#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2va8 s TRP 0 N 0.00 2.12 0.14 4.31 0.52 -1.26 -3.12 118.94 121.65 2va8 s TRP 0 Ca 0.00 -2.37 -0.31 0.00 0.02 0.00 0.00 56.10 53.44 2va8 s TRP 0 Cb 0.00 -1.98 -0.08 0.00 -1.15 0.00 0.00 33.47 30.25 2va8 s TRP 0 CO 0.00 -0.81 1.39 1.41 0.02 0.00 0.00 176.95 178.96 2va8 s MET 1 N 0.61 4.32 0.30 4.98 1.75 -1.23 -4.71 119.30 125.32 2va8 s MET 1 Ca 0.15 2.11 -0.29 0.00 -1.25 0.00 0.00 55.69 56.41 2va8 s MET 1 Cb -0.23 -3.22 -0.10 0.00 2.84 0.00 0.00 34.83 34.12 2va8 s MET 1 CO -0.05 -0.42 1.38 -2.14 -0.65 0.00 0.00 175.02 173.15 2va8 s PRO 2 N 0.78 4.29 0.27 4.11 0.02 -1.26 0.70 135.00 143.89 2va8 s PRO 2 Ca 0.63 2.29 0.25 0.00 0.02 0.00 0.00 61.00 64.20 2va8 s PRO 2 Cb -0.38 -3.08 0.89 0.00 0.02 0.00 0.00 34.50 31.96 2va8 s PRO 2 CO 0.33 -0.33 1.75 -0.84 -0.33 0.00 0.00 177.00 177.58 2va8 h ILE 3 N 3.24 0.00 0.00 2.83 -0.00 -1.86 -2.11 117.51 119.61 2va8 h ILE 3 Ca -0.48 -0.41 0.00 0.00 -0.00 0.00 0.00 64.86 63.97 2va8 h ILE 3 Cb 1.22 1.30 0.00 0.00 -0.00 0.00 0.00 36.82 39.34 2va8 h ILE 3 CO 0.70 0.00 0.00 1.05 -0.00 0.00 0.00 178.15 179.90 2va8 h GLU 4 N 0.00 0.00 -0.00 0.16 9.09 -1.92 -2.64 114.58 119.27 2va8 h GLU 4 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2va8 h GLU 4 Cb 0.59 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.69 2va8 h GLU 4 CO 0.00 0.00 -0.05 -0.25 0.05 0.00 0.00 179.01 178.76 2va8 n ASP 5 N -2.52 0.19 -4.71 3.06 10.43 -0.79 -4.89 116.55 117.30 2va8 n ASP 5 Ca 0.02 -0.29 -0.42 0.00 2.57 0.00 0.00 54.79 56.67 2va8 n ASP 5 Cb 0.31 -0.20 -0.03 0.00 1.84 0.00 0.00 41.12 43.04 2va8 n ASP 5 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2va8 s LEU 6 N -2.55 4.36 -1.32 0.64 1.43 -1.00 -4.91 118.68 115.33 2va8 s LEU 6 Ca 0.28 2.22 -0.12 0.00 -1.03 0.00 0.00 54.13 55.48 2va8 s LEU 6 Cb 0.20 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.79 2va8 s LEU 6 CO 0.47 -0.61 2.42 1.17 0.23 0.00 0.00 176.35 180.03 2va8 n LYS 7 N 4.10 2.81 -4.15 1.70 4.81 -1.26 -4.82 118.16 121.34 2va8 n LYS 7 Ca 0.11 -2.14 -0.10 0.00 -0.87 0.00 0.00 58.31 55.31 2va8 n LYS 7 Cb 0.43 -2.91 -0.10 0.00 0.02 0.00 0.00 35.03 32.47 2va8 n LYS 7 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2va8 s LEU 8 N 0.97 2.30 0.78 3.14 1.43 -1.26 -5.12 118.68 120.91 2va8 s LEU 8 Ca 0.55 -1.07 -0.14 0.00 -1.03 0.00 0.00 54.13 52.44 2va8 s LEU 8 Cb 0.15 0.09 0.05 0.00 0.03 0.00 0.00 46.19 46.51 2va8 s LEU 8 CO -0.04 -0.58 1.13 -2.65 0.23 0.00 0.00 176.35 174.44 2va8 n PRO 9 N -0.04 0.33 -0.15 1.29 -0.02 -1.26 -4.83 135.00 130.32 2va8 n PRO 9 Ca -0.10 0.18 -0.09 0.00 -2.02 0.00 0.00 63.50 61.47 2va8 n PRO 9 Cb 0.62 -2.37 -0.00 0.00 -0.02 0.00 0.00 33.50 31.72 2va8 n PRO 9 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2va8 h SER 10 N -0.64 0.63 0.83 2.55 0.02 -2.00 -2.36 113.55 112.58 2va8 h SER 10 Ca -0.47 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.29 2va8 h SER 10 Cb 1.31 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2va8 h SER 10 CO 0.46 0.65 0.00 0.78 -1.14 0.00 0.00 176.83 177.58 2va8 h ASN 11 N 0.57 0.00 0.14 3.07 2.35 -1.99 -0.81 115.58 118.91 2va8 h ASN 11 Ca 0.14 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2va8 h ASN 11 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 2va8 h ASN 11 CO -0.01 0.00 -0.07 0.58 -1.65 0.00 0.00 177.43 176.28 2va8 h VAL 12 N 0.00 0.95 -0.88 2.81 2.07 -1.80 -2.37 116.25 117.03 2va8 h VAL 12 Ca 0.00 -1.13 0.14 0.00 0.82 0.00 0.00 66.70 66.53 2va8 h VAL 12 Cb 0.42 1.57 -0.09 0.00 -1.52 0.00 0.00 31.29 31.67 2va8 h VAL 12 CO 0.00 0.24 0.49 0.40 0.02 0.00 0.00 177.57 178.72 2va8 h ILE 13 N -0.80 0.79 -0.28 4.57 2.04 -1.19 -1.75 117.51 120.90 2va8 h ILE 13 Ca -0.02 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.61 2va8 h ILE 13 Cb 0.54 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 2va8 h ILE 13 CO 0.03 0.13 0.13 -0.33 0.00 0.00 0.00 178.15 178.12 2va8 h GLU 14 N 0.73 0.28 -0.52 2.37 4.39 -1.19 -1.53 114.58 119.10 2va8 h GLU 14 Ca 0.47 -0.02 0.03 0.00 0.34 0.00 0.00 59.36 60.18 2va8 h GLU 14 Cb 0.60 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.15 2va8 h GLU 14 CO -0.33 0.18 0.35 0.82 -1.16 0.00 0.00 179.01 178.87 2va8 h ILE 15 N 0.29 1.05 -0.40 3.13 2.04 -0.77 -0.06 117.51 122.79 2va8 h ILE 15 Ca 0.12 -0.20 -0.09 0.00 1.00 0.00 0.00 64.86 65.69 2va8 h ILE 15 Cb 0.04 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 2va8 h ILE 15 CO -0.08 0.11 -0.10 0.40 0.00 0.00 0.00 178.15 178.48 2va8 h ILE 16 N 0.59 1.27 0.00 -0.67 2.04 -1.22 -3.29 117.51 116.24 2va8 h ILE 16 Ca 0.21 -1.18 -0.05 0.00 1.00 0.00 0.00 64.86 64.84 2va8 h ILE 16 Cb 0.11 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2va8 h ILE 16 CO -0.05 0.40 -0.23 0.50 0.00 0.00 0.00 178.15 178.76 2va8 h LYS 17 N 0.58 0.00 0.00 2.37 3.64 -0.14 -2.89 116.57 120.14 2va8 h LYS 17 Ca 0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2va8 h LYS 17 Cb 0.62 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2va8 h LYS 17 CO 0.04 0.23 0.00 0.87 -2.27 0.00 0.00 179.45 178.32 2va8 h LYS 18 N 0.00 0.00 -0.15 1.90 1.57 -1.13 -2.27 116.57 116.49 2va8 h LYS 18 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2va8 h LYS 18 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 2va8 h LYS 18 CO 0.03 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.45 2va8 n ARG 19 N -2.79 1.47 -2.14 3.15 1.74 -1.09 -4.89 116.66 112.12 2va8 n ARG 19 Ca -0.00 -0.72 -0.01 0.00 -0.77 0.00 0.00 57.85 56.34 2va8 n ARG 19 Cb 0.19 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 2va8 n ARG 19 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2va8 n GLY 20 N 0.94 0.43 3.42 -0.13 0.00 -0.85 -5.05 105.19 103.95 2va8 n GLY 20 Ca 0.12 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 45.00 2va8 n GLY 20 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2va8 s ILE 21 N -2.26 3.92 -0.11 -0.61 1.01 -1.25 -4.98 121.20 116.93 2va8 s ILE 21 Ca 0.01 -0.32 0.02 0.00 0.00 0.00 0.00 60.65 60.36 2va8 s ILE 21 Cb -0.00 -2.79 -0.24 0.00 0.01 0.00 0.00 42.46 39.43 2va8 s ILE 21 CO 0.01 0.41 0.40 0.29 0.00 0.00 0.00 174.94 176.05 2va8 n LYS 22 N 4.50 0.70 -4.09 2.79 4.76 -1.26 -4.45 118.16 121.12 2va8 n LYS 22 Ca -0.17 0.25 -0.08 0.00 -2.87 0.00 0.00 58.31 55.44 2va8 n LYS 22 Cb 0.51 -1.71 -0.10 0.00 -1.84 0.00 0.00 35.03 31.89 2va8 n LYS 22 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2va8 s LYS 23 N -2.56 0.60 0.30 1.97 1.02 -1.26 -2.76 119.74 117.04 2va8 s LYS 23 Ca -0.17 -1.17 -0.25 0.00 0.02 0.00 0.00 55.97 54.41 2va8 s LYS 23 Cb 0.07 0.16 -0.10 0.00 -0.52 0.00 0.00 37.83 37.45 2va8 s LYS 23 CO 0.78 -0.10 0.90 -0.51 -0.92 0.00 0.00 175.35 175.50 2va8 s LEU 24 N -2.78 4.35 1.00 3.17 1.43 0.22 -4.90 118.68 121.17 2va8 s LEU 24 Ca 0.05 1.76 -0.14 0.00 -1.03 0.00 0.00 54.13 54.77 2va8 s LEU 24 Cb 0.06 -3.91 0.05 0.00 0.03 0.00 0.00 46.19 42.42 2va8 s LEU 24 CO -0.09 -0.04 0.29 0.59 0.23 0.00 0.00 176.35 177.33 2va8 n ASN 25 N 0.63 -2.21 -0.24 2.29 3.02 -1.26 -3.51 115.26 113.98 2va8 n ASN 25 Ca 0.01 0.20 -0.00 0.00 -0.03 0.00 0.00 54.58 54.76 2va8 n ASN 25 Cb 0.50 -1.13 0.12 0.00 -0.61 0.00 0.00 39.78 38.65 2va8 n ASN 25 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2va8 h PRO 26 N -1.70 0.67 0.00 3.52 0.11 -1.94 0.03 132.00 132.68 2va8 h PRO 26 Ca -0.46 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.46 2va8 h PRO 26 Cb 1.30 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2va8 h PRO 26 CO 0.35 0.44 -0.70 -1.00 -0.21 0.00 0.00 178.00 176.88 2va8 h PRO 27 N 0.69 0.00 -0.45 1.05 0.13 -1.90 0.19 132.00 131.71 2va8 h PRO 27 Ca 0.33 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.37 2va8 h PRO 27 Cb 0.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.37 2va8 h PRO 27 CO -0.21 0.70 -0.07 1.96 -0.23 0.00 0.00 178.00 180.15 2va8 h GLN 28 N 0.00 0.83 0.06 0.86 4.20 -1.86 0.94 115.11 120.15 2va8 h GLN 28 Ca -0.01 -0.30 -0.00 0.00 0.06 0.00 0.00 58.65 58.40 2va8 h GLN 28 Cb 1.34 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.06 2va8 h GLN 28 CO 0.09 0.93 -0.03 1.15 -0.67 0.00 0.00 178.83 180.30 2va8 h THR 29 N 0.67 1.02 -0.49 -0.54 2.02 -0.86 -1.97 112.91 112.75 2va8 h THR 29 Ca 0.12 -0.24 0.10 0.00 0.77 0.00 0.00 66.41 67.15 2va8 h THR 29 Cb 0.60 1.18 -0.09 0.00 -1.74 0.00 0.00 68.15 68.10 2va8 h THR 29 CO 0.04 0.06 -0.06 -0.33 0.37 0.00 0.00 175.52 175.60 2va8 h GLU 30 N -0.19 0.05 -0.35 6.66 4.39 -0.52 -0.83 114.58 123.80 2va8 h GLU 30 Ca -0.01 -0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.75 2va8 h GLU 30 Cb 0.16 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.75 2va8 h GLU 30 CO 0.01 0.03 0.02 0.00 -1.16 0.00 0.00 179.01 177.92 2va8 h ALA 31 N 1.47 0.34 -0.63 3.43 0.00 -0.70 -1.40 119.26 121.77 2va8 h ALA 31 Ca 0.25 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.27 2va8 h ALA 31 Cb 0.38 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2va8 h ALA 31 CO -0.46 -0.38 0.39 0.28 0.00 0.00 0.00 179.25 179.07 2va8 h VAL 32 N 0.13 1.08 -0.52 0.00 2.07 -0.78 -1.87 116.25 116.36 2va8 h VAL 32 Ca 0.17 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2va8 h VAL 32 Cb 0.22 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2va8 h VAL 32 CO -0.26 0.14 0.33 0.11 0.02 0.00 0.00 177.57 177.91 2va8 h LYS 33 N 0.76 0.68 -0.24 1.57 1.57 -0.77 -1.29 116.57 118.86 2va8 h LYS 33 Ca 0.25 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2va8 h LYS 33 Cb 0.02 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.17 2va8 h LYS 33 CO -0.10 0.46 0.00 1.63 -0.57 0.00 0.00 179.45 180.87 2va8 n LYS 34 N -4.45 1.44 -1.74 3.15 4.76 -0.56 -4.89 118.16 115.87 2va8 n LYS 34 Ca 0.05 -0.63 0.00 0.00 -2.87 0.00 0.00 58.31 54.86 2va8 n LYS 34 Cb 0.06 -1.18 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 2va8 n LYS 34 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2va8 n GLY 35 N 0.72 0.76 0.25 0.72 0.00 -0.49 -4.76 105.19 102.39 2va8 n GLY 35 Ca 0.06 -0.68 0.03 0.00 0.00 0.00 0.00 46.02 45.43 2va8 n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2va8 h LEU 36 N 0.00 -0.27 -0.84 0.99 5.85 -1.47 -1.45 115.31 118.12 2va8 h LEU 36 Ca 0.00 0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 2va8 h LEU 36 Cb 0.81 0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 2va8 h LEU 36 CO 0.00 -0.12 -0.32 -0.07 -0.34 0.00 0.00 178.44 177.58 2va8 h LEU 37 N 0.13 0.00 0.00 2.25 4.07 -1.85 -2.12 115.31 117.79 2va8 h LEU 37 Ca 0.36 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.32 2va8 h LEU 37 Cb 0.60 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.34 2va8 h LEU 37 CO -0.57 0.32 -0.15 -0.62 -1.08 0.00 0.00 178.44 176.35 2va8 n GLU 38 N -3.41 0.06 -0.89 1.13 -0.58 -0.91 -4.69 120.64 111.36 2va8 n GLU 38 Ca 0.00 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 2va8 n GLU 38 Cb 0.51 -1.56 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 2va8 n GLU 38 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2va8 n GLY 39 N 1.46 0.63 3.76 0.62 0.00 -0.75 -5.05 105.19 105.86 2va8 n GLY 39 Ca 0.06 -0.75 -0.39 0.00 0.00 0.00 0.00 46.02 44.94 2va8 n GLY 39 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2va8 s ASN 40 N -2.71 5.71 -0.26 1.61 3.84 -0.62 -4.90 114.94 117.61 2va8 s ASN 40 Ca 0.00 2.83 -0.29 0.00 0.21 0.00 0.00 52.86 55.61 2va8 s ASN 40 Cb 0.00 -2.64 -0.00 0.00 -0.55 0.00 0.00 41.25 38.05 2va8 s ASN 40 CO 0.00 -1.28 1.25 -0.60 -2.79 0.00 0.00 177.10 173.68 2va8 s ARG 41 N -2.60 4.04 0.00 0.43 3.52 -1.26 -4.72 118.95 118.36 2va8 s ARG 41 Ca 0.64 1.35 0.06 0.00 -0.13 0.00 0.00 55.73 57.65 2va8 s ARG 41 Cb -0.42 -3.82 -0.02 0.00 -1.56 0.00 0.00 34.95 29.14 2va8 s ARG 41 CO 0.52 -0.96 -0.20 -0.51 -0.81 0.00 0.00 175.30 173.35 2va8 s LEU 42 N 3.99 2.08 -0.38 -0.88 1.43 -1.26 -1.13 118.68 122.52 2va8 s LEU 42 Ca 0.54 -0.40 -0.09 0.00 -1.03 0.00 0.00 54.13 53.15 2va8 s LEU 42 Cb -0.17 -0.98 0.05 0.00 0.03 0.00 0.00 46.19 45.12 2va8 s LEU 42 CO 0.19 0.21 0.19 -0.22 0.23 0.00 0.00 176.35 176.95 2va8 s LEU 43 N -0.69 4.77 -0.26 1.79 2.96 -0.30 -1.41 118.68 125.53 2va8 s LEU 43 Ca 0.07 -1.27 -0.07 0.00 -0.22 0.00 0.00 54.13 52.64 2va8 s LEU 43 Cb -0.08 -1.95 -0.02 0.00 0.50 0.00 0.00 46.19 44.64 2va8 s LEU 43 CO 0.00 -0.43 0.08 -0.76 -1.32 0.00 0.00 176.35 173.92 2va8 s LEU 44 N 1.44 3.55 -0.04 -0.68 1.43 -0.15 0.39 118.68 124.62 2va8 s LEU 44 Ca 0.01 -0.32 0.05 0.00 -1.03 0.00 0.00 54.13 52.84 2va8 s LEU 44 Cb -0.21 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 2va8 s LEU 44 CO 0.03 -0.07 -0.18 0.42 0.23 0.00 0.00 176.35 176.78 2va8 s THR 45 N 1.59 2.74 -0.01 5.49 -4.23 -1.01 -1.07 115.64 119.14 2va8 s THR 45 Ca 0.06 -0.84 -0.30 0.00 -1.18 0.00 0.00 61.69 59.43 2va8 s THR 45 Cb -0.16 -2.04 0.11 0.00 1.34 0.00 0.00 72.50 71.75 2va8 s THR 45 CO 0.03 0.58 1.09 -0.94 -0.54 0.00 0.00 174.62 174.85 2va8 s SER 46 N -0.63 -0.18 1.48 3.99 1.04 -0.80 -1.78 113.70 116.81 2va8 s SER 46 Ca 0.09 -0.14 -0.24 0.00 0.48 0.00 0.00 55.95 56.14 2va8 s SER 46 Cb -0.11 0.29 0.38 0.00 0.10 0.00 0.00 66.02 66.68 2va8 s SER 46 CO 0.00 -0.51 0.88 -2.65 0.98 0.00 0.00 173.24 171.95 2va8 n PRO 47 N -0.33 -4.83 0.23 4.02 -0.02 -1.26 -4.26 135.00 128.55 2va8 n PRO 47 Ca -0.06 -1.48 -0.14 0.00 -2.02 0.00 0.00 63.50 59.80 2va8 n PRO 47 Cb 0.61 -1.89 -0.08 0.00 -0.02 0.00 0.00 33.50 32.12 2va8 n PRO 47 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 2va8 h THR 48 N -3.61 0.46 -1.62 3.45 1.35 -1.95 -3.28 112.91 107.71 2va8 h THR 48 Ca -0.40 -0.45 -0.68 0.00 -0.55 0.00 0.00 66.41 64.34 2va8 h THR 48 Cb 1.33 0.64 -0.24 0.00 -1.73 0.00 0.00 68.15 68.14 2va8 h THR 48 CO 0.24 0.07 0.86 0.61 -0.25 0.00 0.00 175.52 177.04 2va8 n GLY 49 N -0.51 5.20 1.06 5.82 0.00 -1.26 -4.58 105.19 110.93 2va8 n GLY 49 Ca -0.10 -2.27 0.11 0.00 0.00 0.00 0.00 46.02 43.75 2va8 n GLY 49 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2va8 n SER 50 N -0.18 3.12 -2.00 1.61 7.64 -1.24 -4.71 113.62 117.87 2va8 n SER 50 Ca 0.53 -1.96 -0.11 0.00 1.01 0.00 0.00 58.87 58.34 2va8 n SER 50 Cb 0.36 -0.31 0.04 0.00 -1.01 0.00 0.00 64.21 63.29 2va8 n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2va8 n GLY 51 N 1.44 0.22 0.26 0.23 0.00 -1.26 -4.79 105.19 101.29 2va8 n GLY 51 Ca 0.20 -0.23 0.16 0.00 0.00 0.00 0.00 46.02 46.14 2va8 n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2va8 h LYS 52 N -1.24 0.00 -0.30 1.61 1.57 -1.92 -3.07 116.57 113.21 2va8 h LYS 52 Ca -0.27 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.49 2va8 h LYS 52 Cb 1.17 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 2va8 h LYS 52 CO 0.26 0.00 0.10 1.15 -0.57 0.00 0.00 179.45 180.40 2va8 h THR 53 N 0.00 1.20 -0.88 -0.16 2.02 -1.97 -1.56 112.91 111.56 2va8 h THR 53 Ca 0.00 -0.62 0.01 0.00 0.77 0.00 0.00 66.41 66.57 2va8 h THR 53 Cb 0.65 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 68.05 2va8 h THR 53 CO 0.00 0.21 0.58 0.25 0.37 0.00 0.00 175.52 176.93 2va8 h LEU 54 N 0.34 1.01 -0.62 2.58 5.85 -1.95 0.15 115.31 122.67 2va8 h LEU 54 Ca 0.10 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.81 2va8 h LEU 54 Cb 0.23 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 2va8 h LEU 54 CO -0.00 0.74 0.40 0.40 -0.34 0.00 0.00 178.44 179.63 2va8 h ILE 55 N 1.19 1.12 -0.38 4.05 2.04 -1.51 0.43 117.51 124.46 2va8 h ILE 55 Ca 0.32 -0.27 -0.04 0.00 1.00 0.00 0.00 64.86 65.87 2va8 h ILE 55 Cb -0.13 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.18 2va8 h ILE 55 CO -0.07 0.15 0.07 0.00 0.00 0.00 0.00 178.15 178.30 2va8 h ALA 56 N 1.25 0.50 -0.24 1.87 0.00 -0.63 -0.83 119.26 121.18 2va8 h ALA 56 Ca 0.24 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2va8 h ALA 56 Cb -0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2va8 h ALA 56 CO -0.08 0.20 0.15 0.93 0.00 0.00 0.00 179.25 180.45 2va8 h GLU 57 N 0.47 0.32 -0.92 0.00 5.08 -0.72 -0.26 114.58 118.55 2va8 h GLU 57 Ca 0.12 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2va8 h GLU 57 Cb 0.34 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 2va8 h GLU 57 CO 0.01 0.25 0.61 0.52 -1.00 0.00 0.00 179.01 179.39 2va8 h MET 58 N 0.30 1.19 0.05 2.33 2.86 -0.85 -0.80 114.93 120.01 2va8 h MET 58 Ca 0.09 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2va8 h MET 58 Cb 0.01 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 31.40 2va8 h MET 58 CO -0.02 0.79 -0.02 0.78 1.06 0.00 0.00 176.91 179.50 2va8 h GLY 59 N 1.23 -0.06 0.84 8.32 0.00 -0.64 -1.56 103.07 111.19 2va8 h GLY 59 Ca 0.34 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.69 2va8 h GLY 59 CO -0.08 -0.02 -0.09 -2.22 0.00 0.00 0.00 176.54 174.12 2va8 h ILE 60 N -0.17 0.88 -0.11 2.60 2.04 -0.93 -1.40 117.51 120.41 2va8 h ILE 60 Ca -0.01 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 2va8 h ILE 60 Cb 0.15 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2va8 h ILE 60 CO 0.01 0.08 0.06 0.40 0.00 0.00 0.00 178.15 178.70 2va8 h ILE 61 N -0.42 1.08 -0.79 -0.67 1.08 -1.21 -0.29 117.51 116.28 2va8 h ILE 61 Ca -0.03 -0.21 0.10 0.00 -0.39 0.00 0.00 64.86 64.33 2va8 h ILE 61 Cb 0.33 1.01 -0.07 0.00 -3.07 0.00 0.00 36.82 35.02 2va8 h ILE 61 CO 0.04 0.07 0.43 -1.28 -0.69 0.00 0.00 178.15 176.73 2va8 h SER 62 N 0.10 0.60 -0.23 1.72 0.87 -1.30 0.47 113.55 115.78 2va8 h SER 62 Ca 0.04 0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 2va8 h SER 62 Cb 0.06 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2va8 h SER 62 CO -0.01 0.34 0.01 0.15 -0.53 0.00 0.00 176.83 176.79 2va8 h PHE 63 N 0.72 0.43 -0.76 2.24 3.57 -0.61 -2.11 116.94 120.43 2va8 h PHE 63 Ca 0.39 -0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.76 2va8 h PHE 63 Cb 0.38 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.98 2va8 h PHE 63 CO -0.08 0.56 0.26 -0.07 -2.23 0.00 0.00 178.31 176.75 2va8 h LEU 64 N 0.18 1.08 -0.90 0.59 3.38 -0.78 0.24 115.31 119.10 2va8 h LEU 64 Ca 0.07 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 2va8 h LEU 64 Cb 0.38 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2va8 h LEU 64 CO 0.01 0.99 0.18 -0.07 0.09 0.00 0.00 178.44 179.64 2va8 h LEU 65 N 1.11 0.92 0.00 1.67 3.38 -0.82 -3.16 115.31 118.41 2va8 h LEU 65 Ca 0.25 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2va8 h LEU 65 Cb 0.28 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2va8 h LEU 65 CO -0.01 0.88 -0.65 0.11 0.09 0.00 0.00 178.44 178.85 2va8 h LYS 66 N 0.95 0.00 -5.01 1.13 1.57 -1.07 -3.48 116.57 110.67 2va8 h LYS 66 Ca 0.21 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.60 2va8 h LYS 66 Cb 0.30 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.47 2va8 h LYS 66 CO -0.00 0.00 -0.62 -0.80 -0.57 0.00 0.00 179.45 177.46 2va8 s ASN 67 N -5.23 1.60 0.00 0.86 0.01 0.05 -5.09 114.94 107.13 2va8 s ASN 67 Ca 0.03 -1.37 0.00 0.00 -0.71 0.00 0.00 52.86 50.81 2va8 s ASN 67 Cb 0.10 0.07 0.00 0.00 0.41 0.00 0.00 41.25 41.83 2va8 s ASN 67 CO 0.74 -0.68 0.00 0.61 -1.51 0.00 0.00 177.10 176.26 2va8 n GLY 68 N -0.53 -1.83 7.00 0.66 0.00 -1.26 -4.57 105.19 104.65 2va8 n GLY 68 Ca -0.01 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.64 2va8 n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2va8 n GLY 69 N 2.55 -0.36 3.35 -0.02 0.00 -1.26 -4.72 105.19 104.73 2va8 n GLY 69 Ca 0.00 -1.07 -0.18 0.00 0.00 0.00 0.00 46.02 44.77 2va8 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2va8 s LYS 70 N 0.00 1.36 0.03 1.61 1.02 0.45 -4.89 119.74 119.31 2va8 s LYS 70 Ca 0.00 -1.67 0.02 0.00 0.02 0.00 0.00 55.97 54.34 2va8 s LYS 70 Cb 0.00 -0.77 -0.02 0.00 -0.52 0.00 0.00 37.83 36.52 2va8 s LYS 70 CO 0.00 -0.03 -0.07 0.00 -0.92 0.00 0.00 175.35 174.33 2va8 s ALA 71 N -3.29 0.48 -0.06 5.17 0.00 0.02 -2.27 121.76 121.81 2va8 s ALA 71 Ca 0.27 -0.63 0.06 0.00 0.00 0.00 0.00 51.96 51.66 2va8 s ALA 71 Cb 0.05 0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 2va8 s ALA 71 CO 0.08 -0.01 -0.24 0.42 0.00 0.00 0.00 175.76 176.01 2va8 s ILE 72 N -1.13 2.18 -0.21 0.00 1.01 -0.72 -1.03 121.20 121.31 2va8 s ILE 72 Ca -0.08 -1.03 -0.04 0.00 0.00 0.00 0.00 60.65 59.50 2va8 s ILE 72 Cb -0.08 -1.79 -0.01 0.00 0.01 0.00 0.00 42.46 40.58 2va8 s ILE 72 CO 0.00 0.57 -0.05 -0.47 0.00 0.00 0.00 174.94 174.99 2va8 s TYR 73 N -0.22 2.95 -0.04 3.97 5.04 0.97 -0.61 117.35 129.41 2va8 s TYR 73 Ca -0.02 -0.84 0.06 0.00 -2.44 0.00 0.00 57.07 53.84 2va8 s TYR 73 Cb -0.13 -2.07 -0.01 0.00 0.35 0.00 0.00 41.96 40.09 2va8 s TYR 73 CO 0.03 -0.47 -0.23 0.54 -1.34 0.00 0.00 175.55 174.08 2va8 s VAL 74 N 1.29 1.88 -0.01 3.14 0.11 -0.40 -0.91 120.40 125.51 2va8 s VAL 74 Ca 0.03 -1.00 -0.16 0.00 -2.93 0.00 0.00 61.98 57.93 2va8 s VAL 74 Cb -0.14 -1.58 0.03 0.00 -1.53 0.00 0.00 36.38 33.15 2va8 s VAL 74 CO -0.02 0.53 0.35 0.28 -3.33 0.00 0.00 175.10 172.91 2va8 s THR 75 N -0.34 0.06 0.26 5.04 -1.32 -0.89 -1.53 115.64 116.91 2va8 s THR 75 Ca 0.03 -0.46 -0.02 0.00 -1.21 0.00 0.00 61.69 60.03 2va8 s THR 75 Cb -0.11 -0.72 0.11 0.00 -1.51 0.00 0.00 72.50 70.28 2va8 s THR 75 CO 0.01 -0.25 1.76 -0.65 -2.21 0.00 0.00 174.62 173.28 2va8 h PRO 76 N 3.64 0.81 -5.76 7.08 0.11 -1.88 -3.31 132.00 132.69 2va8 h PRO 76 Ca -0.30 -0.22 -0.66 0.00 0.11 0.00 0.00 66.00 64.93 2va8 h PRO 76 Cb 1.18 -0.10 -0.20 0.00 0.11 0.00 0.00 31.00 32.00 2va8 h PRO 76 CO 0.41 0.81 -0.67 -0.51 -0.21 0.00 0.00 178.00 177.82 2va8 s LEU 77 N -9.19 3.25 0.36 2.35 1.43 -1.26 -4.70 118.68 110.92 2va8 s LEU 77 Ca -0.10 -0.05 0.07 0.00 -1.03 0.00 0.00 54.13 53.03 2va8 s LEU 77 Cb 0.15 -1.74 0.77 0.00 0.03 0.00 0.00 46.19 45.39 2va8 s LEU 77 CO 0.81 0.28 1.92 0.03 0.23 0.00 0.00 176.35 179.62 2va8 h ARG 78 N 5.85 0.72 0.00 1.70 3.08 -1.98 -0.33 114.38 123.42 2va8 h ARG 78 Ca -0.41 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.55 2va8 h ARG 78 Cb 1.18 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.07 2va8 h ARG 78 CO 0.57 0.47 -0.20 0.00 -1.07 0.00 0.00 179.97 179.74 2va8 h ALA 79 N 1.60 1.48 0.00 0.04 0.00 -1.99 -1.56 119.26 118.83 2va8 h ALA 79 Ca 0.38 -0.18 -0.22 0.00 0.00 0.00 0.00 54.91 54.88 2va8 h ALA 79 Cb 0.47 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2va8 h ALA 79 CO -0.15 0.25 -1.11 -0.07 0.00 0.00 0.00 179.25 178.17 2va8 h LEU 80 N 0.00 0.00 -0.63 0.00 3.38 -1.51 -3.01 115.31 113.54 2va8 h LEU 80 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2va8 h LEU 80 Cb 0.40 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2va8 h LEU 80 CO 0.03 0.99 -0.00 0.71 0.09 0.00 0.00 178.44 180.26 2va8 h THR 81 N 0.00 1.27 -0.46 0.22 1.35 -1.00 -2.38 112.91 111.91 2va8 h THR 81 Ca -0.06 -1.16 -0.14 0.00 -0.55 0.00 0.00 66.41 64.51 2va8 h THR 81 Cb 1.81 0.79 -0.01 0.00 -1.73 0.00 0.00 68.15 69.01 2va8 h THR 81 CO 0.12 0.42 -0.25 0.78 -0.25 0.00 0.00 175.52 176.34 2va8 h ASN 82 N 0.98 1.01 0.43 5.36 2.35 -1.36 -1.37 115.58 122.98 2va8 h ASN 82 Ca 0.17 -0.40 -0.01 0.00 -0.55 0.00 0.00 56.30 55.51 2va8 h ASN 82 Cb 0.56 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.63 2va8 h ASN 82 CO 0.03 1.20 -0.50 -0.33 -1.65 0.00 0.00 177.43 176.17 2va8 h GLU 83 N 0.83 -0.92 -0.03 0.81 5.08 -1.51 -3.07 114.58 115.77 2va8 h GLU 83 Ca 0.10 0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 2va8 h GLU 83 Cb 0.84 0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 2va8 h GLU 83 CO 0.07 -0.61 -0.01 0.87 -1.00 0.00 0.00 179.01 178.33 2va8 h LYS 84 N -0.95 0.04 -0.60 2.33 1.79 -1.35 -2.37 116.57 115.46 2va8 h LYS 84 Ca -0.05 -0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.35 2va8 h LYS 84 Cb 0.85 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.47 2va8 h LYS 84 CO -0.11 0.05 0.11 -0.92 -1.08 0.00 0.00 179.45 177.50 2va8 h TYR 85 N 0.04 1.04 -0.20 -1.35 5.03 -1.19 -0.35 116.97 119.99 2va8 h TYR 85 Ca 0.01 -0.14 -0.13 0.00 2.58 0.00 0.00 58.73 61.05 2va8 h TYR 85 Cb 0.04 -0.29 -0.01 0.00 1.55 0.00 0.00 36.73 38.02 2va8 h TYR 85 CO 0.00 0.89 -0.42 -0.07 -1.32 0.00 0.00 178.16 177.25 2va8 h LEU 86 N 0.89 0.49 -0.11 2.82 3.38 -1.34 -1.98 115.31 119.45 2va8 h LEU 86 Ca 0.18 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 2va8 h LEU 86 Cb 0.41 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 2va8 h LEU 86 CO 0.01 0.85 -0.11 0.74 0.09 0.00 0.00 178.44 180.02 2va8 h THR 87 N 0.38 1.35 0.00 0.22 2.02 -1.40 -3.29 112.91 112.19 2va8 h THR 87 Ca 0.03 -1.25 -0.03 0.00 0.77 0.00 0.00 66.41 65.93 2va8 h THR 87 Cb 0.89 1.93 -0.00 0.00 -1.74 0.00 0.00 68.15 69.23 2va8 h THR 