30.54 2qqv h VAL 404 CO 0.10 0.00 -0.69 -1.28 -1.23 0.00 0.00 177.57 174.47 2qqv h SER 405 N 0.00 0.00 -3.40 4.19 0.87 -1.99 -3.43 113.55 109.78 2qqv h SER 405 Ca 0.00 0.00 -0.59 0.00 -1.23 0.00 0.00 61.79 59.97 2qqv h SER 405 Cb 0.06 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 61.93 2qqv h SER 405 CO -0.00 0.69 0.16 -0.69 -0.53 0.00 0.00 176.83 176.46 2qqv s VAL 406 N -3.13 5.00 -0.07 2.23 1.01 -0.79 -5.05 120.40 119.59 2qqv s VAL 406 Ca 0.01 1.24 -0.04 0.00 0.00 0.00 0.00 61.98 63.20 2qqv s VAL 406 Cb 0.10 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 2qqv s VAL 406 CO 0.77 0.10 0.10 -1.59 0.00 0.00 0.00 175.10 174.47 2qqv s LYS 407 N 1.97 3.25 0.37 2.72 -2.85 -1.26 -4.69 119.74 119.24 2qqv s LYS 407 Ca 0.30 -0.30 0.08 0.00 -1.00 0.00 0.00 55.97 55.05 2qqv s LYS 407 Cb -0.16 -3.01 -0.03 0.00 -2.06 0.00 0.00 37.83 32.57 2qqv s LYS 407 CO 0.10 0.72 0.29 -1.12 0.10 0.00 0.00 175.35 175.45 2qqv s SER 408 N -1.26 5.04 0.14 0.03 0.01 -0.30 -4.93 113.70 112.42 2qqv s SER 408 Ca 0.18 -0.67 -0.24 0.00 1.31 0.00 0.00 55.95 56.52 2qqv s SER 408 Cb -0.12 -0.75 -0.00 0.00 0.21 0.00 0.00 66.02 65.36 2qqv s SER 408 CO 0.08 -0.47 1.62 1.23 0.41 0.00 0.00 173.24 176.11 2qqv h GLY 409 N 1.23 -0.32 -7.81 3.44 0.00 -1.91 -2.03 103.07 95.67 2qqv h GLY 409 Ca -0.43 0.35 -0.68 0.00 0.00 0.00 0.00 47.33 46.57 2qqv h GLY 409 CO 0.60 -0.21 -0.74 1.08 0.00 0.00 0.00 176.54 177.26 2qqv s LEU 410 N -10.45 3.71 0.00 3.11 1.43 -1.26 -2.49 118.68 112.73 2qqv s LEU 410 Ca -0.15 -1.32 0.00 0.00 -1.03 0.00 0.00 54.13 51.63 2qqv s LEU 410 Cb 0.11 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.68 2qqv s LEU 410 CO 0.67 -0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.63 2qqv n GLY 411 N 4.55 2.65 3.72 -3.19 0.00 -1.26 -1.83 105.19 109.82 2qqv n GLY 411 Ca -0.14 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.64 2qqv n GLY 411 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qqv s PRO 412 N -3.53 4.64 -0.00 1.61 0.04 -1.26 -1.15 135.00 135.35 2qqv s PRO 412 Ca 0.00 1.45 0.01 0.00 0.04 0.00 0.00 61.00 62.50 2qqv s PRO 412 Cb 0.00 -3.40 -0.00 0.00 0.04 0.00 0.00 34.50 31.13 2qqv s PRO 412 CO 0.00 0.10 -0.02 -0.59 0.04 0.00 0.00 177.00 176.53 2qqv s PHE 413 N 0.38 0.20 0.00 0.56 -0.12 -1.07 -0.53 117.98 117.40 2qqv s PHE 413 Ca 0.49 -0.04 0.00 0.00 -0.05 0.00 0.00 56.93 57.33 2qqv s PHE 413 Cb -0.23 -0.14 0.00 0.00 -0.63 0.00 0.00 43.02 42.03 2qqv s PHE 413 CO 0.29 -0.01 0.00 0.41 -0.05 0.00 0.00 175.22 175.87 2qqv n GLY 414 N 3.05 -0.63 3.46 1.99 0.00 -0.90 -0.12 105.19 112.04 2qqv n GLY 414 Ca -0.13 -0.21 -0.29 0.00 0.00 0.00 0.00 46.02 45.39 2qqv n GLY 414 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qqv s LEU 415 N 0.00 2.60 -0.29 0.99 1.43 0.10 -1.52 118.68 121.99 2qqv s LEU 415 Ca 0.00 -0.60 -0.02 0.00 -1.03 0.00 0.00 54.13 52.48 2qqv s LEU 415 Cb 0.00 -1.46 0.05 0.00 0.03 0.00 0.00 46.19 44.80 2qqv s LEU 415 CO 0.00 0.18 -0.01 -0.04 0.23 0.00 0.00 176.35 176.71 2qqv s MET 416 N -2.09 2.50 0.28 1.70 -1.94 0.55 -0.33 119.30 119.96 2qqv s MET 416 Ca 0.17 -1.22 0.08 0.00 -1.71 0.00 0.00 55.69 53.01 2qqv s MET 416 Cb -0.10 -3.14 -0.04 0.00 2.01 0.00 0.00 34.83 33.56 2qqv s MET 416 CO 0.09 -0.58 0.16 0.14 -0.01 0.00 0.00 175.02 174.82 2qqv s VAL 417 N 1.26 3.95 -1.03 -6.03 -7.23 0.89 -1.04 120.40 111.17 2qqv s VAL 417 Ca -0.04 -1.55 -0.16 0.00 -1.81 0.00 0.00 61.98 58.41 2qqv s VAL 417 Cb -0.19 -3.20 0.01 0.00 0.56 0.00 0.00 36.38 33.56 2qqv s VAL 417 CO -0.02 -0.32 0.71 0.18 -0.31 0.00 0.00 175.10 175.35 2qqv n LEU 418 N -1.14 -2.48 -4.43 1.32 4.77 -1.22 -1.35 117.00 112.48 2qqv n LEU 418 Ca -0.06 -0.96 -0.31 0.00 -0.03 0.00 0.00 56.01 54.64 2qqv n LEU 418 Cb 0.59 -2.13 -0.14 0.00 -2.33 0.00 0.00 43.42 39.41 2qqv n LEU 418 CO 0.42 0.34 -0.50 0.00 -1.33 0.00 0.00 177.39 176.33 2qqv s ALA 419 N -3.30 2.51 0.57 -1.18 0.00 -1.04 -4.06 121.76 115.25 2qqv s ALA 419 Ca 0.31 -1.12 -0.15 0.00 0.00 0.00 0.00 51.96 51.00 2qqv s ALA 419 Cb -0.13 -0.75 -0.05 0.00 0.00 0.00 0.00 23.12 22.18 2qqv s ALA 419 CO 0.88 0.56 1.02 -1.54 0.00 0.00 0.00 175.76 176.68 2qqv s SER 420 N -1.03 6.24 0.15 0.00 1.04 -0.25 0.55 113.70 120.39 2qqv s SER 420 Ca 0.12 1.62 -0.31 0.00 0.48 0.00 0.00 55.95 57.86 2qqv s SER 420 Cb -0.10 -2.51 -0.08 0.00 0.10 0.00 0.00 66.02 63.43 2qqv s SER 420 CO 0.02 -0.86 1.55 0.11 0.98 0.00 0.00 173.24 175.04 2qqv h LYS 421 N 0.47 -0.24 -0.66 4.02 1.57 -1.91 -1.00 116.57 118.81 2qqv h LYS 421 Ca -0.46 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2qqv h LYS 421 Cb 1.20 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.56 2qqv h LYS 421 CO 