#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2v6a s VAL 3 N 0.00 4.20 -0.09 2.03 1.01 -1.26 -4.86 120.40 121.42 2v6a s VAL 3 Ca 0.00 -0.22 -0.30 0.00 0.00 0.00 0.00 61.98 61.46 2v6a s VAL 3 Cb 0.00 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 2v6a s VAL 3 CO 0.00 0.40 1.47 0.86 0.00 0.00 0.00 175.10 177.83 2v6a s TRP 4 N 1.12 2.43 0.12 5.22 -0.11 -1.26 -0.50 118.94 125.95 2v6a s TRP 4 Ca 0.03 0.59 -0.30 0.00 1.22 0.00 0.00 56.10 57.64 2v6a s TRP 4 Cb -0.14 -3.72 -0.07 0.00 -1.50 0.00 0.00 33.47 28.04 2v6a s TRP 4 CO 0.02 -2.83 1.21 -0.08 -4.62 0.00 0.00 176.95 170.65 2v6a s THR 5 N 3.63 3.80 -1.71 5.86 -1.32 0.29 -4.91 115.64 121.27 2v6a s THR 5 Ca 0.65 1.38 0.28 0.00 -1.21 0.00 0.00 61.69 62.79 2v6a s THR 5 Cb -0.28 -3.88 0.39 0.00 -1.51 0.00 0.00 72.50 67.21 2v6a s THR 5 CO 0.23 0.16 1.75 -0.81 -2.21 0.00 0.00 174.62 173.74 2v6a n PRO 6 N 3.31 0.77 -3.78 7.08 -0.04 -1.26 -4.71 135.00 136.38 2v6a n PRO 6 Ca 0.07 -0.35 -0.36 0.00 -0.04 0.00 0.00 63.50 62.82 2v6a n PRO 6 Cb 0.45 -1.49 -0.10 0.00 -0.04 0.00 0.00 33.50 32.32 2v6a n PRO 6 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2v6a s VAL 7 N -2.47 5.00 -1.42 0.52 1.01 -1.26 -4.50 120.40 117.28 2v6a s VAL 7 Ca 0.27 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.28 2v6a s VAL 7 Cb 0.20 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 33.29 2v6a s VAL 7 CO 0.49 0.37 0.58 0.59 0.00 0.00 0.00 175.10 177.13 2v6a n ASN 8 N 4.23 -1.25 -2.33 3.32 5.03 -1.26 -4.89 115.26 118.11 2v6a n ASN 8 Ca -0.16 -0.94 -0.15 0.00 0.87 0.00 0.00 54.58 54.20 2v6a n ASN 8 Cb 0.52 -3.36 0.03 0.00 -1.02 0.00 0.00 39.78 35.95 2v6a n ASN 8 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 2v6a n ASN 9 N -2.96 3.70 -4.77 6.41 4.05 -1.09 -2.20 115.26 118.40 2v6a n ASN 9 Ca -0.24 -3.12 -0.39 0.00 0.45 0.00 0.00 54.58 51.28 2v6a n ASN 9 Cb 0.65 -0.39 -0.00 0.00 1.23 0.00 0.00 39.78 41.26 2v6a n ASN 9 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 2v6a s LYS 10 N -3.67 3.88 0.55 1.20 1.02 -0.09 -4.85 119.74 117.78 2v6a s LYS 10 Ca 0.42 2.04 0.04 0.00 0.02 0.00 0.00 55.97 58.49 2v6a s LYS 10 Cb 0.38 -2.65 0.03 0.00 -0.52 0.00 0.00 37.83 35.07 2v6a s LYS 10 CO 0.01 -0.53 0.28 -1.64 -0.92 0.00 0.00 175.35 172.55 2v6a s MET 11 N -2.37 2.23 -0.30 1.68 -1.94 -1.26 -4.68 119.30 112.67 2v6a s MET 11 Ca 0.59 -2.18 0.19 0.00 -1.71 0.00 0.00 55.69 52.58 2v6a s MET 11 Cb -0.35 -1.90 0.47 0.00 2.01 0.00 0.00 34.83 35.06 2v6a s MET 11 CO 0.45 -0.57 1.18 1.19 -0.01 0.00 0.00 175.02 177.25 2v6a n PHE 12 N -1.63 0.36 -4.86 -0.03 3.01 -1.26 -5.12 117.46 107.93 2v6a n PHE 12 Ca -0.08 -2.18 0.00 0.00 1.01 0.00 0.00 57.45 56.20 2v6a n PHE 12 Cb 0.65 0.20 0.00 0.00 -0.01 0.00 0.00 39.48 40.32 2v6a n PHE 12 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2v6a