87 CO 0.08 0.36 -0.15 -0.26 0.37 0.00 0.00 175.52 175.92 2va8 h PHE 88 N -0.12 0.00 0.00 3.16 -1.00 -0.95 -2.62 116.94 115.40 2va8 h PHE 88 Ca 0.02 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.80 2va8 h PHE 88 Cb 0.62 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.18 2va8 h PHE 88 CO 0.09 0.15 0.00 0.87 -1.61 0.00 0.00 178.31 177.80 2va8 h LYS 89 N 0.00 0.00 -0.00 1.51 1.57 -1.42 -1.40 116.57 116.82 2va8 h LYS 89 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2va8 h LYS 89 Cb 0.56 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.87 2va8 h LYS 89 CO 0.02 0.00 0.00 -0.44 -0.57 0.00 0.00 179.45 178.46 2va8 h ASP 90 N 0.00 0.00 0.09 0.86 5.19 -1.65 -2.51 116.42 118.40 2va8 h ASP 90 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2va8 h ASP 90 Cb 0.03 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.54 2va8 h ASP 90 CO 0.00 0.00 -0.00 0.79 -3.12 0.00 0.00 179.24 176.91 2va8 n TRP 91 N -4.23 0.00 0.54 4.55 7.02 -0.53 -2.71 117.44 122.08 2va8 n TRP 91 Ca -0.03 0.00 0.08 0.00 -1.02 0.00 0.00 57.50 56.53 2va8 n TRP 91 Cb 0.09 -0.05 0.35 0.00 -2.42 0.00 0.00 31.31 29.28 2va8 n TRP 91 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2va8 n GLU 92 N -0.95 0.01 0.02 -0.99 1.02 -0.95 -2.52 120.64 116.28 2va8 n GLU 92 Ca 0.22 0.23 -0.07 0.00 -0.02 0.00 0.00 57.16 57.52 2va8 n GLU 92 Cb 0.15 -1.52 0.09 0.00 -0.02 0.00 0.00 31.44 30.15 2va8 n GLU 92 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2va8 h LEU 93 N 0.00 0.52 -3.35 -4.62 3.38 -1.74 -2.83 115.31 106.67 2va8 h LEU 93 Ca 0.00 -0.26 -0.23 0.00 0.09 0.00 0.00 57.88 57.48 2va8 h LEU 93 Cb 0.28 -0.15 -0.14 0.00 0.09 0.00 0.00 40.66 40.75 2va8 h LEU 93 CO 0.00 0.94 0.29 2.30 0.09 0.00 0.00 178.44 182.06 2va8 n ILE 94 N -3.97 2.52 -0.99 1.22 -5.35 -1.05 -4.91 119.36 106.84 2va8 n ILE 94 Ca -0.02 -1.35 0.00 0.00 -0.27 0.00 0.00 62.75 61.11 2va8 n ILE 94 Cb 0.57 -0.46 0.00 0.00 -1.74 0.00 0.00 39.64 38.01 2va8 n ILE 94 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2va8 n GLY 95 N -0.22 0.48 3.75 3.28 0.00 -1.07 -5.03 105.19 106.38 2va8 n GLY 95 Ca 0.36 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.98 2va8 n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2va8 s PHE 96 N -2.09 3.91 -0.25 1.61 0.08 -1.09 -4.99 117.98 115.17 2va8 s PHE 96 Ca 0.00 1.81 -0.09 0.00 0.12 0.00 0.00 56.93 58.77 2va8 s PHE 96 Cb 0.00 -2.96 -0.04 0.00 -0.57 0.00 0.00 43.02 39.45 2va8 s PHE 96 CO 0.00 0.39 0.13 0.15 -0.10 0.00 0.00 175.22 175.79 2va8 s LYS 97 N -0.79 3.88 -0.10 0.44 1.02 -1.26 -3.50 119.74 119.43 2va8 s LYS 97 Ca 0.42 -0.36 -0.02 0.00 0.02 0.00 0.00 55.97 56.03 2va8 s LYS 97 Cb -0.24 -3.48 -0.03 0.00 -0.52 0.00 0.00 37.83 33.55 2va8 s LYS 97 CO 0.30 -0.09 -0.02 0.08 -0.92 0.00 0.00 175.35 174.70 2va8 s VAL 98 N 1.43 4.10 0.07 3.17 1.01 -1.26 -0.28 120.40 128.63 2va8 s VAL 98 Ca 0.06 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 61.66 2va8 s VAL 98 Cb -0.15 -2.73 -0.01 0.00 0.00 0.00 0.00 36.38 33.49 2va8 s VAL 98 CO 0.06 0.57 0.14 0.00 0.00 0.00 0.00 175.10 175.88 2va8 s ALA 99 N -0.55 -0.11 -0.10 5.51 0.00 0.18 -4.98 121.76 121.71 2va8 s ALA 99 Ca 0.09 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.37 2va8 s ALA 99 Cb -0.12 0.39 -0.03 0.00 0.00 0.00 0.00 23.12 23.35 2va8 s ALA 99 CO 0.02 -0.44 0.01 -1.64 0.00 0.00 0.00 175.76 173.71 2va8 s MET 100 N -3.49 3.18 0.75 0.00 -1.94 -1.26 -0.50 119.30 116.04 2va8 s MET 100 Ca 0.02 -0.40 -0.15 0.00 -1.71 0.00 0.00 55.69 53.46 2va8 s MET 100 Cb 0.04 -2.87 0.05 0.00 2.01 0.00 0.00 34.83 34.05 2va8 s MET 100 CO -0.09 0.62 1.23 0.25 -0.01 0.00 0.00 175.02 177.02 2va8 n THR 101 N 2.42 3.14 -1.30 2.05 -2.24 -0.86 -4.93 114.28 112.56 2va8 n THR 101 Ca -0.18 -0.32 -0.29 0.00 -2.27 0.00 0.00 64.05 60.99 2va8 n THR 101 Cb 0.53 -1.31 0.16 0.00 -2.10 0.00 0.00 70.33 67.62 2va8 n THR 101 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2va8 s SER 102 N -1.83 2.92 0.00 3.42 1.04 -1.26 -4.98 113.70 113.01 2va8 s SER 102 Ca 0.77 1.10 0.28 0.00 0.48 0.00 0.00 55.95 58.58 2va8 s SER 102 Cb -0.33 -1.74 1.00 0.00 0.10 0.00 0.00 66.02 65.06 2va8 s SER 102 CO 0.47 -2.94 1.75 0.61 0.98 0.00 0.00 173.24 174.11 2va8 n GLY 103 N -1.49 -1.26 3.72 7.32 0.00 -1.26 -4.87 105.19 107.35 2va8 n GLY 103 Ca 0.06 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 2va8 n GLY 103 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2va8 s ASP 104 N -2.85 7.37 0.06 1.61 3.68 -1.26 -4.96 116.67 120.32 2va8 s ASP 104 Ca 0.17 1.82 0.13 0.00 2.13 0.00 0.00 52.55 56.80 2va8 s ASP 104 Cb 0.19 -2.58 -0.16 0.00 -1.45 0.00 0.00 42.92 38.91 2va8 s ASP 104 CO 0.57 -0.21 0.95 1.88 0.13 0.00 0.00 175.17 178.49 2va8 h TYR 105 N 6.08 0.00 -0.68 -5.34 0.05 -1.89 -3.40 116.97 111.79 2va8 h TYR 105 Ca -0.42 0.00 -0.43 0.00 0.05 0.00 0.00 58.73 57.92 2va8 h TYR 105 Cb 1.21 0.00 -0.13 0.00 1.01 0.00 0.00 36.73 38.83 2va8 h TYR 105 CO 0.66 0.82 0.51 -3.47 -1.05 0.00 0.00 178.16 175.63 2va8 n ASP 106 N -3.10 6.35 -3.60 3.88 2.03 -1.25 -4.78 116.55 116.09 2va8 n ASP 106 Ca -0.09 -2.94 -0.08 0.00 0.52 0.00 0.00 54.79 52.21 2va8 n ASP 106 Cb 0.93 -1.32 -0.02 0.00 -0.72 0.00 0.00 41.12 39.99 2va8 n ASP 106 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2va8 s THR 107 N -0.88 0.00 -1.54 5.18 -1.32 -1.26 -5.05 115.64 110.76 2va8 s THR 107 Ca 0.62 -0.31 0.14 0.00 -1.21 0.00 0.00 61.69 60.93 2va8 s THR 107 Cb 0.33 -1.40 0.25 0.00 -1.51 0.00 0.00 72.50 70.17 2va8 s THR 107 CO -0.13 0.00 1.14 -0.90 -2.21 0.00 0.00 174.62 172.52 2va8 n ASP 108 N -0.36 2.69 -3.96 8.08 5.75 -1.26 -4.83 116.55 122.65 2va8 n ASP 108 Ca -0.09 -1.79 -0.38 0.00 -0.01 0.00 0.00 54.79 52.52 2va8 n ASP 108 Cb 0.62 -0.14 0.01 0.00 -1.03 0.00 0.00 41.12 40.58 2va8 n ASP 108 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2va8 n ASP 109 N 0.83 -3.52 0.26 -1.12 8.00 -1.26 -4.82 116.55 114.91 2va8 n ASP 109 Ca 0.12 -1.17 0.12 0.00 0.71 0.00 0.00 54.79 54.56 2va8 n ASP 109 Cb 0.42 -2.38 0.71 0.00 -0.02 0.00 0.00 41.12 39.84 2va8 n ASP 109 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2va8 h ALA 110 N 1.19 1.37 0.00 2.24 0.00 -2.03 -2.11 119.26 119.92 2va8 h ALA 110 Ca -0.68 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.12 2va8 h ALA 110 Cb 1.39 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2va8 h ALA 110 CO 0.54 0.15 0.00 -2.67 0.00 0.00 0.00 179.25 177.27 2va8 n TRP 111 N -3.77 0.20 0.57 0.00 4.27 -1.26 -2.14 117.44 115.32 2va8 n TRP 111 Ca -0.02 0.10 0.10 0.00 -3.89 0.00 0.00 57.50 53.79 2va8 n TRP 111 Cb 0.23 -0.66 0.43 0.00 -1.36 0.00 0.00 31.31 29.94 2va8 n TRP 111 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 2va8 n LEU 112 N -1.70 0.28 0.04 5.67 4.77 -0.79 -3.11 117.00 122.16 2va8 n LEU 112 Ca 0.00 0.56 0.22 0.00 -0.03 0.00 0.00 56.01 56.76 2va8 n LEU 112 Cb 0.05 -0.50 0.73 0.00 -2.33 0.00 0.00 43.42 41.37 2va8 n LEU 112 CO 0.06 -0.29 1.19 0.07 -1.33 0.00 0.00 177.39 177.09 2va8 h LYS 113 N 0.00 0.00 -0.60 3.23 2.10 -1.67 -0.86 116.57 118.77 2va8 h LYS 113 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2va8 h LYS 113 Cb 0.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 2va8 h LYS 113 CO 0.00 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.54 2va8 n ASN 114 N -3.81 3.39 -4.32 7.07 5.03 -1.18 -4.93 115.26 116.50 2va8 n ASN 114 Ca 0.09 -2.12 -0.27 0.00 0.87 0.00 0.00 54.58 53.16 2va8 n ASN 114 Cb 0.69 -0.43 -0.13 0.00 -1.02 0.00 0.00 39.78 38.88 2va8 n ASN 114 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2va8 s TYR 115 N -1.41 2.03 -0.20 3.10 2.02 -0.33 -4.86 117.35 117.70 2va8 s TYR 115 Ca 0.40 -0.40 0.04 0.00 -0.37 0.00 0.00 57.07 56.74 2va8 s TYR 115 Cb 0.22 -1.13 -0.15 0.00 -0.40 0.00 0.00 41.96 40.51 2va8 s TYR 115 CO 0.24 0.23 -0.14 -0.25 -1.57 0.00 0.00 175.55 174.07 2va8 n ASP 116 N 1.18 2.16 -4.15 2.29 8.00 0.62 -4.89 116.55 121.76 2va8 n ASP 116 Ca -0.18 -0.09 -0.33 0.00 0.71 0.00 0.00 54.79 54.90 2va8 n ASP 116 Cb 0.53 -0.11 -0.16 0.00 -0.02 0.00 0.00 41.12 41.36 2va8 n ASP 116 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2va8 s ILE 117 N -2.41 2.13 -0.12 0.53 1.01 -0.43 -0.80 121.20 121.12 2va8 s ILE 117 Ca -0.24 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.50 2va8 s ILE 117 Cb 0.07 -1.88 0.01 0.00 0.01 0.00 0.00 42.46 40.67 2va8 s ILE 117 CO 0.51 0.54 -0.17 -0.63 0.00 0.00 0.00 174.94 175.18 2va8 s ILE 118 N 1.09 1.65 -0.19 2.92 1.01 -0.20 -0.64 121.20 126.84 2va8 s ILE 118 Ca -0.00 -0.73 -0.08 0.00 0.00 0.00 0.00 60.65 59.84 2va8 s ILE 118 Cb -0.14 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.80 2va8 s ILE 118 CO -0.08 0.47 0.08 -0.63 0.00 0.00 0.00 174.94 174.78 2va8 s ILE 119 N 0.92 4.91 0.26 2.92 1.09 0.35 -0.02 121.20 131.63 2va8 s ILE 119 Ca -0.07 0.01 -0.05 0.00 -1.10 0.00 0.00 60.65 59.44 2va8 s ILE 119 Cb -0.15 -3.22 -0.02 0.00 -1.06 0.00 0.00 42.46 38.01 2va8 s ILE 119 CO -0.01 0.45 0.36 0.28 -0.10 0.00 0.00 174.94 175.91 2va8 s THR 120 N 0.46 0.00 0.39 2.92 -1.32 -0.08 -2.02 115.64 115.98 2va8 s THR 120 Ca 0.04 -1.68 0.07 0.00 -1.21 0.00 0.00 61.69 58.92 2va8 s THR 120 Cb -0.12 -2.43 -0.00 0.00 -1.51 0.00 0.00 72.50 68.43 2va8 s THR 120 CO 0.00 0.00 0.50 0.42 -2.21 0.00 0.00 174.62 173.33 2va8 s THR 121 N -3.77 3.35 0.14 5.08 -4.23 -1.26 -2.09 115.64 112.86 2va8 s THR 121 Ca 0.31 -1.06 -0.15 0.00 -1.18 0.00 0.00 61.69 59.60 2va8 s THR 121 Cb 0.02 -3.15 0.01 0.00 1.34 0.00 0.00 72.50 70.72 2va8 s THR 121 CO 0.14 -0.06 1.67 1.88 -0.54 0.00 0.00 174.62 177.71 2va8 h TYR 122 N 0.81 0.69 -0.46 3.99 -1.99 -1.84 -1.64 116.97 116.53 2va8 h TYR 122 Ca -0.42 -0.06 -0.00 0.00 2.00 0.00 0.00 58.73 60.24 2va8 h TYR 122 Cb 1.27 -0.20 -0.02 0.00 2.00 0.00 0.00 36.73 39.78 2va8 h TYR 122 CO 0.43 0.61 0.28 0.93 -0.00 0.00 0.00 178.16 180.41 2va8 h GLU 123 N 0.56 0.62 -0.72 4.88 3.07 -1.93 -0.02 114.58 121.04 2va8 h GLU 123 Ca 0.14 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.36 58.89 2va8 h GLU 123 Cb 0.24 -0.13 -0.03 0.00 -0.84 0.00 0.00 28.75 27.98 2va8 h GLU 123 CO -0.01 0.45 0.22 -0.22 -1.40 0.00 0.00 179.01 178.05 2va8 h LYS 124 N 0.61 1.12 -0.41 2.33 1.63 -1.93 0.14 116.57 120.06 2va8 h LYS 124 Ca 0.16 -0.24 -0.09 0.00 -0.85 0.00 0.00 60.65 59.63 2va8 h LYS 124 Cb -0.01 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.44 2va8 h LYS 124 CO -0.03 0.96 -0.11 1.25 -3.45 0.00 0.00 179.45 178.07 2va8 h LEU 125 N 1.08 0.81 0.16 5.20 5.85 -1.04 0.50 115.31 127.86 2va8 h LEU 125 Ca 0.23 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.59 2va8 h LEU 125 Cb 0.31 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2va8 h LEU 125 CO -0.01 0.99 -0.15 -0.78 -0.34 0.00 0.00 178.44 178.15 2va8 h ASP 126 N 0.61 -0.40 -0.77 1.25 -0.00 -0.76 -1.14 116.42 115.21 2va8 h ASP 126 Ca 0.10 0.04 0.17 0.00 -0.00 0.00 0.00 57.03 57.34 2va8 h ASP 126 Cb 0.64 0.14 -0.11 0.00 -0.00 0.00 0.00 39.33 39.99 2va8 h ASP 126 CO 0.04 -0.23 0.21 -1.28 -0.00 0.00 0.00 179.24 177.98 2va8 h SER 127 N -0.34 0.05 -0.44 2.28 0.87 -0.65 -2.86 113.55 112.46 2va8 h SER 127 Ca 0.00 0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 2va8 h SER 127 Cb 0.32 0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.45 2va8 h SER 127 CO -0.04 -0.04 0.24 -0.07 -0.53 0.00 0.00 176.83 176.39 2va8 h LEU 128 N 0.28 0.55 -1.06 2.23 3.38 0.11 -2.97 115.31 117.83 2va8 h LEU 128 Ca 0.44 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.36 2va8 h LEU 128 Cb 0.78 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 2va8 h LEU 128 CO -0.53 0.48 0.63 -0.50 0.09 0.00 0.00 178.44 178.62 2va8 h TRP 129 N 0.57 1.18 -0.41 1.13 6.55 -1.03 -0.76 115.95 123.19 2va8 h TRP 129 Ca 0.15 0.03 0.12 0.00 0.95 0.00 0.00 58.89 60.14 2va8 h TRP 129 Cb 0.06 -0.39 -0.02 0.00 -0.86 0.00 0.00 29.16 27.95 2va8 h TRP 129 CO -0.02 0.68 0.32 0.00 -1.05 0.00 0.00 178.44 178.37 2va8 h ARG 130 N 1.22 0.00 0.00 0.49 3.08 -1.36 -2.42 114.38 115.39 2va8 h ARG 130 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 2va8 h ARG 130 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 2va8 h ARG 130 CO -0.12 0.00 -0.84 0.45 -1.07 0.00 0.00 179.97 178.39 2va8 h HIS 131 N 0.00 0.00 -5.54 3.04 3.86 -1.08 -3.38 115.15 112.05 2va8 h HIS 131 Ca 0.19 0.00 -0.32 0.00 -1.16 0.00 0.00 60.37 59.08 2va8 h HIS 131 Cb 0.83 0.00 0.16 0.00 1.06 0.00 0.00 27.41 29.46 2va8 h HIS 131 CO 0.00 0.00 -0.75 0.54 0.86 0.00 0.00 177.93 178.58 2va8 n ARG 132 N -2.64 -6.42 -2.74 2.45 1.74 -0.91 -4.97 116.66 103.17 2va8 n ARG 132 Ca 0.01 0.82 -0.36 0.00 -0.77 0.00 0.00 57.85 57.55 2va8 n ARG 132 Cb 0.53 -5.77 -0.06 0.00 -1.02 0.00 0.00 32.46 26.14 2va8 n ARG 132 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2va8 s PRO 133 N -5.32 4.42 0.19 5.56 0.04 -1.26 -4.94 135.00 133.69 2va8 s PRO 133 Ca 0.00 1.31 -0.16 0.00 0.04 0.00 0.00 61.00 62.19 2va8 s PRO 133 Cb -0.00 -2.60 0.17 0.00 0.04 0.00 0.00 34.50 32.11 2va8 s PRO 133 CO 0.71 0.12 1.63 0.93 0.04 0.00 0.00 177.00 180.43 2va8 h GLU 134 N 2.74 -0.05 -0.33 4.56 3.07 -1.94 -1.37 114.58 121.25 2va8 h GLU 134 Ca -0.48 0.00 0.10 0.00 -0.50 0.00 0.00 59.36 58.48 2va8 h GLU 134 Cb 1.19 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 29.10 2va8 h GLU 134 CO 0.63 -0.03 0.33 0.11 -1.40 0.00 0.00 179.01 178.65 2va8 h TRP 135 N -0.05 0.00 0.00 4.33 5.08 -1.92 -1.44 115.95 121.94 2va8 h TRP 135 Ca 0.25 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.17 2va8 h TRP 135 Cb 0.44 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.59 2va8 h TRP 135 CO -0.48 0.00 -0.23 -0.07 -1.28 0.00 0.00 178.44 176.38 2va8 h LEU 136 N 0.00 0.00 -0.82 0.11 3.38 -1.63 -2.55 115.31 113.81 2va8 h LEU 136 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2va8 h LEU 136 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2va8 h LEU 136 CO -0.00 0.23 0.00 0.59 0.09 0.00 0.00 178.44 179.35 2va8 n ASN 137 N -3.41 0.60 -0.15 -0.43 4.13 -0.54 -2.39 115.26 113.08 2va8 n ASN 137 Ca 0.00 0.68 0.11 0.00 1.68 0.00 0.00 54.58 57.04 2va8 n ASN 137 Cb 0.42 -0.79 -0.02 0.00 -1.54 0.00 0.00 39.78 37.85 2va8 n ASN 137 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2va8 n GLU 138 N -2.20 0.37 -2.65 3.52 1.02 -0.96 -4.79 120.64 114.96 2va8 n GLU 138 Ca 0.01 -0.30 -0.43 0.00 -0.02 0.00 0.00 57.16 56.43 2va8 n GLU 138 Cb 0.18 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.08 2va8 n GLU 138 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2va8 s VAL 139 N -2.83 4.19 -1.61 2.62 1.01 -1.00 -0.41 120.40 122.36 2va8 s VAL 139 Ca 0.12 0.96 0.14 0.00 0.00 0.00 0.00 61.98 63.20 2va8 s VAL 139 Cb 0.17 -4.62 0.17 0.00 0.00 0.00 0.00 36.38 32.10 2va8 s VAL 139 CO 0.75 -1.11 1.03 0.59 0.00 0.00 0.00 175.10 176.35 2va8 n ASN 140 N 7.93 2.38 -3.71 3.32 3.02 -0.96 -4.94 115.26 122.30 2va8 n ASN 140 Ca 0.09 -1.67 -0.13 0.00 -0.03 0.00 0.00 54.58 52.83 2va8 n ASN 140 Cb 0.49 -0.07 -0.14 0.00 -0.61 0.00 0.00 39.78 39.46 2va8 n ASN 140 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2va8 s TYR 141 N -1.12 -0.31 -0.08 3.10 5.04 -1.25 -1.72 117.35 121.01 2va8 s TYR 141 Ca 0.19 0.76 0.03 0.00 -2.44 0.00 0.00 57.07 55.62 2va8 s TYR 141 Cb 0.12 -0.02 0.00 0.00 0.35 0.00 0.00 41.96 42.41 2va8 s TYR 141 CO 0.18 -0.25 -0.19 -0.06 -1.34 0.00 0.00 175.55 173.88 2va8 s PHE 142 N 1.61 2.11 -0.32 4.97 0.08 0.24 -1.75 117.98 124.92 2va8 s PHE 142 Ca -0.06 -0.82 -0.13 0.00 0.12 0.00 0.00 56.93 56.04 2va8 s PHE 142 Cb -0.11 -1.45 -0.03 0.00 -0.57 0.00 0.00 43.02 40.87 2va8 s PHE 142 CO -0.08 -0.35 0.24 0.08 -0.10 0.00 0.00 175.22 175.02 2va8 s VAL 143 N 0.42 5.28 -0.63 -0.44 1.01 0.22 0.06 120.40 126.32 2va8 s VAL 143 Ca -0.16 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.60 2va8 s VAL 143 Cb -0.17 -3.68 0.16 0.00 0.00 0.00 0.00 36.38 32.69 2va8 s VAL 143 CO 0.07 0.05 0.57 -0.76 0.00 0.00 0.00 175.10 175.02 2va8 s LEU 144 N 1.77 6.30 0.27 3.92 1.43 0.12 -1.28 118.68 131.21 2va8 s LEU 144 Ca 0.07 -2.12 -0.10 0.00 -1.03 0.00 0.00 54.13 50.95 2va8 s LEU 144 Cb -0.17 -2.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.80 2va8 s LEU 144 CO 0.11 -0.74 0.60 -0.62 0.23 0.00 0.00 176.35 175.93 2va8 s ASP 145 N 2.97 6.62 -1.30 2.29 -1.08 -0.58 -0.88 116.67 124.71 2va8 s ASP 145 Ca 0.08 0.97 -0.01 0.00 -0.52 0.00 0.00 52.55 53.08 2va8 s ASP 145 Cb -0.23 -2.25 -0.00 0.00 -1.46 0.00 0.00 42.92 38.98 2va8 s ASP 145 CO -0.01 -0.14 0.70 -0.62 0.52 0.00 0.00 175.17 175.62 2va8 n GLU 146 N -0.37 -4.77 0.28 4.34 1.02 -0.30 -4.50 120.64 116.33 2va8 n GLU 146 Ca 0.01 0.62 0.16 0.00 -0.02 0.00 0.00 57.16 57.92 2va8 n GLU 146 Cb 0.53 -5.15 0.79 0.00 -0.02 0.00 0.00 31.44 27.58 2va8 n GLU 146 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2va8 h LEU 147 N -1.86 0.00 0.00 -4.62 5.85 -1.44 -1.85 115.31 111.39 2va8 h LEU 147 Ca -0.61 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.11 2va8 h LEU 147 Cb 1.36 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.39 2va8 h LEU 147 CO 0.56 0.07 0.11 0.00 -0.34 0.00 0.00 178.44 178.84 2va8 n HIS 148 N -3.35 0.00 0.71 1.25 1.44 -1.26 -1.35 115.22 112.66 2va8 n HIS 148 Ca -0.01 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.78 2va8 n HIS 148 Cb 0.24 -0.35 0.40 0.00 0.12 0.00 0.00 29.99 30.40 2va8 n HIS 148 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 2va8 n TYR 149 N -1.34 0.00 0.06 -1.40 4.02 -0.70 -2.39 117.16 115.41 2va8 n TYR 149 Ca 0.00 0.00 0.19 0.00 -0.01 0.00 0.00 57.90 58.08 2va8 n TYR 149 Cb 0.11 -0.36 0.72 0.00 -0.02 0.00 0.00 39.34 39.78 2va8 n TYR 149 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 2va8 h LEU 150 N 0.00 0.00 0.00 7.72 3.38 -1.47 -1.73 115.31 123.22 2va8 h LEU 150 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2va8 h LEU 150 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2va8 h LEU 150 CO 0.00 0.00 -0.11 -3.20 0.09 0.00 0.00 178.44 175.22 2va8 n ASN 151 N -4.22 0.55 -4.70 -0.43 2.85 -1.00 -4.22 115.26 104.09 2va8 n ASN 151 Ca 0.07 0.45 -0.42 0.00 -0.11 0.00 0.00 54.58 54.57 2va8 n ASN 151 Cb 0.54 -0.53 -0.03 0.00 1.24 0.00 0.00 39.78 41.00 2va8 n ASN 151 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2va8 s ASP 152 N -3.97 7.05 0.33 1.20 -1.08 -0.68 -4.92 116.67 114.60 2va8 s ASP 152 Ca 0.11 1.94 0.05 0.00 -0.52 0.00 0.00 52.55 54.13 2va8 s ASP 152 Cb 0.15 -2.57 0.70 0.00 -1.46 0.00 0.00 42.92 39.73 2va8 s ASP 152 CO 0.60 -0.53 1.87 -0.65 0.52 0.00 0.00 175.17 176.98 2va8 h PRO 153 N 7.15 0.81 0.10 4.34 0.11 -1.89 0.16 132.00 142.78 2va8 h PRO 153 Ca -0.38 -0.05 -0.29 0.00 0.11 0.00 0.00 66.00 65.39 2va8 h PRO 153 Cb 1.19 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2va8 h PRO 153 CO 0.84 0.53 -1.50 0.93 -0.21 0.00 0.00 178.00 178.60 2va8 h GLU 154 N 0.83 0.22 0.00 1.05 5.08 -1.94 -3.42 114.58 116.41 2va8 h GLU 154 Ca 0.45 -0.38 -0.21 0.00 -1.00 0.00 0.00 59.36 58.23 2va8 h GLU 154 Cb 0.56 0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.91 2va8 h GLU 154 CO -0.21 1.18 -2.00 0.54 -1.00 0.00 0.00 179.01 177.52 2va8 n ARG 155 N -3.90 0.66 -0.29 2.33 1.74 -1.21 -4.52 116.66 111.47 2va8 n ARG 155 Ca -0.27 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.81 2va8 n ARG 155 Cb 0.90 -1.60 0.07 0.00 -1.02 0.00 0.00 32.46 30.81 2va8 n ARG 155 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2va8 h GLY 156 N 3.92 0.30 1.75 -0.13 0.00 -0.37 -0.03 103.07 108.51 2va8 h GLY 156 Ca -0.28 0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.38 2va8 h GLY 156 CO 0.03 -0.26 -0.06 -2.55 0.00 0.00 0.00 176.54 173.69 2va8 h PRO 157 N -0.04 0.31 -0.34 4.80 0.11 -1.79 -0.22 132.00 134.83 2va8 h PRO 157 Ca 0.35 -0.06 -0.17 0.00 0.11 0.00 0.00 66.00 66.23 2va8 h PRO 157 Cb 0.59 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.65 2va8 h PRO 157 CO -0.84 0.39 -0.44 0.28 -0.21 0.00 0.00 178.00 177.18 2va8 h VAL 158 N 0.30 1.28 -0.59 3.15 2.07 -1.37 -2.09 116.25 119.00 2va8 h VAL 158 Ca 0.07 -1.62 -0.01 0.00 0.82 0.00 0.00 66.70 65.96 2va8 h VAL 158 Cb 0.31 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 2va8 h VAL 158 CO 0.01 0.54 0.35 0.58 0.02 0.00 0.00 177.57 179.07 2va8 h VAL 159 N 0.70 1.18 -0.22 2.57 2.07 0.02 -2.26 116.25 120.32 2va8 h VAL 159 Ca 0.04 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 2va8 h VAL 159 Cb 1.03 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2va8 h VAL 159 CO 0.10 0.19 0.13 -0.33 0.02 0.00 0.00 177.57 177.69 2va8 h GLU 160 N 0.80 0.30 -0.61 1.57 5.08 -1.03 -0.68 114.58 120.01 2va8 h GLU 160 Ca 0.21 -0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.63 2va8 h GLU 160 Cb 0.00 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.12 2va8 h GLU 160 CO -0.04 0.25 0.25 0.77 -1.00 0.00 0.00 179.01 179.24 2va8 h SER 161 N 0.27 0.28 -0.11 1.42 0.02 -1.17 0.58 113.55 114.84 2va8 h SER 161 Ca 0.08 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 2va8 h SER 161 Cb 0.02 0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 2va8 h SER 161 CO -0.01 0.17 -0.01 0.58 -1.14 0.00 0.00 176.83 176.42 2va8 h VAL 162 N 0.45 1.27 -0.45 2.27 2.07 -1.26 -3.01 116.25 117.58 2va8 h VAL 162 Ca 0.30 -0.86 0.06 0.00 0.82 0.00 0.00 66.70 67.02 2va8 h VAL 162 Cb 0.34 1.62 -0.05 0.00 -1.52 0.00 0.00 31.29 31.67 2va8 h VAL 162 CO -0.28 0.25 0.15 0.74 0.02 0.00 0.00 177.57 178.45 2va8 h THR 163 N -0.09 0.83 -0.59 2.57 2.02 -0.70 -0.94 112.91 116.02 2va8 h THR 163 Ca 0.03 -0.11 0.11 0.00 0.77 0.00 0.00 66.41 67.21 2va8 h THR 163 Cb 0.39 0.50 -0.08 0.00 -1.74 0.00 0.00 68.15 67.21 2va8 h THR 163 CO 0.01 0.06 0.13 0.40 0.37 0.00 0.00 175.52 176.49 2va8 h ILE 164 N 0.31 0.66 -0.12 3.11 2.04 -0.89 0.37 117.51 123.00 2va8 h ILE 164 Ca 0.22 -0.09 -0.20 0.00 1.00 0.00 0.00 64.86 65.78 2va8 h ILE 164 Cb 0.23 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2va8 h ILE 164 CO -0.23 0.05 -0.75 0.03 0.00 0.00 0.00 178.15 177.25 2va8 h ARG 165 N 0.27 0.61 -0.65 2.37 3.08 -1.24 -3.10 114.38 115.73 2va8 h ARG 165 Ca 0.31 -0.50 0.08 0.00 0.07 0.00 0.00 59.98 59.93 2va8 h ARG 165 Cb 0.44 0.10 -0.06 0.00 0.08 0.00 0.00 29.97 30.53 2va8 h ARG 165 CO -0.38 1.12 0.32 0.00 -1.07 0.00 0.00 179.97 179.96 2va8 h ALA 166 N 0.74 0.87 -1.04 0.04 0.00 -0.75 -2.63 119.26 116.50 2va8 h ALA 166 Ca -0.04 0.04 0.30 0.00 0.00 0.00 0.00 54.91 55.21 2va8 h ALA 166 Cb 1.35 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.04 2va8 h ALA 166 CO 0.14 -0.05 0.74 0.87 0.00 0.00 0.00 179.25 180.96 2va8 h LYS 167 N 0.58 0.01 0.00 0.00 1.57 -0.85 0.26 116.57 118.14 2va8 h LYS 167 Ca 0.31 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 2va8 h LYS 167 Cb 0.28 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2va8 h LYS 167 CO -0.23 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.19 2va8 n ARG 168 N -4.23 0.20 0.00 3.15 1.74 -0.99 -4.76 116.66 111.77 2va8 n ARG 168 Ca 0.22 0.32 0.00 0.00 -0.77 0.00 0.00 57.85 57.62 2va8 n ARG 168 Cb 1.10 -1.81 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 2va8 n ARG 168 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2va8 n ARG 169 N -2.18 0.77 -4.81 5.56 3.00 0.92 -5.14 116.66 114.79 2va8 n ARG 169 Ca 0.04 0.00 -0.30 0.00 -0.01 0.00 0.00 57.85 57.57 2va8 n ARG 169 Cb 0.31 0.00 -0.14 0.00 0.00 0.00 0.00 32.46 32.63 2va8 n ARG 169 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 2va8 s ASN 170 N 0.55 3.42 0.06 0.55 0.01 -0.70 -5.03 114.94 113.80 2va8 s ASN 170 Ca 0.00 -0.52 -0.10 0.00 -0.71 0.00 0.00 52.86 51.53 2va8 s ASN 170 Cb 0.00 -0.42 0.01 0.00 0.41 0.00 0.00 41.25 41.25 2va8 s ASN 170 CO 0.00 0.26 0.21 -1.48 -1.51 0.00 0.00 177.10 174.58 2va8 s LEU 171 N -1.32 1.29 -0.09 0.60 0.05 -1.26 -0.60 118.68 117.35 2va8 s LEU 171 Ca 0.13 -0.44 0.02 0.00 0.05 0.00 0.00 54.13 53.89 2va8 s LEU 171 Cb -0.10 1.07 0.01 0.00 -2.05 0.00 0.00 46.19 45.12 2va8 s LEU 171 CO 0.03 -0.63 -0.15 -0.22 -0.55 0.00 0.00 176.35 174.83 2va8 s LEU 172 N -2.38 1.73 -0.13 1.48 2.96 0.11 -4.13 118.68 118.32 2va8 s LEU 172 Ca -0.01 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.48 2va8 s LEU 172 Cb 0.01 -1.03 -0.03 0.00 0.50 0.00 0.00 46.19 45.65 2va8 s LEU 172 CO -0.07 0.04 -0.06 0.00 -1.32 0.00 0.00 176.35 174.95 2va8 s ALA 173 N 0.79 2.94 -0.01 5.97 0.00 -0.50 0.12 121.76 131.08 2va8 s ALA 173 Ca -0.11 -0.84 0.06 0.00 0.00 0.00 0.00 51.96 51.06 2va8 s ALA 173 Cb -0.16 -1.42 -0.02 0.00 0.00 0.00 0.00 23.12 21.52 2va8 s ALA 173 CO 0.02 0.31 -0.18 -0.51 0.00 0.00 0.00 175.76 175.40 2va8 s