0.60 -0.16 0.00 0.09 -0.57 0.00 0.00 179.45 179.41 2qqv n ASN 422 N -5.34 3.64 -3.56 0.86 4.13 -1.26 -4.93 115.26 108.80 2qqv n ASN 422 Ca -0.01 -2.43 -0.22 0.00 1.68 0.00 0.00 54.58 53.59 2qqv n ASN 422 Cb 0.32 -0.54 0.08 0.00 -1.54 0.00 0.00 39.78 38.10 2qqv n ASN 422 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2qqv n LEU 423 N 0.54 -3.56 0.08 3.41 4.32 -0.38 -4.91 117.00 116.50 2qqv n LEU 423 Ca 0.17 -0.57 -0.10 0.00 -0.02 0.00 0.00 56.01 55.49 2qqv n LEU 423 Cb 0.74 -3.05 -0.07 0.00 -1.62 0.00 0.00 43.42 39.41 2qqv n LEU 423 CO 0.18 0.58 0.14 -0.33 -1.22 0.00 0.00 177.39 176.74 2qqv h GLU 424 N -2.48 0.16 -5.09 3.23 3.07 -1.92 -3.44 114.58 108.12 2qqv h GLU 424 Ca -0.58 -0.23 -0.60 0.00 -0.50 0.00 0.00 59.36 57.46 2qqv h GLU 424 Cb 1.36 0.08 -0.33 0.00 -0.84 0.00 0.00 28.75 29.02 2qqv h GLU 424 CO 0.55 1.03 -0.85 -1.21 -1.40 0.00 0.00 179.01 177.13 2qqv s GLU 425 N -2.93 2.34 -0.19 2.33 2.02 -1.26 -4.85 118.70 116.14 2qqv s GLU 425 Ca -0.02 -0.67 -0.26 0.00 0.02 0.00 0.00 54.97 54.04 2qqv s GLU 425 Cb 0.09 -1.85 0.07 0.00 0.10 0.00 0.00 34.13 32.54 2qqv s GLU 425 CO 0.84 0.15 0.68 1.52 0.02 0.00 0.00 175.26 178.47 2qqv s TYR 426 N 0.38 -0.72 -0.27 1.61 -0.85 -0.65 -1.09 117.35 115.77 2qqv s TYR 426 Ca -0.14 1.61 -0.06 0.00 -0.52 0.00 0.00 57.07 57.96 2qqv s TYR 426 Cb -0.16 0.30 -0.00 0.00 0.38 0.00 0.00 41.96 42.48 2qqv s TYR 426 CO 0.06 -0.43 0.05 0.99 -1.52 0.00 0.00 175.55 174.69 2qqv s THR 427 N -0.12 3.88 -0.18 -3.49 2.01 -0.45 -2.87 115.64 114.41 2qqv s THR 427 Ca -0.03 -0.57 -0.08 0.00 0.31 0.00 0.00 61.69 61.31 2qqv s THR 427 Cb -0.03 -2.92 -0.04 0.00 0.01 0.00 0.00 72.50 69.51 2qqv s THR 427 CO 0.04 0.19 0.09 -0.94 -0.69 0.00 0.00 174.62 173.31 2qqv s SER 428 N 1.51 5.88 -0.20 3.53 1.04 -0.71 -0.07 113.70 124.67 2qqv s SER 428 Ca 0.04 0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.64 2qqv s SER 428 Cb -0.16 -2.01 0.04 0.00 0.10 0.00 0.00 66.02 63.99 2qqv s SER 428 CO 0.01 0.19 -0.15 -0.69 0.98 0.00 0.00 173.24 173.58 2qqv s VAL 429 N 0.29 1.97 0.20 5.02 1.01 0.55 -0.61 120.40 128.82 2qqv s VAL 429 Ca 0.06 -1.13 -0.06 0.00 0.00 0.00 0.00 61.98 60.84 2qqv s VAL 429 Cb -0.12 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 2qqv s VAL 429 CO -0.01 0.29 0.25 -0.72 0.00 0.00 0.00 175.10 174.92 2qqv s TYR 430 N 1.27 0.79 0.17 5.22 -0.85 -0.86 0.01 117.35 123.09 2qqv s TYR 430 Ca -0.00 -1.08 0.07 0.00 -0.52 0.00 0.00 57.07 55.53 2qqv s TYR 430 Cb -0.16 -0.26 -0.04 0.00 0.38 0.00 0.00 41.96 41.89 2qqv s TYR 430 CO -0.10 -0.75 -0.00 -0.06 -1.52 0.00 0.00 175.55 173.13 2qqv s PHE 431 N -4.08 2.86 -0.01 -3.49 0.08 0.83 -1.27 117.98 112.90 2qqv s PHE 431 Ca 0.30 -0.13 0.01 0.00 0.12 0.00 0.00 56.93 57.23 2qqv s PHE 431 Cb 0.04 -1.39 0.00 0.00 -0.57 0.00 0.00 43.02 41.10 2qqv s PHE 431 CO 0.09 0.51 -0.04 1.03 -0.10 0.00 0.00 175.22 176.70 2qqv s ARG 432 N -2.87 0.42 -0.15 0.44 0.52 -0.37 -2.61 118.95 114.31 2qqv s ARG 432 Ca 0.27 -0.15 0.01 0.00 -0.52 0.00 0.00 55.73 55.34 2qqv s ARG 432 Cb -0.10 -0.42 0.00 0.00 0.52 0.00 0.00 34.95 34.96 2qqv s ARG 432 CO 0.18 0.07 -0.17 0.42 0.02 0.00 0.00 175.30 175.83 2qqv s ILE 433 N 0.04 2.51 0.34 1.52 1.01 -0.76 -0.21 121.20 125.64 2qqv s ILE 433 Ca -0.00 -0.83 0.09 0.00 0.00 0.00 0.00 60.65 59.92 2qqv s ILE 433 Cb -0.04 -2.04 -0.06 0.00 0.01 0.00 0.00 42.46 40.33 2qqv s ILE 433 CO -0.00 0.52 -0.05 -0.36 0.00 0.00 0.00 174.94 175.05 2qqv s PHE 434 N 0.81 2.47 -0.05 3.97 0.08 -0.19 -4.10 117.98 120.95 2qqv s PHE 434 Ca -0.06 -0.46 -0.18 0.00 0.12 0.00 0.00 56.93 56.36 2qqv s PHE 434 Cb -0.15 -1.40 -0.05 0.00 -0.57 0.00 0.00 43.02 40.85 2qqv s PHE 434 CO -0.00 0.55 0.48 0.15 -0.10 0.00 0.00 175.22 176.29 2qqv s LYS 435 N -3.65 4.21 0.68 0.44 1.02 0.49 -1.40 119.74 121.52 2qqv s LYS 435 Ca 0.33 0.50 -0.14 0.00 0.02 0.00 0.00 55.97 56.68 2qqv s LYS 435 Cb 0.01 -3.35 0.01 0.00 -0.52 0.00 0.00 37.83 33.98 2qqv s LYS 435 CO 0.18 0.37 1.10 0.00 -0.92 0.00 0.00 175.35 176.08 2qqv s ALA 436 N -0.10 2.46 -1.63 5.17 0.00 -0.55 -1.49 121.76 125.62 2qqv s ALA 436 Ca 0.26 0.46 0.29 0.00 0.00 0.00 0.00 51.96 52.97 2qqv s ALA 436 Cb -0.16 -3.29 1.57 0.00 0.00 0.00 0.00 23.12 21.24 2qqv s ALA 436 CO 0.13 -1.33 2.04 -2.13 0.00 0.00 0.00 175.76 174.47 2qqv n ARG 437 N -2.63 0.60 -1.30 0.00 3.00 -1.26 -4.87 116.66 110.19 2qqv n ARG 437 Ca 0.10 0.01 -0.29 0.00 -0.00 0.00 0.00 57.85 57.67 2qqv n ARG 437 Cb 0.52 -1.50 0.16 0.00 0.00 0.00 0.00 32.46 31.64 2qqv n ARG 437 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2qqv s GLN 438 N -2.37 0.78 0.39 -0.14 -0.21 -1.26 -4.97 119.66 111.88 2qqv s GLN 438 Ca 0.34 0.47 0.20 