n GLU 13 N -0.67 0.00 -1.70 -1.08 -0.58 -1.26 -4.56 120.64 110.79 2v6a n GLU 13 Ca 0.02 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.33 2v6a n GLU 13 Cb 0.82 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.66 2v6a n GLU 13 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2v6a n THR 14 N 0.00 0.21 -0.70 2.62 -1.04 -1.26 -1.71 114.28 112.41 2v6a n THR 14 Ca 0.00 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 2v6a n THR 14 Cb 0.00 -2.02 0.00 0.00 -1.82 0.00 0.00 70.33 66.49 2v6a n THR 14 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2v6a n PHE 15 N 4.90 0.00 0.32 -1.42 0.99 -1.26 -4.57 117.46 116.42 2v6a n PHE 15 Ca 0.17 0.00 0.14 0.00 -0.00 0.00 0.00 57.45 57.76 2v6a n PHE 15 Cb 0.35 0.00 0.62 0.00 -1.00 0.00 0.00 39.48 39.45 2v6a n PHE 15 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 2v6a h SER 16 N 0.00 0.00 0.03 4.37 0.02 -1.61 -2.29 113.55 114.08 2v6a h SER 16 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2v6a h SER 16 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2v6a h SER 16 CO 0.00 0.00 -0.09 -1.22 -1.14 0.00 0.00 176.83 174.38 2v6a n TYR 17 N -2.51 0.00 -3.11 3.45 4.02 -1.26 -4.88 117.16 112.87 2v6a n TYR 17 Ca 0.01 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.71 2v6a n TYR 17 Cb 0.20 -0.02 0.01 0.00 -0.02 0.00 0.00 39.34 39.50 2v6a n TYR 17 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2v6a s LEU 18 N -2.13 3.71 0.65 7.72 1.43 -0.86 -5.08 118.68 124.12 2v6a s LEU 18 Ca 0.32 -0.27 -0.18 0.00 -1.03 0.00 0.00 54.13 52.98 2v6a s LEU 18 Cb 0.20 -2.74 -0.02 0.00 0.03 0.00 0.00 46.19 43.67 2v6a s LEU 18 CO 0.38 -0.70 1.10 -2.65 0.23 0.00 0.00 176.35 174.71 2v6a n PRO 19 N -1.85 0.88 -1.62 1.29 -0.02 -1.26 -4.88 135.00 127.54 2v6a n PRO 19 Ca 0.05 0.35 -0.45 0.00 -2.02 0.00 0.00 63.50 61.44 2v6a n PRO 19 Cb 0.59 -2.33 -0.02 0.00 -0.02 0.00 0.00 33.50 31.72 2v6a n PRO 19 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2v6a n PRO 20 N -1.60 1.57 -2.19 0.52 -0.02 -1.26 -4.86 135.00 127.16 2v6a n PRO 20 Ca 0.15 0.55 -0.42 0.00 -2.02 0.00 0.00 63.50 61.76 2v6a n PRO 20 Cb 0.48 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 2v6a n PRO 20 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2v6a s LEU 21 N 0.13 4.36 0.84 2.45 1.43 -1.26 -5.01 118.68 121.62 2v6a s LEU 21 Ca 0.61 2.27 -0.11 0.00 -1.03 0.00 0.00 54.13 55.87 2v6a s LEU 21 Cb -0.69 -3.58 0.09 0.00 0.03 0.00 0.00 46.19 42.05 2v6a s LEU 21 CO 0.58 -0.66 1.09 0.42 0.23 0.00 0.00 176.35 178.02 2v6a s THR 22 N 1.36 2.92 0.32 5.49 -4.23 -1.26 -4.79 115.64 115.45 2v6a s THR 22 Ca 0.64 0.30 0.04 0.00 -1.18 0.00 0.00 61.69 61.49 2v6a s THR 22 Cb -0.35 -2.93 0.29 0.00 1.34 0.00 0.00 72.50 70.85 2v6a s THR 22 CO 0.30 -0.39 1.89 0.44 -0.54 0.00 0.00 174.62 176.32 2v6a h ASP 23 N -1.27 0.81 -0.63 3.99 3.32 -1.99 0.42 116.42 121.07 2v6a h ASP 23 Ca -0.48 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.55 2v6a h ASP 23 Cb 1.27 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.65 2v6a h ASP 23 CO 0.57 0.47 0.21 -0.08 -1.72 0.00 0.00 179.24 178.69 2v6a h GLU 24 N 0.89 0.96 -0.46 3.56 4.81 -1.99 -0.89 114.58 121.47 2v6a h GLU 24 Ca 0.42 -0.20 -0.14 0.00 -0.13 0.00 0.00 59.36 59.31 2v6a h GLU 24 Cb 0.41 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2v6a h GLU 24 CO -0.18 0.84 -0.26 1.96 -0.73 0.00 0.00 179.01 180.65 2v6a h GLN 25 N 0.89 0.98 -0.25 1.92 4.20 -1.64 -1.18 115.11 120.04 2v6a h GLN 25 Ca 0.20 -0.45 -0.01 0.00 0.06 0.00 0.00 58.65 58.46 2v6a h GLN 25 Cb 0.27 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 2v6a h GLN 25 CO -0.01 1.12 0.13 0.82 -0.67 0.00 0.00 178.83 180.22 2v6a h ILE 26 N 0.83 1.12 -0.99 2.54 2.04 -0.87 -2.07 117.51 120.11 2v6a h ILE 26 Ca 0.10 -0.33 0.09 0.00 1.00 0.00 0.00 64.86 65.71 2v6a h ILE 26 Cb 0.84 0.89 -0.07 0.00 -0.74 0.00 0.00 36.82 37.74 2v6a h ILE 26 CO 0.07 0.12 0.64 0.00 0.00 0.00 0.00 178.15 178.98 2v6a h ALA 27 N 1.01 1.47 -0.71 1.87 0.00 -1.03 -1.16 119.26 120.70 2v6a h ALA 27 Ca 0.09 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2v6a h ALA 27 Cb 0.08 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2v6a h ALA 27 CO -0.01 0.35 0.19 0.00 0.00 0.00 0.00 179.25 179.77 2v6a h ALA 28 N 1.49 0.98 -0.65 0.00 0.00 -0.96 -0.49 119.26 119.64 2v6a h ALA 28 Ca 0.45 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 2v6a h ALA 28 Cb 0.30 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2v6a h ALA 28 CO -0.20 0.67 0.14 1.96 0.00 0.00 0.00 179.25 181.81 2v6a h GLN 29 N 1.08 1.04 -0.63 0.00 1.08 -0.65 -1.89 115.11 115.14 2v6a h GLN 29 Ca 0.23 -0.25 -0.05 0.00 -1.45 0.00 0.00 58.65 57.13 2v6a h GLN 29 Cb 0.35 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.62 2v6a h GLN 29 CO -0.00 0.94 0.21 0.28 -0.95 0.00 0.00 178.83 179.30 2v6a h VAL 30 N 0.99 1.24 -0.98 -0.54 2.07 -0.91 -2.02 116.25 116.10 2v6a h VAL 30 Ca 0.20 -0.82 0.08 0.00 0.82 0.00 0.00 66.70 66.99 2v6a h VAL 30 Cb 0.38 0.59 -0.07 0.00 -1.52 0.00 0.00 31.29 30.67 2v6a h VAL 30 CO 0.01 0.32 0.63 0.44 0.02 0.00 0.00 177.57 178.98 2v6a h ASP 31 N 0.90 0.97 -0.59 0.57 3.32 -0.82 -1.74 116.42 119.03 2v6a h ASP 31 Ca 0.20 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.23 2v6a h ASP 31 Cb 0.27 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 2v6a h ASP 31 CO -0.01 0.59 0.20 0.22 -1.72 0.00 0.00 179.24 178.52 2v6a h TYR 32 N 1.08 0.93 -0.10 4.55 3.20 -0.84 0.79 116.97 126.57 2v6a h TYR 32 Ca 0.45 -0.08 0.03 0.00 3.14 0.00 0.00 58.73 62.26 2v6a h TYR 32 Cb 0.29 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 2v6a h TYR 32 CO -0.00 0.76 -0.07 0.82 -1.64 0.00 0.00 178.16 178.03 2v6a h ILE 33 N 0.82 0.78 -0.43 1.81 2.04 -0.78 -2.59 117.51 119.17 2v6a h ILE 33 Ca 0.19 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.97 2v6a h ILE 33 Cb 0.25 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 2v6a h ILE 33 CO -0.01 0.00 -0.06 0.58 0.00 0.00 0.00 178.15 178.66 2v6a h VAL 34 N -0.08 1.27 -0.12 1.67 2.07 -1.14 -1.82 116.25 118.10 2v6a h VAL 34 Ca 0.07 -1.14 0.01 0.00 0.82 0.00 0.00 66.70 66.46 2v6a h VAL 34 Cb 0.18 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 2v6a h VAL 34 CO -0.15 0.39 0.08 0.00 0.02 0.00 0.00 177.57 177.90 2v6a h ALA 35 N 0.87 1.94 -0.02 1.67 0.00 -0.77 -2.20 119.26 120.75 2v6a h ALA 35 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2v6a h ALA 35 Cb 0.58 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2v6a h ALA 35 CO 0.03 0.05 -0.03 0.09 0.00 0.00 0.00 179.25 179.39 2v6a n ASN 36 N -4.52 2.53 -0.79 0.00 3.02 -0.98 -4.96 115.26 109.55 2v6a n ASN 36 Ca -0.01 -1.82 -0.08 0.00 -0.03 0.00 0.00 54.58 52.64 2v6a n ASN 36 Cb 0.10 0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.28 2v6a n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2v6a n GLY 37 N 1.31 0.43 3.91 7.41 0.00 -0.83 -5.03 105.19 112.40 2v6a n GLY 37 Ca 0.15 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 45.30 2v6a n GLY 37 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2v6a s TRP 38 N -2.36 3.28 -0.40 1.61 0.51 -0.74 -4.97 118.94 115.87 2v6a s TRP 38 Ca 0.00 0.68 -0.14 0.00 -2.12 0.00 0.00 56.10 54.52 2v6a s TRP 38 Cb 0.00 -2.74 0.02 0.00 -0.81 0.00 0.00 33.47 29.94 2v6a s TRP 38 CO 0.00 -0.82 0.28 0.42 -0.51 0.00 0.00 176.95 176.32 2v6a s ILE 39 N -3.00 5.12 0.51 2.03 1.01 -0.18 -4.70 121.20 121.98 2v6a s ILE 39 Ca 0.54 -0.68 -0.20 0.00 0.00 0.00 0.00 60.65 60.31 2v6a s ILE 39 Cb -0.11 -3.84 -0.08 0.00 0.01 0.00 0.00 42.46 38.45 2v6a s ILE 39 CO 0.46 -0.28 1.06 -2.84 0.00 0.00 0.00 174.94 173.33 2v6a s PRO 40 N 1.66 3.67 -0.04 2.79 0.02 -1.26 -0.77 135.00 141.05 2v6a s PRO 40 Ca 0.04 1.41 -0.24 0.00 0.02 0.00 0.00 61.00 62.23 2v6a s PRO 40 Cb -0.19 -2.07 0.05 0.00 0.02 0.00 0.00 34.50 32.31 2v6a s PRO 40 CO 0.09 -0.55 0.52 0.00 -0.33 0.00 0.00 177.00 176.74 2v6a s LEU 42 N -1.17 3.29 0.06 0.00 1.43 -1.26 -0.60 118.68 120.42 2v6a s LEU 42 Ca -0.11 -0.10 0.02 0.00 -1.03 0.00 0.00 54.13 52.91 2v6a s LEU 42 Cb -0.02 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 2v6a s LEU 42 CO 0.07 0.28 -0.08 -1.61 0.23 0.00 0.00 176.35 175.24 2v6a s GLU 43 N -1.45 0.62 0.11 1.70 2.02 -0.58 -0.85 118.70 120.27 2v6a s GLU 43 Ca 0.18 -0.89 -0.08 0.00 0.02 0.00 0.00 54.97 54.20 2v6a s GLU 43 Cb -0.11 -0.33 -0.01 0.00 0.10 0.00 0.00 34.13 33.77 2v6a s GLU 43 CO 0.08 0.05 0.19 -0.59 0.02 0.00 0.00 175.26 175.01 2v6a s PHE 44 N -1.81 0.28 -0.18 