LEU 174 N 0.05 2.05 0.08 0.00 1.43 -0.05 -0.98 118.68 121.27 2va8 s LEU 174 Ca -0.01 -0.35 -0.19 0.00 -1.03 0.00 0.00 54.13 52.54 2va8 s LEU 174 Cb -0.14 -0.92 0.04 0.00 0.03 0.00 0.00 46.19 45.21 2va8 s LEU 174 CO 0.03 0.21 0.47 -0.55 0.23 0.00 0.00 176.35 176.73 2va8 s SER 175 N -0.53 -0.35 1.38 2.29 0.15 -0.24 -1.14 113.70 115.26 2va8 s SER 175 Ca 0.07 -0.03 -0.21 0.00 0.70 0.00 0.00 55.95 56.47 2va8 s SER 175 Cb -0.07 0.48 0.35 0.00 -1.71 0.00 0.00 66.02 65.07 2va8 s SER 175 CO -0.00 -0.77 0.96 0.00 1.20 0.00 0.00 173.24 174.62 2va8 s ALA 176 N -2.98 -0.59 0.14 5.45 0.00 -1.26 -1.91 121.76 120.61 2va8 s ALA 176 Ca -0.02 -0.76 -0.35 0.00 0.00 0.00 0.00 51.96 50.83 2va8 s ALA 176 Cb 0.00 -2.97 -0.15 0.00 0.00 0.00 0.00 23.12 20.01 2va8 s ALA 176 CO -0.06 -4.44 1.49 2.41 0.00 0.00 0.00 175.76 175.17 2va8 n THR 177 N -5.49 0.06 -4.37 0.00 -1.04 -1.26 -4.49 114.28 97.69 2va8 n THR 177 Ca 0.12 -0.01 -0.33 0.00 -2.04 0.00 0.00 64.05 61.78 2va8 n THR 177 Cb 0.59 -1.32 -0.16 0.00 -1.82 0.00 0.00 70.33 67.63 2va8 n THR 177 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2va8 s ILE 178 N 0.72 2.31 0.12 12.58 1.01 -1.26 -4.97 121.20 131.70 2va8 s ILE 178 Ca 0.80 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 60.48 2va8 s ILE 178 Cb -0.76 -1.96 -0.17 0.00 0.01 0.00 0.00 42.46 39.58 2va8 s ILE 178 CO 0.41 0.53 1.31 0.77 0.00 0.00 0.00 174.94 177.96 2va8 h SER 179 N 7.61 0.76 -1.17 3.58 4.64 -1.82 -3.21 113.55 123.94 2va8 h SER 179 Ca -0.38 -0.54 -0.57 0.00 -0.47 0.00 0.00 61.79 59.82 2va8 h SER 179 Cb 1.17 -0.23 -0.22 0.00 -0.31 0.00 0.00 62.40 62.81 2va8 h SER 179 CO 0.59 1.33 0.69 -0.46 -0.87 0.00 0.00 176.83 178.11 2va8 n ASN 180 N -3.86 7.04 0.25 4.97 6.94 -1.26 -4.71 115.26 124.63 2va8 n ASN 180 Ca -0.07 -3.48 0.13 0.00 -0.02 0.00 0.00 54.58 51.14 2va8 n ASN 180 Cb 0.79 -1.10 0.65 0.00 -2.36 0.00 0.00 39.78 37.76 2va8 n ASN 180 CO 0.00 0.00 0.00 0.10 -1.03 0.00 0.00 177.26 176.33 2va8 h TYR 181 N 2.45 0.00 -0.29 -2.53 -0.00 -1.99 -1.51 116.97 113.10 2va8 h TYR 181 Ca 0.47 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 59.07 2va8 h TYR 181 Cb 0.60 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.33 2va8 h TYR 181 CO 1.25 0.14 -0.33 0.87 -0.00 0.00 0.00 178.16 180.09 2va8 h LYS 182 N 0.00 0.73 -0.31 0.10 1.57 -1.90 -0.44 116.57 116.32 2va8 h LYS 182 Ca -0.00 -0.40 -0.08 0.00 -1.87 0.00 0.00 60.65 58.29 2va8 h LYS 182 Cb 0.49 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 2va8 h LYS 182 CO 0.02 1.03 -0.15 0.37 -0.57 0.00 0.00 179.45 180.14 2va8 h GLN 183 N 0.48 0.55 0.03 3.15 4.15 -1.73 -1.65 115.11 120.10 2va8 h GLN 183 Ca 0.04 -0.18 -0.10 0.00 0.77 0.00 0.00 58.65 59.19 2va8 h GLN 183 Cb 0.91 -0.05 0.01 0.00 0.21 0.00 0.00 27.48 28.56 2va8 h GLN 183 CO 0.08 0.69 -0.40 0.82 -1.93 0.00 0.00 178.83 178.09 2va8 h ILE 184 N 0.50 1.57 -0.56 2.39 1.08 -1.27 -2.77 117.51 118.45 2va8 h ILE 184 Ca 0.09 -2.18 0.08 0.00 -0.39 0.00 0.00 64.86 62.45 2va8 h ILE 184 Cb 0.56 2.96 -0.06 0.00 -3.07 0.00 0.00 36.82 37.20 2va8 h ILE 184 CO 0.04 0.60 0.21 0.00 -0.69 0.00 0.00 178.15 178.31 2va8 h ALA 185 N 0.18 0.71 -0.38 1.87 0.00 -1.09 0.16 119.26 120.72 2va8 h ALA 185 Ca -0.06 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2va8 h ALA 185 Cb 1.21 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 2va8 h ALA 185 CO 0.08 -0.19 0.20 -0.22 0.00 0.00 0.00 179.25 179.12 2va8 h LYS 186 N 0.40 0.40 -0.60 0.00 1.63 -1.38 0.33 116.57 117.35 2va8 h LYS 186 Ca 0.28 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 60.03 2va8 h LYS 186 Cb 0.31 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.82 2va8 h LYS 186 CO -0.27 0.26 0.30 2.35 -3.45 0.00 0.00 179.45 178.64 2va8 h TRP 187 N 0.41 0.83 0.00 1.91 7.01 -1.14 -2.03 115.95 122.94 2va8 h TRP 187 Ca 0.15 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.13 2va8 h TRP 187 Cb 0.04 -0.26 0.00 0.00 -2.10 0.00 0.00 29.16 26.84 2va8 h TRP 187 CO -0.09 0.60 0.00 -0.07 -2.79 0.00 0.00 178.44 176.09 2va8 h LEU 188 N 0.84 0.00 2.14 0.65 3.38 -0.10 -3.47 115.31 118.75 2va8 h LEU 188 Ca 0.21 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.85 2va8 h LEU 188 Cb 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2va8 h LEU 188 CO -0.03 0.00 -0.41 0.61 0.09 0.00 0.00 178.44 178.70 2va8 n GLY 189 N 0.64 -0.07 3.83 0.83 0.00 0.91 -4.98 105.19 106.34 2va8 n GLY 189 Ca 0.03 -0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 2va8 n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2va8 s ALA 190 N -2.79 3.67 -0.15 4.61 0.00 0.21 -4.84 121.76 122.47 2va8 s ALA 190 Ca 0.00 -1.12 -0.29 0.00 0.00 0.00 0.00 51.96 50.55 2va8 s ALA 190 Cb 0.00 -1.48 -0.01 0.00 0.00 0.00 0.00 23.12 21.62 2va8 s ALA 190 CO 0.00 0.58 1.17 -2.00 0.00 0.00 0.00 175.76 175.51 2va8 s GLU 191 N -2.95 4.29 0.39 0.00 2.12 -0.29 -4.37 118.70 117.89 2va8 s GLU 191 Ca 0.31 1.56 -0.25 0.00 0.36 0.00 0.00 54.97 56.96 2va8 s GLU 191 Cb -0.11 -3.66 -0.09 0.00 0.26 0.00 0.00 34.13 30.53 2va8 s GLU 191 CO 0.24 -0.59 1.10 -1.25 -0.54 0.00 0.00 175.26 174.22 2va8 s PRO 192 N 2.97 4.16 -0.41 4.30 0.04 -1.26 -1.15 135.00 143.65 2va8 s PRO 192 Ca 0.52 1.66 0.04 0.00 0.04 0.00 0.00 61.00 63.25 2va8 s PRO 192 Cb -0.20 -2.65 0.17 0.00 0.04 0.00 0.00 34.50 31.85 2va8 s PRO 192 CO 0.15 -0.18 0.36 0.08 0.04 0.00 0.00 177.00 177.45 2va8 s VAL 193 N -1.52 0.19 -0.16 -0.36 1.01 0.16 -4.87 120.40 114.86 2va8 s VAL 193 Ca 0.56 -2.38 -0.19 0.00 0.00 0.00 0.00 61.98 59.97 2va8 s VAL 193 Cb -0.26 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2va8 s VAL 193 CO 0.33 -1.10 0.53 0.00 0.00 0.00 0.00 175.10 174.86 2va8 s ALA 194 N 0.26 3.50 0.28 5.51 0.00 -1.26 -2.41 121.76 127.64 2va8 s ALA 194 Ca 0.31 -0.26 0.07 0.00 0.00 0.00 0.00 51.96 52.08 2va8 s ALA 194 Cb 0.01 -2.78 -0.06 0.00 0.00 0.00 0.00 23.12 20.29 2va8 s ALA 194 CO -0.16 -0.25 -0.07 -0.08 0.00 0.00 0.00 175.76 175.20 2va8 s THR 195 N 1.20 1.73 -0.72 0.00 -1.32 -0.74 -4.98 115.64 110.82 2va8 s THR 195 Ca 0.27 -2.14 0.07 0.00 -1.21 0.00 0.00 61.69 58.67 2va8 s THR 195 Cb -0.16 -2.45 0.02 0.00 -1.51 0.00 0.00 72.50 68.40 2va8 s THR 195 CO 0.11 -0.31 0.58 0.59 -2.21 0.00 0.00 174.62 173.38 2va8 n ASN 196 N -0.60 1.18 -4.76 8.08 3.02 -1.26 -4.45 115.26 116.48 2va8 n ASN 196 Ca -0.05 -1.09 -0.39 0.00 -0.03 0.00 0.00 54.58 53.01 2va8 n ASN 196 Cb 0.63 0.33 0.03 0.00 -0.61 0.00 0.00 39.78 40.16 2va8 n ASN 196 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2va8 s TRP 197 N -0.94 2.33 -0.00 3.10 -0.00 -1.26 -4.92 118.94 117.25 2va8 s TRP 197 Ca 0.07 1.33 -0.00 0.00 -0.00 0.00 0.00 56.10 57.49 2va8 s TRP 197 Cb 0.06 -3.85 0.00 0.00 -0.00 0.00 0.00 33.47 29.68 2va8 s TRP 197 CO 0.15 -2.94 0.01 1.03 -0.00 0.00 0.00 176.95 175.19 2va8 s ARG 198 N -2.75 0.00 0.64 5.86 0.52 -1.26 -4.49 118.95 117.47 2va8 s ARG 198 Ca 0.68 0.03 0.42 0.00 -0.52 0.00 0.00 55.73 56.34 2va8 s ARG 198 Cb -0.42 -0.02 2.22 0.00 0.52 0.00 0.00 34.95 37.25 2va8 s ARG 198 CO 0.51 -0.02 2.29 -1.00 0.02 0.00 0.00 175.30 177.10 2va8 h PRO 199 N 6.26 0.00 -3.87 3.54 0.13 -1.96 -3.41 132.00 132.69 2va8 h PRO 199 Ca -0.26 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.46 2va8 h PRO 199 Cb 1.20 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.98 2va8 h PRO 199 CO 0.50 0.00 -0.77 0.08 -0.23 0.00 0.00 178.00 177.59 2va8 s VAL 200 N -4.05 0.41 0.58 1.56 1.01 -1.26 -4.93 120.40 113.72 2va8 s VAL 200 Ca -0.04 -0.01 -0.20 0.00 0.00 0.00 0.00 61.98 61.73 2va8 s VAL 200 Cb 0.12 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.97 2va8 s VAL 200 CO 0.43 0.22 1.20 -0.81 0.00 0.00 0.00 175.10 176.14 2va8 n PRO 201 N 4.38 1.29 -5.23 2.72 -0.04 -1.26 -4.79 135.00 132.07 2va8 n PRO 201 Ca -0.20 0.49 -0.31 0.00 -0.04 0.00 0.00 63.50 63.44 2va8 n PRO 201 Cb 0.50 -2.40 -0.16 0.00 -0.04 0.00 0.00 33.50 31.40 2va8 n PRO 201 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2va8 s LEU 202 N -3.01 2.05 -0.13 1.53 2.96 -1.26 -1.05 118.68 119.78 2va8 s LEU 202 Ca 0.75 -0.47 0.02 0.00 -0.22 0.00 0.00 54.13 54.20 2va8 s LEU 202 Cb -0.42 -1.30 -0.01 0.00 0.50 0.00 0.00 46.19 44.96 2va8 s LEU 202 CO 0.47 0.27 -0.18 0.27 -1.32 0.00 0.00 176.35 175.86 2va8 s ILE 203 N -0.35 2.56 -0.22 6.68 -4.36 -0.49 -4.98 121.20 120.05 2va8 s ILE 203 Ca 0.03 -0.83 -0.09 0.00 -0.26 0.00 0.00 60.65 59.50 2va8 s ILE 203 Cb -0.12 -2.05 -0.04 0.00 1.25 0.00 0.00 42.46 41.50 2va8 s ILE 203 CO 0.01 0.54 0.11 -1.61 0.24 0.00 0.00 174.94 174.23 2va8 s GLU 204 N 0.48 4.00 0.23 0.37 2.02 -1.26 -2.09 118.70 122.44 2va8 s GLU 204 Ca -0.12 -0.32 0.04 0.00 0.02 0.00 0.00 54.97 54.59 2va8 s GLU 204 Cb -0.16 -3.39 -0.05 0.00 0.10 0.00 0.00 34.13 30.62 2va8 s GLU 204 CO 0.05 0.12 -0.02 0.20 0.02 0.00 0.00 175.26 175.64 2va8 s GLY 205 N 0.83 1.56 -0.07 -1.39 0.00 0.10 -0.99 107.32 107.36 2va8 s GLY 205 Ca 0.06 -1.76 -0.00 0.00 0.00 0.00 0.00 44.72 43.01 2va8 s GLY 205 CO 0.02 -1.68 -0.03 0.14 0.00 0.00 0.00 173.10 171.55 2va8 s VAL 206 N -3.36 0.59 -0.09 1.40 1.01 0.14 -1.26 120.40 118.83 2va8 s VAL 206 Ca 0.28 -0.07 -0.05 0.00 0.00 0.00 0.00 61.98 62.14 2va8 s VAL 206 Cb 0.05 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 2va8 s VAL 206 CO 0.09 0.27 0.10 -0.51 0.00 0.00 0.00 175.10 175.05 2va8 s ILE 207 N 1.49 5.14 0.09 2.22 2.07 -0.71 -0.73 121.20 130.77 2va8 s ILE 207 Ca -0.02 0.02 -0.10 0.00 -1.41 0.00 0.00 60.65 59.14 2va8 s ILE 207 Cb -0.13 -3.24 0.01 0.00 0.13 0.00 0.00 42.46 39.22 2va8 s ILE 207 CO -0.03 0.57 0.23 -0.72 -1.91 0.00 0.00 174.94 173.08 2va8 s TYR 208 N -1.03 0.06 0.35 3.50 1.13 -0.40 -1.70 117.35 119.26 2va8 s TYR 208 Ca 0.16 -0.43 -0.11 0.00 -1.41 0.00 0.00 57.07 55.28 2va8 s TYR 208 Cb -0.12 0.01 -0.07 0.00 -1.10 0.00 0.00 41.96 40.68 2va8 s TYR 208 CO 0.05 -0.55 0.72 -1.25 -2.51 0.00 0.00 175.55 172.01 2va8 s PRO 209 N -3.60 3.84 0.15 -3.49 0.04 -1.26 -0.83 135.00 129.84 2va8 s PRO 209 Ca 0.03 0.47 0.01 0.00 0.04 0.00 0.00 61.00 61.54 2va8 s PRO 209 Cb 0.03 -2.45 -0.00 0.00 0.04 0.00 0.00 34.50 32.11 2va8 s PRO 209 CO -0.10 0.08 0.04 -0.85 0.04 0.00 0.00 177.00 176.22 2va8 n GLU 210 N -0.85 0.97 -0.07 4.56 0.28 -1.24 -4.48 120.64 119.80 2va8 n GLU 210 Ca 0.02 -1.21 -0.02 0.00 -0.16 0.00 0.00 57.16 55.79 2va8 n GLU 210 Cb 0.54 0.59 -0.02 0.00 1.43 0.00 0.00 31.44 33.98 2va8 n GLU 210 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2va8 n ARG 211 N -0.34 -0.08 -1.88 3.44 1.74 -1.26 -4.34 116.66 113.94 2va8 n ARG 211 Ca -0.03 1.00 -0.42 0.00 -0.77 0.00 0.00 57.85 57.62 2va8 n ARG 211 Cb 0.21 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.14 2va8 n ARG 211 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2va8 s LYS 212 N -3.47 4.09 0.41 5.56 1.02 -1.26 -4.89 119.74 121.21 2va8 s LYS 212 Ca -0.02 2.29 0.11 0.00 0.02 0.00 0.00 55.97 58.37 2va8 s LYS 212 Cb 0.02 -4.07 0.87 0.00 -0.52 0.00 0.00 37.83 34.13 2va8 s LYS 212 CO 0.11 -0.98 1.96 0.87 -0.92 0.00 0.00 175.35 176.39 2va8 h LYS 213 N 10.26 0.17 -0.65 1.68 1.57 -2.00 -1.51 116.57 126.09 2va8 h LYS 213 Ca -0.43 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2va8 h LYS 213 Cb 1.20 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2va8 h LYS 213 CO 0.95 0.30 0.00 1.63 -0.57 0.00 0.00 179.45 181.76 2va8 n LYS 214 N -4.31 3.67 -4.56 3.15 5.02 -1.26 -4.92 118.16 114.95 2va8 n LYS 214 Ca -0.01 -2.76 -0.33 0.00 -2.02 0.00 0.00 58.31 53.19 2va8 n LYS 214 Cb 0.24 -1.89 -0.11 0.00 -0.02 0.00 0.00 35.03 33.25 2va8 n LYS 214 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2va8 s GLU 215 N -1.87 2.68 0.00 1.97 2.12 -0.57 -0.76 118.70 122.28 2va8 s GLU 215 Ca 0.49 -0.61 0.01 0.00 0.36 0.00 0.00 54.97 55.22 2va8 s GLU 215 Cb 0.32 -2.56 -0.01 0.00 0.26 0.00 0.00 34.13 32.14 2va8 s GLU 215 CO 0.23 0.64 -0.03 0.71 -0.54 0.00 0.00 175.26 176.28 2va8 s TYR 216 N -0.88 0.23 -0.22 5.30 1.51 -0.64 -3.71 117.35 118.95 2va8 s TYR 216 Ca 0.14 -0.12 -0.07 0.00 -1.01 0.00 0.00 57.07 56.01 2va8 s TYR 216 Cb -0.11 -0.15 -0.04 0.00 -0.11 0.00 0.00 41.96 41.55 2va8 s TYR 216 CO 0.04 -0.03 0.07 1.21 -1.11 0.00 0.00 175.55 175.73 2va8 s ASN 217 N -0.31 5.40 -0.25 2.29 2.47 -0.01 -2.07 114.94 122.46 2va8 s ASN 217 Ca -0.02 -0.06 -0.09 0.00 0.42 0.00 0.00 52.86 53.11 2va8 s ASN 217 Cb -0.02 -1.95 -0.04 0.00 -1.45 0.00 0.00 41.25 37.79 2va8 s ASN 217 CO -0.00 0.07 0.14 -0.69 -3.72 0.00 0.00 177.10 172.89 2va8 s VAL 218 N 1.01 4.95 -0.17 -5.21 1.01 0.83 -1.28 120.40 121.54 2va8 s VAL 218 Ca 0.04 0.04 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 2va8 s VAL 218 Cb -0.14 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 2va8 s VAL 218 CO 0.03 0.31 -0.06 -0.63 0.00 0.00 0.00 175.10 174.75 2va8 s ILE 219 N 1.48 3.52 0.37 2.22 1.01 0.10 -1.19 121.20 128.70 2va8 s ILE 219 Ca 0.06 -0.48 0.07 0.00 0.00 0.00 0.00 60.65 60.31 2va8 s ILE 219 Cb -0.15 -2.55 -0.01 0.00 0.01 0.00 0.00 42.46 39.77 2va8 s ILE 219 CO 0.07 0.48 0.48 -0.36 0.00 0.00 0.00 174.94 175.60 2va8 s PHE 220 N 0.74 2.95 0.21 3.97 0.08 -0.06 0.26 117.98 126.13 2va8 s PHE 220 Ca -0.03 -0.32 -0.09 0.00 0.12 0.00 0.00 56.93 56.62 2va8 s PHE 220 Cb -0.15 -2.12 0.17 0.00 -0.57 0.00 0.00 43.02 40.35 2va8 s PHE 220 CO 0.02 -0.14 1.86 -0.22 -0.10 0.00 0.00 175.22 176.64 2va8 h LYS 221 N 0.86 1.08 -0.96 0.44 3.64 -1.38 -1.27 116.57 118.98 2va8 h LYS 221 Ca -0.43 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 58.81 2va8 h LYS 221 Cb 1.27 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 2va8 h LYS 221 CO 0.51 0.76 0.05 -0.40 -2.27 0.00 0.00 179.45 178.10 2va8 n ASP 222 N -4.47 2.41 -1.08 4.20 5.68 -1.26 -4.84 116.55 117.18 2va8 n ASP 222 Ca 0.08 -2.20 -0.14 0.00 -0.50 0.00 0.00 54.79 52.02 2va8 n ASP 222 Cb 0.05 -0.54 -0.06 0.00 -1.14 0.00 0.00 41.12 39.43 2va8 n ASP 222 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2va8 n ASN 223 N 0.16 -5.48 -4.76 -1.12 5.03 -0.48 -4.99 115.26 103.63 2va8 n ASN 223 Ca 0.07 0.35 -0.38 0.00 0.87 0.00 0.00 54.58 55.49 2va8 n ASN 223 Cb 0.54 -4.22 0.02 0.00 -1.02 0.00 0.00 39.78 35.10 2va8 n ASN 223 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2va8 s THR 224 N -2.26 2.38 -0.02 3.41 2.01 -1.26 -4.82 115.64 115.09 2va8 s THR 224 Ca 0.00 0.30 0.04 0.00 0.31 0.00 0.00 61.69 62.34 2va8 s THR 224 Cb 0.00 -3.16 -0.01 0.00 0.01 0.00 0.00 72.50 69.35 2va8 s THR 224 CO 0.00 0.01 -0.13 -0.89 -0.69 0.00 0.00 174.62 172.92 2va8 s THR 225 N -1.34 1.05 -0.04 -0.82 2.01 -1.26 -0.88 115.64 114.36 2va8 s THR 225 Ca 0.66 -0.55 -0.05 0.00 0.31 0.00 0.00 61.69 62.07 2va8 s THR 225 Cb -0.38 -0.89 0.01 0.00 0.01 0.00 0.00 72.50 71.25 2va8 s THR 225 CO 0.46 0.30 0.13 -0.75 -0.69 0.00 0.00 174.62 174.07 2va8 s LYS 226 N -0.17 0.23 -0.08 4.92 2.20 -0.33 -5.01 119.74 121.50 2va8 s LYS 226 Ca 0.02 0.04 -0.00 0.00 -0.36 0.00 0.00 55.97 55.67 2va8 s LYS 226 Cb -0.07 0.10 -0.03 0.00 -1.51 0.00 0.00 37.83 36.33 2va8 s LYS 226 CO 0.00 -0.04 -0.05 0.15 -0.36 0.00 0.00 175.35 175.05 2va8 s LYS 227 N -0.28 2.90 0.12 4.03 1.02 -1.26 -0.12 119.74 126.15 2va8 s LYS 227 Ca -0.04 -0.51 0.03 0.00 0.02 0.00 0.00 55.97 55.48 2va8 s LYS 227 Cb -0.03 -2.68 -0.04 0.00 -0.52 0.00 0.00 37.83 34.56 2va8 s LYS 227 CO 0.00 0.63 -0.09 0.14 -0.92 0.00 0.00 175.35 175.12 2va8 s VAL 228 N -0.71 0.96 -0.00 3.17 -7.23 -0.88 -5.00 120.40 110.71 2va8 s VAL 228 Ca 0.11 -1.95 0.05 0.00 -1.81 0.00 0.00 61.98 58.38 2va8 s VAL 228 Cb -0.11 -1.71 -0.01 0.00 0.56 0.00 0.00 36.38 35.10 2va8 s VAL 228 CO 0.02 -0.76 -0.15 -2.28 -0.31 0.00 0.00 175.10 171.61 2va8 s HIS 229 N -3.29 1.37 0.00 2.82 2.46 -1.26 -1.61 115.29 115.78 2va8 s HIS 229 Ca 0.13 -0.27 0.00 0.00 0.47 0.00 0.00 55.06 55.39 2va8 s HIS 229 Cb 0.03 -0.87 0.00 0.00 -0.13 0.00 0.00 32.58 31.61 2va8 s HIS 229 CO -0.01 -0.01 0.00 0.41 -2.47 0.00 0.00 174.74 172.66 2va8 n GLY 230 N 2.56 1.08 0.24 1.59 0.00 0.06 -4.50 105.19 106.21 2va8 n GLY 230 Ca -0.15 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.73 2va8 n GLY 230 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2va8 h ASP 231 N 0.00 0.25 -5.78 1.61 3.58 -1.93 -3.41 116.42 110.74 2va8 h ASP 231 Ca 0.00 0.08 -0.40 0.00 0.42 0.00 0.00 57.03 57.13 2va8 h ASP 231 Cb 0.00 0.05 -0.12 0.00 1.72 0.00 0.00 39.33 40.98 2va8 h ASP 231 CO 0.00 0.15 -0.42 1.51 -2.88 0.00 0.00 179.24 177.59 2va8 s ASP 232 N -5.40 1.36 0.17 2.28 1.47 -1.26 -4.93 116.67 110.36 2va8 s ASP 232 Ca -0.13 -1.66 -0.15 0.00 1.18 0.00 0.00 52.55 51.80 2va8 s ASP 232 Cb 0.17 0.57 0.07 0.00 -0.34 0.00 0.00 42.92 43.39 2va8 s ASP 232 CO 0.75 -1.10 1.82 0.00 0.68 0.00 0.00 175.17 177.31 2va8 h ALA 233 N 2.17 0.61 0.70 2.11 0.00 -1.97 -0.98 119.26 121.90 2va8 h ALA 233 Ca -0.27 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 2va8 h ALA 233 Cb 1.24 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 2va8 h ALA 233 CO 0.38 0.00 -0.43 0.82 0.00 0.00 0.00 179.25 180.03 2va8 h ILE 234 N 0.60 0.14 -0.84 0.00 5.03 -1.98 -2.24 117.51 118.21 2va8 h ILE 234 Ca 0.19 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.92 2va8 h ILE 234 Cb -0.01 0.14 -0.04 0.00 -3.03 0.00 0.00 36.82 33.87 2va8 h ILE 234 CO -0.07 0.00 0.50 0.40 -0.68 0.00 0.00 178.15 178.30 2va8 h ILE 235 N -1.06 1.23 -0.41 -0.67 2.04 -1.96 -0.47 117.51 116.22 2va8 h ILE 235 Ca -0.09 -0.52 0.01 0.00 1.00 0.00 0.00 64.86 65.26 2va8 h ILE 235 Cb 0.85 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 2va8 h ILE 235 CO 0.09 0.25 0.26 0.00 0.00 0.00 0.00 178.15 178.75 2va8 h ALA 236 N 1.27 0.52 0.00 1.87 0.00 -1.13 -1.82 119.26 119.97 2va8 h ALA 236 Ca 0.30 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.99 2va8 h ALA 236 Cb -0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 2va8 h ALA 236 CO -0.06 -0.05 -0.96 -0.92 0.00 0.00 0.00 179.25 177.26 2va8 h TYR 237 N 0.53 0.01 0.24 0.00 5.03 -1.16 -2.88 116.97 118.74 2va8 h TYR 237 Ca 0.16 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.45 2va8 h TYR 237 Cb -0.03 -0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.25 2va8 h TYR 237 CO -0.06 0.96 -0.12 1.15 -1.32 0.00 0.00 178.16 178.77 2va8 h THR 238 N 0.00 0.76 0.00 1.81 2.02 -0.93 -1.89 112.91 114.68 2va8 h THR 238 Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.12 2va8 h THR 238 Cb 1.69 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.85 2va8 h THR 238 CO 0.12 0.00 -0.21 -0.07 0.37 0.00 0.00 175.52 175.74 2va8 h LEU 239 N -0.33 0.00 -0.32 2.58 3.38 -1.39 -1.36 115.31 117.88 2va8 h LEU 239 Ca -0.03 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 2va8 h LEU 239 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2va8 h LEU 239 CO 0.05 0.21 -0.03 -0.78 0.09 0.00 0.00 178.44 177.98 2va8 h ASP 240 N 0.00 0.58 0.30 -0.43 1.82 -1.31 -3.18 116.42 114.19 2va8 h ASP 240 Ca -0.00 -0.33 -0.16 0.00 -0.39 0.00 0.00 57.03 56.15 2va8 h ASP 240 Cb 0.58 -0.16 -0.01 0.00 0.68 0.00 0.00 39.33 40.42 2va8 h ASP 240 CO 0.03 0.77 -0.63 -1.28 -1.61 0.00 0.00 179.24 176.52 2va8 h SER 241 N 0.37 0.37 0.73 2.28 0.87 -0.75 -3.21 113.55 114.21 2va8 h SER 241 Ca 0.09 -0.22 -0.04 0.00 -1.23 0.00 0.00 61.79 60.39 2va8 h SER 241 Cb 0.50 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 2va8 h SER 241 CO 0.02 0.90 -0.20 -0.07 -0.53 0.00 0.00 176.83 176.95 2va8 h LEU 242 N 0.23 0.00 -0.18 2.23 3.38 -1.32 -2.32 115.31 117.34 2va8 h LEU 242 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2va8 h LEU 242 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2va8 h LEU 242 CO 0.10 0.20 0.00 -1.54 0.09 0.00 0.00 178.44 177.30 2va8 n SER 243 N -3.48 0.70 -2.31 -0.43 3.41 -1.20 -2.83 113.62 107.48 2va8 n SER 243 Ca -0.01 0.59 -0.31 0.00 -0.26 0.00 0.00 58.87 58.88 2va8 n SER 243 Cb 0.37 -0.77 0.05 0.00 -0.26 0.00 0.00 64.21 63.60 2va8 n SER 243 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2va8 n LYS 244 N -2.19 3.06 -2.41 4.33 5.02 -1.10 -4.90 118.16 119.97 2va8 n LYS 244 Ca 0.05 -3.71 -0.16 0.00 -2.02 0.00 0.00 58.31 52.47 2va8 n LYS 244 Cb 0.37 -2.28 -0.01 0.00 -0.02 0.00 0.00 35.03 33.09 2va8 n LYS 244 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2va8 n ASN 245 N -0.77 -4.70 -4.90 4.39 5.15 -1.13 -4.96 115.26 108.34 2va8 n ASN 245 Ca 0.54 0.12 -0.28 0.00 -0.60 0.00 0.00 54.58 54.35 2va8 n ASN 245 Cb 0.71 -3.96 0.04 0.00 -0.53 0.00 0.00 39.78 36.04 2va8 n ASN 245 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2va8 s GLY 246 N -2.04 1.61 0.06 8.20 0.00 -0.89 -5.03 107.32 109.24 2va8 s GLY 246 Ca 0.00 -0.50 0.08 0.00 0.00 0.00 0.00 44.72 44.30 2va8 s GLY 246 CO 0.00 -0.18 -0.21 1.20 0.00 0.00 0.00 173.10 173.91 2va8 s GLN 247 N -5.17 1.88 -0.06 2.90 -0.21 -1.26 -4.60 119.66 113.13 2va8 s GLN 247 Ca 0.56 -1.08 0.04 0.00 0.02 0.00 0.00 55.36 54.90 2va8 s GLN 247 Cb -0.11 -2.09 -0.00 0.00 1.00 0.00 0.00 33.01 31.81 2va8 s GLN 247 CO 0.49 0.51 -0.19 0.08 -2.12 0.00 0.00 175.29 174.06 2va8 s VAL 248 N -0.94 1.65 -0.22 1.09 1.01 0.41 -1.31 120.40 122.10 2va8 s VAL 248 Ca 0.14 -0.82 -0.05 0.00 0.00 0.00 0.00 61.98 61.25 2va8 s VAL 248 Cb -0.10 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 2va8 s VAL 248 CO 0.05 0.47 0.00 -0.76 0.00 0.00 0.00 175.10 174.86 2va8 s LEU 249 N 0.17 3.18 -0.20 3.92 1.43 0.62 -1.96 118.68 125.84 2va8 s LEU 249 Ca -0.09 -0.27 -0.04 0.00 -1.03 0.00 0.00 54.13 52.71 2va8 s LEU 249 Cb -0.14 -1.82 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 2va8 s LEU 249 CO 0.04 0.01 -0.04 -0.69 0.23 0.00 0.00 176.35 175.91 2va8 s VAL 250 N 1.30 3.55 -0.28 -1.59 1.01 -0.03 0.01 120.40 124.38 2va8 s VAL 250 Ca 0.04 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 2va8 s VAL 250 Cb -0.15 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 2va8 s VAL 250 CO 0.01 0.44 0.23 -0.36 0.00 0.00 0.00 175.10 175.42 2va8 s PHE 251 N 1.10 3.23 0.29 5.22 0.40 0.66 -0.02 117.98 128.86 2va8 s PHE 251 Ca 0.01 0.18 0.09 0.00 -0.60 0.00 0.00 56.93 56.62 2va8 s PHE 251 Cb -0.15 -2.42 -0.04 0.00 0.51 0.00 0.00 43.02 40.92 2va8 s PHE 251 CO 0.00 -0.17 0.07 1.03 0.70 0.00 0.00 175.22 176.84 2va8 s ARG 252 N 1.82 2.39 0.05 0.44 1.81 0.32 -0.82 118.95 124.96 2va8 s ARG 252 Ca 0.09 -1.42 0.09 0.00 -1.72 0.00 0.00 55.73 52.77 2va8 s ARG 252 Cb -0.16 -2.21 -0.22 0.00 -0.45 0.00 0.00 34.95 31.91 2va8 s ARG 252 CO 0.11 0.29 1.00 -0.91 -0.68 0.00 0.00 175.30 175.10 2va8 h ASN 253 N 1.73 0.02 -2.20 0.23 4.21 -1.92 -3.33 115.58 114.32 2va8 h ASN 253 Ca -0.45 -0.03 -0.60 0.00 1.21 0.00 0.00 56.30 56.44 2va8 h ASN 253 Cb 1.25 -0.01 -0.13 0.00 -1.12 0.00 0.00 38.32 38.31 2va8 h ASN 253 CO 0.61 1.02 -0.73 -0.94 -1.29 0.00 0.00 177.43 176.11 2va8 s SER 254 N -6.47 3.85 0.06 5.81 1.04 -1.26 -4.82 113.70 111.91 2va8 s SER 254 Ca -0.02 -0.93 -0.23 0.00 0.48 0.00 0.00 55.95 55.24 2va8 s SER 254 Cb 0.09 -0.44 -0.16 0.00 0.10 0.00 0.00 66.02 65.61 2va8 s SER 254 CO 0.82 0.02 1.59 0.03 0.98 0.00 0.00 173.24 176.68 2va8 h ARG 255 N 2.16 0.04 -0.83 4.02 3.08 -1.98 -1.63 114.38 119.25 2va8 h ARG 255 Ca -0.41 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.60 2va8 h ARG 255 Cb 1.26 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 31.26 2va8 h ARG 255 CO 0.60 0.19 0.38 0.87 -1.07 0.00 0.00 179.97 180.95 2va8 h LYS 256 N -0.12 1.20 -0.41 0.04 1.57 -1.99 -1.75 116.57 115.11 2va8 h LYS 256 Ca 0.01 -0.18 -0.04 0.00 -1.87 0.00 0.00 60.65 58.56 2va8 h LYS 256 Cb 0.17 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2va8 h LYS 256 CO -0.00 0.93 0.07 1.98 -0.57 0.00 0.00 179.45 181.86 2va8 h MET 257 N 1.18 0.62 -0.43 3.15 4.05 -1.94 -0.02 114.93 121.53 2va8 h MET 257 Ca 0.28 -0.12 -0.15 0.00 -0.28 0.00 0.00 59.70 59.44 2va8 h MET 257 Cb 0.14 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.83 2va8 h MET 257 CO -0.03 0.59 -0.31 0.00 0.23 0.00 0.00 176.91 177.39 2va8 h ALA 258 N 1.48 0.62 0.12 0.39 0.00 -0.90 -0.46 119.26 120.52 2va8 h ALA 258 Ca 0.13 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2va8 h ALA 258 Cb 0.27 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2va8 h ALA 258 CO 0.00 0.68 -0.06 0.93 0.00 0.00 0.00 179.25 180.80 2va8 h GLU 259 N 0.81 -0.15 -0.36 0.00 5.08 -0.83 -1.45 114.58 117.68 2va8 h GLU 259 Ca 0.08 0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.30 2va8 h GLU 259 Cb 0.90 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 2va8 h GLU 259 CO 0.08 -0.02 -0.37 0.66 -1.00 0.00 0.00 179.01 178.36 2va8 h SER 260 N -0.26 0.91 -0.96 1.42 4.64 -1.03 -2.18 113.55 116.09 2va8 h SER 260 Ca -0.02 -0.40 0.01 0.00 -0.47 