0.00 0.02 0.00 0.00 55.36 56.38 2qqv s GLN 438 Cb 0.20 -1.78 0.74 0.00 1.00 0.00 0.00 33.01 33.17 2qqv s GLN 438 CO 0.41 -2.48 1.76 -0.91 -2.12 0.00 0.00 175.29 171.94 2qqv h ASN 439 N -1.71 0.00 -2.42 5.90 2.35 -2.00 -3.46 115.58 114.24 2qqv h ASN 439 Ca -0.53 0.00 -0.45 0.00 -0.55 0.00 0.00 56.30 54.78 2qqv h ASN 439 Cb 1.32 0.00 0.06 0.00 0.05 0.00 0.00 38.32 39.75 2qqv h ASN 439 CO 0.59 0.33 0.01 -0.94 -1.65 0.00 0.00 177.43 175.76 2qqv s SER 440 N -6.37 5.03 -1.17 5.81 1.04 -1.26 -4.98 113.70 111.80 2qqv s SER 440 Ca 0.00 -0.11 -0.11 0.00 0.48 0.00 0.00 55.95 56.22 2qqv s SER 440 Cb 0.11 -0.64 -0.07 0.00 0.10 0.00 0.00 66.02 65.52 2qqv s SER 440 CO 0.67 -1.34 2.34 0.59 0.98 0.00 0.00 173.24 176.49 2qqv n ASN 441 N -2.48 5.45 -4.79 7.02 4.13 -1.26 -4.91 115.26 118.43 2qqv n ASN 441 Ca 0.10 -2.53 -0.35 0.00 1.68 0.00 0.00 54.58 53.48 2qqv n ASN 441 Cb 0.60 -1.31 -0.07 0.00 -1.54 0.00 0.00 39.78 37.46 2qqv n ASN 441 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 2qqv s LYS 442 N 3.30 3.20 0.08 3.52 2.47 -1.26 -5.07 119.74 125.98 2qqv s LYS 442 Ca 0.52 -0.33 0.08 0.00 -1.56 0.00 0.00 55.97 54.68 2qqv s LYS 442 Cb 0.14 -2.97 -0.03 0.00 -1.46 0.00 0.00 37.83 33.51 2qqv s LYS 442 CO -0.02 0.71 -0.21 0.71 0.16 0.00 0.00 175.35 176.69 2qqv s TYR 443 N -1.06 1.84 -0.27 4.03 2.02 -1.26 -1.48 117.35 121.17 2qqv s TYR 443 Ca 0.18 -0.40 -0.07 0.00 -0.37 0.00 0.00 57.07 56.41 2qqv s TYR 443 Cb -0.12 -1.04 -0.01 0.00 -0.40 0.00 0.00 41.96 40.39 2qqv s TYR 443 CO 0.07 0.17 0.07 0.08 -1.57 0.00 0.00 175.55 174.38 2qqv s VAL 444 N -1.02 4.06 -0.24 0.71 1.01 -0.50 -4.82 120.40 119.60 2qqv s VAL 444 Ca 0.07 -0.49 -0.10 0.00 0.00 0.00 0.00 61.98 61.47 2qqv s VAL 444 Cb -0.10 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 2qqv s VAL 444 CO 0.03 0.19 0.13 0.68 0.00 0.00 0.00 175.10 176.14 2qqv s VAL 445 N 1.54 5.07 -0.11 2.92 -7.23 -1.26 -1.02 120.40 120.31 2qqv s VAL 445 Ca 0.04 0.08 -0.04 0.00 -1.81 0.00 0.00 61.98 60.25 2qqv s VAL 445 Cb -0.16 -3.36 -0.04 0.00 0.56 0.00 0.00 36.38 33.38 2qqv s VAL 445 CO 0.02 0.34 0.04 -0.22 -0.31 0.00 0.00 175.10 174.97 2qqv s LEU 446 N 1.19 3.75 -0.15 1.32 2.96 0.71 -1.43 118.68 127.02 2qqv s LEU 446 Ca 0.06 0.18 0.01 0.00 -0.22 0.00 0.00 54.13 54.16 2qqv s LEU 446 Cb -0.14 -1.89 0.02 0.00 0.50 0.00 0.00 46.19 44.68 2qqv s LEU 446 CO 0.05 0.33 -0.15 -0.32 -1.32 0.00 0.00 176.35 174.94 2qqv s MET 447 N -0.60 2.44 0.11 1.98 -2.45 0.43 -1.24 119.30 119.97 2qqv s MET 447 Ca 0.11 -0.61 0.08 0.00 -1.25 0.00 0.00 55.69 54.02 2qqv s MET 447 Cb -0.12 -2.19 -0.04 0.00 1.25 0.00 0.00 34.83 33.73 2qqv s MET 447 CO 0.02 -0.22 -0.16 0.00 1.05 0.00 0.00 175.02 175.71 2qqv s SER 449 N -2.14 4.54 -0.28 0.00 0.15 -0.09 -2.04 113.70 113.83 2qqv s SER 449 Ca 0.19 -2.06 -0.15 0.00 0.70 0.00 0.00 55.95 54.63 2qqv s SER 449 Cb -0.11 -1.42 -0.03 0.00 -1.71 0.00 0.00 66.02 62.75 2qqv s SER 449 CO 0.11 -0.38 0.36 -0.62 1.20 0.00 0.00 173.24 173.91 2qqv s ASP 450 N 1.04 6.22 -0.15 5.45 -1.08 0.22 -2.07 116.67 126.30 2qqv s ASP 450 Ca 0.11 0.17 0.15 0.00 -0.52 0.00 0.00 52.55 52.46 2qqv s ASP 450 Cb -0.19 -2.20 0.34 0.00 -1.46 0.00 0.00 42.92 39.40 2qqv s ASP 450 CO -0.12 -0.21 1.17 0.00 0.52 0.00 0.00 175.17 176.53 2qqv n GLN 451 N 5.33 1.24 0.21 4.34 0.00 -1.26 -1.73 117.38 125.52 2qqv n GLN 451 Ca -0.09 -2.75 0.05 0.00 0.00 0.00 0.00 57.00 54.21 2qqv n GLN 451 Cb 0.51 -1.39 0.46 0.00 0.00 0.00 0.00 30.24 29.82 2qqv n GLN 451 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2qqv h SER 452 N 0.50 0.00 -0.30 2.61 4.64 -1.89 -2.82 113.55 116.29 2qqv h SER 452 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2qqv h SER 452 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2qqv h SER 452 CO 0.01 0.26 0.00 -1.14 -0.87 0.00 0.00 176.83 175.08 2qqv n ARG 453 N -4.15 2.92 0.13 4.77 3.00 -1.26 -4.74 116.66 117.33 2qqv n ARG 453 Ca -0.02 -2.49 -0.01 0.00 -0.00 0.00 0.00 57.85 55.33 2qqv n ARG 453 Cb 0.32 -1.59 0.22 0.00 0.00 0.00 0.00 32.46 31.41 2qqv n ARG 453 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 2qqv h SER 454 N 1.90 0.08 -4.07 6.15 4.64 -1.35 -1.73 113.55 119.16 2qqv h SER 454 Ca 0.00 -0.04 -0.16 0.00 -0.47 0.00 0.00 61.79 61.12 2qqv h SER 454 Cb 1.13 -0.02 -0.25 0.00 -0.31 0.00 0.00 62.40 62.95 2qqv h SER 454 CO 0.13 0.59 -0.44 -0.55 -0.87 0.00 0.00 176.83 175.68 2qqv s SER 455 N -6.88 -0.20 0.32 4.97 0.15 -1.26 -4.22 113.70 106.57 2qqv s SER 455 Ca -0.03 0.35 0.13 0.00 0.70 0.00 0.00 55.95 57.10 2qqv s SER 455 Cb 0.13 0.43 0.53 0.00 -1.71 0.00 0.00 66.02 65.40 2qqv s SER 455 CO 0.76 -0.15 1.70 -0.07 1.20 0.00 0.00 173.24 176.68 2qqv h