1.61 -0.12 0.08 -0.77 117.98 117.07 2v6a s PHE 44 Ca -0.05 -0.70 -0.20 0.00 -0.05 0.00 0.00 56.93 55.93 2v6a s PHE 44 Cb -0.07 -0.11 0.05 0.00 -0.63 0.00 0.00 43.02 42.27 2v6a s PHE 44 CO -0.00 -0.57 0.55 0.00 -0.05 0.00 0.00 175.22 175.15 2v6a s ALA 45 N -3.90 -1.38 0.83 1.99 0.00 -0.31 -1.02 121.76 117.97 2v6a s ALA 45 Ca 0.09 1.47 -0.10 0.00 0.00 0.00 0.00 51.96 53.42 2v6a s ALA 45 Cb 0.05 -0.76 0.09 0.00 0.00 0.00 0.00 23.12 22.50 2v6a s ALA 45 CO -0.07 -0.27 1.11 -1.83 0.00 0.00 0.00 175.76 174.69 2v6a s GLU 46 N 0.04 1.74 0.26 0.00 -1.05 -1.26 -0.72 118.70 117.71 2v6a s GLU 46 Ca -0.02 1.31 -0.01 0.00 -0.15 0.00 0.00 54.97 56.10 2v6a s GLU 46 Cb -0.04 -1.83 0.50 0.00 -0.44 0.00 0.00 34.13 32.33 2v6a s GLU 46 CO 0.02 -2.05 1.79 0.00 0.95 0.00 0.00 175.26 175.96 2v6a h ALA 47 N -1.44 1.30 0.00 -0.84 0.00 -1.97 -0.04 119.26 116.27 2v6a h ALA 47 Ca -0.43 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2v6a h ALA 47 Cb 1.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2v6a h ALA 47 CO 0.47 0.01 0.00 -0.25 0.00 0.00 0.00 179.25 179.48 2v6a n ASP 48 N -4.80 0.33 -0.34 0.00 8.00 -1.26 -2.56 116.55 115.94 2v6a n ASP 48 Ca 0.17 0.60 0.05 0.00 0.71 0.00 0.00 54.79 56.31 2v6a n ASP 48 Cb 0.38 -0.67 0.11 0.00 -0.02 0.00 0.00 41.12 40.93 2v6a n ASP 48 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2v6a n LYS 49 N -1.89 2.67 0.06 -1.24 4.76 -0.05 -4.78 118.16 117.69 2v6a n LYS 49 Ca 0.02 -2.04 -0.21 0.00 -2.87 0.00 0.00 58.31 53.21 2v6a n LYS 49 Cb 0.15 -1.29 -0.15 0.00 -1.84 0.00 0.00 35.03 31.90 2v6a n LYS 49 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2v6a h ALA 50 N 0.88 0.23 -3.47 7.82 0.00 -1.30 -3.45 119.26 119.97 2v6a h ALA 50 Ca 0.00 -1.17 -0.66 0.00 0.00 0.00 0.00 54.91 53.07 2v6a h ALA 50 Cb 0.79 0.45 -0.15 0.00 0.00 0.00 0.00 17.79 18.88 2v6a h ALA 50 CO 0.03 1.10 -0.69 0.71 0.00 0.00 0.00 179.25 180.40 2v6a s TYR 51 N -2.59 2.91 0.38 0.00 1.51 -1.26 -4.95 117.35 113.35 2v6a s TYR 51 Ca -0.15 -0.05 -0.25 0.00 -1.01 0.00 0.00 57.07 55.61 2v6a s TYR 51 Cb 0.06 -1.55 -0.12 0.00 -0.11 0.00 0.00 41.96 40.24 2v6a s TYR 51 CO 0.84 0.43 0.98 1.33 -1.11 0.00 0.00 175.55 178.03 2v6a n VAL 52 N 0.98 2.23 -4.18 0.71 0.24 -1.26 -4.73 118.33 112.33 2v6a n VAL 52 Ca -0.13 -0.50 -0.17 0.00 -2.04 0.00 0.00 64.34 61.50 2v6a n VAL 52 Cb 0.52 -1.08 -0.06 0.00 -1.47 0.00 0.00 33.84 31.75 2v6a n VAL 52 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2v6a s SER 53 N -0.68 1.25 0.00 -1.34 1.04 -0.62 -4.97 113.70 108.38 2v6a s SER 53 Ca 0.61 -1.61 0.01 0.00 0.48 0.00 0.00 55.95 55.44 2v6a s SER 53 Cb -0.60 0.60 0.02 0.00 0.10 0.00 0.00 66.02 66.14 2v6a s SER 53 CO 0.58 -1.17 0.76 0.59 0.98 0.00 0.00 173.24 174.98 2v6a n ASN 54 N -1.44 1.55 -0.21 7.02 3.02 -1.26 -0.78 115.26 123.16 2v6a n ASN 54 Ca 