0.00 0.00 61.79 60.91 2va8 h SER 260 Cb 0.21 -0.25 -0.05 0.00 -0.31 0.00 0.00 62.40 62.00 2va8 h SER 260 CO 0.03 1.17 0.63 0.74 -0.87 0.00 0.00 176.83 178.53 2va8 h THR 261 N 0.70 1.25 -0.51 2.95 2.02 -1.12 -1.87 112.91 116.34 2va8 h THR 261 Ca 0.06 -0.45 -0.06 0.00 0.77 0.00 0.00 66.41 66.73 2va8 h THR 261 Cb 0.94 -0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 2va8 h THR 261 CO 0.09 0.24 0.10 0.00 0.37 0.00 0.00 175.52 176.32 2va8 h ALA 262 N 1.40 0.67 -0.35 6.16 0.00 -1.03 -2.28 119.26 123.82 2va8 h ALA 262 Ca 0.35 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 2va8 h ALA 262 Cb -0.15 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 2va8 h ALA 262 CO -0.08 0.39 -0.18 1.25 0.00 0.00 0.00 179.25 180.64 2va8 h LEU 263 N 0.71 0.64 -0.49 0.00 5.85 -1.21 -0.89 115.31 119.93 2va8 h LEU 263 Ca 0.16 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 2va8 h LEU 263 Cb 0.37 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 2va8 h LEU 263 CO 0.01 0.83 0.14 0.50 -0.34 0.00 0.00 178.44 179.58 2va8 h LYS 264 N 0.58 0.77 -0.30 1.25 3.64 -1.26 -2.69 116.57 118.56 2va8 h LYS 264 Ca 0.09 -0.17 -0.06 0.00 -1.27 0.00 0.00 60.65 59.24 2va8 h LYS 264 Cb 0.63 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 2va8 h LYS 264 CO 0.04 0.73 -0.04 0.82 -2.27 0.00 0.00 179.45 178.73 2va8 h ILE 265 N 0.66 1.27 -0.83 2.00 2.04 -1.20 -3.15 117.51 118.30 2va8 h ILE 265 Ca 0.16 -1.04 0.20 0.00 1.00 0.00 0.00 64.86 65.18 2va8 h ILE 265 Cb 0.29 1.35 -0.13 0.00 -0.74 0.00 0.00 36.82 37.59 2va8 h ILE 265 CO -0.00 0.33 0.23 0.00 0.00 0.00 0.00 178.15 178.71 2va8 h ALA 266 N 0.81 1.17 -0.81 1.87 0.00 -1.03 0.45 119.26 121.72 2va8 h ALA 266 Ca 0.08 0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.38 2va8 h ALA 266 Cb 0.50 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 2va8 h ALA 266 CO 0.02 -0.40 0.55 -0.91 0.00 0.00 0.00 179.25 178.52 2va8 h ASN 267 N 0.26 0.26 -0.60 0.00 2.35 -1.43 -2.03 115.58 114.39 2va8 h ASN 267 Ca 0.50 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.27 2va8 h ASN 267 Cb 0.95 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.29 2va8 h ASN 267 CO -0.59 0.12 0.00 -1.22 -1.65 0.00 0.00 177.43 174.09 2va8 n TYR 268 N -4.43 1.09 0.58 1.19 4.01 0.14 -4.53 117.16 115.21 2va8 n TYR 268 Ca 0.16 -0.47 0.01 0.00 -0.16 0.00 0.00 57.90 57.44 2va8 n TYR 268 Cb 0.69 -0.12 0.08 0.00 -0.31 0.00 0.00 39.34 39.69 2va8 n TYR 268 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2va8 n MET 269 N 1.15 1.80 -0.14 -0.72 2.81 -0.76 -4.39 117.12 116.87 2va8 n MET 269 Ca 0.22 -0.68 -0.04 0.00 -1.81 0.00 0.00 57.70 55.39 2va8 n MET 269 Cb 0.67 -1.63 0.04 0.00 -0.71 0.00 0.00 33.22 31.59 2va8 n MET 269 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2va8 h ASN 270 N 0.81 0.06 0.11 7.83 4.21 -1.83 -3.24 115.58 123.53 2va8 h ASN 270 Ca 0.01 0.07 0.00 0.00 1.21 0.00 0.00 56.30 57.59 2va8 h ASN 270 Cb 0.88 0.08 0.00 0.00 -1.12 0.00 0.00 38.32 38.15 2va8 h ASN 270 CO 0.12 0.07 -0.93 2.22 -1.29 0.00 0.00 177.43 177.61 2va8 n PHE 271 N -5.07 0.01 -2.51 1.19 -1.74 -1.26 -4.91 117.46 103.16 2va8 n PHE 271 Ca 0.04 0.00 -0.41 0.00 -0.56 0.00 0.00 57.45 56.52 2va8 n PHE 271 Cb 0.19 -0.07 -0.04 0.00 1.52 0.00 0.00 39.48 41.08 2va8 n PHE 271 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 2va8 s VAL 272 N -3.02 4.02 0.06 1.97 1.01 -1.22 -5.01 120.40 118.21 2va8 s VAL 272 Ca 0.08 1.63 -0.31 0.00 0.00 0.00 0.00 61.98 63.38 2va8 s VAL 272 Cb 0.16 -4.04 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 2va8 s VAL 272 CO 0.84 0.23 1.24 -0.44 0.00 0.00 0.00 175.10 176.97 2va8 s SER 273 N 0.29 7.02 -0.02 3.32 0.01 -1.26 -5.03 113.70 118.02 2va8 s SER 273 Ca 0.52 2.07 0.04 0.00 1.31 0.00 0.00 55.95 59.89 2va8 s SER 273 Cb -0.28 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.36 2va8 s SER 273 CO 0.33 -0.52 -0.15 -0.76 0.41 0.00 0.00 173.24 172.54 2va8 s LEU 274 N 1.19 1.98 -1.05 2.44 1.43 -1.26 -5.07 118.68 118.34 2va8 s LEU 274 Ca 0.60 -0.29 -0.23 0.00 -1.03 0.00 0.00 54.13 53.18 2va8 s LEU 274 Cb -0.31 -0.82 0.00 0.00 0.03 0.00 0.00 46.19 45.10 2va8 s LEU 274 CO 0.29 0.17 1.72 -0.62 0.23 0.00 0.00 176.35 178.14 2va8 s ASP 275 N -0.22 5.93 0.25 2.29 3.68 -1.26 -4.82 116.67 122.51 2va8 s ASP 275 Ca 0.03 -1.39 0.01 0.00 2.13 0.00 0.00 52.55 53.32 2va8 s ASP 275 Cb -0.08 -2.57 0.30 0.00 -1.45 0.00 0.00 42.92 39.12 2va8 s ASP 275 CO 0.00 -2.05 1.64 -0.08 0.13 0.00 0.00 175.17 174.81 2va8 h GLU 276 N 9.90 0.49 -0.49 4.34 4.57 -1.98 -1.66 114.58 129.76 2va8 h GLU 276 Ca 0.21 -0.23 -0.09 0.00 -1.18 0.00 0.00 59.36 58.07 2va8 h GLU 276 Cb 0.98 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.54 2va8 h GLU 276 CO 1.34 0.79 -0.06 -0.91 -1.18 0.00 0.00 179.01 178.98 2va8 h ASN 277 N 0.41 0.84 0.87 1.04 4.21 -2.01 -1.19 115.58 119.76 2va8 h ASN 277 Ca 0.04 -0.24 -0.15 0.00 1.21 0.00 0.00 56.30 57.16 2va8 h ASN 277 Cb 0.83 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 37.79 2va8 h ASN 277 CO 0.07 0.94 -0.73 0.00 -1.29 0.00 0.00 177.43 176.42 2va8 h ALA 278 N 1.14 0.71 -0.03 -0.83 0.00 -1.91 -2.99 119.26 115.36 2va8 h ALA 278 Ca 0.14 -0.66 -0.16 0.00 0.00 0.00 0.00 54.91 54.23 2va8 h ALA 278 Cb 0.56 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.24 2va8 h ALA 278 CO 0.03 0.91 -0.60 -0.07 0.00 0.00 0.00 179.25 179.52 2va8 h LEU 279 N 0.00 0.57 -1.52 0.00 3.38 -1.19 -2.56 115.31 113.99 2va8 h LEU 279 Ca -0.01 -0.73 0.05 0.00 0.09 0.00 0.00 57.88 57.28 2va8 h LEU 279 Cb 1.36 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.90 2va8 h LEU 279 CO 0.09 1.22 0.38 0.77 0.09 0.00 0.00 178.44 180.99 2va8 h SER 280 N -0.03 0.52 -0.10 -0.43 4.64 -1.25 0.16 113.55 117.06 2va8 h SER 280 Ca -0.07 -0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.26 2va8 h SER 280 Cb 1.29 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 2va8 h SER 280 CO 0.12 0.35 0.04 -0.08 -0.87 0.00 0.00 176.83 176.38 2va8 h GLU 281 N 0.60 0.08 -0.79 4.77 4.57 -1.55 0.14 114.58 122.41 2va8 h GLU 281 Ca 0.24 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.39 2va8 h GLU 281 Cb 0.19 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.73 2va8 h GLU 281 CO -0.07 0.06 0.39 0.82 -1.18 0.00 0.00 179.01 179.03 2va8 h ILE 282 N 0.09 1.25 -0.93 2.32 2.04 -0.72 -1.48 117.51 120.07 2va8 h ILE 282 Ca 0.04 -0.68 0.01 0.00 1.00 0.00 0.00 64.86 65.23 2va8 h ILE 282 Cb 0.02 0.24 -0.05 0.00 -0.74 0.00 0.00 36.82 36.29 2va8 h ILE 282 CO -0.04 0.29 0.62 -0.07 0.00 0.00 0.00 178.15 178.95 2va8 h LEU 283 N 1.11 1.07 -0.28 1.44 3.38 -0.67 0.13 115.31 121.50 2va8 h LEU 283 Ca 0.27 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.23 2va8 h LEU 283 Cb 0.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2va8 h LEU 283 CO -0.04 0.77 0.16 0.11 0.09 0.00 0.00 178.44 179.54 2va8 h LYS 284 N 1.26 0.32 -0.26 1.13 1.57 -0.42 -2.24 116.57 117.93 2va8 h LYS 284 Ca 0.34 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 59.01 2va8 h LYS 284 Cb -0.14 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 2va8 h LYS 284 CO -0.08 0.21 -0.26 1.96 -0.57 0.00 0.00 179.45 180.72 2va8 h GLN 285 N 0.33 0.50 0.06 3.15 4.20 -0.68 -3.04 115.11 119.64 2va8 h GLN 285 Ca 0.11 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 2va8 h GLN 285 Cb -0.00 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.75 2va8 h GLN 285 CO -0.05 0.72 -0.03 1.25 -0.67 0.00 0.00 178.83 180.05 2va8 h LEU 286 N 0.44 -0.07 -1.66 1.46 5.85 -0.63 -2.99 115.31 117.72 2va8 h LEU 286 Ca 0.06 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 2va8 h LEU 286 Cb 0.69 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 2va8 h LEU 286 CO 0.05 -0.02 -0.05 -0.78 -0.34 0.00 0.00 178.44 177.30 2va8 h ASP 287 N -0.11 0.14 -0.03 1.25 3.58 -1.30 -2.54 116.42 117.42 2va8 h ASP 287 Ca -0.01 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.43 2va8 h ASP 287 Cb 0.09 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2va8 h ASP 287 CO 0.01 0.22 0.00 0.47 -2.88 0.00 0.00 179.24 177.06 2va8 n ASP 288 N -4.39 1.58 -4.66 2.28 8.00 -1.17 -4.82 116.55 113.38 2va8 n ASP 288 Ca -0.01 -1.54 -0.43 0.00 0.71 0.00 0.00 54.79 53.53 2va8 n ASP 288 Cb 0.18 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.25 2va8 n ASP 288 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2va8 s ILE 289 N -1.99 3.85 -0.16 0.53 1.01 -0.96 -4.88 121.20 118.60 2va8 s ILE 289 Ca 0.37 1.02 0.21 0.00 0.00 0.00 0.00 60.65 62.25 2va8 s ILE 289 Cb 0.21 -3.66 -0.13 0.00 0.01 0.00 0.00 42.46 38.89 2va8 s ILE 289 CO 0.33 -0.10 0.81 -0.62 0.00 0.00 0.00 174.94 175.36 2va8 n GLU 290 N 6.95 0.63 -2.61 2.79 1.02 -1.26 -4.58 120.64 123.57 2va8 n GLU 290 Ca 0.16 0.06 -0.43 0.00 -0.02 0.00 0.00 57.16 56.93 2va8 n GLU 290 Cb 0.44 -1.73 0.00 0.00 -0.02 0.00 0.00 31.44 30.13 2va8 n GLU 290 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2va8 n GLU 291 N -2.63 3.74 0.00 3.49 -0.58 -1.26 -4.86 120.64 118.54 2va8 n GLU 291 Ca -0.05 -3.82 0.00 0.00 -0.42 0.00 0.00 57.16 52.88 2va8 n GLU 291 Cb 0.65 -2.85 0.00 0.00 -0.57 0.00 0.00 31.44 28.67 2va8 n GLU 291 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2va8 n GLY 292 N 2.73 1.11 3.83 0.62 0.00 -1.26 -4.49 105.19 107.74 2va8 n GLY 292 Ca 0.36 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 45.35 2va8 n GLY 292 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2va8 s GLY 293 N 0.00 2.17 0.16 -0.02 0.00 -1.26 -4.97 107.32 103.40 2va8 s GLY 293 Ca 0.00 0.26 -0.11 0.00 0.00 0.00 0.00 44.72 44.87 2va8 s GLY 293 CO 0.00 0.54 1.64 1.76 0.00 0.00 0.00 173.10 177.04 2va8 h SER 294 N 1.21 0.92 -0.45 1.64 0.02 -1.97 -1.03 113.55 113.89 2va8 h SER 294 Ca -0.47 -0.28 -0.14 0.00 -0.84 0.00 0.00 61.79 60.06 2va8 h SER 294 Cb 1.18 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 2va8 h SER 294 CO 0.61 0.96 -0.26 0.44 -1.14 0.00 0.00 176.83 177.45 2va8 h ASP 295 N 0.84 1.00 0.41 3.07 3.45 -1.98 0.34 116.42 123.54 2va8 h ASP 295 Ca 0.17 -0.42 -0.01 0.00 0.43 0.00 0.00 57.03 57.20 2va8 h ASP 295 Cb 0.46 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 38.93 2va8 h ASP 295 CO 0.02 1.20 -0.36 -0.33 -1.57 0.00 0.00 179.24 178.20 2va8 h GLU 296 N 0.80 -0.75 -0.53 3.56 5.08 -1.96 0.74 114.58 121.52 2va8 h GLU 296 Ca 0.09 0.05 0.11 0.00 -1.00 0.00 0.00 59.36 58.61 2va8 h GLU 296 Cb 0.84 0.17 -0.09 0.00 0.50 0.00 0.00 28.75 30.17 2va8 h GLU 296 CO 0.07 -0.50 -0.03 0.87 -1.00 0.00 0.00 179.01 178.42 2va8 h LYS 297 N -0.77 0.08 -0.31 2.33 1.57 -1.02 0.16 116.57 118.62 2va8 h LYS 297 Ca -0.03 -0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.78 2va8 h LYS 297 Cb 0.68 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.93 2va8 h LYS 297 CO -0.03 0.05 0.06 1.49 -0.57 0.00 0.00 179.45 180.45 2va8 h GLU 298 N 0.08 0.17 -0.34 3.15 4.81 -0.10 -0.73 114.58 121.63 2va8 h GLU 298 Ca 0.27 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.45 2va8 h GLU 298 Cb 0.42 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 2va8 h GLU 298 CO -0.48 0.11 0.06 1.25 -0.73 0.00 0.00 179.01 179.23 2va8 h LEU 299 N 0.17 0.52 -0.79 1.64 5.85 -0.27 -2.73 115.31 119.71 2va8 h LEU 299 Ca 0.14 -0.25 -0.07 0.00 0.84 0.00 0.00 57.88 58.54 2va8 h LEU 299 Cb 0.15 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 2va8 h LEU 299 CO -0.19 0.64 0.11 -0.07 -0.34 0.00 0.00 178.44 178.59 2va8 h LEU 300 N 0.39 0.98 -0.18 2.25 3.38 -0.71 -2.76 115.31 118.65 2va8 h LEU 300 Ca 0.10 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.89 2va8 h LEU 300 Cb 0.33 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2va8 h LEU 300 CO 0.00 0.97 -0.04 0.50 0.09 0.00 0.00 178.44 179.96 2va8 h LYS 301 N 0.97 0.01 -0.90 1.13 3.64 -1.07 0.58 116.57 120.92 2va8 h LYS 301 Ca 0.20 -0.00 0.18 0.00 -1.27 0.00 0.00 60.65 59.76 2va8 h LYS 301 Cb 0.40 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.15 2va8 h LYS 301 CO 0.01 0.00 0.59 1.03 -2.27 0.00 0.00 179.45 178.81 2va8 h SER 302 N 0.01 0.52 0.02 4.20 0.87 -1.21 -2.54 113.55 115.42 2va8 h SER 302 Ca 0.09 0.05 -0.24 0.00 -1.23 0.00 0.00 61.79 60.46 2va8 h SER 302 Cb 0.13 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.01 2va8 h SER 302 CO -0.18 0.22 -1.28 -0.07 -0.53 0.00 0.00 176.83 174.99 2va8 h LEU 303 N 0.53 0.08 -1.53 2.23 3.38 -1.01 -3.37 115.31 115.61 2va8 h LEU 303 Ca 0.47 -0.62 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 2va8 h LEU 303 Cb 0.99 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 2va8 h LEU 303 CO -0.21 1.52 0.07 0.40 0.09 0.00 0.00 178.44 180.31 2va8 h ILE 304 N -0.81 1.13 0.00 1.22 2.04 0.15 0.14 117.51 121.38 2va8 h ILE 304 Ca -0.33 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.09 2va8 h ILE 304 Cb 1.41 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 2va8 h ILE 304 CO -0.14 0.16 0.00 -1.54 0.00 0.00 0.00 178.15 176.63 2va8 n SER 305 N -4.39 0.00 -0.40 1.72 3.41 -0.96 -1.77 113.62 111.22 2va8 n SER 305 Ca 0.01 0.46 0.04 0.00 -0.26 0.00 0.00 58.87 59.12 2va8 n SER 305 Cb 0.16 -0.48 0.08 0.00 -0.26 0.00 0.00 64.21 63.71 2va8 n SER 305 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2va8 n LYS 306 N -1.48 1.85 -0.56 4.33 3.00 0.42 -4.98 118.16 120.75 2va8 n LYS 306 Ca 0.03 -1.55 0.00 0.00 -0.00 0.00 0.00 58.31 56.79 2va8 n LYS 306 Cb 0.11 -1.18 0.00 0.00 0.00 0.00 0.00 35.03 33.96 2va8 n LYS 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2va8 n GLY 307 N 0.31 0.68 3.26 3.14 0.00 -0.73 -4.86 105.19 106.99 2va8 n GLY 307 Ca 0.07 -0.38 -0.18 0.00 0.00 0.00 0.00 46.02 45.53 2va8 n GLY 307 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2va8 s VAL 308 N -2.00 1.42 0.07 1.61 1.01 -0.69 -0.07 120.40 121.75 2va8 s VAL 308 Ca 0.00 -1.83 -0.24 0.00 0.00 0.00 0.00 61.98 59.91 2va8 s VAL 308 Cb 0.00 -1.65 0.06 0.00 0.00 0.00 0.00 36.38 34.79 2va8 s VAL 308 CO 0.00 -0.45 0.58 0.00 0.00 0.00 0.00 175.10 175.22 2va8 s ALA 309 N -2.32 -1.50 0.35 5.51 0.00 -0.55 -1.25 121.76 121.99 2va8 s ALA 309 Ca 0.12 0.67 0.07 0.00 0.00 0.00 0.00 51.96 52.83 2va8 s ALA 309 Cb -0.04 0.51 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 2va8 s ALA 309 CO 0.04 -0.58 0.34 1.52 0.00 0.00 0.00 175.76 177.07 2va8 s TYR 310 N -2.74 2.89 -0.19 0.00 -0.85 -1.26 -0.60 117.35 114.60 2va8 s TYR 310 Ca -0.04 -0.33 -0.06 0.00 -0.52 0.00 0.00 57.07 56.13 2va8 s TYR 310 Cb -0.00 -1.90 0.09 0.00 0.38 0.00 0.00 41.96 40.53 2va8 s TYR 310 CO -0.04 0.09 0.38 -1.58 -1.52 0.00 0.00 175.55 172.88 2va8 s HIS 311 N -2.32 -0.71 0.30 -3.49 2.46 -0.13 -4.85 115.29 106.55 2va8 s HIS 311 Ca 0.43 1.28 -0.09 0.00 0.47 0.00 0.00 55.06 57.15 2va8 s HIS 311 Cb -0.06 0.18 0.01 0.00 -0.13 0.00 0.00 32.58 32.57 2va8 s HIS 311 CO 0.27 -0.49 0.51 -3.38 -2.47 0.00 0.00 174.74 169.18 2va8 s HIS 312 N 2.56 0.61 -1.34 3.88 -3.43 -1.26 -2.47 115.29 113.84 2va8 s HIS 312 Ca 0.01 -0.96 0.21 0.00 -0.80 0.00 0.00 55.06 53.52 2va8 s HIS 312 Cb -0.13 0.16 1.01 0.00 -1.43 0.00 0.00 32.58 32.20 2va8 s HIS 312 CO -0.12 -1.12 1.66 0.00 -2.00 0.00 0.00 174.74 173.16 2va8 n ALA 313 N -0.47 2.06 0.22 -1.38 0.00 -1.26 -2.31 120.51 117.37 2va8 n ALA 313 Ca -0.01 -0.09 0.07 0.00 0.00 0.00 0.00 53.44 53.40 2va8 n ALA 313 Cb 0.62 -1.34 0.51 0.00 0.00 0.00 0.00 19.45 19.24 2va8 n ALA 313 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2va8 h GLY 314 N 3.45 0.00 -3.15 0.00 0.00 -1.94 -3.34 103.07 98.09 2va8 h GLY 314 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 2va8 h GLY 314 CO 0.00 0.00 0.36 1.08 0.00 0.00 0.00 176.54 177.98 2va8 s LEU 315 N -7.72 4.38 0.78 3.11 1.43 -0.98 -0.66 118.68 119.02 2va8 s LEU 315 Ca -0.02 1.91 -0.11 0.00 -1.03 0.00 0.00 54.13 54.87 2va8 s LEU 315 Cb 0.13 -3.94 0.06 0.00 0.03 0.00 0.00 46.19 42.48 2va8 s LEU 315 CO 0.66 -0.09 1.12 -0.94 0.23 0.00 0.00 176.35 177.33 2va8 s SER 316 N -1.49 4.24 0.18 2.29 1.04 -1.26 -3.80 113.70 114.90 2va8 s SER 316 Ca 0.49 1.97 -0.17 0.00 0.48 0.00 0.00 55.95 58.73 2va8 s SER 316 Cb -0.21 -2.54 0.13 0.00 0.10 0.00 0.00 66.02 63.50 2va8 s SER 316 CO 0.27 -2.22 1.65 0.50 0.98 0.00 0.00 173.24 174.42 2va8 h LYS 317 N -1.03 -0.04 -0.91 4.02 3.64 -1.93 -1.01 116.57 119.31 2va8 h LYS 317 Ca -0.44 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.01 2va8 h LYS 317 Cb 1.25 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 33.01 2va8 h LYS 317 CO 0.50 -0.03 0.59 0.00 -2.27 0.00 0.00 179.45 178.24 2va8 h ALA 318 N 1.38 1.53 -0.19 5.00 0.00 -1.93 0.90 119.26 125.94 2va8 h ALA 318 Ca 0.22 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 2va8 h ALA 318 Cb 0.38 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2va8 h ALA 318 CO -0.50 0.33 -0.24 -0.07 0.00 0.00 0.00 179.25 178.77 2va8 h LEU 319 N 1.01 0.54 -0.94 0.00 3.38 -1.57 -2.67 115.31 115.07 2va8 h LEU 319 Ca 0.40 -0.50 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2va8 h LEU 319 Cb 0.24 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 2va8 h LEU 319 CO -0.16 0.93 0.55 0.03 0.09 0.00 0.00 178.44 179.89 2va8 h ARG 320 N 0.17 1.28 -0.90 1.13 3.08 -0.64 -2.43 114.38 116.07 2va8 h ARG 320 Ca 0.03 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.95 2va8 h ARG 320 Cb 0.80 -0.26 -0.04 0.00 0.08 0.00 0.00 29.97 30.54 2va8 h ARG 320 CO 0.06 0.91 0.57 -0.44 -1.07 0.00 0.00 179.97 179.99 2va8 h ASP 321 N 1.30 1.06 -0.42 7.04 3.45 -0.82 -0.26 116.42 127.77 2va8 h ASP 321 Ca 0.33 -0.05 -0.13 0.00 0.43 0.00 0.00 57.03 57.61 2va8 h ASP 321 Cb -0.04 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.46 2va8 h ASP 321 CO -0.06 0.79 -0.26 0.25 -1.57 0.00 0.00 179.24 178.39 2va8 h LEU 322 N 1.23 0.96 0.42 1.55 6.46 -1.20 -0.80 115.31 123.93 2va8 h LEU 322 Ca 0.33 -0.42 -0.02 0.00 -0.12 0.00 0.00 57.88 57.64 2va8 h LEU 322 Cb -0.10 -0.27 0.00 0.00 -0.73 0.00 0.00 40.66 39.57 2va8 h LEU 322 CO -0.07 1.17 -0.20 0.40 -0.62 0.00 0.00 178.44 179.12 2va8 h ILE 323 N 0.75 0.59 -0.49 4.05 2.04 -1.31 0.13 117.51 123.26 2va8 h ILE 323 Ca 0.09 -0.09 0.08 0.00 1.00 0.00 0.00 64.86 65.94 2va8 h ILE 323 Cb 0.84 0.63 -0.07 0.00 -0.74 0.00 0.00 36.82 37.49 2va8 h ILE 323 CO 0.07 0.02 0.12 -0.33 0.00 0.00 0.00 178.15 178.03 2va8 h GLU 324 N -0.62 0.25 -0.22 2.37 5.08 -1.01 -1.66 114.58 118.78 2va8 h GLU 324 Ca -0.06 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.16 2va8 h GLU 324 Cb 0.46 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2va8 h GLU 324 CO 0.09 0.17 -0.41 1.49 -1.00 0.00 0.00 179.01 179.35 2va8 h GLU 325 N 0.26 0.51 -0.73 2.33 4.57 -1.12 0.15 114.58 120.55 2va8 h GLU 325 Ca 0.25 -0.26 -0.05 0.00 -1.18 0.00 0.00 59.36 58.12 2va8 h GLU 325 Cb 0.32 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 2va8 h GLU 325 CO -0.31 0.84 0.27 0.78 -1.18 0.00 0.00 179.01 179.41 2va8 h GLY 326 N 1.09 1.18 1.47 1.92 0.00 -0.43 -2.25 103.07 106.05 2va8 h GLY 326 Ca 0.04 -0.65 -0.20 0.00 0.00 0.00 0.00 47.33 46.51 2va8 h GLY 326 CO 0.08 0.61 -0.79 -2.75 0.00 0.00 0.00 176.54 173.69 2va8 h PHE 327 N 1.07 0.71 -0.58 5.60 3.04 -1.18 -1.03 116.94 124.56 2va8 h PHE 327 Ca 0.24 -0.33 -0.02 0.00 3.98 0.00 0.00 57.97 61.85 2va8 h PHE 327 Cb 0.24 -0.10 -0.03 0.00 2.56 0.00 0.00 35.95 38.61 2va8 h PHE 327 CO 0.02 1.12 0.30 -0.09 -2.02 0.00 0.00 178.31 177.64 2va8 h ARG 328 N 0.34 0.81 -0.03 1.11 2.43 -0.37 -0.45 114.38 118.22 2va8 h ARG 328 Ca -0.05 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 2va8 h ARG 328 Cb 1.39 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2va8 h ARG 328 CO 0.14 0.61 0.00 1.04 -1.51 0.00 0.00 179.97 180.26 2va8 n GLN 329 N -4.38 1.29 -2.07 0.20 1.13 -0.88 -4.92 117.38 107.75 2va8 n GLN 329 Ca 0.05 -0.42 -0.15 0.00 -1.94 0.00 0.00 57.00 54.54 2va8 n GLN 329 Cb 0.11 -1.44 -0.02 0.00 0.11 0.00 0.00 30.24 29.00 2va8 n GLN 329 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2va8 n ARG 330 N -0.45 -1.17 -0.05 -1.09 1.74 -0.18 -4.91 116.66 110.55 2va8 n ARG 330 Ca 0.20 0.81 -0.21 0.00 -0.77 0.00 0.00 57.85 57.88 2va8 n ARG 330 Cb 0.20 -5.10 -0.13 0.00 -1.02 0.00 0.00 32.46 26.41 2va8 n ARG 330 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2va8 h LYS 331 N 0.00 0.11 -6.34 5.56 1.79 -1.43 -3.44 116.57 112.82 2va8 h LYS 331 Ca -0.35 -0.19 -0.55 0.00 -2.18 0.00 0.00 60.65 57.38 2va8 h LYS 331 Cb 1.19 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.89 2va8 h LYS 331 CO 0.43 1.09 0.53 0.42 -1.08 0.00 0.00 179.45 180.84 2va8 s ILE 332 N -2.43 4.63 -0.11 1.86 1.01 -0.98 -4.77 121.20 120.41 2va8 s ILE 332 Ca -0.25 1.90 0.16 0.00 0.00 0.00 0.00 60.65 62.46 2va8 s ILE 332 Cb 0.06 -4.22 -0.19 0.00 0.01 0.00 0.00 42.46 38.12 2va8 s ILE 332 CO 0.67 0.07 0.65 0.29 0.00 0.00 0.00 174.94 176.62 2va8 n LYS 333 N 4.55 0.64 -3.80 2.79 4.76 0.90 -4.49 118.16 123.51 2va8 n LYS 333 Ca 0.08 0.17 -0.15 0.00 -2.87 0.00 0.00 58.31 55.55 2va8 n LYS 333 Cb 0.49 -1.74 -0.16 0.00 -1.84 0.00 0.00 35.03 31.78 2va8 n LYS 333 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2va8 s VAL 334 N -2.83 -0.03 -0.08 -0.18 1.01 -0.90 -0.44 120.40 116.94 2va8 s VAL 334 Ca -0.05 0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.17 2va8 s VAL 334 Cb 0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 36.38 36.37 2va8 s VAL 334 CO 0.82 0.09 -0.24 -0.63 0.00 0.00 0.00 175.10 175.14 2va8 s ILE 335 N 0.97 2.03 -0.29 2.22 1.01 -0.83 -1.49 121.20 124.84 2va8 s ILE 335 Ca -0.08 -1.02 -0.09 0.00 0.00 0.00 0.00 60.65 59.45 2va8 s ILE 335 Cb -0.12 -1.74 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 2va8 s ILE 335 CO -0.03 0.56 0.14 -0.69 0.00 0.00 0.00 174.94 174.92 2va8 s VAL 336 N 0.17 4.71 0.19 2.92 1.01 0.23 -0.85 120.40 128.77 2va8 s VAL 336 Ca -0.13 -0.20 0.09 0.00 0.00 0.00 0.00 61.98 61.74 2va8 s VAL 336 Cb -0.16 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 2va8 s VAL 336 CO 0.07 0.19 -0.19 0.00 0.00 0.00 0.00 175.10 175.17 2va8 s ALA 337 N 1.65 2.15 0.83 5.51 0.00 0.97 -0.95 121.76 131.92 2va8 s ALA 337 Ca 0.06 -1.57 -0.12 0.00 0.00 0.00 0.00 51.96 50.33 2va8 s ALA 337 Cb -0.16 -0.20 0.09 0.00 0.00 0.00 0.00 23.12 22.85 2va8 s ALA 337 CO 0.07 0.24 1.11 0.95 0.00 0.00 0.00 175.76 178.13 2va8 s THR 338 N -2.17 2.70 0.66 0.00 -4.23 -1.03 -0.52 115.64 111.05 2va8 s THR 338 Ca 0.19 0.23 0.43 0.00 -1.18 0.00 0.00 61.69 61.35 2va8 s THR 338 Cb -0.05 -2.99 0.43 0.00 1.34 0.00 0.00 72.50 71.23 2va8 s THR 338 CO 0.08 -0.30 2.34 -0.65 -0.54 0.00 0.00 174.62 175.55 2va8 h PRO 339 N -1.21 0.00 -0.84 3.99 0.11 -1.88 -3.09 132.00 129.08 2va8 h PRO 339 Ca -0.48 0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.70 2va8 h PRO 339 Cb 1.29 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.34 2va8 h PRO 339 CO 0.60 0.00 0.51 1.15 -0.21 0.00 0.00 178.00 180.05 2va8 h THR 340 N 0.00 1.01 -0.95 -1.15 2.02 -1.94 -1.22 112.91 110.68 2va8 h THR 340 Ca 0.00 -0.31 0.19 0.00 0.77 0.00 0.00 66.41 67.06 2va8 h THR 340 Cb 0.05 0.02 -0.08 0.00 -1.74 0.00 0.00 68.15 66.39 2va8 h THR 340 CO -0.00 0.17 0.61 0.25 0.37 0.00 0.00 175.52 176.91 2va8 h LEU 341 N 0.91 0.57 -2.24 2.58 6.46 -1.89 -0.36 115.31 121.36 2va8 h LEU 341 Ca 0.37 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 58.18 2va8 h LEU 341 Cb 0.21 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 40.09 2va8 h LEU 341 CO -0.19 0.22 -0.06 0.00 -0.62 0.00 0.00 178.44 177.80 2va8 h ALA 342 N 1.62 1.35 -0.01 1.25 0.00 -1.44 -1.28 119.26 120.75 2va8 h ALA 342 Ca 0.51 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2va8 h ALA 342 Cb 1.