LEU 456 N 5.42 0.00 -9.48 3.45 3.38 -1.87 -3.44 115.31 112.77 2qqv h LEU 456 Ca -0.27 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.16 2qqv h LEU 456 Cb 1.19 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.98 2qqv h LEU 456 CO 0.37 0.50 1.09 1.17 0.09 0.00 0.00 178.44 181.66 2qqv n LYS 457 N -3.81 2.68 -0.06 1.13 4.81 -1.26 -4.91 118.16 116.74 2qqv n LYS 457 Ca -0.01 0.97 -0.12 0.00 -0.87 0.00 0.00 58.31 58.28 2qqv n LYS 457 Cb 0.54 -2.86 -0.06 0.00 0.02 0.00 0.00 35.03 32.67 2qqv n LYS 457 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 2qqv h GLU 458 N 8.46 0.33 -2.15 1.64 4.57 -2.00 -3.34 114.58 122.07 2qqv h GLU 458 Ca -0.47 -0.14 -0.66 0.00 -1.18 0.00 0.00 59.36 56.91 2qqv h GLU 458 Cb 1.23 -0.01 -0.21 0.00 -0.16 0.00 0.00 28.75 29.60 2qqv h GLU 458 CO 0.94 0.64 1.05 -0.40 -1.18 0.00 0.00 179.01 180.06 2qqv n ASP 459 N -4.64 7.19 -4.70 1.04 5.75 -1.26 -4.91 116.55 115.02 2qqv n ASP 459 Ca -0.06 -3.44 -0.25 0.00 -0.01 0.00 0.00 54.79 51.04 2qqv n ASP 459 Cb 0.29 -1.20 -0.07 0.00 -1.03 0.00 0.00 41.12 39.11 2qqv n ASP 459 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 2qqv s ASN 460 N -0.28 4.95 -0.45 -1.12 0.01 -1.26 -3.88 114.94 112.91 2qqv s ASN 460 Ca 0.53 -0.38 -0.28 0.00 -0.71 0.00 0.00 52.86 52.02 2qqv s ASN 460 Cb 0.33 -1.10 -0.01 0.00 0.41 0.00 0.00 41.25 40.89 2qqv s ASN 460 CO -0.24 0.05 1.64 -0.62 -1.51 0.00 0.00 177.10 176.42 2qqv s ASP 461 N -3.24 5.92 -0.15 -1.22 3.68 0.15 -4.86 116.67 116.95 2qqv s ASP 461 Ca 0.30 0.79 0.16 0.00 2.13 0.00 0.00 52.55 55.93 2qqv s ASP 461 Cb -0.09 -2.53 0.73 0.00 -1.45 0.00 0.00 42.92 39.58 2qqv s ASP 461 CO 0.20 -1.78 1.63 0.29 0.13 0.00 0.00 175.17 175.65 2qqv n LYS 462 N 8.54 4.00 -1.70 4.34 4.76 -1.26 -4.95 118.16 131.89 2qqv n LYS 462 Ca 0.19 -2.85 -0.44 0.00 -2.87 0.00 0.00 58.31 52.34 2qqv n LYS 462 Cb 0.49 -2.00 -0.03 0.00 -1.84 0.00 0.00 35.03 31.65 2qqv n LYS 462 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 2qqv n THR 463 N 0.95 0.28 -3.33 -0.18 -1.04 -1.26 -3.78 114.28 105.91 2qqv n THR 463 Ca 0.26 -0.07 -0.38 0.00 -2.04 0.00 0.00 64.05 61.82 2qqv n THR 463 Cb 0.96 -1.78 -0.06 0.00 -1.82 0.00 0.00 70.33 67.64 2qqv n THR 463 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2qqv s THR 464 N 0.75 5.16 0.05 12.58 2.01 -1.26 -4.55 115.64 130.37 2qqv s THR 464 Ca 0.74 0.96 0.02 0.00 0.31 0.00 0.00 61.69 63.71 2qqv s THR 464 Cb -0.58 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.08 2qqv s THR 464 CO 0.39 0.36 0.07 -0.31 -0.69 0.00 0.00 174.62 174.43 2qqv s TYR 465 N 0.42 3.19 0.01 4.92 2.02 -0.88 -4.88 117.35 122.15 2qqv s TYR 465 Ca 0.26 0.11 -0.06 0.00 -0.37 0.00 0.00 57.07 57.01 2qqv s TYR 465 Cb -0.15 -1.66 -0.00 0.00 -0.40 0.00 0.00 41.96 39.75 2qqv s TYR 465 CO 0.11 0.52 0.11 0.20 -1.57 0.00 0.00 175.55 174.92 2qqv s GLY 466 N -2.09 0.09 -0.06 0.71 0.00 -1.26 -0.91 107.32 103.79 2qqv s GLY 466 Ca 0.26 -0.24 -0.23 0.00 0.00 0.00 0.00 44.72 44.51 2qqv s GLY 466 CO 0.18 -0.37 0.53 0.00 0.00 0.00 0.00 173.10 173.43 2qqv s ALA 467 N -1.50 -1.35 0.22 3.20 0.00 -0.43 -4.12 121.76 117.79 2qqv s ALA 467 Ca -0.14 1.01 -0.16 0.00 0.00 0.00 0.00 51.96 52.66 2qqv s ALA 467 Cb -0.08 -0.13 -0.08 0.00 0.00 0.00 0.00 23.12 22.83 2qqv s ALA 467 CO 0.01 -0.31 0.66 -0.06 0.00 0.00 0.00 175.76 176.06 2qqv s PHE 468 N -0.98 3.55 -0.08 0.00 2.99 -1.26 -0.43 117.98 121.78 2qqv s PHE 468 Ca -0.10 1.21 0.02 0.00 0.00 0.00 0.00 56.93 58.06 2qqv s PHE 468 Cb -0.03 -2.50 -0.02 0.00 0.00 0.00 0.00 43.02 40.47 2qqv s PHE 468 CO 0.06 0.30 -0.12 0.08 -0.00 0.00 0.00 175.22 175.54 2qqv s VAL 469 N -1.64 3.23 -1.20 -0.44 1.01 -0.52 -4.80 120.40 116.06 2qqv s VAL 469 Ca 0.44 -0.64 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 2qqv s VAL 469 Cb -0.14 -2.31 0.23 0.00 0.00 0.00 0.00 36.38 34.16 2qqv s VAL 469 CO 0.20 0.57 1.75 -0.67 0.00 0.00 0.00 175.10 176.95 2qqv n ASP 470 N 2.61 5.83 -4.32 3.32 2.03 -1.26 -4.33 116.55 120.43 2qqv n ASP 470 Ca -0.18 -3.25 -0.17 0.00 0.52 0.00 0.00 54.79 51.71 2qqv n ASP 470 Cb 0.52 -1.38 -0.10 0.00 -0.72 0.00 0.00 41.12 39.44 2qqv n ASP 470 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2qqv s ILE 471 N -1.11 1.13 -0.34 5.18 -4.36 -1.26 -5.07 121.20 115.37 2qqv s ILE 471 Ca 0.37 -2.05 -0.13 0.00 -0.26 0.00 0.00 60.65 58.58 2qqv s ILE 471 Cb 0.09 -2.24 -0.01 0.00 1.25 0.00 0.00 42.46 41.54 2qqv s ILE 471 CO 0.04 -0.42 0.23 0.21 0.24 0.00 0.00 174.94 175.24 2qqv s ASN 472 N -3.29 6.01 0.00 4.36 2.47 -1.26 -4.84 114.94 118.39 2qqv s ASN 472 Ca 0.26 -0.45 0.14 0.00 0.42 0.00 0.00 52.86 53.22 2qqv s ASN 472 Cb 0.05 -2.12 0.81 0.00 -1.45 0.00 0.00 