0.04 -1.48 0.04 0.00 -0.03 0.00 0.00 54.58 53.15 2v6a n ASN 54 Cb 0.62 -0.01 0.30 0.00 -0.61 0.00 0.00 39.78 40.08 2v6a n ASN 54 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 2v6a h GLU 55 N 0.21 0.86 0.00 3.52 9.09 -1.98 -1.18 114.58 125.10 2v6a h GLU 55 Ca 0.00 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 59.36 2v6a h GLU 55 Cb 0.26 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 27.17 2v6a h GLU 55 CO 0.00 0.57 0.00 0.77 0.05 0.00 0.00 179.01 180.40 2v6a h SER 56 N 0.89 0.00 0.37 3.06 0.02 -2.00 -2.94 113.55 112.94 2v6a h SER 56 Ca 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 2v6a h SER 56 Cb 0.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.65 2v6a h SER 56 CO -0.10 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.59 2v6a n ALA 57 N -2.00 1.36 0.20 3.77 0.00 -0.45 -1.41 120.51 121.98 2v6a n ALA 57 Ca -0.00 0.12 0.17 0.00 0.00 0.00 0.00 53.44 53.73 2v6a n ALA 57 Cb 0.22 -1.33 0.83 0.00 0.00 0.00 0.00 19.45 19.17 2v6a n ALA 57 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2v6a h ILE 58 N 0.00 0.48 -0.01 0.00 2.10 -1.71 -1.53 117.51 116.85 2v6a h ILE 58 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 2v6a h ILE 58 Cb 0.18 0.84 0.00 0.00 -1.09 0.00 0.00 36.82 36.76 2v6a h ILE 58 CO 0.00 0.00 -0.12 0.54 -1.08 0.00 0.00 178.15 177.49 2v6a n ARG 59 N -3.83 1.19 -3.88 2.19 1.74 -0.50 -4.96 116.66 108.60 2v6a n ARG 59 Ca 0.02 -0.65 -0.24 0.00 -0.77 0.00 0.00 57.85 56.21 2v6a n ARG 59 Cb 0.32 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.25 2v6a n ARG 59 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2v6a s PHE 60 N -2.26 3.47 0.00 -1.55 2.99 -0.58 -5.12 117.98 114.94 2v6a s PHE 60 Ca 0.32 0.10 0.00 0.00 0.00 0.00 0.00 56.93 57.35 2v6a s PHE 60 Cb 0.20 -1.66 0.00 0.00 0.00 0.00 0.00 43.02 41.56 2v6a s PHE 60 CO 0.43 0.44 0.00 0.41 -0.00 0.00 0.00 175.22 176.49 2v6a n GLY 61 N -1.03 0.92 2.29 4.36 0.00 -1.26 -4.90 105.19 105.57 2v6a n GLY 61 Ca -0.07 -1.49 -0.28 0.00 0.00 0.00 0.00 46.02 44.17 2v6a n GLY 61 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2v6a n SER 62 N 0.00 7.08 -0.74 1.61 7.64 -1.26 -4.33 113.62 123.61 2v6a n SER 62 Ca 0.00 -2.79 0.05 0.00 1.01 0.00 0.00 58.87 57.14 2v6a n SER 62 Cb 0.00 -1.41 0.12 0.00 -1.01 0.00 0.00 64.21 61.91 2v6a n SER 62 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2v6a n VAL 63 N 2.30 1.30 0.47 0.44 0.24 -1.26 -4.80 118.33 117.02 2v6a n VAL 63 Ca 0.58 -2.09 0.13 0.00 -2.04 0.00 0.00 64.34 60.93 2v6a n VAL 63 Cb 0.51 0.18 0.45 0.00 -1.47 0.00 0.00 33.84 33.51 2v6a n VAL 63 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2v6a h SER 64 N 0.70 0.00 -1.59 -1.34 0.02 -1.95 -3.44 113.55 105.96 2v6a h SER 64 Ca -0.06 0.00 -0.72 0.00 -0.84 0.00 0.00 61.79 60.17 2v6a h SER 64 Cb 1.29 