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2va8 h ALA 342 CO -0.25 0.07 -0.54 0.00 0.00 0.00 0.00 179.25 178.53 2va8 n ALA 343 N -2.27 3.69 -1.44 0.00 0.00 -0.16 -4.78 120.51 115.55 2va8 n ALA 343 Ca -0.02 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.94 2va8 n ALA 343 Cb 0.16 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2va8 n ALA 343 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2va8 n GLY 344 N 1.44 0.18 3.45 0.00 0.00 -0.49 -5.04 105.19 104.74 2va8 n GLY 344 Ca 0.08 -1.79 -0.33 0.00 0.00 0.00 0.00 46.02 43.98 2va8 n GLY 344 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2va8 n VAL 345 N -0.33 0.18 -1.69 1.61 0.24 -1.26 -4.87 118.33 112.21 2va8 n VAL 345 Ca 0.00 -0.19 -0.45 0.00 -2.04 0.00 0.00 64.34 61.67 2va8 n VAL 345 Cb 0.00 -0.68 -0.03 0.00 -1.47 0.00 0.00 33.84 31.65 2va8 n VAL 345 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2va8 n ASN 346 N -1.60 3.25 -2.95 -1.34 4.13 -1.26 -4.95 115.26 110.53 2va8 n ASN 346 Ca 0.08 1.10 0.02 0.00 1.68 0.00 0.00 54.58 57.46 2va8 n ASN 346 Cb 0.53 -1.47 0.00 0.00 -1.54 0.00 0.00 39.78 37.30 2va8 n ASN 346 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2va8 s LEU 347 N 0.60 -0.76 0.44 3.41 2.96 -1.26 -5.10 118.68 118.97 2va8 s LEU 347 Ca 0.74 -0.32 -0.03 0.00 -0.22 0.00 0.00 54.13 54.30 2va8 s LEU 347 Cb -0.62 1.03 -0.03 0.00 0.50 0.00 0.00 46.19 47.07 2va8 s LEU 347 CO 0.41 -0.09 0.70 -2.16 -1.32 0.00 0.00 176.35 173.89 2va8 s PRO 348 N 2.05 3.51 0.44 0.98 0.04 -1.26 -4.95 135.00 135.80 2va8 s PRO 348 Ca 0.16 0.00 0.03 0.00 0.04 0.00 0.00 61.00 61.23 2va8 s PRO 348 Cb -0.00 -2.47 -0.03 0.00 0.04 0.00 0.00 34.50 32.04 2va8 s PRO 348 CO -0.14 -0.09 0.08 0.00 0.04 0.00 0.00 177.00 176.89 2va8 s ALA 349 N -2.60 3.30 -0.01 8.56 0.00 0.01 -4.87 121.76 126.16 2va8 s ALA 349 Ca 0.45 -1.05 -0.20 0.00 0.00 0.00 0.00 51.96 51.16 2va8 s ALA 349 Cb -0.10 0.48 -0.27 0.00 0.00 0.00 0.00 23.12 23.23 2va8 s ALA 349 CO 0.42 -0.22 1.03 -0.09 0.00 0.00 0.00 175.76 176.90 2va8 h ARG 350 N 1.66 0.39 -5.72 0.00 2.43 -1.48 0.53 114.38 112.19 2va8 h ARG 350 Ca -0.39 -0.49 -0.68 0.00 -0.81 0.00 0.00 59.98 57.60 2va8 h ARG 350 Cb 1.28 0.16 -0.31 0.00 -0.42 0.00 0.00 29.97 30.68 2va8 h ARG 350 CO 0.64 1.17 -0.87 0.99 -1.51 0.00 0.00 179.97 180.40 2va8 s THR 351 N -2.93 2.18 -0.17 0.20 2.01 -0.72 -1.74 115.64 114.47 2va8 s THR 351 Ca -0.13 -1.00 -0.03 0.00 0.31 0.00 0.00 61.69 60.84 2va8 s THR 351 Cb 0.03 -1.81 -0.02 0.00 0.01 0.00 0.00 72.50 70.70 2va8 s THR 351 CO 0.83 0.56 -0.06 -0.69 -0.69 0.00 0.00 174.62 174.57 2va8 s VAL 352 N 0.05 3.52 -0.21 3.82 1.01 0.19 -0.27 120.40 128.50 2va8 s VAL 352 Ca -0.09 -0.48 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 2va8 s VAL 352 Cb -0.15 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.69 2va8 s VAL 352 CO 0.06 0.48 -0.10 -0.63 0.00 0.00 0.00 175.10 174.91 2va8 s ILE 353 N 0.70 2.88 -0.40 2.22 1.01 0.10 -0.91 121.20 126.80 2va8 s ILE 353 Ca -0.03 -0.66 -0.15 0.00 0.00 0.00 0.00 60.65 59.80 2va8 s ILE 353 Cb -0.15 -2.29 0.01 0.00 0.01 0.00 0.00 42.46 40.05 2va8 s ILE 353 CO 0.02 0.46 0.33 -0.63 0.00 0.00 0.00 174.94 175.12 2va8 s ILE 354 N 1.41 5.22 -0.21 2.92 1.01 0.45 -0.24 121.20 131.75 2va8 s ILE 354 Ca 0.05 -0.51 0.21 0.00 0.00 0.00 0.00 60.65 60.41 2va8 s ILE 354 Cb -0.14 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 2va8 s ILE 354 CO -0.07 -0.30 0.98 0.61 0.00 0.00 0.00 174.94 176.16 2va8 n GLY 355 N 5.13 -1.40 0.78 6.18 0.00 0.00 -0.89 105.19 114.99 2va8 n GLY 355 Ca -0.10 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 45.75 2va8 n GLY 355 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2va8 n ASP 356 N -2.71 1.47 -4.48 1.61 8.00 -1.26 -4.77 116.55 114.42 2va8 n ASP 356 Ca -0.02 -3.12 -0.50 0.00 0.71 0.00 0.00 54.79 51.86 2va8 n ASP 356 Cb 0.61 -0.43 -0.04 0.00 -0.02 0.00 0.00 41.12 41.24 2va8 n ASP 356 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2va8 n ILE 357 N -0.62 1.39 0.00 0.53 -6.64 -1.26 -4.93 119.36 107.82 2va8 n ILE 357 Ca 0.13 -0.35 0.00 0.00 -1.77 0.00 0.00 62.75 60.77 2va8 n ILE 357 Cb 0.81 -0.27 0.00 0.00 -1.44 0.00 0.00 39.64 38.74 2va8 n ILE 357 CO 0.00 0.00 0.00 -2.65 -1.77 0.00 0.00 176.55 172.13 2va8 n PRO 372 N 1.20 0.00 -0.11 6.28 -0.02 -1.26 -5.22 135.00 135.87 2va8 n PRO 372 Ca 0.17 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.52 2va8 n PRO 372 Cb 0.22 -0.04 -0.03 0.00 -0.02 0.00 0.00 33.50 33.64 2va8 n PRO 372 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2va8 h ILE 373 N 0.00 1.27 -0.73 4.25 2.04 -1.96 -2.00 117.51 120.38 2va8 h ILE 373 Ca 0.00 -1.56 0.06 0.00 1.00 0.00 0.00 64.86 64.36 2va8 h ILE 373 Cb 0.00 1.42 -0.06 0.00 -0.74 0.00 0.00 36.82 37.44 2va8 h ILE 373 CO 0.00 0.52 0.43 -0.03 0.00 0.00 0.00 178.15 179.07 2va8 h MET 374 N 0.72 0.76 -0.48 2.37 4.05 -1.96 -0.31 114.93 120.09 2va8 h MET 374 Ca 0.06 -0.05 -0.05 0.00 -0.28 0.00 0.00 59.70 59.38 2va8 h MET 374 Cb 0.98 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.58 2va8 h MET 374 CO 0.09 0.50 0.09 1.49 0.23 0.00 0.00 176.91 179.32 2va8 h GLU 375 N 0.79 0.74 -0.27 0.39 4.57 -1.96 0.96 114.58 119.79 2va8 h GLU 375 Ca 0.33 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 58.35 2va8 h GLU 375 Cb 0.18 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 2va8 h GLU 375 CO -0.18 0.69 0.14 -0.92 -1.18 0.00 0.00 179.01 177.56 2va8 h TYR 376 N 0.71 0.38 -0.79 0.92 5.03 -0.65 -0.84 116.97 121.74 2va8 h TYR 376 Ca 0.16 -0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.41 2va8 h TYR 376 Cb 0.30 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.42 2va8 h TYR 376 CO 0.02 0.33 0.31 0.87 -1.32 0.00 0.00 178.16 178.37 2va8 h LYS 377 N 0.32 1.18 -0.18 1.82 1.79 -0.31 0.62 116.57 121.81 2va8 h LYS 377 Ca 0.10 -0.22 -0.15 0.00 -2.18 0.00 0.00 60.65 58.20 2va8 h LYS 377 Cb 0.08 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.53 2va8 h LYS 377 CO -0.01 0.96 -0.51 1.96 -1.08 0.00 0.00 179.45 180.76 2va8 h GLN 378 N 1.15 0.50 -0.11 3.15 4.20 -0.71 -0.82 115.11 122.46 2va8 h GLN 378 Ca 0.26 -0.30 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 2va8 h GLN 378 Cb 0.23 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 2va8 h GLN 378 CO -0.02 0.89 -0.15 0.52 -0.67 0.00 0.00 178.83 179.40 2va8 h MET 379 N 0.39 0.30 -0.21 1.46 2.86 -0.89 -3.32 114.93 115.51 2va8 h MET 379 Ca 0.01 -0.17 -0.11 0.00 -2.06 0.00 0.00 59.70 57.37 2va8 h MET 379 Cb 1.03 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.69 2va8 h MET 379 CO 0.09 0.74 -0.35 0.66 1.06 0.00 0.00 176.91 179.12 2va8 h SER 380 N -0.13 0.46 0.25 1.22 4.64 -0.83 -2.81 113.55 116.34 2va8 h SER 380 Ca 0.01 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2va8 h SER 380 Cb 0.71 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 2va8 h SER 380 CO 0.04 0.77 0.00 0.61 -0.87 0.00 0.00 176.83 177.38 2va8 n GLY 381 N -0.20 -0.70 0.05 -0.77 0.00 -0.32 -1.29 105.19 101.95 2va8 n GLY 381 Ca -0.01 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.10 2va8 n GLY 381 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2va8 n ARG 382 N -1.34 0.42 -2.37 1.61 1.74 -1.06 -4.75 116.66 110.91 2va8 n ARG 382 Ca 0.04 -0.10 -0.42 0.00 -0.77 0.00 0.00 57.85 56.61 2va8 n ARG 382 Cb 0.10 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 2va8 n ARG 382 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2va8 s ALA 383 N -2.64 2.84 0.00 7.54 0.00 -0.41 -0.81 121.76 128.27 2va8 s ALA 383 Ca 0.25 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2va8 s ALA 383 Cb 0.20 -4.08 0.00 0.00 0.00 0.00 0.00 23.12 19.24 2va8 s ALA 383 CO 0.50 -2.85 0.00 0.41 0.00 0.00 0.00 175.76 173.82 2va8 n GLY 384 N 5.24 2.77 3.57 0.00 0.00 0.18 -4.41 105.19 112.55 2va8 n GLY 384 Ca 0.14 -0.67 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 2va8 n GLY 384 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2va8 s ARG 385 N -2.21 3.65 0.32 1.61 0.52 -1.24 -4.73 118.95 116.87 2va8 s ARG 385 Ca 0.00 0.22 0.10 0.00 -0.52 0.00 0.00 55.73 55.54 2va8 s ARG 385 Cb 0.00 -3.86 0.95 0.00 0.52 0.00 0.00 34.95 32.56 2va8 s ARG 385 CO 0.00 -0.99 1.67 -1.35 0.02 0.00 0.00 175.30 174.65 2va8 h PRO 386 N 8.70 0.32 -0.24 3.54 0.11 -1.92 0.78 132.00 143.29 2va8 h PRO 386 Ca -0.24 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2va8 h PRO 386 Cb 1.09 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2va8 h PRO 386 CO 0.95 0.21 0.00 0.41 -0.21 0.00 0.00 178.00 179.36 2va8 n GLY 387 N -1.32 3.08 1.43 -0.55 0.00 -1.26 -4.78 105.19 101.79 2va8 n GLY 387 Ca 0.28 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2va8 n GLY 387 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2va8 n PHE 388 N 0.07 -0.15 -3.21 1.61 -0.00 -0.61 -5.08 117.46 110.08 2va8 n PHE 388 Ca 0.10 0.03 -0.31 0.00 -0.00 0.00 0.00 57.45 57.27 2va8 n PHE 388 Cb 0.46 0.22 -0.04 0.00 -0.00 0.00 0.00 39.48 40.11 2va8 n PHE 388 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2va8 s ASP 389 N -5.07 6.58 -0.00 -2.13 -0.00 0.17 -4.99 116.67 111.22 2va8 s ASP 389 Ca 0.00 0.98 0.17 0.00 -0.00 0.00 0.00 52.55 53.70 2va8 s ASP 389 Cb 0.00 -2.25 -0.18 0.00 -0.00 0.00 0.00 42.92 40.48 2va8 s ASP 389 CO 0.00 -0.20 0.65 0.00 -0.00 0.00 0.00 175.17 175.62 2va8 n GLN 390 N -0.65 0.64 -3.66 8.23 1.13 -1.26 -4.78 117.38 117.02 2va8 n GLN 390 Ca 0.01 0.16 -0.15 0.00 -1.94 0.00 0.00 57.00 55.08 2va8 n GLN 390 Cb 0.53 -1.74 -0.08 0.00 0.11 0.00 0.00 30.24 29.07 2va8 n GLN 390 CO 0.00 0.00 0.00 -1.50 -1.44 0.00 0.00 177.06 174.12 2va8 s ILE 391 N -2.86 0.01 0.19 5.09 2.07 -1.26 -4.33 121.20 120.11 2va8 s ILE 391 Ca -0.05 -0.12 0.08 0.00 -1.41 0.00 0.00 60.65 59.15 2va8 s ILE 391 Cb 0.09 -0.78 -0.04 0.00 0.13 0.00 0.00 42.46 41.85 2va8 s ILE 391 CO 0.82 -0.07 -0.00 -0.83 -1.91 0.00 0.00 174.94 172.96 2va8 s GLY 392 N -0.51 1.71 -0.04 1.50 0.00 -0.21 -4.81 107.32 104.95 2va8 s GLY 392 Ca -0.06 -1.41 0.01 0.00 0.00 0.00 0.00 44.72 43.26 2va8 s GLY 392 CO 0.04 -1.43 -0.04 -1.83 0.00 0.00 0.00 173.10 169.84 2va8 s GLU 393 N -3.05 0.73 -0.06 2.90 -1.05 -0.71 -1.40 118.70 116.07 2va8 s GLU 393 Ca 0.28 -0.10 0.03 0.00 -0.15 0.00 0.00 54.97 55.02 2va8 s GLU 393 Cb -0.09 -0.75 -0.03 0.00 -0.44 0.00 0.00 34.13 32.83 2va8 s GLU 393 CO 0.19 -0.06 -0.12 -1.54 0.95 0.00 0.00 175.26 174.67 2va8 s SER 394 N 0.79 4.18 -0.02 0.83 1.04 -0.89 -0.64 113.70 118.99 2va8 s SER 394 Ca -0.10 -0.17 0.04 0.00 0.48 0.00 0.00 55.95 56.20 2va8 s SER 394 Cb -0.13 -1.00 -0.01 0.00 0.10 0.00 0.00 66.02 64.98 2va8 s SER 394 CO 0.00 0.33 -0.13 0.27 0.98 0.00 0.00 173.24 174.69 2va8 s ILE 395 N -0.63 1.03 -0.22 -1.02 -4.36 -0.09 0.01 121.20 115.92 2va8 s ILE 395 Ca 0.09 -0.54 -0.10 0.00 -0.26 0.00 0.00 60.65 59.84 2va8 s ILE 395 Cb -0.11 -0.87 -0.05 0.00 1.25 0.00 0.00 42.46 42.67 2va8 s ILE 395 CO 0.01 0.30 0.15 -0.69 0.24 0.00 0.00 174.94 174.94 2va8 s VAL 396 N -0.18 5.38 -0.03 8.37 1.01 -0.39 -0.41 120.40 134.15 2va8 s VAL 396 Ca 0.03 0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.89 2va8 s VAL 396 Cb -0.06 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 2va8 s VAL 396 CO -0.00 0.39 1.04 -0.69 0.00 0.00 0.00 175.10 175.84 2va8 s VAL 397 N 0.71 4.67 0.20 2.92 1.01 -0.07 -1.74 120.40 128.10 2va8 s VAL 397 Ca 0.08 1.93 0.09 0.00 0.00 0.00 0.00 61.98 64.08 2va8 s VAL 397 Cb -0.12 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 2va8 s VAL 397 CO 0.01 0.09 -0.18 0.68 0.00 0.00 0.00 175.10 175.71 2va8 s VAL 398 N 1.46 1.94 -0.50 2.92 -7.23 -0.69 -4.64 120.40 113.66 2va8 s VAL 398 Ca 0.52 -2.11 0.24 0.00 -1.81 0.00 0.00 61.98 58.81 2va8 s VAL 398 Cb -0.22 -2.01 0.06 0.00 0.56 0.00 0.00 36.38 34.78 2va8 s VAL 398 CO 0.24 -0.42 1.26 0.03 -0.31 0.00 0.00 175.10 175.91 2va8 h ARG 399 N 2.83 0.00 -2.19 4.82 3.08 -1.97 -3.40 114.38 117.56 2va8 h ARG 399 Ca -0.41 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.59 2va8 h ARG 399 Cb 1.22 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 31.09 2va8 h ARG 399 CO 0.56 0.00 0.17 0.16 -1.07 0.00 0.00 179.97 179.79 2va8 s ASP 400 N -4.76 -0.62 0.34 7.04 -4.77 -1.26 -4.68 116.67 107.96 2va8 s ASP 400 Ca 0.04 0.59 0.14 0.00 -3.30 0.00 0.00 52.55 50.02 2va8 s ASP 400 Cb 0.11 0.54 1.06 0.00 -1.09 0.00 0.00 42.92 43.54 2va8 s ASP 400 CO 0.74 -0.65 1.67 0.50 0.70 0.00 0.00 175.17 178.13 2va8 h LYS 401 N 2.91 0.35 -1.10 2.11 3.64 -1.92 -0.79 116.57 121.77 2va8 h LYS 401 Ca -0.28 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 2va8 h LYS 401 Cb 1.16 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 2va8 h LYS 401 CO 0.39 0.23 0.00 0.39 -2.27 0.00 0.00 179.45 178.19 2va8 n GLU 402 N -5.03 0.85 0.00 1.90 1.02 -1.26 -2.20 120.64 115.92 2va8 n GLU 402 Ca 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.45 2va8 n GLU 402 Cb 0.95 -1.14 0.00 0.00 -0.02 0.00 0.00 31.44 31.23 2va8 n GLU 402 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2va8 n ASP 403 N 0.49 0.02 -0.15 1.62 2.03 -0.30 -4.87 116.55 115.40 2va8 n ASP 403 Ca 0.00 -0.59 -0.10 0.00 0.52 0.00 0.00 54.79 54.62 2va8 n ASP 403 Cb 0.39 0.02 -0.01 0.00 -0.72 0.00 0.00 41.12 40.79 2va8 n ASP 403 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2va8 h VAL 404 N 0.56 1.25 -0.87 5.18 2.07 -1.53 -2.94 116.25 119.98 2va8 h VAL 404 Ca 0.00 -0.97 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 2va8 h VAL 404 Cb 0.28 1.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2va8 h VAL 404 CO 0.00 0.33 0.46 -0.78 0.02 0.00 0.00 177.57 177.60 2va8 h ASP 405 N 0.58 1.09 0.27 0.57 3.58 -1.89 -2.39 116.42 118.22 2va8 h ASP 405 Ca 0.12 -0.11 -0.10 0.00 0.42 0.00 0.00 57.03 57.36 2va8 h ASP 405 Cb 0.44 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 2va8 h ASP 405 CO 0.02 0.89 -0.41 -0.09 -2.88 0.00 0.00 179.24 176.76 2va8 h ARG 406 N 1.21 0.19 0.13 0.28 2.43 -1.89 -1.95 114.38 114.78 2va8 h ARG 406 Ca 0.30 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 2va8 h ARG 406 Cb 0.05 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 2va8 h ARG 406 CO -0.05 0.58 -0.06 0.28 -1.51 0.00 0.00 179.97 179.21 2va8 h VAL 407 N 0.16 1.05 -0.22 0.20 2.07 -1.32 -2.17 116.25 116.02 2va8 h VAL 407 Ca 0.01 -0.82 0.05 0.00 0.82 0.00 0.00 66.70 66.77 2va8 h VAL 407 Cb 0.80 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 32.07 2va8 h VAL 407 CO 0.06 0.19 -0.08 -0.26 0.02 0.00 0.00 177.57 177.50 2va8 h PHE 408 N -0.56 -0.20 -0.66 1.57 0.04 -1.39 0.24 116.94 115.99 2va8 h PHE 408 Ca -0.02 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 2va8 h PHE 408 Cb 0.44 0.12 -0.03 0.00 2.20 0.00 0.00 35.95 38.68 2va8 h PHE 408 CO 0.05 -0.14 0.35 -0.22 -0.60 0.00 0.00 178.31 177.75 2va8 h LYS 409 N -0.05 0.93 0.17 1.51 1.63 -1.42 0.44 116.57 119.79 2va8 h LYS 409 Ca 0.11 -0.12 -0.28 0.00 -0.85 0.00 0.00 60.65 59.52 2va8 h LYS 409 Cb 0.22 -0.18 0.02 0.00 -0.60 0.00 0.00 32.23 31.69 2va8 h LYS 409 CO -0.26 0.71 -1.30 -0.22 -3.45 0.00 0.00 179.45 174.93 2va8 h LYS 410 N 0.91 0.37 0.00 1.90 3.64 -1.11 -3.28 116.57 118.99 2va8 h LYS 410 Ca 0.23 -0.63 -0.36 0.00 -1.27 0.00 0.00 60.65 58.62 2va8 h LYS 410 Cb 0.06 0.23 -0.06 0.00 -0.41 0.00 0.00 32.23 32.06 2va8 h LYS 410 CO -0.03 1.30 -2.24 0.66 -2.27 0.00 0.00 179.45 176.86 2va8 n TYR 411 N -3.88 0.00 -0.03 1.91 4.02 0.84 -4.43 117.16 115.58 2va8 n TYR 411 Ca -0.19 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.54 2va8 n TYR 411 Cb 0.96 -0.81 -0.12 0.00 -0.02 0.00 0.00 39.34 39.35 2va8 n TYR 411 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2va8 h VAL 412 N -0.60 1.64 -0.00 -0.72 2.07 -1.19 -3.37 116.25 114.08 2va8 h VAL 412 Ca -0.54 -2.14 0.00 0.00 0.82 0.00 0.00 66.70 64.84 2va8 h VAL 412 Cb 1.56 3.05 0.00 0.00 -1.52 0.00 0.00 31.29 34.38 2va8 h VAL 412 CO -0.28 0.57 -0.65 0.18 0.02 0.00 0.00 177.57 177.42 2va8 n LEU 413 N -4.52 0.75 -4.77 2.57 4.77 0.14 -4.96 117.00 110.99 2va8 n LEU 413 Ca -0.10 -0.21 -0.22 0.00 -0.03 0.00 0.00 56.01 55.45 2va8 n LEU 413 Cb 0.52 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.41 2va8 n LEU 413 CO 0.38 0.18 -0.22 -0.94 -1.33 0.00 0.00 177.39 175.46 2va8 s SER 414 N -2.95 5.21 0.56 -1.43 1.04 -1.24 -5.05 113.70 109.84 2va8 s SER 414 Ca 0.11 -0.38 -0.07 0.00 0.48 0.00 0.00 55.95 56.09 2va8 s SER 414 Cb 0.17 -1.22 -0.03 0.00 0.10 0.00 0.00 66.02 65.04 2va8 s SER 414 CO 0.74 -0.03 0.90 1.51 0.98 0.00 0.00 173.24 177.34 2va8 s ASP 415 N -3.79 6.07 0.95 7.02 1.47 -1.26 -4.87 116.67 122.27 2va8 s ASP 415 Ca 0.32 1.04 -0.11 0.00 1.18 0.00 0.00 52.55 54.99 2va8 s ASP 415 Cb -0.07 -2.19 0.16 0.00 -0.34 0.00 0.00 42.92 40.47 2va8 s ASP 415 CO 0.23 -0.80 1.08 1.33 0.68 0.00 0.00 175.17 177.69 2va8 n VAL 416 N -2.51 0.00 -1.87 2.11 0.24 -1.26 -4.96 118.33 110.07 2va8 n VAL 416 Ca 0.03 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.34 61.86 2va8 n VAL 416 Cb 0.55 -0.97 -0.01 0.00 -1.47 0.00 0.00 33.84 31.94 2va8 n VAL 416 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2va8 s GLU 417 N -4.55 4.17 0.68 7.34 8.01 -1.26 -4.60 118.70 128.49 2va8 s GLU 417 Ca 0.67 2.48 -0.17 0.00 0.01 0.00 0.00 54.97 57.96 2va8 s GLU 417 Cb -0.23 -3.01 -0.01 0.00 -4.31 0.00 0.00 34.13 26.57 2va8 s GLU 417 CO 0.59 -0.48 1.08 -2.30 0.01 0.00 0.00 175.26 174.16 2va8 n PRO 418 N 1.08 0.76 -2.50 0.39 -0.02 -1.26 -4.64 135.00 128.80 2va8 n PRO 418 Ca 0.03 0.31 -0.42 0.00 -2.02 0.00 0.00 63.50 61.41 2va8 n PRO 418 Cb 0.39 -2.31 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 2va8 n PRO 418 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2va8 s ILE 419 N -1.63 4.06 -0.02 4.25 1.01 -1.26 -5.01 121.20 122.60 2va8 s ILE 419 Ca 0.77 1.61 -0.04 0.00 0.00 0.00 0.00 60.65 62.99 2va8 s ILE 419 Cb -0.37 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.07 2va8 s ILE 419 CO 0.46 0.20 0.09 -1.83 0.00 0.00 0.00 174.94 173.86 2va8 s GLU 420 N 0.37 0.24 0.57 2.79 -1.05 -1.26 -5.00 118.70 115.36 2va8 s GLU 420 Ca 0.53 -0.10 -0.21 0.00 -0.15 0.00 0.00 54.97 55.05 2va8 s GLU 420 Cb -0.28 0.10 -0.04 0.00 -0.44 0.00 0.00 34.13 33.47 2va8 s GLU 420 CO 0.32 -0.04 1.28 0.45 0.95 0.00 0.00 175.26 178.22 2va8 n SER 421 N 2.43 2.27 -0.59 0.83 2.88 -1.26 -4.60 113.62 115.59 2va8 n SER 421 Ca -0.17 0.93 0.05 0.00 -1.33 0.00 0.00 58.87 58.36 2va8 n SER 421 Cb 0.58 -1.54 0.13 0.00 -0.75 0.00 0.00 64.21 62.62 2va8 n SER 421 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2va8 n LYS 422 N -1.14 2.33 0.00 -1.46 4.76 -1.26 -4.44 118.16 116.95 2va8 n LYS 422 Ca 0.12 -1.84 0.05 0.00 -2.87 0.00 0.00 58.31 53.77 2va8 n LYS 422 Cb 0.45 -1.25 0.22 0.00 -1.84 0.00 0.00 35.03 32.61 2va8 n LYS 422 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2va8 n LEU 423 N 0.53 0.00 -2.47 -0.35 4.77 -1.26 -4.30 117.00 113.92 2va8 n LEU 423 Ca 0.10 0.42 -0.21 0.00 -0.03 0.00 0.00 56.01 56.29 2va8 n LEU 423 Cb 0.39 -0.42 -0.12 0.00 -2.33 0.00 0.00 43.42 40.94 2va8 n LEU 423 CO 0.08 -0.29 2.23 0.61 -1.33 0.00 0.00 177.39 178.69 2va8 n GLY 424 N -0.50 3.40 3.29 -0.72 0.00 -1.26 -4.07 105.19 105.33 2va8 n GLY 424 Ca 0.03 -1.29 -0.09 0.00 0.00 0.00 0.00 46.02 44.67 2va8 n GLY 424 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2va8 s SER 425 N 2.09 0.08 0.18 1.61 1.04 -1.26 -5.06 113.70 112.39 2va8 s SER 425 Ca 0.67 -0.83 -0.00 0.00 0.48 0.00 0.00 55.95 56.27 2va8 s SER 425 Cb 0.26 0.40 0.08 0.00 0.10 0.00 0.00 66.02 66.86 2va8 s SER 425 CO -0.02 -0.83 1.44 -0.33 0.98 0.00 0.00 173.24 174.48 2va8 h GLU 426 N 2.63 0.36 0.00 4.02 5.08 -1.97 -1.74 114.58 122.96 2va8 h GLU 426 Ca -0.33 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 57.74 2va8 h GLU 426 Cb 1.22 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2va8 h GLU 426 CO 0.51 0.94 0.00 -2.13 -1.00 0.00 0.00 179.01 177.33 2va8 n ARG 427 N -3.82 0.00 -0.33 2.33 0.63 -1.26 -2.33 116.66 111.88 2va8 n ARG 427 Ca -0.04 0.33 0.21 0.00 -0.92 0.00 0.00 57.85 57.43 2va8 n ARG 427 Cb 0.71 -1.31 0.40 0.00 0.45 0.00 0.00 32.46 32.71 2va8 n ARG 427 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2va8 h ALA 428 N -2.00 1.57 -0.01 5.13 0.00 -1.87 -2.26 119.26 119.83 2va8 h ALA 428 Ca 0.00 0.29 -0.23 0.00 0.00 0.00 0.00 54.91 54.97 2va8 h ALA 428 Cb 0.00 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2va8 h ALA 428 CO 0.00 -0.68 -0.94 0.35 0.00 0.00 0.00 179.25 177.98 2va8 h PHE 429 N 0.06 0.68 -0.64 0.00 3.04 -1.34 -1.01 116.94 117.72 2va8 h PHE 429 Ca 0.68 -0.36 -0.07 0.00 3.98 0.00 0.00 57.97 62.20 2va8 h PHE 429 Cb 1.58 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 39.99 2va8 h PHE 429 CO -0.27 1.18 0.11 1.88 -2.02 0.00 0.00 178.31 179.19 2va8 h TYR 430 N 0.26 1.11 -0.36 0.41 -1.99 -1.01 -1.94 116.97 113.45 2va8 h TYR 430 Ca -0.08 -0.14 -0.10 0.00 2.00 0.00 0.00 58.73 60.41 2va8 h TYR 430 Cb 1.57 -0.31 -0.01 0.00 2.00 0.00 0.00 36.73 39.99 2va8 h TYR 430 CO 0.07 0.93 -0.15 1.15 -0.00 0.00 0.00 178.16 180.16 2va8 h THR 431 N 0.99 1.28 -0.22 -2.88 2.02 -1.46 -2.16 112.91 110.48 2va8 h THR 431 Ca 0.20 -1.26 0.00 0.00 0.77 0.00 0.00 66.41 66.12 2va8 h THR 431 Cb 0.42 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 2va8 h THR 431 CO 0.01 0.41 0.14 0.15 0.37 0.00 0.00 175.52 176.60 2va8 h PHE 432 N 0.53 0.26 -0.19 3.16 -0.00 -1.01 -1.05 116.94 118.65 2va8 h PHE 432 Ca 0.08 0.01 -0.14 0.00 -0.00 0.00 0.00 57.97 57.92 2va8 h PHE 432 Cb 0.68 -0.09 -0.01 0.00 -0.00 0.00 0.00 35.95 36.54 2va8 h PHE 432 CO 0.06 0.16 -0.46 -0.07 -0.00 0.00 0.00 178.31 177.99 2va8 h LEU 433 N 0.28 0.52 -0.57 0.59 3.38 -1.38 -2.03 115.31 116.10 2va8 h LEU 433 Ca 0.08 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 2va8 h LEU 433 Cb -0.02 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2va8 h LEU 433 CO -0.02 0.91 0.29 0.25 0.09 0.00 0.00 178.44 179.95 2va8 h LEU 434 N 0.39 0.74 -0.32 1.67 5.85 -1.18 -2.41 115.31 120.05 2va8 h LEU 434 Ca 0.02 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.63 2va8 h LEU 434 Cb 0.96 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 2va8 h LEU 434 CO 0.08 0.64 0.21 1.23 -0.34 0.00 0.00 178.44 180.26 2va8 h GLY 435 N 0.78 0.44 0.49 3.75 0.00 -1.01 -1.79 103.07 105.72 2va8 h GLY 435 Ca 0.20 -0.17 0.08 0.00 0.00 0.00 0.00 47.33 47.44 2va8 h GLY 435 CO -0.03 0.16 0.24 -2.22 0.00 0.00 0.00 176.54 174.69 2va8 h ILE 436 N 0.43 0.82 -0.40 2.60 2.04 -1.25 -0.19 117.51 121.56 2va8 h ILE 436 Ca 0.12 -0.15 -0.10 0.00 1.00 0.00 0.00 64.86 65.73 2va8 h ILE 436 Cb -0.05 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 2va8 h ILE 436 CO -0.02 0.08 -0.15 -0.07 0.00 0.00 0.00 178.15 177.99 2va8 h LEU 437 N 0.43 0.72 -0.75 1.44 3.38 -1.28 0.17 115.31 119.43 2va8 h LEU 437 Ca 0.28 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 2va8 h LEU 437 Cb 0.31 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2va8 h LEU 437 CO -0.26 0.88 -0.08 -1.28 0.09 0.00 0.00 178.44 177.79 2va8 h SER 438 N 0.65 0.86 0.48 -0.43 0.87 -0.84 -1.04 113.55 114.10 2va8 h SER 438 Ca 0.11 -0.25 -0.30 0.00 -1.23 0.00 0.00 61.79 60.11 2va8 h SER 438 Cb 0.62 -0.23 0.02 0.00 -0.44 0.00 0.00 62.40 62.36 2va8 h SER 438 CO 0.04 0.97 -1.37 0.00 -0.53 0.00 0.00 176.83 175.94 2va8 h ALA 439 N 1.11 0.01 0.00 6.23 0.00 -0.75 -3.38 119.26 122.50 2va8 h ALA 439 Ca 0.13 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.14 2va8 h ALA 439 Cb 0.59 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2va8 h ALA 439 CO 0.04 0.89 -1.82 0.39 0.00 0.00 0.00 179.25 178.74 2va8 n GLU 440 N -3.59 0.58 0.00 0.00 -0.58 0.57 -4.94 120.64 112.67 2va8 n GLU 440 Ca -0.12 -0.16 0.00 0.00 -0.42 0.00 0.00 57.16 56.46 2va8 n GLU 440 Cb 1.06 -1.53 0.00 0.00 -0.57 0.00 0.00 31.44 30.39 2va8 n GLU 440 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2va8 n GLY 441 N 1.28 -1.56 3.74 0.62 0.00 -0.39 -4.91 105.19 103.96 2va8 n GLY 441 Ca -0.03 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 2va8 n GLY 441 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2va8 s ASN 442 N -4.00 6.59 0.01 1.61 -0.87 -1.26 -4.69 114.94 112.32 2va8 s ASN 442 Ca 0.00 2.69 -0.00 0.00 -1.57 0.00 0.00 52.86 53.98 2va8 s ASN 442 Cb 0.00 -2.61 -0.01 0.00 -0.02 0.00 0.00 41.25 38.60 2va8 s ASN 442 CO 0.00 -0.77 -0.01 -0.76 -2.57 0.00 0.00 177.10 172.99 2va8 s LEU 443 N 0.11 2.10 0.80 0.60 1.43 -0.86 -4.92 118.68 117.95 2va8 s LEU 443 Ca 0.63 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 53.37 2va8 s LEU 443 Cb -0.43 0.08 0.07 0.00 0.03 0.00 0.00 46.19 45.94 2va8 s LEU 443 CO 0.40 -0.17 1.09 -0.94 0.23 0.00 0.00 176.35 176.96 2va8 s SER 444 N -0.79 4.31 0.16 2.29 1.04 -1.26 0.96 113.70 120.42 2va8 s SER 444 Ca -0.09 1.63 -0.22 0.00 0.48 0.00 0.00 55.95 57.74 2va8 s SER 444 Cb -0.05 -2.35 0.05 0.00 0.10 0.00 0.00 66.02 63.77 2va8 s SER 444 CO -0.00 -2.13 1.61 -0.08 0.98 0.00 0.00 173.24 173.62 2va8 h GLU 445 N -1.19 -0.24 -0.65 4.02 4.81 -1.95 -0.77 114.58 118.60 2va8 h GLU 445 Ca -0.46 0.02 0.10 0.00 -0.13 0.00 0.00 59.36 58.89 2va8 h GLU 445 Cb 1.25 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.61 2va8 h GLU 445 CO 0.54 -0.16 0.27 -0.22 -0.73 0.00 0.00 179.01 178.71 2va8 h LYS 446 N -0.25 0.45 -0.45 1.92 3.64 -1.92 -0.25 116.57 119.70 2va8 h LYS 446 Ca 0.16 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.42 2va8 h LYS 446 Cb 0.51 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2va8 h LYS 446 CO -0.47 0.30 -0.09 1.96 -2.27 0.00 0.00 179.45 178.87 2va8 h GLN 447 N 0.46 0.86 -0.37 1.90 4.20 -1.79 -1.51 115.11 118.85 2va8 h GLN 447 Ca 0.33 -0.32 -0.06 0.00 0.06 0.00 0.00 58.65 58.66 2va8 h GLN 447 Cb 0.41 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 2va8 h GLN 447 CO -0.31 0.95 -0.00 1.25 -0.67 0.00 0.00 178.83 180.05 2va8 h LEU 448 N 0.69 0.64 -0.31 1.46 5.85 -0.80 -2.39 115.31 120.45 2va8 h LEU 448 Ca 0.12 -0.31 0.02 0.00 0.84 0.00 0.00 57.88 58.55 2va8 h LEU 448 Cb 0.63 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2va8 h LEU 448 CO 0.04 0.80 0.16 -0.08 -0.34 0.00 0.00 178.44 179.02 2va8 h GLU 449 N 0.47 0.32 -1.00 1.25 4.81 -1.03 -1.62 114.58 117.79 2va8 h GLU 449 Ca 0.10 -0.02 0.14 0.00 -0.13 0.00 0.00 59.36 59.46 2va8 h GLU 449 Cb 0.47 -0.07 -0.09 0.00 0.63 0.00 0.00 28.75 29.69 2va8 h GLU 449 CO 0.02 0.21 0.63 -0.91 -0.73 0.00 0.00 179.01 178.23 2va8 h ASN 450 N 0.33 0.88 -0.62 1.04 2.35 -1.08 -0.67 115.58 117.81 2va8 h ASN 450 Ca 0.13 0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.88 2va8 h ASN 450 Cb 0.03 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 2va8 h ASN 450 CO -0.08 0.43 0.17 -0.26 -1.65 0.00 0.00 177.43 176.04 2va8 h PHE 451 N 0.92 1.02 0.00 1.19 -1.00 -0.92 -3.05 116.94 115.10 2va8 h PHE 451 Ca 0.52 -0.11 -0.04 0.00 2.81 0.00 0.00 57.97 61.15 2va8 h PHE 451 Cb 0.61 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 39.88 2va8 h PHE 451 CO -0.00 0.85 -0.19 0.00 -1.61 0.00 0.00 178.31 177.36 2va8 h ALA 452 N 1.06 1.65 0.00 2.45 0.00 -0.23 -1.78 119.26 122.41 2va8 h ALA 452 Ca 0.20 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2va8 h ALA 452 Cb 0.