41.25 38.53 2qqv s ASN 472 CO 0.07 -0.24 1.26 -0.81 -3.72 0.00 0.00 177.10 173.67 2qqv n PRO 473 N 5.09 0.60 -0.07 0.43 -0.04 -1.26 -1.48 135.00 138.28 2qqv n PRO 473 Ca -0.13 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.21 2qqv n PRO 473 Cb 0.50 -1.35 -0.05 0.00 -0.04 0.00 0.00 33.50 32.55 2qqv n PRO 473 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2qqv h HIS 474 N 0.00 0.45 -4.34 0.54 3.86 -1.96 -3.43 115.15 110.27 2qqv h HIS 474 Ca 0.00 -0.09 -0.51 0.00 -1.16 0.00 0.00 60.37 58.61 2qqv h HIS 474 Cb 0.00 -0.11 0.09 0.00 1.06 0.00 0.00 27.41 28.45 2qqv h HIS 474 CO 0.00 0.64 0.37 -0.65 0.86 0.00 0.00 177.93 179.15 2qqv s GLN 475 N -4.77 2.85 0.41 2.45 1.11 -0.55 -4.93 119.66 116.23 2qqv s GLN 475 Ca -0.14 0.86 -0.27 0.00 0.01 0.00 0.00 55.36 55.83 2qqv s GLN 475 Cb 0.07 -1.99 -0.09 0.00 -1.01 0.00 0.00 33.01 29.99 2qqv s GLN 475 CO 0.75 -1.14 1.40 -1.25 0.01 0.00 0.00 175.29 175.06 2qqv s PRO 476 N -5.09 3.94 -0.08 2.91 0.04 -1.26 -4.86 135.00 130.61 2qqv s PRO 476 Ca 0.58 2.38 -0.24 0.00 0.04 0.00 0.00 61.00 63.75 2qqv s PRO 476 Cb -0.14 -2.81 -0.03 0.00 0.04 0.00 0.00 34.50 31.56 2qqv s PRO 476 CO 0.55 -0.59 0.75 -0.51 0.04 0.00 0.00 177.00 177.23 2qqv s LEU 477 N -2.38 4.29 -0.23 -3.56 1.02 0.86 -4.82 118.68 113.86 2qqv s LEU 477 Ca 0.56 1.22 -0.12 0.00 0.02 0.00 0.00 54.13 55.82 2qqv s LEU 477 Cb -0.43 -3.15 -0.05 0.00 0.02 0.00 0.00 46.19 42.59 2qqv s LEU 477 CO 0.56 -0.18 0.22 -0.55 0.02 0.00 0.00 176.35 176.42 2qqv s SER 478 N 0.89 6.19 -0.04 2.29 0.15 -1.26 -1.27 113.70 120.64 2qqv s SER 478 Ca 0.39 0.20 0.01 0.00 0.70 0.00 0.00 55.95 57.25 2qqv s SER 478 Cb -0.18 -2.13 0.02 0.00 -1.71 0.00 0.00 66.02 62.01 2qqv s SER 478 CO 0.18 0.03 -0.06 -0.22 1.20 0.00 0.00 173.24 174.37 2qqv s LEU 479 N 1.14 1.50 0.04 3.45 2.96 -0.90 -0.96 118.68 125.91 2qqv s LEU 479 Ca 0.10 -0.15 0.05 0.00 -0.22 0.00 0.00 54.13 53.91 2qqv s LEU 479 Cb -0.14 -0.48 -0.02 0.00 0.50 0.00 0.00 46.19 46.05 2qqv s LEU 479 CO 0.05 -0.01 -0.15 -0.60 -1.32 0.00 0.00 176.35 174.32 2qqv s ARG 480 N 0.66 1.02 -0.04 1.98 3.52 0.07 -0.87 118.95 125.29 2qqv s ARG 480 Ca -0.09 -0.80 -0.02 0.00 -0.13 0.00 0.00 55.73 54.69 2qqv s ARG 480 Cb -0.13 -1.05 0.03 0.00 -1.56 0.00 0.00 34.95 32.25 2qqv s ARG 480 CO 0.01 0.26 0.08 0.00 -0.81 0.00 0.00 175.30 174.84 2qqv s ALA 481 N -0.85 0.03 -0.35 6.12 0.00 -0.54 0.10 121.76 126.27 2qqv s ALA 481 Ca 0.03 0.38 -0.14 0.00 0.00 0.00 0.00 51.96 52.22 2qqv s ALA 481 Cb -0.08 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 2qqv s ALA 481 CO 0.01 -0.30 0.31 -0.51 0.00 0.00 0.00 175.76 175.28 2qqv s LEU 482 N 1.60 4.51 -0.22 0.00 1.43 -0.88 -1.85 118.68 123.26 2qqv s LEU 482 Ca -0.03 -0.34 -0.07 0.00 -1.03 0.00 0.00 54.13 52.66 2qqv s LEU 482 Cb -0.12 -2.25 -0.03 0.00 0.03 0.00 0.00 46.19 43.81 2qqv s LEU 482 CO -0.04 -0.31 0.07 -0.63 0.23 0.00 0.00 176.35 175.67 2qqv s ILE 483 N 1.89 4.53 -0.40 -0.59 1.01 0.22 -1.79 121.20 126.08 2qqv s ILE 483 Ca 0.09 -0.11 0.08 0.00 0.00 0.00 0.00 60.65 60.71 2qqv s ILE 483 Cb -0.17 -3.08 0.25 0.00 0.01 0.00 0.00 42.46 39.47 2qqv s ILE 483 CO 0.11 0.39 0.56 -0.67 0.00 0.00 0.00 174.94 175.33 2qqv n ASP 484 N 4.26 -0.17 0.00 3.58 -0.08 0.07 -1.38 116.55 122.84 2qqv n ASP 484 Ca -0.16 -2.75 0.00 0.00 -1.51 0.00 0.00 54.79 50.36 2qqv n ASP 484 Cb 0.52 -0.37 0.00 0.00 2.34 0.00 0.00 41.12 43.61 2qqv n ASP 484 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2qqv n HIS 485 N 1.45 0.00 -0.05 -0.67 8.25 0.17 -2.52 115.22 121.85 2qqv n HIS 485 Ca 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 2qqv n HIS 485 Cb 0.54 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.65 2qqv n HIS 485 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2qqv n SER 486 N 0.93 0.86 -4.05 0.41 3.41 -1.26 -4.79 113.62 109.13 2qqv n SER 486 Ca 0.00 -0.95 -0.21 0.00 -0.26 0.00 0.00 58.87 57.45 2qqv n SER 486 Cb 0.00 0.09 -0.15 0.00 -0.26 0.00 0.00 64.21 63.89 2qqv n SER 486 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2qqv s VAL 487 N -0.09 0.92 -0.06 -3.33 0.11 -1.05 -0.04 120.40 116.86 2qqv s VAL 487 Ca 0.00 -0.47 0.01 0.00 -2.93 0.00 0.00 61.98 58.59 2qqv s VAL 487 Cb 0.00 -0.79 0.02 0.00 -1.53 0.00 0.00 36.38 34.08 2qqv s VAL 487 CO 0.00 0.27 -0.07 0.54 -3.33 0.00 0.00 175.10 172.51 2qqv s VAL 488 N -0.09 0.76 -0.37 2.04 0.11 -0.96 -0.75 120.40 121.14 2qqv s VAL 488 Ca 0.01 -0.23 -0.05 0.00 -2.93 0.00 0.00 61.98 58.78 2qqv s VAL 488 Cb -0.06 -0.76 0.07 0.00 -1.53 0.00 0.00 36.38 34.10 2qqv s VAL 488 CO 0.00 0.28 0.15 -1.61 -3.33 0.00 0.00 175.10 170.60 2qqv s GLU 489 N 1.02 2.39 -0.09 1.54 2.02 -0.74 -2.19 118.70 