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.86 2v6a h SER 64 CO 0.03 0.00 0.75 0.00 -1.14 0.00 0.00 176.83 176.47 2v6a n LEU 66 N 4.41 -1.38 -4.59 0.00 4.77 -1.26 -4.98 117.00 113.97 2v6a n LEU 66 Ca 0.24 0.22 -0.36 0.00 -0.03 0.00 0.00 56.01 56.08 2v6a n LEU 66 Cb 0.15 -2.44 -0.10 0.00 -2.33 0.00 0.00 43.42 38.69 2v6a n LEU 66 CO 0.75 -0.43 -0.23 -0.47 -1.33 0.00 0.00 177.39 175.67 2v6a s TYR 67 N -2.64 3.22 -0.00 -1.77 5.04 0.23 -5.10 117.35 116.34 2v6a s TYR 67 Ca 0.00 -0.00 -0.02 0.00 -2.44 0.00 0.00 57.07 54.61 2v6a s TYR 67 Cb 0.00 -2.19 -0.00 0.00 0.35 0.00 0.00 41.96 40.12 2v6a s TYR 67 CO 0.00 -0.02 0.03 0.71 -1.34 0.00 0.00 175.55 174.93 2v6a s TYR 68 N 0.95 0.08 0.59 4.97 2.02 -1.26 -4.97 117.35 119.72 2v6a s TYR 68 Ca 0.05 -0.15 -0.12 0.00 -0.37 0.00 0.00 57.07 56.48 2v6a s TYR 68 Cb -0.14 -0.07 -0.05 0.00 -0.40 0.00 0.00 41.96 41.31 2v6a s TYR 68 CO 0.03 -0.12 1.01 -0.51 -1.57 0.00 0.00 175.55 174.39 2v6a s ASP 69 N -0.71 6.34 -0.19 2.29 1.01 0.04 -4.33 116.67 121.12 2v6a s ASP 69 Ca -0.08 1.44 0.00 0.00 0.71 0.00 0.00 52.55 54.62 2v6a s ASP 69 Cb -0.05 -2.47 0.00 0.00 1.01 0.00 0.00 42.92 41.41 2v6a s ASP 69 CO -0.00 -0.78 0.00 0.59 0.21 0.00 0.00 175.17 175.18 2v6a n ASN 70 N -2.42 -3.70 -0.03 0.27 3.02 -1.26 -1.59 115.26 109.54 2v6a n ASN 70 Ca 0.06 0.04 -0.14 0.00 -0.03 0.00 0.00 54.58 54.51 2v6a n ASN 70 Cb 0.54 -1.36 -0.10 0.00 -0.61 0.00 0.00 39.78 38.26 2v6a n ASN 70 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2v6a h ARG 71 N 0.49 0.22 -6.58 3.52 3.08 -1.90 -3.41 114.38 109.80 2v6a h ARG 71 Ca -0.04 -0.16 -0.53 0.00 0.07 0.00 0.00 59.98 59.32 2v6a h ARG 71 Cb 0.28 0.03 0.03 0.00 0.08 0.00 0.00 29.97 30.39 2v6a h ARG 71 CO 0.05 0.79 0.76 0.71 -1.07 0.00 0.00 179.97 181.21 2v6a s TYR 72 N -3.74 3.19 0.18 3.04 2.02 -1.26 -5.04 117.35 115.73 2v6a s TYR 72 Ca -0.15 0.90 0.02 0.00 -0.37 0.00 0.00 57.07 57.46 2v6a s TYR 72 Cb 0.03 -3.74 0.02 0.00 -0.40 0.00 0.00 41.96 37.86 2v6a s TYR 72 CO 0.74 -2.62 0.15 0.91 -1.57 0.00 0.00 175.55 173.17 2v6a n TRP 73 N 3.76 -1.54 -3.78 2.71 7.02 -1.26 -5.05 117.44 119.29 2v6a n TRP 73 Ca 0.11 -0.72 -0.36 0.00 -1.02 0.00 0.00 57.50 55.51 2v6a n TRP 73 Cb 0.41 -0.15 -0.07 0.00 -2.42 0.00 0.00 31.31 29.09 2v6a n TRP 73 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2v6a s THR 74 N -0.71 5.44 0.11 -0.99 2.01 -0.19 -4.87 115.64 116.44 2v6a s THR 74 Ca 0.12 0.25 -0.30 0.00 0.31 0.00 0.00 61.69 62.06 2v6a s THR 74 Cb -0.01 -3.46 -0.07 0.00 0.01 0.00 0.00 72.50 68.98 2v6a s THR 74 CO 0.07 0.53 1.19 -0.32 -0.69 0.00 0.00 174.62 175.40 2v6a s MET 75 N -0.37 4.47 -0.38 4.92 1.75 -1.26 -0.74 119.30 127.68 2v6a s MET 75 Ca 0.13 1.80 -0.25 0.00 -1.25 0.00 0.00 55.69 56.11 2v6a s MET 75 Cb -0.12 -3.31 0.02 0.00 2.84 0.00 0.00 34.83 34.26 2v6a s MET 75 CO 