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2va8 h ALA 452 CO -0.00 0.24 0.00 1.88 0.00 0.00 0.00 179.25 181.37 2va8 h TYR 453 N 0.00 0.00 0.00 0.00 0.05 -1.10 -2.66 116.97 113.26 2va8 h TYR 453 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2va8 h TYR 453 Cb 0.34 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.08 2va8 h TYR 453 CO 0.00 0.00 0.00 0.93 -1.05 0.00 0.00 178.16 178.04 2va8 h GLU 454 N 0.00 0.00 -6.92 4.88 4.39 -1.30 -3.44 114.58 112.18 2va8 h GLU 454 Ca 0.00 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.15 2va8 h GLU 454 Cb 0.59 0.00 0.18 0.00 -0.10 0.00 0.00 28.75 29.42 2va8 h GLU 454 CO 0.00 0.00 -0.01 0.45 -1.16 0.00 0.00 179.01 178.29 2va8 n SER 455 N -3.04 0.06 0.02 1.42 2.88 -1.01 -4.92 113.62 109.04 2va8 n SER 455 Ca -0.02 0.62 0.11 0.00 -1.33 0.00 0.00 58.87 58.25 2va8 n SER 455 Cb 0.11 -1.37 0.48 0.00 -0.75 0.00 0.00 64.21 62.68 2va8 n SER 455 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 2va8 n LEU 456 N -1.63 0.15 -4.74 2.46 7.94 -1.26 -4.83 117.00 115.09 2va8 n LEU 456 Ca 0.12 0.52 -0.41 0.00 -1.11 0.00 0.00 56.01 55.13 2va8 n LEU 456 Cb 0.50 -0.49 -0.03 0.00 0.53 0.00 0.00 43.42 43.94 2va8 n LEU 456 CO 0.49 -0.15 1.06 -0.22 -1.11 0.00 0.00 177.39 177.46 2va8 s LEU 457 N -3.30 4.40 0.19 -1.96 2.96 -1.26 -4.58 118.68 115.13 2va8 s LEU 457 Ca 0.10 2.55 -0.32 0.00 -0.22 0.00 0.00 54.13 56.24 2va8 s LEU 457 Cb 0.14 -3.62 -0.15 0.00 0.50 0.00 0.00 46.19 43.07 2va8 s LEU 457 CO 0.44 -0.63 1.30 0.00 -1.32 0.00 0.00 176.35 176.14 2va8 n ALA 458 N 2.52 0.12 -0.33 5.97 0.00 -1.26 -4.73 120.51 122.80 2va8 n ALA 458 Ca 0.07 0.44 0.21 0.00 0.00 0.00 0.00 53.44 54.16 2va8 n ALA 458 Cb 0.41 -2.15 0.43 0.00 0.00 0.00 0.00 19.45 18.14 2va8 n ALA 458 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2va8 h LYS 459 N 3.97 0.37 -0.38 0.00 1.57 -1.94 -0.10 116.57 120.06 2va8 h LYS 459 Ca -0.44 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.28 2va8 h LYS 459 Cb 1.31 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.52 2va8 h LYS 459 CO 0.74 0.24 0.09 0.37 -0.57 0.00 0.00 179.45 180.33 2va8 h GLN 460 N 0.38 0.56 0.15 3.15 4.15 -2.00 -0.74 115.11 120.76 2va8 h GLN 460 Ca 0.69 -0.09 -0.30 0.00 0.77 0.00 0.00 58.65 59.72 2va8 h GLN 460 Cb 1.49 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 29.09 2va8 h GLN 460 CO -0.58 0.51 -1.44 -0.07 -1.93 0.00 0.00 178.83 175.33 2va8 h LEU 461 N 0.55 0.50 -0.52 -2.39 3.38 -1.43 -3.16 115.31 112.24 2va8 h LEU 461 Ca 0.13 -0.60 0.08 0.00 0.09 0.00 0.00 57.88 57.58 2va8 h LEU 461 Cb 0.21 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.73 2va8 h LEU 461 CO -0.00 1.49 0.15 0.58 0.09 0.00 0.00 178.44 180.74 2va8 h VAL 462 N 0.09 0.76 -0.14 1.22 2.07 -0.78 -2.24 116.25 117.22 2va8 h VAL 462 Ca -0.21 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 2va8 h VAL 462 Cb 2.04 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.23 2va8 h VAL 462 CO 0.20 0.05 -0.04 0.44 0.02 0.00 0.00 177.57 178.24 2va8 h ASP 463 N 0.30 0.18 -0.32 0.57 3.32 -1.21 0.18 116.42 119.45 2va8 h ASP 463 Ca 0.26 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.20 2va8 h ASP 463 Cb 0.32 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2va8 h ASP 463 CO -0.30 0.26 -0.13 0.58 -1.72 0.00 0.00 179.24 177.92 2va8 h VAL 464 N 0.20 1.29 0.00 -1.35 2.07 -1.38 -3.34 116.25 113.74 2va8 h VAL 464 Ca 0.05 -1.22 -0.22 0.00 0.82 0.00 0.00 66.70 66.12 2va8 h VAL 464 Cb 0.20 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 2va8 h VAL 464 CO 0.01 0.40 -1.38 1.88 0.02 0.00 0.00 177.57 178.50 2va8 h TYR 465 N 0.42 0.00 0.61 1.57 0.05 -1.03 -3.36 116.97 115.22 2va8 h TYR 465 Ca 0.07 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.83 2va8 h TYR 465 Cb 0.65 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.39 2va8 h TYR 465 CO 0.06 0.82 -0.41 0.35 -1.05 0.00 0.00 178.16 177.94 2va8 h PHE 466 N 0.00 -1.09 -0.55 4.88 3.04 -0.77 -0.09 116.94 122.36 2va8 h PHE 466 Ca -0.17 -0.01 -0.10 0.00 3.98 0.00 0.00 57.97 61.67 2va8 h PHE 466 Cb 1.78 0.40 -0.02 0.00 2.56 0.00 0.00 35.95 40.67 2va8 h PHE 466 CO 0.00 -0.59 -0.03 -0.44 -2.02 0.00 0.00 178.31 175.23 2va8 h ASP 467 N -0.96 0.99 -0.94 0.41 3.32 -1.80 -0.88 116.42 116.56 2va8 h ASP 467 Ca -0.08 -0.32 0.19 0.00 0.02 0.00 0.00 57.03 56.84 2va8 h ASP 467 Cb 0.78 -0.27 -0.18 0.00 0.22 0.00 0.00 39.33 39.88 2va8 h ASP 467 CO 0.06 1.07 -0.22 0.03 -1.72 0.00 0.00 179.24 178.46 2va8 h ARG 468 N 0.88 0.00 -0.15 3.56 3.08 -1.70 -2.38 114.38 117.67 2va8 h ARG 468 Ca 0.15 -0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.10 2va8 h ARG 468 Cb 0.58 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2va8 h ARG 468 CO 0.03 0.00 -0.29 0.00 -1.07 0.00 0.00 179.97 178.65 2va8 h ALA 469 N 1.94 0.23 -0.25 0.04 0.00 -0.06 -2.91 119.26 118.26 2va8 h ALA 469 Ca 0.46 -0.41 0.06 0.00 0.00 0.00 0.00 54.91 55.03 2va8 h ALA 469 Cb 0.72 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 2va8 h ALA 469 CO -0.96 0.25 -0.29 0.82 0.00 0.00 0.00 179.25 179.06 2va8 h ILE 470 N 0.07 0.31 -0.35 0.00 1.08 -0.92 -0.98 117.51 116.72 2va8 h ILE 470 Ca 0.01 0.00 -0.12 0.00 -0.39 0.00 0.00 64.86 64.35 2va8 h ILE 470 Cb 0.88 0.31 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 2va8 h ILE 470 CO 0.06 0.00 -0.28 0.08 -0.69 0.00 0.00 178.15 177.32 2va8 h ARG 471 N -0.30 0.72 -0.25 2.37 0.11 -1.50 -1.20 114.38 114.34 2va8 h ARG 471 Ca 0.13 -0.32 -0.00 0.00 0.10 0.00 0.00 59.98 59.89 2va8 h ARG 471 Cb 0.51 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.56 2va8 h ARG 471 CO -0.42 0.92 0.14 2.35 0.10 0.00 0.00 179.97 183.06 2va8 h TRP 472 N 0.62 0.33 0.00 4.08 7.01 -1.28 0.32 115.95 127.03 2va8 h TRP 472 Ca 0.08 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.02 2va8 h TRP 472 Cb 0.80 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.74 2va8 h TRP 472 CO 0.04 0.27 -0.27 -0.07 -2.79 0.00 0.00 178.44 175.62 2va8 h LEU 473 N 0.30 0.00 0.12 0.65 3.38 -0.96 -0.02 115.31 118.77 2va8 h LEU 473 Ca 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2va8 h LEU 473 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2va8 h LEU 473 CO -0.02 0.27 -0.06 -0.07 0.09 0.00 0.00 178.44 178.66 2va8 h LEU 474 N 0.00 -0.13 -1.02 1.67 3.38 -0.81 0.33 115.31 118.73 2va8 h LEU 474 Ca -0.00 -0.43 0.09 0.00 0.09 0.00 0.00 57.88 57.62 2va8 h LEU 474 Cb 0.56 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.27 2va8 h LEU 474 CO 0.03 0.45 0.64 -0.33 0.09 0.00 0.00 178.44 179.33 2va8 h GLU 475 N -0.81 1.06 -0.65 1.13 5.08 0.03 -1.32 114.58 119.09 2va8 h GLU 475 Ca -0.02 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2va8 h GLU 475 Cb 0.56 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2va8 h GLU 475 CO 0.03 0.70 0.00 0.72 -1.00 0.00 0.00 179.01 179.46 2va8 n HIS 476 N -4.55 1.07 -3.83 4.33 8.25 -0.06 -4.97 115.22 115.46 2va8 n HIS 476 Ca 0.17 -0.48 -0.25 0.00 -0.26 0.00 0.00 57.72 56.91 2va8 n HIS 476 Cb 0.27 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.29 2va8 n HIS 476 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2va8 n SER 477 N 1.26 -1.23 -0.02 0.41 3.41 -0.50 -4.89 113.62 112.06 2va8 n SER 477 Ca 0.22 -0.95 -0.13 0.00 -0.26 0.00 0.00 58.87 57.76 2va8 n SER 477 Cb 0.66 -3.43 -0.14 0.00 -0.26 0.00 0.00 64.21 61.04 2va8 n SER 477 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2va8 n PHE 478 N -4.32 1.02 -4.45 7.33 3.72 0.06 -4.52 117.46 116.30 2va8 n PHE 478 Ca -0.28 0.31 -0.24 0.00 -0.05 0.00 0.00 57.45 57.18 2va8 n PHE 478 Cb 0.67 -1.17 -0.10 0.00 -0.94 0.00 0.00 39.48 37.95 2va8 n PHE 478 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 2va8 s ILE 479 N -2.58 2.58 0.05 4.37 -4.36 -0.94 -0.72 121.20 119.61 2va8 s ILE 479 Ca -0.11 -2.27 0.02 0.00 -0.26 0.00 0.00 60.65 58.03 2va8 s ILE 479 Cb 0.07 -2.48 -0.03 0.00 1.25 0.00 0.00 42.46 41.28 2va8 s ILE 479 CO 0.80 -0.34 -0.07 -1.59 0.24 0.00 0.00 174.94 173.98 2va8 s LYS 480 N -3.57 0.59 -0.07 0.37 -2.85 0.21 -4.56 119.74 109.85 2va8 s LYS 480 Ca 0.31 -0.89 -0.17 0.00 -1.00 0.00 0.00 55.97 54.22 2va8 s LYS 480 Cb -0.03 -0.25 -0.05 0.00 -2.06 0.00 0.00 37.83 35.44 2va8 s LYS 480 CO 0.16 0.03 0.46 -1.21 0.10 0.00 0.00 175.35 174.89 2va8 s GLU 481 N -2.12 4.22 -0.03 1.78 2.02 -1.26 -1.23 118.70 122.07 2va8 s GLU 481 Ca -0.05 0.44 0.05 0.00 0.02 0.00 0.00 54.97 55.43 2va8 s GLU 481 Cb -0.06 -3.36 0.09 0.00 0.10 0.00 0.00 34.13 30.89 2va8 s GLU 481 CO -0.01 0.34 1.06 0.39 0.02 0.00 0.00 175.26 177.06 2va8 n GLU 482 N 3.03 2.68 0.00 1.61 1.02 -0.59 -5.01 120.64 123.37 2va8 n GLU 482 Ca -0.09 -1.77 0.00 0.00 -0.02 0.00 0.00 57.16 55.27 2va8 n GLU 482 Cb 0.52 -1.13 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 2va8 n GLU 482 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2va8 n GLY 483 N -0.58 0.99 0.00 0.62 0.00 -1.26 -4.73 105.19 100.22 2va8 n GLY 483 Ca 0.04 -0.66 0.13 0.00 0.00 0.00 0.00 46.02 45.54 2va8 n GLY 483 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2va8 n ASN 484 N 0.00 0.00 -4.16 1.61 5.15 -1.26 -4.92 115.26 111.68 2va8 n ASN 484 Ca 0.00 -0.33 -0.16 0.00 -0.60 0.00 0.00 54.58 53.50 2va8 n ASN 484 Cb 0.00 -0.19 -0.11 0.00 -0.53 0.00 0.00 39.78 38.94 2va8 n ASN 484 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2va8 s THR 485 N -2.39 0.95 -0.07 -0.44 -1.32 -1.26 -4.06 115.64 107.05 2va8 s THR 485 Ca 0.30 -1.45 -0.04 0.00 -1.21 0.00 0.00 61.69 59.29 2va8 s THR 485 Cb 0.18 -1.16 -0.04 0.00 -1.51 0.00 0.00 72.50 69.97 2va8 s THR 485 CO 0.37 -0.42 0.12 -0.36 -2.21 0.00 0.00 174.62 172.12 2va8 s PHE 486 N -1.89 3.47 0.00 9.09 0.08 0.27 -1.54 117.98 127.46 2va8 s PHE 486 Ca 0.01 0.38 -0.02 0.00 0.12 0.00 0.00 56.93 57.42 2va8 s PHE 486 Cb -0.06 -1.86 -0.01 0.00 -0.57 0.00 0.00 43.02 40.52 2va8 s PHE 486 CO 0.01 0.65 0.04 0.00 -0.10 0.00 0.00 175.22 175.81 2va8 s ALA 487 N -1.11 -0.07 0.36 5.36 0.00 -0.37 -2.03 121.76 123.90 2va8 s ALA 487 Ca 0.19 -0.25 -0.28 0.00 0.00 0.00 0.00 51.96 51.62 2va8 s ALA 487 Cb -0.12 0.07 -0.10 0.00 0.00 0.00 0.00 23.12 22.96 2va8 s ALA 487 CO 0.09 -0.13 1.35 -0.51 0.00 0.00 0.00 175.76 176.56 2va8 s LEU 488 N -0.99 4.36 1.02 0.00 1.43 -1.26 0.64 118.68 123.88 2va8 s LEU 488 Ca -0.11 2.77 -0.13 0.00 -1.03 0.00 0.00 54.13 55.63 2va8 s LEU 488 Cb -0.07 -3.70 0.20 0.00 0.03 0.00 0.00 46.19 42.65 2va8 s LEU 488 CO -0.00 -0.68 1.10 0.42 0.23 0.00 0.00 176.35 177.42 2va8 s THR 489 N -1.16 1.97 0.32 5.49 -4.23 0.10 -4.74 115.64 113.40 2va8 s THR 489 Ca 0.51 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 61.03 2va8 s THR 489 Cb -0.41 -2.51 0.24 0.00 1.34 0.00 0.00 72.50 71.16 2va8 s THR 489 CO 0.55 0.00 1.96 0.78 -0.54 0.00 0.00 174.62 177.37 2va8 h ASN 490 N -1.96 0.79 -0.01 3.99 -0.26 -1.92 0.17 115.58 116.38 2va8 h ASN 490 Ca -0.54 -0.04 -0.00 0.00 -0.56 0.00 0.00 56.30 55.15 2va8 h ASN 490 Cb 1.33 -0.20 -0.00 0.00 -1.06 0.00 0.00 38.32 38.39 2va8 h ASN 490 CO 0.56 0.61 -0.01 0.15 -1.06 0.00 0.00 177.43 177.69 2va8 h PHE 491 N 0.91 0.02 -0.95 1.19 3.57 -1.91 -2.62 116.94 117.15 2va8 h PHE 491 Ca 0.24 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.85 2va8 h PHE 491 Cb -0.03 -0.00 -0.08 0.00 2.79 0.00 0.00 35.95 38.63 2va8 h PHE 491 CO 0.00 0.47 0.61 0.78 -2.23 0.00 0.00 178.31 177.94 2va8 h GLY 492 N -0.44 1.45 1.11 2.40 0.00 -1.62 -0.80 103.07 105.17 2va8 h GLY 492 Ca 0.00 -0.38 -0.18 0.00 0.00 0.00 0.00 47.33 46.76 2va8 h GLY 492 CO 0.00 0.16 -0.55 1.70 0.00 0.00 0.00 176.54 177.85 2va8 h LYS 493 N 0.91 0.82 -0.58 4.80 1.63 -1.02 -2.32 116.57 120.81 2va8 h LYS 493 Ca 0.46 -0.55 -0.04 0.00 -0.85 0.00 0.00 60.65 59.67 2va8 h LYS 493 Cb 0.51 0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 32.19 2va8 h LYS 493 CO -0.23 1.17 0.18 -0.09 -3.45 0.00 0.00 179.45 177.04 2va8 h ARG 494 N 0.58 0.87 -0.34 1.90 9.65 -1.02 -1.78 114.38 124.24 2va8 h ARG 494 Ca 0.00 -0.16 -0.08 0.00 -1.10 0.00 0.00 59.98 58.64 2va8 h ARG 494 Cb 1.17 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.60 2va8 h ARG 494 CO 0.12 0.75 -0.10 0.28 2.80 0.00 0.00 179.97 183.82 2va8 h VAL 495 N 0.84 1.28 -0.42 0.20 2.07 -1.15 -1.40 116.25 117.67 2va8 h VAL 495 Ca 0.19 -1.18 0.01 0.00 0.82 0.00 0.00 66.70 66.55 2va8 h VAL 495 Cb 0.25 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 2va8 h VAL 495 CO -0.01 0.38 0.26 0.00 0.02 0.00 0.00 177.57 178.23 2va8 h ALA 496 N 0.80 0.54 -0.19 1.67 0.00 -1.27 -0.72 119.26 120.08 2va8 h ALA 496 Ca 0.08 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2va8 h ALA 496 Cb 0.61 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2va8 h ALA 496 CO 0.04 -0.05 -0.13 -0.44 0.00 0.00 0.00 179.25 178.66 2va8 h ASP 497 N 0.53 0.30 1.80 0.00 3.32 -1.25 -2.81 116.42 118.31 2va8 h ASP 497 Ca 0.16 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2va8 h ASP 497 Cb -0.02 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.45 2va8 h ASP 497 CO -0.06 0.46 -0.12 -0.07 -1.72 0.00 0.00 179.24 177.73 2va8 h LEU 498 N 0.29 0.00 0.91 1.55 3.38 -0.83 -3.31 115.31 117.31 2va8 h LEU 498 Ca 0.06 -0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.84 2va8 h LEU 498 Cb 0.42 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2va8 h LEU 498 CO 0.02 0.00 -0.21 0.00 0.09 0.00 0.00 178.44 178.35 2va8 n TYR 499 N -2.92 -0.24 -3.31 1.13 4.19 -0.32 -4.70 117.16 110.99 2va8 n TYR 499 Ca 0.04 0.00 -0.34 0.00 3.31 0.00 0.00 57.90 60.91 2va8 n TYR 499 Cb 0.52 -2.09 -0.06 0.00 0.49 0.00 0.00 39.34 38.20 2va8 n TYR 499 CO 0.00 0.00 0.00 0.96 0.91 0.00 0.00 176.86 178.73 2va8 s ILE 500 N -2.41 4.82 0.36 2.97 -4.36 -1.20 -5.04 121.20 116.34 2va8 s ILE 500 Ca 0.00 0.77 -0.27 0.00 -0.26 0.00 0.00 60.65 60.89 2va8 s ILE 500 Cb 0.00 -3.68 -0.12 0.00 1.25 0.00 0.00 42.46 39.91 2va8 s ILE 500 CO 0.00 0.04 1.24 -3.20 0.24 0.00 0.00 174.94 173.26 2va8 n ASN 501 N 0.23 2.48 -0.31 4.36 2.85 -1.26 -4.79 115.26 118.82 2va8 n ASN 501 Ca -0.01 1.17 0.11 0.00 -0.11 0.00 0.00 54.58 55.74 2va8 n ASN 501 Cb 0.52 -1.46 0.34 0.00 1.24 0.00 0.00 39.78 40.42 2va8 n ASN 501 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2va8 h PRO 502 N 2.32 0.75 -0.93 1.20 0.11 -1.94 -0.52 132.00 132.99 2va8 h PRO 502 Ca -0.46 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 2va8 h PRO 502 Cb 1.29 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 32.19 2va8 h PRO 502 CO 0.61 0.50 0.57 0.74 -0.21 0.00 0.00 178.00 180.21 2va8 h PHE 503 N 0.78 1.21 0.17 0.65 -1.00 -1.96 0.15 116.94 116.95 2va8 h PHE 503 Ca 0.49 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.27 2va8 h PHE 503 Cb 0.72 -0.40 0.00 0.00 3.61 0.00 0.00 35.95 39.88 2va8 h PHE 503 CO -0.00 0.80 -0.08 1.15 -1.61 0.00 0.00 178.31 178.56 2va8 h THR 504 N 1.28 0.86 -0.92 -1.55 2.02 -1.56 -2.22 112.91 110.82 2va8 h THR 504 Ca 0.34 -0.13 0.06 0.00 0.77 0.00 0.00 66.41 67.44 2va8 h THR 504 Cb -0.07 0.94 -0.06 0.00 -1.74 0.00 0.00 68.15 67.22 2va8 h THR 504 CO -0.06 0.03 0.60 0.00 0.37 0.00 0.00 175.52 176.46 2va8 h ALA 505 N 0.53 1.47 -0.59 6.16 0.00 -0.76 -1.72 119.26 124.34 2va8 h ALA 505 Ca -0.02 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2va8 h ALA 505 Cb 0.23 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2va8 h ALA 505 CO 0.04 0.41 0.05 0.22 0.00 0.00 0.00 179.25 179.96 2va8 h ASP 506 N 1.09 0.98 -0.44 0.00 1.82 -0.62 -1.99 116.42 117.26 2va8 h ASP 506 Ca 0.39 -0.29 -0.05 0.00 -0.39 0.00 0.00 57.03 56.69 2va8 h ASP 506 Cb 0.14 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 39.87 2va8 h ASP 506 CO -0.14 1.02 0.06 0.40 -1.61 0.00 0.00 179.24 178.98 2va8 h ILE 507 N 0.91 1.25 -0.11 2.25 2.04 -0.75 -1.95 117.51 121.16 2va8 h ILE 507 Ca 0.17 -0.91 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 2va8 h ILE 507 Cb 0.49 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 37.56 2va8 h ILE 507 CO 0.02 0.32 0.05 0.40 0.00 0.00 0.00 178.15 178.94 2va8 h ILE 508 N 0.59 1.11 -0.26 -0.67 2.04 -1.29 0.03 117.51 119.06 2va8 h ILE 508 Ca 0.13 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2va8 h ILE 508 Cb 0.40 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2va8 h ILE 508 CO 0.01 0.10 0.13 -0.09 0.00 0.00 0.00 178.15 178.30 2va8 h ARG 509 N 0.05 0.37 -0.41 2.37 2.43 -1.32 0.20 114.38 118.07 2va8 h ARG 509 Ca 0.04 -0.05 0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2va8 h ARG 509 Cb 0.11 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.54 2va8 h ARG 509 CO -0.00 0.34 0.13 -0.22 -1.51 0.00 0.00 179.97 178.70 2va8 h LYS 510 N 0.30 0.27 -0.75 0.20 3.64 -1.28 -0.61 116.57 118.33 2va8 h LYS 510 Ca 0.09 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2va8 h LYS 510 Cb 0.09 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.81 2va8 h LYS 510 CO -0.01 0.18 0.45 0.78 -2.27 0.00 0.00 179.45 178.58 2va8 h GLY 511 N 0.28 1.09 1.67 5.01 0.00 -0.53 -1.81 103.07 108.78 2va8 h GLY 511 Ca 0.19 -0.46 -0.21 0.00 0.00 0.00 0.00 47.33 46.86 2va8 h GLY 511 CO -0.21 0.44 -0.88 1.41 0.00 0.00 0.00 176.54 177.30 2va8 h LEU 512 N 1.03 0.39 0.00 3.11 3.38 -0.31 -3.21 115.31 119.69 2va8 h LEU 512 Ca 0.27 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2va8 h LEU 512 Cb -0.03 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 2va8 h LEU 512 CO -0.05 1.09 -0.52 -0.33 0.09 0.00 0.00 178.44 178.73 2va8 h GLU 513 N 0.17 0.00 0.00 1.13 5.08 -1.12 -3.35 114.58 116.50 2va8 h GLU 513 Ca -0.06 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 2va8 h GLU 513 Cb 1.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.74 2va8 h GLU 513 CO 0.14 0.01 -0.86 0.78 -1.00 0.00 0.00 179.01 178.09 2va8 h GLY 514 N 3.99 0.00 -4.34 -3.84 0.00 -1.38 -3.48 103.07 94.02 2va8 h GLY 514 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 2va8 h GLY 514 CO 0.00 0.00 -0.73 0.30 0.00 0.00 0.00 176.54 176.11 2va8 s HIS 515 N -3.07 0.74 0.87 5.60 3.76 -1.21 -5.10 115.29 116.88 2va8 s HIS 515 Ca 0.01 -0.60 -0.12 0.00 -0.15 0.00 0.00 55.06 54.21 2va8 s HIS 515 Cb 0.08 -0.44 0.11 0.00 1.11 0.00 0.00 32.58 33.44 2va8 s HIS 515 CO 0.77 -0.09 1.10 -1.59 -0.85 0.00 0.00 174.74 174.08 2va8 s LYS 516 N -2.12 1.50 0.06 1.40 -2.85 -1.26 -4.80 119.74 111.67 2va8 s LYS 516 Ca -0.04 0.58 -0.37 0.00 -1.00 0.00 0.00 55.97 55.14 2va8 s LYS 516 Cb -0.06 -1.86 -0.17 0.00 -2.06 0.00 0.00 37.83 33.68 2va8 s LYS 516 CO -0.01 -2.01 1.33 0.00 0.10 0.00 0.00 175.35 174.76 2va8 n ALA 517 N -3.69 -1.19 -3.29 0.59 0.00 -1.26 -4.96 120.51 106.71 2va8 n ALA 517 Ca 0.07 0.52 0.00 0.00 0.00 0.00 0.00 53.44 54.03 2va8 n ALA 517 Cb 0.57 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.97 2va8 n ALA 517 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2va8 n SER 518 N 2.53 1.89 -4.94 0.00 2.88 -1.26 -5.09 113.62 109.63 2va8 n SER 518 Ca 0.19 -0.34 -0.24 0.00 -1.33 0.00 0.00 58.87 57.14 2va8 n SER 518 Cb 0.18 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.69 2va8 n SER 518 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2va8 h GLU 520 N -0.24 0.33 -0.92 0.00 5.08 -1.99 -2.43 114.58 114.41 2va8 h GLU 520 Ca -0.44 -0.09 0.09 0.00 -1.00 0.00 0.00 59.36 57.93 2va8 h GLU 520 Cb 1.30 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.43 2va8 h GLU 520 CO 0.57 0.48 0.57 1.25 -1.00 0.00 0.00 179.01 180.88 2va8 h LEU 521 N 0.31 0.85 -0.60 1.33 5.85 -1.94 -2.06 115.31 119.05 2va8 h LEU 521 Ca 0.06 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.71 2va8 h LEU 521 Cb 0.44 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 2va8 h LEU 521 CO 0.03 0.49 -0.10 0.00 -0.34 0.00 0.00 178.44 178.52 2va8 h ALA 522 N 1.48 0.80 -0.40 1.25 0.00 -1.72 0.49 119.26 121.16 2va8 h ALA 522 Ca 0.43 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 2va8 h ALA 522 Cb 0.34 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2va8 h ALA 522 CO -0.23 0.67 -0.32 1.88 0.00 0.00 0.00 179.25 181.25 2va8 h TYR 523 N 0.90 1.09 -0.53 0.00 0.05 -1.48 -1.68 116.97 115.31 2va8 h TYR 523 Ca 0.14 -0.31 -0.03 0.00 0.05 0.00 0.00 58.73 58.58 2va8 h TYR 523 Cb 0.66 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 38.14 2va8 h TYR 523 CO 0.04 1.12 0.21 -0.07 -1.05 0.00 0.00 178.16 178.41 2va8 h LEU 524 N 0.74 0.74 0.12 3.88 3.38 -1.12 -2.33 115.31 120.72 2va8 h LEU 524 Ca 0.07 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2va8 h LEU 524 Cb 0.91 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2va8 h LEU 524 CO 0.08 0.71 -0.12 -0.74 0.09 0.00 0.00 178.44 178.47 2va8 h HIS 525 N 0.72 -0.30 -0.88 1.13 2.76 -0.81 -1.16 115.15 116.61 2va8 h HIS 525 Ca 0.18 0.00 0.11 0.00 -2.20 0.00 0.00 60.37 58.46 2va8 h HIS 525 Cb 0.21 0.12 -0.08 0.00 1.55 0.00 0.00 27.41 29.21 2va8 h HIS 525 CO 0.01 -0.18 0.52 1.25 -1.30 0.00 0.00 177.93 178.23 2va8 h LEU 526 N -0.26 0.74 -0.04 0.26 5.85 -1.17 -1.55 115.31 119.13 2va8 h LEU 526 Ca 0.00 0.05 -0.25 0.00 0.84 0.00 0.00 57.88 58.53 2va8 h LEU 526 Cb 0.25 -0.09 0.02 0.00 0.37 0.00 0.00 40.66 41.21 2va8 h LEU 526 CO -0.03 0.40 -0.95 -0.07 -0.34 0.00 0.00 178.44 177.45 2va8 h LEU 527 N 0.83 0.91 -1.27 2.25 3.38 -1.17 -3.02 115.31 117.23 2va8 h LEU 527 Ca 0.44 -0.71 0.03 0.00 0.09 0.00 0.00 57.88 57.72 2va8 h LEU 527 Cb 0.44 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2va8 h LEU 527 CO -0.27 1.49 0.51 0.00 0.09 0.00 0.00 178.44 180.26 2va8 h ALA 528 N 0.44 1.51 0.00 1.53 0.00 -1.02 -2.63 119.26 119.09 2va8 h ALA 528 Ca -0.11 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2va8 h ALA 528 Cb 1.59 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 2va8 h ALA 528 CO 0.19 0.42 -0.15 0.35 0.00 0.00 0.00 179.25 180.06 2va8 h PHE 529 N 0.98 0.00 -4.24 0.00 3.04 -1.15 -3.38 116.94 112.18 2va8 h PHE 529 Ca 0.30 0.00 -0.52 0.00 3.98 0.00 0.00 57.97 61.73 2va8 h PHE 529 Cb -0.01 0.00 0.15 0.00 2.56 0.00 0.00 35.95 38.65 2va8 h PHE 529 CO -0.00 0.15 0.32 0.95 -2.02 0.00 0.00 178.31 177.71 2va8 s THR 530 N -4.52 2.68 0.53 4.41 -4.23 -0.99 -4.86 115.64 108.65 2va8 s THR 530 Ca -0.04 0.27 0.25 0.00 -1.18 0.00 0.00 61.69 60.99 2va8 s THR 530 Cb 0.15 -2.65 0.40 0.00 1.34 0.00 0.00 72.50 71.74 2va8 s THR 530 CO 0.66 -0.24 1.99 -0.65 -0.54 0.00 0.00 174.62 175.84 2va8 h PRO 531 N -0.90 0.00 0.00 3.99 0.11 -1.87 -0.07 132.00 133.26 2va8 h PRO 531 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2va8 h PRO 531 Cb 1.26 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2va8 h PRO 531 CO 0.49 0.00 -0.26 -0.25 -0.21 0.00 0.00 178.00 177.77 2va8 n ASP 532 N -4.38 0.66 -4.78 -2.05 10.43 -1.26 -4.92 116.55 110.26 2va8 n ASP 532 Ca 0.10 0.34 -0.31 0.00 2.57 0.00 0.00 54.79 57.50 2va8 n ASP 532 Cb 0.62 -0.35 0.09 0.00 1.84 0.00 0.00 41.12 43.32 2va8 n ASP 532 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 2va8 s GLY 533 N -3.50 1.66 0.80 0.44 0.00 -0.04 -5.02 107.32 101.66 2va8 s GLY 533 Ca 0.09 0.17 -0.11 0.00 0.00 0.00 