122.64 2qqv s GLU 489 Ca -0.09 -1.47 -0.14 0.00 0.02 0.00 0.00 54.97 53.29 2qqv s GLU 489 Cb -0.14 -3.52 -0.05 0.00 0.10 0.00 0.00 34.13 30.51 2qqv s GLU 489 CO -0.00 -0.86 0.35 -1.12 0.02 0.00 0.00 175.26 173.65 2qqv s SER 490 N 1.70 6.61 -0.21 -0.19 0.01 0.55 -2.08 113.70 120.09 2qqv s SER 490 Ca 0.02 0.72 0.00 0.00 1.31 0.00 0.00 55.95 58.00 2qqv s SER 490 Cb -0.22 -2.22 0.05 0.00 0.21 0.00 0.00 66.02 63.85 2qqv s SER 490 CO -0.00 0.19 -0.05 -0.36 0.41 0.00 0.00 173.24 173.43 2qqv s PHE 491 N -0.18 2.08 0.10 2.43 0.08 0.11 -1.08 117.98 121.52 2qqv s PHE 491 Ca 0.21 -1.49 -0.00 0.00 0.12 0.00 0.00 56.93 55.76 2qqv s PHE 491 Cb -0.15 -1.46 -0.04 0.00 -0.57 0.00 0.00 43.02 40.80 2qqv s PHE 491 CO 0.08 -0.72 0.27 0.20 -0.10 0.00 0.00 175.22 174.95 2qqv s GLY 492 N 1.50 2.08 -1.46 4.36 0.00 0.55 -0.75 107.32 113.62 2qqv s GLY 492 Ca -0.03 -0.82 -0.03 0.00 0.00 0.00 0.00 44.72 43.83 2qqv s GLY 492 CO -0.07 -0.80 0.48 0.61 0.00 0.00 0.00 173.10 173.33 2qqv n GLY 493 N 0.04 -0.26 3.76 0.20 0.00 -0.13 -1.24 105.19 107.55 2qqv n GLY 493 Ca -0.05 0.15 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 2qqv n GLY 493 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qqv n LYS 494 N -4.41 -4.79 -0.77 1.61 4.76 -1.26 -2.80 118.16 110.50 2qqv n LYS 494 Ca -0.24 0.59 0.00 0.00 -2.87 0.00 0.00 58.31 55.79 2qqv n LYS 494 Cb 0.65 -5.14 0.00 0.00 -1.84 0.00 0.00 35.03 28.71 2qqv n LYS 494 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qqv n GLY 495 N -1.64 0.57 0.19 0.72 0.00 -0.71 -4.80 105.19 99.52 2qqv n GLY 495 Ca -0.26 -0.43 0.09 0.00 0.00 0.00 0.00 46.02 45.42 2qqv n GLY 495 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qqv h ARG 496 N 0.84 0.00 -3.56 1.61 3.08 -1.00 -2.41 114.38 112.94 2qqv h ARG 496 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.75 2qqv h ARG 496 Cb 0.00 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 29.71 2qqv h ARG 496 CO 0.00 0.15 -0.73 0.00 -1.07 0.00 0.00 179.97 178.31 2qqv s ALA 497 N -3.14 0.11 -0.06 0.04 0.00 -0.97 -4.79 121.76 112.95 2qqv s ALA 497 Ca 0.05 0.28 0.04 0.00 0.00 0.00 0.00 51.96 52.33 2qqv s ALA 497 Cb 0.06 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.93 2qqv s ALA 497 CO 0.70 -0.10 -0.17 0.00 0.00 0.00 0.00 175.76 176.19 2qqv s ILE 499 N 0.31 0.52 -0.15 0.00 1.01 -0.24 -0.61 121.20 122.04 2qqv s ILE 499 Ca -0.11 0.02 -0.04 0.00 0.00 0.00 0.00 60.65 60.51 2qqv s ILE 499 Cb -0.15 -0.64 -0.03 0.00 0.01 0.00 0.00 42.46 41.66 2qqv s ILE 499 CO 0.04 0.28 -0.01 -0.89 0.00 0.00 0.00 174.94 174.36 2qqv s THR 500 N 1.80 4.15 0.08 2.92 2.01 -1.26 -0.33 115.64 125.01 2qqv s THR 500 Ca 0.03 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 61.78 2qqv s THR 500 Cb -0.13 -2.82 -0.04 0.00 0.01 0.00 0.00 72.50 69.53 2qqv s THR 500 CO -0.05 0.50 -0.07 -0.94 -0.69 0.00 0.00 174.62 173.37 2qqv s SER 501 N 0.18 1.06 -0.16 3.53 1.04 -0.93 0.16 113.70 118.59 2qqv s SER 501 Ca -0.00 -0.84 0.01 0.00 0.48 0.00 0.00 55.95 55.60 2qqv s SER 501 Cb -0.13 0.07 0.01 0.00 0.10 0.00 0.00 66.02 66.06 2qqv s SER 501 CO 0.02 -0.36 -0.18 -0.13 0.98 0.00 0.00 173.24 173.56 2qqv s ARG 502 N -3.00 3.10 -0.05 4.02 1.81 -1.26 -2.26 118.95 121.31 2qqv s ARG 502 Ca 0.04 -0.80 0.03 0.00 -1.72 0.00 0.00 55.73 53.27 2qqv s ARG 502 Cb -0.00 -2.55 0.01 0.00 -0.45 0.00 0.00 34.95 31.95 2qqv s ARG 502 CO -0.03 -0.05 -0.12 0.08 -0.68 0.00 0.00 175.30 174.51 2qqv s VAL 503 N 0.93 1.05 -0.60 3.52 1.01 0.94 -4.80 120.40 122.45 2qqv s VAL 503 Ca -0.04 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.53 2qqv s VAL 503 Cb -0.15 -0.94 0.22 0.00 0.00 0.00 0.00 36.38 35.50 2qqv s VAL 503 CO -0.03 0.32 0.59 -1.22 0.00 0.00 0.00 175.10 174.76 2qqv n TYR 504 N 3.52 2.39 -2.45 5.22 4.01 -1.26 -4.13 117.16 124.45 2qqv n TYR 504 Ca -0.21 -4.02 -0.38 0.00 -0.16 0.00 0.00 57.90 53.13 2qqv n TYR 504 Cb 0.53 -0.45 -0.04 0.00 -0.31 0.00 0.00 39.34 39.07 2qqv n TYR 504 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2qqv s PRO 505 N -1.67 4.31 0.12 -0.72 0.04 -1.26 -4.79 135.00 131.04 2qqv s PRO 505 Ca 0.34 1.71 0.17 0.00 0.04 0.00 0.00 61.00 63.25 2qqv s PRO 505 Cb 0.08 -2.82 -0.08 0.00 0.04 0.00 0.00 34.50 31.72 2qqv s PRO 505 CO -0.10 -0.05 0.99 -0.22 0.04 0.00 0.00 177.00 177.65 2qqv h LYS 506 N 3.03 0.00 0.00 4.56 1.63 -1.94 -3.41 116.57 120.44 2qqv h LYS 506 Ca -0.48 0.00 -0.38 0.00 -0.85 0.00 0.00 60.65 58.94 2qqv h LYS 506 Cb 1.22 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.79 2qqv h LYS 506 CO 0.64 0.31 -2.29 1.28 -3.45 0.00 0.00 179.45 175.94 2qqv n LEU 507 N -2.95 1.79 -4.44 5.20 4.77 -1.26 -4.85 117.00 115.26 2qqv n LEU 507 Ca -0.06 0.23 -0.39 0.00 -0.03 0.00 0.00 56.01 55.77 2qqv n LEU 507 Cb 0.79 -0.69 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2qqv n LEU 507 CO 0.42 0.53 1.93 0.00 -1.33 0.00 0.00 177.39 178.94 2qqv n ALA 508 N -3.93 3.27 -3.62 -1.18 0.00 -1.26 -4.66 120.51 109.12 2qqv n ALA 508 Ca -0.45 -3.59 -0.17 0.00 0.00 0.00 0.00 53.44 49.23 2qqv n ALA 508 Cb 0.83 -3.57 -0.16 0.00 0.00 0.00 0.00 19.45 16.56 2qqv n ALA 508 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2qqv s ILE 509 N 6.05 0.23 0.00 0.00 -4.36 -1.26 -4.68 121.20 117.19 2qqv s ILE 509 Ca 0.57 0.04 0.00 0.00 -0.26 0.00 0.00 60.65 61.00 2qqv s ILE 509 Cb 0.04 -0.31 0.00 0.00 1.25 0.00 0.00 42.46 43.45 2qqv s ILE 509 CO 0.08 0.15 0.00 0.61 0.24 0.00 0.00 174.94 176.02 2qqv n GLY 510 N 4.01 1.61 0.22 6.27 0.00 -1.26 -1.71 105.19 114.33 2qqv n GLY 510 Ca -0.26 0.41 0.07 0.00 0.00 0.00 0.00 46.02 46.24 2qqv n GLY 510 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qqv h LYS 511 N 0.00 0.00 -0.01 1.61 1.63 -1.98 -3.16 116.57 114.67 2qqv h LYS 511 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2qqv h LYS 511 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 2qqv h LYS 511 CO 0.00 0.24 -0.31 0.43 -3.45 0.00 0.00 179.45 176.35 2qqv n SER 512 N -3.96 0.87 -4.80 4.20 7.64 -0.70 -4.91 113.62 111.96 2qqv n SER 512 Ca -0.02 -0.71 -0.35 0.00 1.01 0.00 0.00 58.87 58.80 2qqv n SER 512 Cb 0.31 0.16 -0.05 0.00 -1.01 0.00 0.00 64.21 63.62 2qqv n SER 512 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2qqv s SER 513 N -2.63 6.77 0.38 6.43 1.04 -1.19 -4.27 113.70 120.23 2qqv s SER 513 Ca 0.21 1.87 0.04 0.00 0.48 0.00 0.00 55.95 58.54 2qqv s SER 513 Cb 0.19 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.71 2qqv s SER 513 CO 0.56 -0.48 0.09 -1.00 0.98 0.00 0.00 173.24 173.39 2qqv s HIS 514 N -1.91 1.86 -0.05 5.02 3.76 0.19 -4.57 115.29 119.60 2qqv s HIS 514 Ca 0.61 -1.13 -0.02 0.00 -0.15 0.00 0.00 55.06 54.38 2qqv s HIS 514 Cb -0.16 -1.24 0.04 0.00 1.11 0.00 0.00 32.58 32.33 2qqv s HIS 514 CO 0.20 -0.14 0.09 -1.17 -0.85 0.00 0.00 174.74 172.88 2qqv s LEU 515 N -3.58 0.71 0.06 0.89 2.96 -1.26 -2.49 118.68 115.96 2qqv s LEU 515 Ca 0.28 0.17 0.06 0.00 -0.22 0.00 0.00 54.13 54.42 2qqv s LEU 515 Cb 0.05 0.12 -0.03 0.00 0.50 0.00 0.00 46.19 46.83 2qqv s LEU 515 CO 0.14 -0.16 -0.16 -0.36 -1.32 0.00 0.00 176.35 174.48 2qqv s PHE 516 N 1.37 1.40 -0.09 5.38 0.08 -0.21 -0.82 117.98 125.10 2qqv s PHE 516 Ca -0.06 -0.39 -0.02 0.00 0.12 0.00 0.00 56.93 56.58 2qqv s PHE 516 Cb -0.12 -0.81 -0.03 0.00 -0.57 0.00 0.00 43.02 41.48 2qqv s PHE 516 CO -0.04 0.08 -0.02 0.00 -0.10 0.00 0.00 175.22 175.13 2qqv s ALA 517 N -0.99 3.18 0.16 5.36 0.00 -0.37 -0.33 121.76 128.78 2qqv s ALA 517 Ca 0.02 -0.83 -0.05 0.00 0.00 0.00 0.00 51.96 51.11 2qqv s ALA 517 Cb -0.09 -1.45 -0.03 0.00 0.00 0.00 0.00 23.12 21.56 2qqv s ALA 517 CO 0.02 0.52 0.18 -0.59 0.00 0.00 0.00 175.76 175.89 2qqv s PHE 518 N -0.64 0.72 -0.25 0.00 -0.12 -0.57 -0.19 117.98 116.92 2qqv s PHE 518 Ca 0.10 -1.06 -0.10 0.00 -0.05 0.00 0.00 56.93 55.82 2qqv s PHE 518 Cb -0.12 -0.30 0.10 0.00 -0.63 0.00 0.00 43.02 42.07 2qqv s PHE 518 CO 0.02 -0.64 0.56 1.21 -0.05 0.00 0.00 175.22 176.32 2qqv s ASN 519 N -3.04 -0.77 0.00 1.98 2.47 -0.80 -2.12 114.94 112.66 2qqv s ASN 519 Ca 0.24 1.31 0.01 0.00 0.42 0.00 0.00 52.86 54.85 2qqv s ASN 519 Cb 0.05 1.66 0.02 0.00 -1.45 0.00 0.00 41.25 41.53 2qqv s ASN 519 CO 0.03 -0.22 0.66 -1.22 -3.72 0.00 0.00 177.10 172.63 2qqv n TYR 520 N 5.06 0.01 -1.33 0.43 0.53 0.31 -1.04 117.16 121.12 2qqv n TYR 520 Ca -0.14 -0.12 -0.31 0.00 -1.02 0.00 0.00 57.90 56.31 2qqv n TYR 520 Cb 0.52 -0.01 0.09 0.00 -1.03 0.00 0.00 39.34 38.90 2qqv n TYR 520 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 2qqv s GLY 521 N -0.32 1.75 0.22 2.72 0.00 -1.23 -4.49 107.32 105.97 2qqv s GLY 521 Ca 0.02 0.31 -0.07 0.00 0.00 0.00 0.00 44.72 44.98 2qqv s GLY 521 CO 0.02 0.66 1.76 -0.97 0.00 0.00 0.00 173.10 174.57 2qqv h TYR 522 N -0.96 0.55 -2.83 1.90 0.05 -1.34 -3.39 116.97 110.96 2qqv h TYR 522 Ca -0.44 0.03 -0.64 0.00 0.05 0.00 0.00 58.73 57.73 2qqv h TYR 522 Cb 1.23 -0.14 -0.06 0.00 1.01 0.00 0.00 36.73 38.77 2qqv h TYR 522 CO 0.57 0.17 -0.41 -0.65 -1.05 0.00 0.00 178.16 176.79 2qqv s GLN 523 N -6.06 3.55 0.48 4.88 -1.52 -1.04 -4.58 119.66 115.38 2qqv s GLN 523 Ca -0.13 -0.09 -0.21 0.00 -1.95 0.00 0.00 55.36 52.99 2qqv s GLN 523 Cb 0.18 -3.12 -0.08 0.00 -0.22 0.00 0.00 33.01 29.77 2qqv s GLN 523 CO 0.76 0.69 1.08 -1.54 -0.25 0.00 0.00 175.29 176.02 2qqv s SER 524 N -1.52 6.24 0.10 5.90 1.04 -1.26 -4.66 113.70 119.54 2qqv s SER 524 Ca 0.24 2.05 0.07 0.00 