0.00 44.72 44.87 2va8 s GLY 533 CO 0.64 0.52 1.12 -4.14 0.00 0.00 0.00 173.10 171.24 2va8 s PRO 534 N -4.95 1.96 -0.03 2.90 0.02 -1.26 -4.92 135.00 128.72 2va8 s PRO 534 Ca 0.61 1.33 0.08 0.00 0.02 0.00 0.00 61.00 63.03 2va8 s PRO 534 Cb -0.16 -1.85 -0.02 0.00 0.02 0.00 0.00 34.50 32.49 2va8 s PRO 534 CO 0.56 -1.89 -0.26 -0.51 -0.33 0.00 0.00 177.00 174.57 2va8 s LEU 535 N -5.97 2.07 0.15 -5.54 1.43 -1.26 -4.83 118.68 104.72 2va8 s LEU 535 Ca 0.64 -0.47 0.07 0.00 -1.03 0.00 0.00 54.13 53.34 2va8 s LEU 535 Cb -0.20 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.63 2va8 s LEU 535 CO 0.55 0.31 -0.16 0.54 0.23 0.00 0.00 176.35 177.82 2va8 s VAL 536 N -0.55 1.56 0.37 -1.59 0.11 -1.26 -5.11 120.40 113.93 2va8 s VAL 536 Ca 0.08 -1.85 -0.24 0.00 -2.93 0.00 0.00 61.98 57.04 2va8 s VAL 536 Cb -0.11 -1.71 -0.10 0.00 -1.53 0.00 0.00 36.38 32.93 2va8 s VAL 536 CO -0.00 -0.40 0.97 -0.94 -3.33 0.00 0.00 175.10 171.40 2va8 s SER 537 N -2.64 7.07 -0.08 3.54 1.04 -1.26 -5.01 113.70 116.36 2va8 s SER 537 Ca 0.13 1.85 0.02 0.00 0.48 0.00 0.00 55.95 58.43 2va8 s SER 537 Cb -0.05 -2.57 0.01 0.00 0.10 0.00 0.00 66.02 63.52 2va8 s SER 537 CO 0.05 -0.27 -0.14 -0.69 0.98 0.00 0.00 173.24 173.17 2va8 s VAL 538 N -1.79 1.27 0.80 5.02 1.01 -1.26 -5.07 120.40 120.39 2va8 s VAL 538 Ca 0.56 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.89 2va8 s VAL 538 Cb -0.17 -1.16 0.07 0.00 0.00 0.00 0.00 36.38 35.13 2va8 s VAL 538 CO 0.22 0.39 1.09 -0.83 0.00 0.00 0.00 175.10 175.97 2va8 s GLY 539 N 0.73 1.66 0.01 4.51 0.00 -1.26 -4.85 107.32 108.12 2va8 s GLY 539 Ca -0.13 0.21 -0.25 0.00 0.00 0.00 0.00 44.72 44.55 2va8 s GLY 539 CO 0.03 0.59 1.33 -0.09 0.00 0.00 0.00 173.10 174.96 2va8 h ARG 540 N -1.23 -0.13 -0.86 2.90 9.65 -2.00 0.16 114.38 122.87 2va8 h ARG 540 Ca -0.45 0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.43 2va8 h ARG 540 Cb 1.24 0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.81 2va8 h ARG 540 CO 0.52 0.22 0.50 -0.97 2.80 0.00 0.00 179.97 183.04 2va8 h ASN 541 N -0.49 1.04 -0.32 -3.80 -0.73 -2.00 -2.67 115.58 106.62 2va8 h ASN 541 Ca -0.01 -0.08 0.03 0.00 1.87 0.00 0.00 56.30 58.11 2va8 h ASN 541 Cb 0.41 -0.26 -0.03 0.00 0.27 0.00 0.00 38.32 38.70 2va8 h ASN 541 CO 0.02 0.82 0.14 -0.08 -0.37 0.00 0.00 177.43 177.96 2va8 h GLU 542 N 1.18 0.30 -0.83 6.67 4.81 -1.92 -0.59 114.58 124.20 2va8 h GLU 542 Ca 0.31 -0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.62 2va8 h GLU 542 Cb -0.02 -0.07 -0.07 0.00 0.63 0.00 0.00 28.75 29.21 2va8 h GLU 542 CO -0.05 0.20 0.47 1.49 -0.73 0.00 0.00 179.01 180.38 2va8 h GLU 543 N 0.31 0.76 -0.38 1.92 4.81 -0.50 -0.00 114.58 121.50 2va8 h GLU 543 Ca 0.14 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 2va8 h GLU 543 Cb 0.07 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2va8 h GLU 543 CO -0.11 0.50 0.19 0.93 -0.73 0.00 0.00 179.01 179.80 2va8 h GLU 544 N 0.78 0.54 -0.95 1.92 5.08 -1.03 -0.54 114.58 120.38 2va8 h GLU 544 Ca 0.40 -0.08 0.02 0.00 -1.00 0.00 0.00 59.36 58.70 2va8 h GLU 544 Cb 0.38 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 2va8 h GLU 544 CO -0.25 0.47 0.63 0.93 -1.00 0.00 0.00 179.01 179.79 2va8 h GLU 545 N 0.48 1.22 -0.60 2.33 5.08 -0.52 -1.68 114.58 120.89 2va8 h GLU 545 Ca 0.13 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 2va8 h GLU 545 Cb 0.10 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 2va8 h GLU 545 CO -0.02 0.81 0.11 -0.07 -1.00 0.00 0.00 179.01 178.84 2va8 h LEU 546 N 1.26 0.93 -0.43 1.33 3.38 -0.74 -0.45 115.31 120.60 2va8 h LEU 546 Ca 0.36 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2va8 h LEU 546 Cb -0.10 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 2va8 h LEU 546 CO -0.09 0.95 0.20 0.40 0.09 0.00 0.00 178.44 179.99 2va8 h ILE 547 N 0.88 1.19 -0.96 1.22 2.04 -0.81 -1.80 117.51 119.27 2va8 h ILE 547 Ca 0.18 -0.54 0.06 0.00 1.00 0.00 0.00 64.86 65.57 2va8 h ILE 547 Cb 0.40 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 2va8 h ILE 547 CO 0.01 0.20 0.62 -0.08 0.00 0.00 0.00 178.15 178.91 2va8 h GLU 548 N 0.55 1.08 -0.49 2.37 4.81 -1.19 -2.92 114.58 118.80 2va8 h GLU 548 Ca 0.15 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2va8 h GLU 548 Cb 0.14 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2va8 h GLU 548 CO -0.02 0.71 0.19 1.25 -0.73 0.00 0.00 179.01 180.41 2va8 h LEU 549 N 1.11 0.68 -1.93 1.64 5.85 -0.60 -2.10 115.31 119.96 2va8 h LEU 549 Ca 0.41 -0.18 0.25 0.00 0.84 0.00 0.00 57.88 59.21 2va8 h LEU 549 Cb 0.18 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2va8 h LEU 549 CO -0.16 0.67 0.64 -0.07 -0.34 0.00 0.00 178.44 179.18 2va8 h LEU 550 N 0.65 0.06 -0.07 2.25 3.38 -1.14 0.47 115.31 120.90 2va8 h LEU 550 Ca 0.16 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2va8 h LEU 550 Cb 0.21 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2va8 h LEU 550 CO -0.01 0.02 0.00 -0.62 0.09 0.00 0.00 178.44 177.92 2va8 n GLU 551 N -4.31 0.11 0.00 1.13 -0.58 -0.80 -3.86 120.64 112.34 2va8 n GLU 551 Ca 0.19 0.15 0.01 0.00 -0.42 0.00 0.00 57.16 57.09 2va8 n GLU 551 Cb 0.93 -1.64 0.00 0.00 -0.57 0.00 0.00 31.44 30.16 2va8 n GLU 551 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2va8 n ASP 552 N -1.83 0.78 -4.67 1.62 8.00 0.15 -5.03 116.55 115.58 2va8 n ASP 552 Ca 0.06 -0.89 -0.43 0.00 0.71 0.00 0.00 54.79 54.24 2va8 n ASP 552 Cb 0.34 0.42 -0.02 0.00 -0.02 0.00 0.00 41.12 41.83 2va8 n ASP 552 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2va8 s LEU 553 N -1.04 4.25 -0.02 0.64 2.96 -0.61 -4.93 118.68 119.93 2va8 s LEU 553 Ca 0.03 1.85 -0.24 0.00 -0.22 0.00 0.00 54.13 55.55 2va8 s LEU 553 Cb 0.02 -3.55 -0.18 0.00 0.50 0.00 0.00 46.19 42.99 2va8 s LEU 553 CO 0.07 -0.71 1.17 0.44 -1.32 0.00 0.00 176.35 176.00 2va8 h ASP 554 N 8.00 -0.18 -2.09 3.68 3.32 -1.94 -3.45 116.42 123.76 2va8 h ASP 554 Ca -0.32 -0.33 -0.63 0.00 0.02 0.00 0.00 57.03 55.77 2va8 h ASP 554 Cb 1.14 0.05 0.10 0.00 0.22 0.00 0.00 39.33 40.83 2va8 h ASP 554 CO 0.93 0.27 0.12 0.00 -1.72 0.00 0.00 179.24 178.83 2va8 s GLU 556 N -1.02 4.19 0.25 0.00 2.56 -1.26 -5.07 118.70 118.35 2va8 s GLU 556 Ca 0.65 0.78 -0.04 0.00 0.00 0.00 0.00 54.97 56.37 2va8 s GLU 556 Cb -0.79 -2.88 -0.05 0.00 2.00 0.00 0.00 34.13 32.42 2va8 s GLU 556 CO 0.56 0.40 0.49 -0.51 -0.56 0.00 0.00 175.26 175.65 2va8 s LEU 557 N -2.00 4.12 0.00 2.70 1.43 -1.26 -4.70 118.68 118.97 2va8 s LEU 557 Ca 0.42 0.62 0.21 0.00 -1.03 0.00 0.00 54.13 54.35 2va8 s LEU 557 Cb -0.16 -3.42 0.66 0.00 0.03 0.00 0.00 46.19 43.31 2va8 s LEU 557 CO 0.20 -0.13 1.50 0.18 0.23 0.00 0.00 176.35 178.34 2va8 n LEU 558 N -0.76 2.00 -4.00 1.79 4.77 -1.26 -4.79 117.00 114.75 2va8 n LEU 558 Ca -0.03 -0.85 -0.20 0.00 -0.03 0.00 0.00 56.01 54.90 2va8 n LEU 558 Cb 0.54 -0.14 -0.15 0.00 -2.33 0.00 0.00 43.42 41.34 2va8 n LEU 558 CO 0.48 0.42 -0.44 -0.63 -1.33 0.00 0.00 177.39 175.90 2va8 s ILE 559 N -1.73 0.76 0.39 -0.08 1.01 -1.26 -4.32 121.20 115.98 2va8 s ILE 559 Ca 0.33 -0.35 -0.25 0.00 0.00 0.00 0.00 60.65 60.37 2va8 s ILE 559 Cb 0.18 -0.68 -0.09 0.00 0.01 0.00 0.00 42.46 41.88 2va8 s ILE 559 CO 0.27 0.24 1.17 -0.70 0.00 0.00 0.00 174.94 175.92 2va8 s GLU 560 N 0.19 4.08 0.04 2.79 2.12 -1.26 -4.96 118.70 121.71 2va8 s GLU 560 Ca -0.03 1.86 -0.30 0.00 0.36 0.00 0.00 54.97 56.86 2va8 s GLU 560 Cb -0.08 -2.71 -0.09 0.00 0.26 0.00 0.00 34.13 31.51 2va8 s GLU 560 CO 0.00 -0.30 1.95 -2.00 -0.54 0.00 0.00 175.26 174.37 2va8 s GLU 561 N -2.25 4.14 0.58 4.30 2.12 -1.26 -4.96 118.70 121.38 2va8 s GLU 561 Ca 0.56 2.60 -0.20 0.00 0.36 0.00 0.00 54.97 58.30 2va8 s GLU 561 Cb -0.31 -4.10 -0.04 0.00 0.26 0.00 0.00 34.13 29.94 2va8 s GLU 561 CO 0.39 -0.94 1.25 -2.14 -0.54 0.00 0.00 175.26 173.28 2va8 s PRO 562 N 4.28 2.98 0.03 4.30 0.02 -1.26 -4.97 135.00 140.37 2va8 s PRO 562 Ca 0.87 1.96 0.19 0.00 0.02 0.00 0.00 61.00 64.04 2va8 s PRO 562 Cb -0.43 -2.01 -0.17 0.00 0.02 0.00 0.00 34.50 31.91 2va8 s PRO 562 CO 0.41 -1.24 0.68 0.66 -0.33 0.00 0.00 177.00 177.18 2va8 n TYR 563 N -1.46 0.63 -3.23 6.54 4.02 -1.26 -4.74 117.16 117.66 2va8 n TYR 563 Ca 0.13 0.20 -0.39 0.00 -0.01 0.00 0.00 57.90 57.84 2va8 n TYR 563 Cb 0.48 -0.93 -0.06 0.00 -0.02 0.00 0.00 39.34 38.82 2va8 n TYR 563 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2va8 s GLU 564 N -3.07 4.27 0.19 -0.72 0.41 -1.26 -4.99 118.70 113.54 2va8 s GLU 564 Ca -0.05 0.72 -0.12 0.00 -0.41 0.00 0.00 54.97 55.12 2va8 s GLU 564 Cb 0.10 -3.31 0.18 0.00 -1.78 0.00 0.00 34.13 29.32 2va8 s GLU 564 CO 0.83 0.46 1.79 1.49 -0.49 0.00 0.00 175.26 179.34 2va8 h GLU 565 N 5.30 0.54 -0.48 1.61 4.81 -1.98 0.09 114.58 124.46 2va8 h GLU 565 Ca -0.47 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 58.65 2va8 h GLU 565 Cb 1.20 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.45 2va8 h GLU 565 CO 0.68 0.36 0.00 -0.44 -0.73 0.00 0.00 179.01 178.88 2va8 h ASP 566 N 0.56 0.84 -0.03 1.04 3.32 -2.00 -1.52 116.42 118.62 2va8 h ASP 566 Ca 0.25 -0.31 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 2va8 h ASP 566 Cb 0.16 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2va8 h ASP 566 CO -0.17 0.94 -0.27 -0.33 -1.72 0.00 0.00 179.24 177.69 2va8 h GLU 567 N 0.71 0.47 -0.56 3.56 5.08 -1.87 -2.84 114.58 119.13 2va8 h GLU 567 Ca 0.14 -0.18 -0.11 0.00 -1.00 0.00 0.00 59.36 58.20 2va8 h GLU 567 Cb 0.51 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 2va8 h GLU 567 CO 0.02 0.70 -0.09 -0.92 -1.00 0.00 0.00 179.01 177.72 2va8 h TYR 568 N 0.41 1.17 -0.79 4.33 5.03 -0.70 -1.74 116.97 124.67 2va8 h TYR 568 Ca 0.06 -0.24 0.01 0.00 2.58 0.00 0.00 58.73 61.15 2va8 h TYR 568 Cb 0.68 -0.29 -0.04 0.00 1.55 0.00 0.00 36.73 38.63 2va8 h TYR 568 CO 0.02 1.07 0.52 0.77 -1.32 0.00 0.00 178.16 179.22 2va8 h SER 569 N 0.93 0.90 -0.80 -2.11 0.02 -1.16 -1.61 113.55 109.72 2va8 h SER 569 Ca 0.15 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2va8 h SER 569 Cb 0.66 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.95 2va8 h SER 569 CO 0.05 0.64 0.48 -0.07 -1.14 0.00 0.00 176.83 176.79 2va8 h LEU 570 N 1.06 0.97 -0.73 5.07 3.38 -1.25 0.67 115.31 124.49 2va8 h LEU 570 Ca 0.30 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.25 2va8 h LEU 570 Cb -0.10 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.35 2va8 h LEU 570 CO -0.07 0.76 0.43 0.22 0.09 0.00 0.00 178.44 179.87 2va8 h TYR 571 N 1.10 0.79 -0.22 1.13 5.03 -0.80 0.20 116.97 124.21 2va8 h TYR 571 Ca 0.29 0.03 -0.20 0.00 2.58 0.00 0.00 58.73 61.43 2va8 h TYR 571 Cb -0.03 -0.25 0.00 0.00 1.55 0.00 0.00 36.73 38.00 2va8 h TYR 571 CO -0.00 0.40 -0.64 0.82 -1.32 0.00 0.00 178.16 177.42 2va8 h ILE 572 N 0.80 1.29 -0.62 1.81 1.08 -1.03 -3.04 117.51 117.79 2va8 h ILE 572 Ca 0.32 -1.84 0.03 0.00 -0.39 0.00 0.00 64.86 62.98 2va8 h ILE 572 Cb 0.15 1.79 -0.04 0.00 -3.07 0.00 0.00 36.82 35.65 2va8 h ILE 572 CO -0.16 0.59 0.37 -1.13 -0.69 0.00 0.00 178.15 177.13 2va8 h ASN 573 N 0.58 0.60 0.19 1.72 -0.73 -0.37 -2.39 115.58 115.18 2va8 h ASN 573 Ca -0.01 0.01 -0.05 0.00 1.87 0.00 0.00 56.30 58.12 2va8 h ASN 573 Cb 1.24 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 39.70 2va8 h ASN 573 CO 0.13 0.41 -0.21 0.00 -0.37 0.00 0.00 177.43 177.40 2va8 h ALA 574 N 1.28 1.61 -0.34 1.57 0.00 -0.96 -2.38 119.26 120.05 2va8 h ALA 574 Ca 0.25 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2va8 h ALA 574 Cb 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2va8 h ALA 574 CO -0.12 0.29 -0.25 1.25 0.00 0.00 0.00 179.25 180.43 2va8 h LEU 575 N 0.03 0.81 -0.19 0.00 5.85 -1.32 -0.49 115.31 120.00 2va8 h LEU 575 Ca 0.00 -0.44 0.02 0.00 0.84 0.00 0.00 57.88 58.30 2va8 h LEU 575 Cb 0.39 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2va8 h LEU 575 CO 0.03 1.08 0.07 0.50 -0.34 0.00 0.00 178.44 179.78 2va8 h LYS 576 N 0.55 0.17 -0.23 1.25 3.64 -1.14 -0.42 116.57 120.38 2va8 h LYS 576 Ca 0.07 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.48 2va8 h LYS 576 Cb 0.81 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.55 2va8 h LYS 576 CO 0.07 0.11 -0.08 0.28 -2.27 0.00 0.00 179.45 177.56 2va8 h VAL 577 N 0.17 0.71 -0.60 2.00 2.07 -1.41 -0.64 116.25 118.56 2va8 h VAL 577 Ca 0.08 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.70 2va8 h VAL 577 Cb 0.04 0.71 -0.08 0.00 -1.52 0.00 0.00 31.29 30.44 2va8 h VAL 577 CO -0.07 0.00 0.17 0.00 0.02 0.00 0.00 177.57 177.69 2va8 h ALA 578 N 1.18 0.73 -0.55 1.67 0.00 -0.86 -0.85 119.26 120.58 2va8 h ALA 578 Ca 0.12 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 2va8 h ALA 578 Cb 0.21 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2va8 h ALA 578 CO -0.26 -0.26 0.02 -0.07 0.00 0.00 0.00 179.25 178.68 2va8 h LEU 579 N 0.32 0.90 0.05 0.00 3.38 -0.64 -1.63 115.31 117.68 2va8 h LEU 579 Ca 0.31 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2va8 h LEU 579 Cb 0.42 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2va8 h LEU 579 CO -0.36 0.94 -0.02 0.40 0.09 0.00 0.00 178.44 179.49 2va8 h ILE 580 N 0.86 1.02 -0.98 1.22 2.04 -0.48 -2.31 117.51 118.88 2va8 h ILE 580 Ca 0.16 -0.21 0.07 0.00 1.00 0.00 0.00 64.86 65.89 2va8 h ILE 580 Cb 0.48 1.16 -0.07 0.00 -0.74 0.00 0.00 36.82 37.65 2va8 h ILE 580 CO 0.02 0.05 0.63 0.24 0.00 0.00 0.00 178.15 179.10 2va8 h MET 581 N -0.16 1.08 -0.67 2.37 2.86 -1.03 -1.21 114.93 118.16 2va8 h MET 581 Ca -0.01 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.49 2va8 h MET 581 Cb 0.14 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.53 2va8 h MET 581 CO 0.01 0.71 0.10 -0.22 1.06 0.00 0.00 176.91 178.57 2va8 h LYS 582 N 1.11 1.12 -0.60 1.72 3.64 -1.22 -0.03 116.57 122.31 2va8 h LYS 582 Ca 0.43 -0.31 -0.10 0.00 -1.27 0.00 0.00 60.65 59.41 2va8 h LYS 582 Cb 0.22 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 2va8 h LYS 582 CO -0.18 1.03 -0.01 -0.44 -2.27 0.00 0.00 179.45 177.58 2va8 h ASP 583 N 1.05 1.05 -0.29 4.20 3.45 -0.80 -1.74 116.42 123.33 2va8 h ASP 583 Ca 0.20 -0.31 0.05 0.00 0.43 0.00 0.00 57.03 57.40 2va8 h ASP 583 Cb 0.46 -0.28 -0.05 0.00 -0.56 0.00 0.00 39.33 38.90 2va8 h ASP 583 CO 0.02 1.10 -0.02 -0.25 -1.57 0.00 0.00 179.24 178.52 2va8 h TRP 584 N 0.97 -0.04 -0.54 4.55 2.91 -1.00 -1.86 115.95 120.93 2va8 h TRP 584 Ca 0.17 0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.18 2va8 h TRP 584 Cb 0.57 0.06 -0.03 0.00 -0.51 0.00 0.00 29.16 29.26 2va8 h TRP 584 CO 0.04 -0.07 0.21 0.52 -1.03 0.00 0.00 178.44 178.12 2va8 h MET 585 N 0.07 0.79 -0.08 2.65 2.86 -0.87 -2.57 114.93 117.78 2va8 h MET 585 Ca 0.14 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2va8 h MET 585 Cb 0.19 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.71 2va8 h MET 585 CO -0.25 0.65 0.00 -0.25 1.06 0.00 0.00 176.91 178.13 2va8 n ASP 586 N -4.33 0.47 -2.18 1.22 8.00 -0.67 -2.40 116.55 116.67 2va8 n ASP 586 Ca 0.04 -1.85 -0.18 0.00 0.71 0.00 0.00 54.79 53.52 2va8 n ASP 586 Cb 0.17 -0.05 0.01 0.00 -0.02 0.00 0.00 41.12 41.22 2va8 n ASP 586 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2va8 n GLU 587 N -0.31 -2.35 -2.07 -1.24 1.02 -0.97 -4.89 120.64 109.84 2va8 n GLU 587 Ca 0.06 0.81 -0.41 0.00 -0.02 0.00 0.00 57.16 57.61 2va8 n GLU 587 Cb 0.09 -5.30 -0.02 0.00 -0.02 0.00 0.00 31.44 26.19 2va8 n GLU 587 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2va8 s VAL 588 N -2.94 2.73 0.26 2.62 1.01 -0.74 -4.92 120.40 118.42 2va8 s VAL 588 Ca 0.09 0.65 -0.30 0.00 0.00 0.00 0.00 61.98 62.42 2va8 s VAL 588 Cb -0.04 -3.42 -0.14 0.00 0.00 0.00 0.00 36.38 32.79 2va8 s VAL 588 CO 0.11 0.12 1.29 -0.67 0.00 0.00 0.00 175.10 175.95 2va8 n ASP 589 N 1.75 2.36 -0.21 3.32 -0.08 -1.26 -4.79 116.55 117.63 2va8 n ASP 589 Ca 0.04 1.16 0.01 0.00 -1.51 0.00 0.00 54.79 54.50 2va8 n ASP 589 Cb 0.41 -1.39 0.11 0.00 2.34 0.00 0.00 41.12 42.58 2va8 n ASP 589 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2va8 h GLU 590 N 3.39 0.11 -0.69 -0.67 4.81 -1.98 -1.57 114.58 117.99 2va8 h GLU 590 Ca -0.44 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2va8 h GLU 590 Cb 1.30 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.62 2va8 h GLU 590 CO 0.70 0.08 0.37 -0.44 -0.73 0.00 0.00 179.01 178.99 2va8 h ASP 591 N 0.12 0.86 0.17 1.04 3.45 -1.94 0.32 116.42 120.43 2va8 h ASP 591 Ca 0.33 -0.07 -0.01 0.00 0.43 0.00 0.00 57.03 57.71 2va8 h ASP 591 Cb 0.54 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 39.09 2va8 h ASP 591 CO -0.54 0.69 -0.08 0.74 -1.57 0.00 0.00 179.24 178.48 2va8 h THR 592 N 0.97 0.84 -0.58 0.35 2.02 -1.68 -1.93 112.91 112.90 2va8 h THR 592 Ca 0.25 -0.05 0.02 0.00 0.77 0.00 0.00 66.41 67.40 2va8 h THR 592 Cb 0.03 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 2va8 h THR 592 CO -0.04 0.01 0.36 0.40 0.37 0.00 0.00 175.52 176.62 2va8 h ILE 593 N -0.25 1.08 -0.63 3.11 2.04 -0.58 -0.30 117.51 121.98 2va8 h ILE 593 Ca -0.02 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.52 2va8 h ILE 593 Cb 0.19 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 2va8 h ILE 593 CO 0.04 0.13 0.13 -0.07 0.00 0.00 0.00 178.15 178.38 2va8 h LEU 594 N 0.71 0.98 -0.07 1.44 3.38 -0.30 -2.39 115.31 119.07 2va8 h LEU 594 Ca 0.23 -0.25 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 2va8 h LEU 594 Cb 0.00 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.50 2va8 h LEU 594 CO -0.09 0.98 -0.47 -1.28 0.09 0.00 0.00 178.44 177.66 2va8 h SER 595 N 0.95 0.54 -0.84 -0.43 0.87 -1.20 -0.29 113.55 113.15 2va8 h SER 595 Ca 0.20 -0.67 0.13 0.00 -1.23 0.00 0.00 61.79 60.22 2va8 h SER 595 Cb 0.39 -0.16 -0.09 0.00 -0.44 0.00 0.00 62.40 62.11 2va8 h SER 595 CO 0.01 1.13 0.45 0.50 -0.53 0.00 0.00 176.83 178.38 2va8 h LYS 596 N -0.00 0.66 -0.06 2.24 3.64 -1.04 -2.98 116.57 119.03 2va8 h LYS 596 Ca -0.04 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2va8 h LYS 596 Cb 1.13 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 2va8 h LYS 596 CO 0.10 0.44 0.00 0.66 -2.27 0.00 0.00 179.45 178.38 2va8 n TYR 597 N -4.82 0.05 -3.70 1.91 4.02 -0.90 -4.99 117.16 108.73 2va8 n TYR 597 Ca 0.16 -0.04 -0.23 0.00 -0.01 0.00 0.00 57.90 57.78 2va8 n TYR 597 Cb 0.38 -0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.74 2va8 n TYR 597 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2va8 n ASN 598 N 0.91 -2.65 -4.47 7.72 4.05 -0.20 -5.01 115.26 115.61 2va8 n ASN 598 Ca 0.10 -0.75 -0.24 0.00 0.45 0.00 0.00 54.58 54.14 2va8 n ASN 598 Cb 0.41 -4.27 -0.10 0.00 1.23 0.00 0.00 39.78 37.05 2va8 n ASN 598 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 2va8 s ILE 599 N -3.50 2.26 0.41 -1.44 -4.36 -0.70 -5.03 121.20 108.83 2va8 s ILE 599 Ca 0.21 -2.31 -0.01 0.00 -0.26 0.00 0.00 60.65 58.28 2va8 s ILE 599 Cb -0.10 -2.38 -0.03 0.00 1.25 0.00 0.00 42.46 41.20 2va8 s ILE 599 CO 0.80 -0.36 0.64 -0.83 0.24 0.00 0.00 174.94 175.42 2va8 s GLY 600 N -3.51 1.43 0.38 6.27 0.00 -1.26 -4.62 107.32 106.01 2va8 s GLY 600 Ca 0.30 -0.83 0.10 0.00 0.00 0.00 0.00 44.72 44.28 2va8 s GLY 600 CO 0.14 -0.72 1.92 1.48 0.00 0.00 0.00 173.10 175.92 2va8 h SER 601 N 0.53 0.58 -0.40 1.64 4.64 -1.80 -1.48 113.55 117.27 2va8 h SER 601 Ca -0.48 0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 60.71 2va8 h SER 601 Cb 1.22 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 2va8 h SER 601 CO 0.61 0.33 -0.31 1.23 -0.87 0.00 0.00 176.83 177.81 2va8 h GLY 602 N 0.63 1.01 0.84 -0.77 0.00 -0.99 -2.43 103.07 101.37 2va8 h GLY 602 Ca 0.37 -0.97 0.02 0.00 0.00 0.00 0.00 47.33 46.75 2va8 h GLY 602 CO -0.14 0.88 0.10 -0.55 0.00 0.00 0.00 176.54 176.83 2va8 h ASP 603 N 0.78 0.13 -0.41 0.19 3.32 -1.45 -1.66 116.42 117.32 2va8 h ASP 603 Ca 0.08 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.18 2va8 h ASP 603 Cb 0.89 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.40 2va8 h ASP 603 CO 0.08 0.11 0.20 0.25 -1.72 0.00 0.00 179.24 178.16 2va8 h LEU 604 N 0.22 0.29 -0.61 1.55 5.85 -1.22 -1.73 115.31 119.66 2va8 h LEU 604 Ca 0.10 0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.72 2va8 h LEU 604 Cb 0.05 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2va8 h LEU 604 CO -0.09 0.21 -0.24 0.03 -0.34 0.00 0.00 178.44 178.01 2va8 h ARG 605 N 0.41 0.85 -0.09 1.25 3.08 -1.38 -0.79 114.38 117.71 2va8 h ARG 605 Ca 0.17 -0.36 -0.00 0.00 0.07 0.00 0.00 59.98 59.87 2va8 h ARG 605 Cb 0.08 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 2va8 h ARG 605 CO -0.12 0.99 0.05 -0.91 -1.07 0.00 0.00 179.97 178.91 2va8 h ASN 606 N 0.73 0.10 -0.34 7.04 2.35 -1.18 -2.18 115.58 122.10 2va8 h ASN 606 Ca 0.10 -0.03 0.04 0.00 -0.55 0.00 0.00 56.30 55.85 2va8 h ASN 606 Cb 0.77 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 39.08 2va8 h ASN 606 CO 0.06 0.10 0.13 -0.03 -1.65 0.00 0.00 177.43 176.04 2va8 h MET 607 N 0.09 0.27 -0.19 0.81 4.05 -1.12 -1.67 114.93 117.17 2va8 h MET 607 Ca 0.03 -0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.46 2va8 h MET 607 Cb 0.02 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 30.73 2va8 h MET 607 CO -0.01 0.18 0.03 0.28 0.23 0.00 0.00 176.91 177.62 2va8 h VAL 608 N 0.28 0.91 -0.71 -5.77 2.07 -1.09 -0.62 116.25 111.32 2va8 h VAL 608 Ca 0.15 -0.04 0.01 0.00 0.82 0.00 0.00 66.70 67.64 2va8 h VAL 608 Cb 0.12 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 2va8 h VAL 608 CO -0.15 0.02 0.47 -0.08 0.02 0.00 0.00 177.57 177.84 2va8 h GLU 609 N 0.10 0.93 -0.35 1.57 4.81 -1.06 0.44 114.58 121.02 2va8 h GLU 609 Ca 0.09 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 2va8 h GLU 609 Cb 0.09 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 2va8 h GLU 609 CO -0.12 0.62 0.04 1.15 -0.73 0.00 0.00 179.01 179.96 2va8 h THR 610 N 0.96 1.25 -0.03 0.32 2.02 -1.14 -2.77 112.91 113.51 2va8 h THR 610 Ca 0.26 -0.89 -0.12 0.00 0.77 0.00 0.00 66.41 66.42 2va8 h THR 610 Cb -0.11 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 2va8 h THR 610 CO -0.06 0.30 -0.55 0.24 0.37 0.00 0.00 175.52 175.82 2va8 h MET 611 N 0.42 0.10 -0.06 6.66 2.86 -0.81 -0.22 114.93 123.87 2va8 h MET 611 Ca 0.10 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2va8 h MET 611 Cb 0.40 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 2va8 h MET 611 CO 0.01 0.63 -0.02 0.22 1.06 0.00 0.00 176.91 178.81 2va8 h ASP 612 N 0.08 -0.06 -0.30 1.22 3.58 -0.90 0.19 116.42 120.22 2va8 h ASP 612 Ca -0.00 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.47 2va8 h ASP 612 Cb 1.00 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 42.08 2va8 h ASP 612 CO 0.08 -0.02 0.19 -0.25 -2.88 0.00 0.00 179.24 176.35 2va8 h TRP 613 N -0.00 0.38 -0.43 0.28 7.01 -1.19 0.11 115.95 122.09 2va8 h TRP 613 Ca 0.03 0.01 -0.12 0.00 2.11 0.00 0.00 58.89 60.91 2va8 h TRP 613 Cb 0.05 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 26.97 2va8 h TRP 613 CO -0.12 0.26 -0.20 -0.07 -2.79 0.00 0.00 178.44 175.51 2va8 h LEU 614 N 0.39 0.93 -0.36 0.65 3.38 -0.94 -0.28 115.31 119.07 2va8 h LEU 614 Ca 0.11 -0.40 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 2va8 h LEU 614 Cb -0.02 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 2va8 h LEU 614 CO -0.02 1.12 -0.01 0.71 0.09 0.00 0.00 178.44 180.33 2va8 h THR 615 N 0.73 1.26 -0.56 0.22 1.35 -0.59 0.97 112.91 116.29 2va8 h THR 615 Ca 0.10 -1.01 0.10 0.00 -0.55 0.00 0.00 66.41 65.05 2va8 h THR 615 Cb 0.77 1.19 -0.08 0.00 -1.73 0.00 0.00 68.15 68.30 2va8 h THR 615 CO 0.06 0.34 0.12 0.22 -0.25 0.00 0.00 175.52 176.00 2va8 h TYR 616 N 0.46 0.19 -0.15 4.73 3.20 -0.94 -1.33 116.97 123.14 2va8 h TYR 616 Ca 0.10 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.86 2va8 h TYR 616 Cb 0.48 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.76 2va8 h TYR 616 CO 0.04 -0.02 -0.47 0.77 -1.64 0.00 0.00 178.16 176.84 2va8 h SER 617 N 0.25 0.66 -0.78 -2.11 0.02 -0.85 -2.87 113.55 107.89 2va8 h SER 617 Ca 0.29 -0.60 0.10 0.00 -0.84 0.00 0.00 61.79 60.73 2va8 h SER 617 Cb 0.41 -0.19 -0.07 0.00 0.14 0.00 0.00 62.40 62.68 2va8 h SER 617 CO -0.37 1.15 0.42 0.00 -1.14 0.00 0.00 176.83 176.89 2va8 h ALA 618 N 0.53 1.10 -0.36 3.77 0.00 -0.74 0.88 119.26 124.43 2va8 h ALA 618 Ca -0.02 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.00 2va8 h ALA 618 Cb 1.09 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 2va8 h ALA 618 CO 0.10 0.03 0.03 -0.92 0.00 0.00 0.00 179.25 178.49 2va8 h TYR 619 N 0.71 0.03 -0.18 0.00 3.20 -1.10 0.48 116.97 120.10 2va8 h TYR 619 Ca 0.38 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 62.12 2va8 h TYR 619 Cb 0.38 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 2va8 h TYR 619 CO -0.08 -0.04 -0.52 0.45 -1.64 0.00 0.00 178.16 176.34 2va8 h HIS 620 N 0.13 0.63 -0.84 -3.82 3.86 -1.16 -1.20 115.15 112.76 2va8 h HIS 620 Ca 0.18 -0.21 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 2va8 h HIS 620 Cb 0.23 -0.12 -0.04 0.00 1.06 0.00 0.00 27.41 28.54 2va8 h HIS 620 CO -0.23 0.92 0.49 -0.07 0.86 0.00 0.00 177.93 179.90 2va8 h LEU 621 N 0.40 1.02 -0.71 2.43 3.38 -0.50 -0.04 115.31 121.29 2va8 h LEU 621 Ca 0.01 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2va8 h LEU 621 Cb 1.04 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 2va8 h LEU 621 CO 0.09 0.79 0.40 -1.28 0.09 0.00 0.00 178.44 178.54 2va8 h SER 622 N 1.15 0.87 -0.50 -0.43 0.87 -0.55 0.78 113.55 115.74 2va8 h SER 622 Ca 0.30 -0.08 -0.11 0.00 -1.23 0.00 0.00 61.79 60.67 2va8 h SER 622 Cb -0.03 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.70 2va8 h SER 622 CO -0.05 0.70 -0.10 0.03 -0.53 0.00 0.00 176.83 176.87 2va8 h ARG 623 N 0.97 0.96 -0.45 2.24 2.47 -1.00 -0.06 114.38 119.51 2va8 h ARG 623 Ca 0.25 -0.36 0.04 0.00 -1.26 0.00 0.00 59.98 58.65 2va8 h ARG 623 Cb 0.01 -0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 28.23 2va8 h ARG 623 CO -0.04 1.03 0.21 1.49 0.56 0.00 0.00 179.97 183.21 2va8 h GLU 624 N 0.82 0.41 0.00 0.04 4.57 -0.66 -2.71 114.58 117.05 2va8 h GLU 624 Ca 0.13 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2va8 h GLU 624 Cb 0.66 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 2va8 h GLU 624 CO 0.05 0.27 0.00 1.28 -1.18 0.00 0.00 179.01 179.43 2va8 n LEU 625 N -4.93 0.00 -3.71 1.64 4.77 0.24 -4.91 117.00 110.10 2va8 n LEU 625 Ca 0.03 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.75 2va8 n LEU 625 Cb 0.13 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.28 2va8 n LEU 625 CO 0.28 0.00 0.20 0.29 -1.33 0.00 0.00 177.39 176.83 2va8 n LYS 626 N -0.86 -7.09 -3.50 3.23 5.02 -0.80 -4.95 118.16 109.21 2va8 n LYS 626 Ca 0.17 0.75 -0.41 0.00 -2.02 0.00 0.00 58.31 56.79 2va8 n LYS 626 Cb 0.08 -5.74 -0.05 0.00 -0.02 0.00 0.00 35.03 29.30 2va8 n LYS 626 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2va8 s LEU 627 N -7.30 6.02 0.10 -0.35 1.43 -0.10 -4.94 118.68 113.53 2va8 s LEU 627 Ca 0.61 -3.15 -0.13 0.00 -1.03 0.00 0.00 54.13 50.44 2va8 s LEU 627 Cb -0.28 -2.05 -0.17 0.00 0.03 0.00 0.00 46.19 43.72 2va8 s LEU 627 CO 0.77 -0.38 1.29 0.78 0.23 0.00 0.00 176.35 179.04 2va8 h ASN 628 N 6.96 0.95 -0.12 2.29 2.35 -1.93 -1.51 115.58 124.58 2va8 h ASN 628 Ca 0.10 -0.64 0.03 0.00 -0.55 0.00 0.00 56.30 55.23 2va8 h ASN 628 Cb 0.93 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 2va8 h ASN 628 CO 0.81 1.45 -0.03 -0.33 -1.65 0.00 0.00 177.43 177.68 2va8 h GLU 629 N 0.53 -0.00 -0.53 0.81 5.08 -1.97 -1.20 114.58 117.29 2va8 h GLU 629 Ca -0.07 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2va8 h GLU 629 Cb 1.46 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.68 2va8 h GLU 629 CO 0.17 -0.00 0.34 0.45 -1.00 0.00 0.00 179.01 178.97 2va8 h HIS 630 N -0.00 0.64 -0.69 4.33 3.86 -1.95 -2.79 115.15 118.55 2va8 h HIS 630 Ca 0.06 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.32 2va8 h HIS 630 Cb 0.09 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 28.31 2va8 h HIS 630 CO -0.17 0.39 0.43 0.00 0.86 0.00 0.00 177.93 179.44 2va8 h ALA 631 N 1.21 0.90 -0.79 2.45 0.00 -1.04 0.40 119.26 122.39 2va8 h ALA 631 Ca 0.20 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2va8 h ALA 631 Cb -0.05 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 2va8 h ALA 631 CO -0.06 0.20 0.39 -0.44 0.00 0.00 0.00 179.25 179.34 2va8 h ASP 632 N 0.84 1.01 -0.46 0.00 3.32 -1.07 -0.28 116.42 119.77 2va8 h ASP 632 Ca 0.28 -0.11 -0.10 0.00 0.02 0.00 0.00 57.03 57.12 2va8 h ASP 632 Cb 0.02 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 2va8 h ASP 632 CO -0.11 0.84 -0.09 0.11 -1.72 0.00 0.00 179.24 178.27 2va8 h LYS 633 N 1.11 0.87 -0.04 3.56 1.79 -1.14 -3.03 116.57 119.70 2va8 h LYS 633 Ca 0.27 -0.32 -0.09 0.00 -2.18 0.00 0.00 60.65 58.32 2va8 h LYS 633 Cb 0.09 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.68 2va8 h LYS 633 CO -0.04 0.96 -0.42 -0.07 -1.08 0.00 0.00 179.45 178.81 2va8 h LEU 634 N 0.72 0.08 -0.33 2.94 3.38 -0.68 -0.23 115.31 121.19 2va8 h LEU 634 Ca 0.12 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 2va8 h LEU 634 Cb 0.63 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2va8 h LEU 634 CO 0.04 0.50 -0.22 -0.09 0.09 0.00 0.00 178.44 178.76 2va8 h ARG 635 N 0.07 0.74 -0.18 1.13 2.43 -1.04 -1.52 114.38 116.02 2va8 h ARG 635 Ca 0.00 -0.35 -0.09 0.00 -0.81 0.00 0.00 59.98 58.74 2va8 h ARG 635 Cb 0.77 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.31 2va8 h ARG 635 CO 0.06 0.96 -0.24 0.82 -1.51 0.00 0.00 179.97 180.06 2va8 h ILE 636 N 0.51 1.34 -0.57 1.20 2.04 -1.48 -2.90 117.51 117.65 2va8 h ILE 636 Ca 0.07 -1.44 0.12 0.00 1.00 0.00 0.00 64.86 64.60 2va8 h ILE 636 Cb 0.78 1.87 -0.10 0.00 -0.74 0.00 0.00 36.82 38.62 2va8 h ILE 636 CO 0.06 0.44 -0.09 0.25 0.00 0.00 0.00 178.15 178.81 2va8 h LEU 637 N 0.12 -0.42 -0.32 1.44 5.85 -1.03 -0.21 115.31 120.73 2va8 h LEU 637 Ca 0.02 0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.94 2va8 h LEU 637 Cb 0.81 0.31 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 2va8 h LEU 637 CO 0.06 -0.16 0.10 -1.13 -0.34 0.00 0.00 178.44 176.97 2va8 h ASN 638 N 0.04 0.10 0.24 1.25 -0.73 -1.26 0.11 115.58 115.33 2va8 h ASN 638 Ca 0.28 0.04 -0.09 0.00 1.87 0.00 0.00 56.30 58.40 2va8 h ASN 638 Cb 0.44 0.03 -0.01 0.00 0.27 0.00 0.00 38.32 39.05 2va8 h ASN 638 CO -0.55 0.09 -0.37 -0.07 -0.37 0.00 0.00 177.43 176.17 2va8 h LEU 639 N 0.24 0.19 -0.17 0.34 3.38 -1.22 0.38 115.31 118.45 2va8 h LEU 639 Ca 0.15 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 2va8 h LEU 639 Cb 0.12 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2va8 h LEU 639 CO -0.16 0.55 -0.03 0.03 0.09 0.00 0.00 178.44 178.92 2va8 h ARG 640 N 0.16 0.31 -0.48 1.13 3.08 -0.56 -3.24 114.38 114.79 2va8 h ARG 640 Ca 0.02 -0.11 -0.11 0.00 0.07 0.00 0.00 59.98 59.84 2va8 h ARG 640 Cb 0.73 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.74 2va8 h ARG 640 CO 0.06 0.57 -0.15 0.28 -1.07 0.00 0.00 179.97 179.65 2va8 h VAL 641 N 0.03 1.27 -0.87 2.04 2.07 -0.51 0.17 116.25 120.45 2va8 h VAL 641 Ca 0.04 -1.29 0.05 0.00 0.82 0.00 0.00 66.70 66.33 2va8 h VAL 641 Cb 0.45 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 2va8 h VAL 641 CO 0.01 0.44 0.55 -0.09 0.02 0.00 0.00 177.57 178.51 2va8 h ARG 642 N 0.81 1.00 0.00 1.57 2.43 -0.99 -3.16 114.38 116.05 2va8 h ARG 642 Ca 0.12 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2va8 h ARG 642 Cb 0.69 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2va8 h ARG 642 CO 0.05 0.66 -0.43 -0.25 -1.51 0.00 0.00 179.97 178.50 2va8 n ASP 643 N -4.58 0.60 -2.69 -3.80 8.00 -1.22 -5.02 116.55 107.83 2va8 n ASP 643 Ca 0.12 -0.61 -0.11 0.00 0.71 0.00 0.00 54.79 54.90 2va8 n ASP 643 Cb 0.14 1.03 0.05 0.00 -0.02 0.00 0.00 41.12 42.33 2va8 n ASP 643 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2va8 n GLY 644 N 1.25 -0.34 3.18 0.44 0.00 0.55 -4.73 105.19 105.54 2va8 n GLY 644 Ca 0.01 0.15 -0.17 0.00 0.00 0.00 0.00 46.02 46.01 2va8 n GLY 644 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2va8 s ILE 645 N -3.26 1.10 0.56 -0.61 -4.36 -0.81 -4.16 121.20 109.66 2va8 s ILE 645 Ca 0.18 -1.44 -0.17 0.00 -0.26 0.00 0.00 60.65 58.96 2va8 s ILE 645 Cb -0.02 -1.19 -0.05 0.00 1.25 0.00 0.00 42.46 42.44 2va8 s ILE 645 CO 0.51 -0.33 1.06 -0.75 0.24 0.00 0.00 174.94 175.66 2va8 s LYS 646 N -2.11 3.45 0.56 0.37 2.47 -1.01 -4.62 119.74 118.85 2va8 s LYS 646 Ca 0.01 1.28 0.32 0.00 -1.56 0.00 0.00 55.97 56.02 2va8 s LYS 646 Cb -0.08 -2.05 1.47 0.00 -1.46 0.00 0.00 37.83 35.71 2va8 s LYS 646 CO 0.02 -0.71 1.83 1.49 0.16 0.00 0.00 175.35 178.14 2va8 h GLU 647 N 0.81 0.00 -0.05 4.03 4.81 -1.97 0.02 114.58 122.23 2va8 h GLU 647 Ca -0.48 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2va8 h GLU 647 Cb 1.22 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 2va8 h GLU 647 CO 0.58 0.00 0.05 1.05 -0.73 0.00 0.00 179.01 179.95 2va8 h GLU 648 N 0.00 0.00 -0.01 1.92 4.11 -2.00 -2.59 114.58 116.00 2va8 h GLU 648 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.84 2va8 h GLU 648 Cb 1.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.06 2va8 h GLU 648 CO -0.00 0.00 -0.31 1.28 0.07 0.00 0.00 179.01 180.05 2va8 n LEU 649 N -4.00 1.54 -0.35 3.06 4.77 -0.01 -4.54 117.00 117.48 2va8 n LEU 649 Ca -0.02 -0.50 0.03 0.00 -0.03 0.00 0.00 56.01 55.49 2va8 n LEU 649 Cb 0.14 -0.06 0.18 0.00 -2.33 0.00 0.00 43.42 41.35 2va8 n LEU 649 CO 0.29 0.28 1.23 -0.07 -1.33 0.00 0.00 177.39 177.79 2va8 h LEU 650 N 1.92 0.93 -0.51 2.23 3.38 -1.59 -1.99 115.31 119.68 2va8 h LEU 650 Ca 0.00 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 2va8 h LEU 650 Cb 0.62 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2va8 h LEU 650 CO 0.00 0.56 0.14 -0.33 0.09 0.00 0.00 178.44 178.90 2va8 h GLU 651 N 1.04 0.80 -0.25 1.13 5.08 -1.82 -3.28 114.58 117.28 2va8 h GLU 651 Ca 0.43 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.59 2va8 h GLU 651 Cb 0.28 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2va8 h GLU 651 CO -0.21 0.76 0.07 -0.07 -1.00 0.00 0.00 179.01 178.56 2va8 h LEU 652 N 0.69 0.37 -0.66 1.33 3.38 -1.65 -3.02 115.31 115.75 2va8 h LEU 652 Ca 0.16 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2va8 h LEU 652 Cb 0.31 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2va8 h LEU 652 CO -0.00 0.49 0.00 1.33 0.09 0.00 0.00 178.44 180.35 2va8 n VAL 653 N -4.74 1.10 -0.07 1.22 0.24 -1.06 -2.03 118.33 112.99 2va8 n VAL 653 Ca -0.03 0.42 0.13 0.00 -2.04 0.00 0.00 64.34 62.81 2va8 n VAL 653 Cb 0.17 -1.34 0.52 0.00 -1.47 0.00 0.00 33.84 31.71 2va8 n VAL 653 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 2va8 h GLN 654 N 0.00 0.36 -6.44 7.34 4.20 -1.58 -3.43 115.11 115.56 2va8 h GLN 654 Ca 0.00 -0.02 -0.54 0.00 0.06 0.00 0.00 58.65 58.15 2va8 h GLN 654 Cb 0.19 -0.08 0.02 0.00 0.30 0.00 0.00 27.48 27.90 2va8 h GLN 654 CO 0.00 0.24 0.92 0.42 -0.67 0.00 0.00 178.83 179.74 2va8 s ILE 655 N -5.36 3.25 0.01 2.54 1.01 -0.86 -4.94 121.20 116.85 2va8 s ILE 655 Ca -0.07 0.71 -0.33 0.00 0.00 0.00 0.00 60.65 60.96 2va8 s ILE 655 Cb 0.20 -3.46 -0.12 0.00 0.01 0.00 0.00 42.46 39.09 2va8 s ILE 655 CO 0.75 0.01 1.82 -0.24 0.00 0.00 0.00 174.94 177.27 2va8 n SER 656 N 5.30 3.51 0.00 3.58 2.88 -1.26 -1.06 113.62 126.57 2va8 n SER 656 Ca 0.15 0.99 0.00 0.00 -1.33 0.00 0.00 58.87 58.68 2va8 n SER 656 Cb 0.42 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.46 2va8 n SER 656 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2va8 n GLY 657 N 4.17 1.21 3.45 0.46 0.00 -1.26 -4.82 105.19 108.40 2va8 n GLY 657 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 2va8 n GLY 657 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2va8 s VAL 658 N -3.00 4.99 0.00 1.61 1.01 -0.22 -4.99 120.40 119.79 2va8 s VAL 658 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.38 2va8 s VAL 658 Cb 0.00 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.67 2va8 s VAL 658 CO 0.00 -0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.52 2va8 n GLY 659 N 5.08 1.65 0.26 4.51 0.00 -1.26 -4.47 105.19 110.96 2va8 n GLY 659 Ca -0.12 -2.05 -0.08 0.00 0.00 0.00 0.00 46.02 43.76 2va8 n GLY 659 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2va8 h ARG 660 N 0.00 0.88 0.24 1.61 2.43 -1.96 0.44 114.38 118.03 2va8 h ARG 660 Ca 0.00 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 58.96 2va8 h ARG 660 Cb 0.00 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 2va8 h ARG 660 CO 0.00 0.81 -0.11 0.87 -1.51 0.00 0.00 179.97 180.03 2va8 h LYS 661 N 0.79 -0.31 -0.01 0.20 1.57 -1.95 0.56 116.57 117.42 2va8 h LYS 661 Ca 0.18 0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.89 2va8 h LYS 661 Cb 0.31 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 2va8 h LYS 661 CO -0.00 -0.13 -0.42 0.00 -0.57 0.00 0.00 179.45 178.33 2va8 h ARG 662 N -0.42 0.02 -0.12 3.15 3.08 -1.94 -0.48 114.38 117.67 2va8 h ARG 662 Ca -0.03 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 2va8 h ARG 662 Cb 0.32 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 2va8 h ARG 662 CO 0.05 0.44 -0.07 0.00 -1.07 0.00 0.00 179.97 179.32 2va8 h ALA 663 N 1.56 0.17 -0.50 0.04 0.00 -0.68 -1.77 119.26 118.08 2va8 h ALA 663 Ca -0.00 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 54.72 2va8 h ALA 663 Cb 0.75 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 2va8 h ALA 663 CO 0.06 -0.03 0.14 -0.09 0.00 0.00 0.00 179.25 179.33 2va8 h ARG 664 N -0.10 0.28 -0.39 0.00 9.65 0.31 0.10 114.38 124.23 2va8 h ARG 664 Ca 0.03 -0.02 0.06 0.00 -1.10 0.00 0.00 59.98 58.94 2va8 h ARG 664 Cb 0.55 -0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 29.02 2va8 h ARG 664 CO 0.02 0.18 0.10 1.25 2.80 0.00 0.00 179.97 184.33 2va8 h LEU 665 N 0.29 0.06 0.42 3.80 5.85 -1.05 -2.55 115.31 122.13 2va8 h LEU 665 Ca 0.25 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 59.01 2va8 h LEU 665 Cb 0.31 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2va8 h LEU 665 CO -0.30 0.07 -0.20 -0.07 -0.34 0.00 0.00 178.44 177.60 2va8 h LEU 666 N 0.24 -0.48 -0.80 2.25 3.38 -0.45 -2.91 115.31 116.53 2va8 h LEU 666 Ca 0.19 -0.02 0.14 0.00 0.09 0.00 0.00 57.88 58.27 2va8 h LEU 666 Cb 0.20 0.12 -0.09 0.00 0.09 0.00 0.00 40.66 40.99 2va8 h LEU 666 CO -0.22 -0.29 0.39 0.22 0.09 0.00 0.00 178.44 178.63 2va8 h TYR 667 N -0.64 0.68 0.00 1.13 5.03 -0.49 -0.94 116.97 121.74 2va8 h TYR 667 Ca -0.06 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.29 2va8 h TYR 667 Cb 0.48 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 38.57 2va8 h TYR 667 CO -0.03 0.16 0.00 -0.91 -1.32 0.00 0.00 178.16 176.06 2va8 h ASN 668 N 0.58 0.00 -0.45 -2.11 4.21 -1.46 -2.40 115.58 113.95 2va8 h ASN 668 Ca 0.43 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.94 2va8 h ASN 668 Cb 0.59 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.79 2va8 h ASN 668 CO -0.35 0.00 0.00 0.59 -1.29 0.00 0.00 177.43 176.38 2va8 n ASN 669 N -2.49 3.21 0.00 5.81 3.02 -0.45 -4.92 115.26 119.44 2va8 n ASN 669 Ca 0.04 -2.24 0.00 0.00 -0.03 0.00 0.00 54.58 52.35 2va8 n ASN 669 Cb 0.40 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 2va8 n ASN 669 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2va8 n GLY 670 N 0.93 0.82 3.40 7.41 0.00 -0.90 -5.01 105.19 111.84 2va8 n GLY 670 Ca 0.17 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.74 2va8 n GLY 670 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2va8 s ILE 671 N -3.06 4.88 -0.06 -0.61 1.01 -0.67 -4.86 121.20 117.83 2va8 s ILE 671 Ca 0.00 -1.43 0.17 0.00 0.00 0.00 0.00 60.65 59.39 2va8 s ILE 671 Cb 0.00 -4.62 -0.26 0.00 0.01 0.00 0.00 42.46 37.59 2va8 s ILE 671 CO 0.00 -1.29 0.32 0.29 0.00 0.00 0.00 174.94 174.25 2va8 n LYS 672 N 6.12 0.71 -4.27 2.79 5.02 -1.26 -2.45 118.16 124.82 2va8 n LYS 672 Ca 0.08 -0.13 -0.15 0.00 -2.02 0.00 0.00 58.31 56.10 2va8 n LYS 672 Cb 0.46 -1.42 -0.10 0.00 -0.02 0.00 0.00 35.03 33.95 2va8 n LYS 672 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2va8 s GLU 673 N -3.05 1.14 0.31 1.97 2.02 -1.26 -4.70 118.70 115.12 2va8 s GLU 673 Ca -0.07 -1.51 0.02 0.00 0.02 0.00 0.00 54.97 53.42 2va8 s GLU 673 Cb 0.10 -0.61 0.57 0.00 0.10 0.00 0.00 34.13 34.29 2va8 s GLU 673 CO 0.72 0.02 1.90 -0.07 0.02 0.00 0.00 175.26 177.86 2va8 h LEU 674 N 2.69 0.87 -1.41 1.80 3.38 -1.95 -1.83 115.31 118.87 2va8 h LEU 674 Ca -0.37 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.55 2va8 h LEU 674 Cb 1.20 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 2va8 h LEU 674 CO 0.64 0.55 -0.30 1.23 0.09 0.00 0.00 178.44 180.64 2va8 h GLY 675 N 0.98 0.00 1.23 0.83 0.00 -1.96 -1.57 103.07 102.58 2va8 h GLY 675 Ca 0.40 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.65 2va8 h GLY 675 CO -0.16 0.00 0.04 -0.55 0.00 0.00 0.00 176.54 175.87 2va8 h ASP 676 N 0.00 0.90 0.31 0.19 3.32 -1.74 -1.54 116.42 117.86 2va8 h ASP 676 Ca -0.00 -0.22 -0.02 0.00 0.02 0.00 0.00 57.03 56.81 2va8 h ASP 676 Cb 0.53 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2va8 h ASP 676 CO 0.04 0.94 -0.15 0.58 -1.72 0.00 0.00 179.24 178.92 2va8 h VAL 677 N 0.87 0.72 -0.97 -1.35 2.07 -1.11 -0.88 116.25 115.60 2va8 h VAL 677 Ca 0.17 -0.35 0.12 0.00 0.82 0.00 0.00 66.70 67.46 2va8 h VAL 677 Cb 0.46 0.91 -0.09 0.00 -1.52 0.00 0.00 31.29 31.05 2va8 h VAL 677 CO 0.02 0.07 0.59 0.58 0.02 0.00 0.00 177.57 178.85 2va8 h VAL 678 N -0.61 0.89 -0.00 2.57 2.07 -1.34 -2.93 116.25 116.89 2va8 h VAL 678 Ca -0.04 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2va8 h VAL 678 Cb 0.44 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 2va8 h VAL 678 CO 0.07 0.17 -0.59 0.23 0.02 0.00 0.00 177.57 177.47 2va8 n MET 679 N -4.67 0.20 -2.95 1.57 2.00 -0.58 -4.16 117.12 108.53 2va8 n MET 679 Ca 0.18 -0.14 -0.25 0.00 0.00 0.00 0.00 57.70 57.49 2va8 n MET 679 Cb 0.37 -1.50 -0.03 0.00 0.00 0.00 0.00 33.22 32.05 2va8 n MET 679 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2va8 n ASN 680 N -1.28 3.80 0.14 7.83 3.02 -0.34 -4.91 115.26 123.52 2va8 n ASN 680 Ca 0.06 -3.55 0.13 0.00 -0.03 0.00 0.00 54.58 51.19 2va8 n ASN 680 Cb 0.34 -0.56 0.45 0.00 -0.61 0.00 0.00 39.78 39.40 2va8 n ASN 680 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2va8 h PRO 681 N 2.96 0.00 -0.03 3.52 0.13 -1.71 -1.54 132.00 135.33 2va8 h PRO 681 Ca 0.13 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.07 2va8 h PRO 681 Cb 0.62 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.77 2va8 h PRO 681 CO 0.76 0.00 -0.72 0.22 -0.23 0.00 0.00 178.00 178.03 2va8 h ASP 682 N 0.00 0.68 1.28 1.44 -0.00 -1.90 -2.93 116.42 114.98 2va8 h ASP 682 Ca 0.00 -0.73 0.00 0.00 -0.00 0.00 0.00 57.03 56.30 2va8 h ASP 682 Cb 0.57 -0.21 0.00 0.00 -0.00 0.00 0.00 39.33 39.70 2va8 h ASP 682 CO 0.00 1.31 0.00 1.17 -0.00 0.00 0.00 179.24 181.72 2va8 n LYS 683 N -4.10 0.20 0.06 0.28 4.81 -0.90 -1.62 118.16 116.89 2va8 n LYS 683 Ca -0.10 0.20 -0.21 0.00 -0.87 0.00 0.00 58.31 57.33 2va8 n LYS 683 Cb 0.72 -1.75 -0.15 0.00 0.02 0.00 0.00 35.03 33.88 2va8 n LYS 683 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2va8 h VAL 684 N 0.00 1.43 0.00 3.15 2.07 -1.36 -2.99 116.25 118.55 2va8 h VAL 684 Ca 0.00 -2.54 -0.04 0.00 0.82 0.00 0.00 66.70 64.94 2va8 h VAL 684 Cb 0.64 3.13 -0.01 0.00 -1.52 0.00 0.00 31.29 33.53 2va8 h VAL 684 CO 0.00 0.73 -0.19 0.11 0.02 0.00 0.00 177.57 178.24 2va8 h LYS 685 N -0.30 0.00 0.00 1.57 1.57 -1.45 0.22 116.57 118.17 2va8 h LYS 685 Ca -0.18 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 2va8 h LYS 685 Cb 1.72 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.02 2va8 h LYS 685 CO 0.16 0.19 -0.47 -0.97 -0.57 0.00 0.00 179.45 177.79 2va8 h ASN 686 N 0.00 0.00 0.00 0.86 -0.73 -1.37 -2.49 115.58 111.86 2va8 h ASN 686 Ca -0.00 0.00 -0.35 0.00 1.87 0.00 0.00 56.30 57.82 2va8 h ASN 686 Cb 0.61 0.00 -0.06 0.00 0.27 0.00 0.00 38.32 39.14 2va8 h ASN 686 CO 0.02 0.47 -2.34 0.18 -0.37 0.00 0.00 177.43 175.39 2va8 n LEU 687 N -3.53 2.29 -0.00 0.34 4.77 -0.95 -4.68 117.00 115.24 2va8 n LEU 687 Ca -0.00 -0.10 0.08 0.00 -0.03 0.00 0.00 56.01 55.96 2va8 n LEU 687 Cb 0.58 -0.53 -0.11 0.00 -2.33 0.00 0.00 43.42 41.03 2va8 n LEU 687 CO 0.39 0.80 -0.26 0.18 -1.33 0.00 0.00 177.39 177.17 2va8 n LEU 688 N -3.08 0.53 0.00 2.23 4.77 0.72 -5.10 117.00 117.07 2va8 n LEU 688 Ca -0.39 -0.34 0.00 0.00 -0.03 0.00 0.00 56.01 55.25 2va8 n LEU 688 Cb 0.98 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.07 2va8 n LEU 688 CO 0.27 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 2va8 n GLY 689 N 1.44 2.32 0.44 -0.72 0.00 -0.94 -4.42 105.19 103.31 2va8 n GLY 689 Ca 0.01 -1.85 -0.18 0.00 0.00 0.00 0.00 46.02 44.00 2va8 n GLY 689 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2va8 h GLN 690 N 0.00 -0.98 -0.05 1.61 4.20 -1.91 0.34 115.11 118.32 2va8 h GLN 690 Ca 0.00 0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2va8 h GLN 690 Cb 0.00 0.22 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 2va8 h GLN 690 CO 0.00 -0.65 0.00 0.87 -0.67 0.00 0.00 178.83 178.38 2va8 h LYS 691 N -1.02 0.09 -0.28 1.46 1.57 -1.94 0.11 116.57 116.56 2va8 h LYS 691 Ca -0.09 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.54 2va8 h LYS 691 Cb 0.81 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 2va8 h LYS 691 CO 0.10 0.37 -0.33 1.25 -0.57 0.00 0.00 179.45 180.27 2va8 h LEU 692 N -0.20 0.62 -0.68 2.94 5.85 -1.83 -2.99 115.31 119.03 2va8 h LEU 692 Ca 0.01 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.49 2va8 h LEU 692 Cb 0.33 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 2va8 h LEU 692 CO 0.00 0.91 0.43 1.23 -0.34 0.00 0.00 178.44 180.67 2va8 h GLY 693 N 1.02 0.96 0.63 3.75 0.00 -0.15 -2.00 103.07 107.29 2va8 h GLY 693 Ca 0.06 -0.38 0.02 0.00 0.00 0.00 0.00 47.33 47.03 2va8 h GLY 693 CO 0.07 0.37 -0.18 -2.09 0.00 0.00 0.00 176.54 174.71 2va8 h GLU 694 N 0.92 -0.31 -0.48 4.80 4.81 -0.72 -2.90 114.58 120.70 2va8 h GLU 694 Ca 0.25 0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.43 2va8 h GLU 694 Cb -0.07 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2va8 h GLU 694 CO -0.05 -0.21 0.02 -0.22 -0.73 0.00 0.00 179.01 177.82 2va8 h LYS 695 N -0.32 0.78 -0.40 1.92 3.64 -1.40 -2.75 116.57 118.03 2va8 h LYS 695 Ca 0.04 -0.20 -0.03 0.00 -1.27 0.00 0.00 60.65 59.19 2va8 h LYS 695 Cb 0.37 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2va8 h LYS 695 CO -0.13 0.77 0.13 0.28 -2.27 0.00 0.00 179.45 178.23 2va8 h VAL 696 N 0.73 1.17 -0.02 2.00 2.07 -1.28 -1.95 116.25 118.97 2va8 h VAL 696 Ca 0.15 -0.56 -0.23 0.00 0.82 0.00 0.00 66.70 66.88 2va8 h VAL 696 Cb 0.41 0.72 0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2va8 h VAL 696 CO 0.01 0.21 -0.93 0.58 0.02 0.00 0.00 177.57 177.47 2va8 h VAL 697 N 0.57 1.36 0.19 2.57 2.07 -1.32 -2.68 116.25 119.02 2va8 h VAL 697 Ca 0.14 -2.33 0.01 0.00 0.82 0.00 0.00 66.70 65.33 2va8 h VAL 697 Cb 0.17 2.34 -0.04 0.00 -1.52 0.00 0.00 31.29 32.24 2va8 h VAL 697 CO -0.01 0.71 -0.51 1.56 0.02 0.00 0.00 177.57 179.33 2va8 h GLN 698 N 0.29 -0.76 -0.96 1.57 7.50 -1.18 -3.02 115.11 118.56 2va8 h GLN 698 Ca -0.08 0.05 0.06 0.00 0.50 0.00 0.00 58.65 59.18 2va8 h GLN 698 Cb 1.56 0.17 -0.07 0.00 0.05 0.00 0.00 27.48 29.19 2va8 h GLN 698 CO 0.17 -0.50 0.61 0.93 -1.50 0.00 0.00 178.83 178.54 2va8 h GLU 699 N -0.79 1.08 -0.72 1.46 4.39 -1.42 -2.40 114.58 116.19 2va8 h GLU 699 Ca -0.02 -0.07 0.07 0.00 0.34 0.00 0.00 59.36 59.69 2va8 h GLU 699 Cb 0.76 -0.24 -0.06 0.00 -0.10 0.00 0.00 28.75 29.11 2va8 h GLU 699 CO -0.24 0.72 0.40 0.00 -1.16 0.00 0.00 179.01 178.73 2va8 h ALA 700 N 1.44 0.98 -0.12 3.43 0.00 -1.43 -0.69 119.26 122.87 2va8 h ALA 700 Ca 0.42 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 2va8 h ALA 700 Cb 0.17 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2va8 h ALA 700 CO -0.17 0.07 -0.01 0.00 0.00 0.00 0.00 179.25 179.14 2va8 h ALA 701 N 1.38 0.16 -0.03 0.00 0.00 -1.31 -2.07 119.26 117.39 2va8 h ALA 701 Ca 0.33 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 2va8 h ALA 701 Cb 0.24 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2va8 h ALA 701 CO -0.20 -0.14 -0.41 0.07 0.00 0.00 0.00 179.25 178.57 2va8 h ARG 702 N -0.07 0.07 0.10 0.00 -0.00 -1.28 0.19 114.38 113.40 2va8 h ARG 702 Ca 0.03 -0.03 -0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2va8 h ARG 702 Cb 0.38 -0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.35 2va8 h ARG 702 CO 0.01 0.47 -0.05 -0.07 -0.00 0.00 0.00 179.97 180.33 2va8 h LEU 703 N 0.06 -0.11 -1.07 0.08 3.38 -1.14 -3.15 115.31 113.36 2va8 h LEU 703 Ca 0.00 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.80 2va8 h LEU 703 Cb 0.75 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 2va8 h LEU 703 CO 0.06 0.12 0.62 -0.07 0.09 0.00 0.00 178.44 179.25 2va8 h LEU 704 N -0.34 1.08 0.00 1.67 3.38 -0.95 -3.51 115.31 116.64 2va8 h LEU 704 Ca -0.01 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2va8 h LEU 704 Cb 0.28 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2va8 h LEU 704 CO 0.02 0.79 0.00 0.59 0.09 0.00 0.00 178.44 179.93