0.48 0.00 0.00 55.95 58.79 2qqv s SER 524 Cb -0.13 -2.57 -0.03 0.00 0.10 0.00 0.00 66.02 63.38 2qqv s SER 524 CO 0.13 -0.85 -0.19 0.68 0.98 0.00 0.00 173.24 173.99 2qqv s VAL 525 N -1.83 1.58 -0.15 5.02 -7.23 -0.94 -4.57 120.40 112.29 2qqv s VAL 525 Ca 0.67 -1.55 -0.13 0.00 -1.81 0.00 0.00 61.98 59.15 2qqv s VAL 525 Cb -0.20 -1.49 -0.05 0.00 0.56 0.00 0.00 36.38 35.20 2qqv s VAL 525 CO 0.24 -0.14 0.29 -1.81 -0.31 0.00 0.00 175.10 173.37 2qqv s ASP 526 N -2.00 6.46 -0.72 4.85 1.11 -0.46 -2.59 116.67 123.33 2qqv s ASP 526 Ca 0.06 0.53 -0.20 0.00 0.18 0.00 0.00 52.55 53.12 2qqv s ASP 526 Cb -0.09 -2.18 0.10 0.00 1.07 0.00 0.00 42.92 41.82 2qqv s ASP 526 CO 0.04 0.14 0.92 -0.69 1.18 0.00 0.00 175.17 176.76 2qqv s VAL 527 N 0.25 4.62 0.14 -1.27 1.01 -0.32 -0.13 120.40 124.71 2qqv s VAL 527 Ca 0.17 -0.94 -0.16 0.00 0.00 0.00 0.00 61.98 61.05 2qqv s VAL 527 Cb -0.13 -4.65 0.01 0.00 0.00 0.00 0.00 36.38 31.61 2qqv s VAL 527 CO 0.04 -1.36 1.72 0.25 0.00 0.00 0.00 175.10 175.75 2qqv h LEU 528 N 10.58 0.55 -7.24 3.92 6.46 -1.19 -1.49 115.31 126.90 2qqv h LEU 528 Ca -0.16 -0.13 -0.09 0.00 -0.12 0.00 0.00 57.88 57.38 2qqv h LEU 528 Cb 1.06 -0.14 -0.21 0.00 -0.73 0.00 0.00 40.66 40.64 2qqv h LEU 528 CO 1.12 0.52 -0.08 0.21 -0.62 0.00 0.00 178.44 179.60 2qqv s ASN 529 N -5.80 -0.47 -0.15 1.25 2.47 -1.22 -2.56 114.94 108.46 2qqv s ASN 529 Ca -0.13 0.69 -0.06 0.00 0.42 0.00 0.00 52.86 53.77 2qqv s ASN 529 Cb 0.10 0.71 0.07 0.00 -1.45 0.00 0.00 41.25 40.68 2qqv s ASN 529 CO 0.75 -0.37 0.32 -0.22 -3.72 0.00 0.00 177.10 173.86 2qqv s LEU 530 N -0.57 -0.20 -0.10 3.21 1.98 0.18 -0.92 118.68 122.27 2qqv s LEU 530 Ca -0.07 0.72 -0.01 0.00 -2.89 0.00 0.00 54.13 51.88 2qqv s LEU 530 Cb -0.03 0.95 0.03 0.00 0.66 0.00 0.00 46.19 47.80 2qqv s LEU 530 CO 0.04 -0.22 -0.06 0.20 -1.89 0.00 0.00 176.35 174.43 2qqv s ASN 531 N 2.06 1.97 -0.14 3.68 -0.87 -0.58 -0.37 114.94 120.68 2qqv s ASN 531 Ca -0.03 -0.24 -0.02 0.00 -1.57 0.00 0.00 52.86 51.00 2qqv s ASN 531 Cb -0.11 -0.72 -0.02 0.00 -0.02 0.00 0.00 41.25 40.38 2qqv s ASN 531 CO -0.10 -0.13 -0.09 0.00 -2.57 0.00 0.00 177.10 174.20 2qqv s ALA 532 N 1.73 2.77 -0.16 0.60 0.00 -0.01 -1.17 121.76 125.52 2qqv s ALA 532 Ca 0.04 -0.88 -0.00 0.00 0.00 0.00 0.00 51.96 51.12 2qqv s ALA 532 Cb -0.13 -1.36 -0.00 0.00 0.00 0.00 0.00 23.12 21.63 2qqv s ALA 532 CO -0.07 0.19 -0.14 -1.58 0.00 0.00 0.00 175.76 174.17 2qqv s TRP 533 N 0.43 2.81 0.37 0.00 0.51 0.15 -1.66 118.94 121.54 2qqv s TRP 533 Ca -0.07 -0.96 -0.27 0.00 -2.12 0.00 0.00 56.10 52.67 2qqv s TRP 533 Cb -0.15 -1.90 -0.10 0.00 -0.81 0.00 0.00 33.47 30.51 2qqv s TRP 533 CO 0.04 -0.43 1.34 -1.12 -0.51 0.00 0.00 176.95 176.27 2qqv s SER 534 N 0.80 6.50 -0.15 2.95 0.01 -1.26 -0.43 113.70 122.12 2qqv s SER 534 Ca -0.05 2.75 -0.02 0.00 1.31 0.00 0.00 55.95 59.94 2qqv s SER 534 Cb -0.15 -2.65 -0.02 0.00 0.21 0.00 0.00 66.02 63.41 2qqv s SER 534 CO 0.00 -0.73 -0.09 -0.32 0.41 0.00 0.00 173.24 172.52 2qqv s MET 535 N -2.03 3.49 0.60 12.44 1.75 -0.44 -0.56 119.30 134.55 2qqv s MET 535 Ca 0.53 -0.62 -0.16 0.00 -1.25 0.00 0.00 55.69 54.19 2qqv s MET 535 Cb -0.40 -2.77 -0.03 0.00 2.84 0.00 0.00 34.83 34.46 2qqv s MET 535 CO 0.53 0.18 1.07 -0.80 -0.65 0.00 0.00 175.02 175.36 2qqv s ASN 536 N 0.48 5.63 0.76 1.11 0.01 0.12 -4.80 114.94 118.25 2qqv s ASN 536 Ca -0.07 1.89 -0.11 0.00 -0.71 0.00 0.00 52.86 53.86 2qqv s ASN 536 Cb -0.15 -2.54 0.05 0.00 0.41 0.00 0.00 41.25 39.02 2qqv s ASN 536 CO 0.04 -1.27 1.08 -0.44 -1.51 0.00 0.00 177.10 174.99 2qqv s SER 537 N -2.64 4.72 0.13 -1.22 0.01 -1.26 -4.69 113.70 108.76 2qqv s SER 537 Ca 0.65 1.55 0.09 0.00 1.31 0.00 0.00 55.95 59.56 2qqv s SER 537 Cb -0.18 -2.33 -0.04 0.00 0.21 0.00 0.00 66.02 63.68 2qqv s SER 537 CO 0.37 -1.85 -0.19 0.00 0.41 0.00 0.00 173.24 171.97 2qqv s ALA 538 N -3.04 2.66 -0.99 1.44 0.00 -0.63 -4.95 121.76 116.25 2qqv s ALA 538 Ca 0.60 -1.41 -0.20 0.00 0.00 0.00 0.00 51.96 50.95 2qqv s ALA 538 Cb -0.15 -0.59 0.09 0.00 0.00 0.00 0.00 23.12 22.47 2qqv s ALA 538 CO 0.55 0.56 1.30 -1.14 0.00 0.00 0.00 175.76 177.03 2qqv s GLN 539 N -2.26 3.62 0.11 0.00 0.74 -1.26 -4.85 119.66 115.76 2qqv s GLN 539 Ca 0.18 -1.51 0.09 0.00 0.05 0.00 0.00 55.36 54.18 2qqv s GLN 539 Cb -0.10 -5.14 -0.04 0.00 1.10 0.00 0.00 33.01 28.83 2qqv s GLN 539 CO 0.10 -1.98 -0.21 0.96 -0.55 0.00 0.00 175.29 173.61 2qqv s ILE 540 N 3.72 2.63 0.00 -2.34 -0.00 -1.26 0.77 121.20 124.73 2qqv s ILE 540 Ca 0.40 -1.54 0.00 0.00 -0.00 0.00 0.00 60.65 59.50 2qqv s ILE 540 Cb -0.02 -2.18 0.00 0.00 -0.00 0.00 0.00 42.46 40.26 2qqv s ILE 540 CO -0.09 0.13 0.00 -1.20 -0.00 0.00 0.00 174.94 173.78