0.02 -0.17 0.90 -0.46 -0.65 0.00 0.00 175.02 174.66 2v6a s TRP 76 N 0.61 3.06 0.00 4.11 -0.11 -0.03 -4.90 118.94 121.68 2v6a s TRP 76 Ca 0.56 0.67 0.00 0.00 1.22 0.00 0.00 56.10 58.55 2v6a s TRP 76 Cb -0.30 -3.66 0.00 0.00 -1.50 0.00 0.00 33.47 28.01 2v6a s TRP 76 CO 0.32 -0.86 0.00 1.63 -4.62 0.00 0.00 176.95 173.42 2v6a n LYS 77 N 6.78 0.00 -4.30 5.86 5.02 -1.26 -4.51 118.16 125.74 2v6a n LYS 77 Ca 0.06 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.19 2v6a n LYS 77 Cb 0.48 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.39 2v6a n LYS 77 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2v6a s LEU 78 N 0.00 2.43 0.60 -0.35 1.43 -1.26 -5.10 118.68 116.42 2v6a s LEU 78 Ca 0.00 -1.09 -0.19 0.00 -1.03 0.00 0.00 54.13 51.82 2v6a s LEU 78 Cb 0.00 -0.40 -0.04 0.00 0.03 0.00 0.00 46.19 45.78 2v6a s LEU 78 CO 0.00 -0.36 1.17 -2.65 0.23 0.00 0.00 176.35 174.74 2v6a n PRO 79 N -0.32 1.17 -2.21 1.29 -0.02 -1.26 -4.85 135.00 128.80 2v6a n PRO 79 Ca -0.08 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.43 2v6a n PRO 79 Cb 0.62 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 2v6a n PRO 79 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2v6a n MET 80 N -1.28 3.72 -1.76 -0.52 2.81 0.56 -4.97 117.12 115.69 2v6a n MET 80 Ca 0.14 -3.41 -0.42 0.00 -1.81 0.00 0.00 57.70 52.19 2v6a n MET 80 Cb 0.47 -2.90 -0.02 0.00 -0.71 0.00 0.00 33.22 30.05 2v6a n MET 80 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 2v6a s PHE 81 N 0.38 2.79 0.00 2.03 0.08 -1.26 -1.88 117.98 120.13 2v6a s PHE 81 Ca 0.43 0.63 0.00 0.00 0.12 0.00 0.00 56.93 58.11 2v6a s PHE 81 Cb 0.12 -4.10 0.00 0.00 -0.57 0.00 0.00 43.02 38.47 2v6a s PHE 81 CO -0.02 -3.85 0.00 0.41 -0.10 0.00 0.00 175.22 171.66 2v6a n GLY 82 N 2.75 1.85 3.68 4.36 0.00 -1.26 -5.00 105.19 111.56 2v6a n GLY 82 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2v6a n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2v6a n ARG 84 N 6.09 1.25 -3.97 0.00 1.74 -1.26 -4.93 116.66 115.57 2v6a n ARG 84 Ca 0.15 -1.81 -0.33 0.00 -0.77 0.00 0.00 57.85 55.09 2v6a n ARG 84 Cb 0.43 -1.08 -0.14 0.00 -1.02 0.00 0.00 32.46 30.65 2v6a n ARG 84 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2v6a s ASP 85 N -1.79 4.77 0.49 0.55 -1.08 -1.26 -4.99 116.67 113.35 2v6a s ASP 85 Ca 0.15 -1.65 0.14 0.00 -0.52 0.00 0.00 52.55 50.68 2v6a s ASP 85 Cb 0.13 -1.65 1.15 0.00 -1.46 0.00 0.00 42.92 41.09 2v6a s ASP 85 CO 0.01 -0.31 2.10 1.55 0.52 0.00 0.00 175.17 179.05 2v6a h PRO 86 N 7.83 0.17 -0.30 4.34 0.13 -1.94 -1.97 132.00 140.27 2v6a h PRO 86 Ca -0.15 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.92 2v6a h PRO 86 Cb 1.04 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 2v6a h PRO 86 CO 0.53 0.11 -0.04 0.52 -0.23 0.00 0.00 178.00 178.89 2v6a h MET 87 N 0.18 0.46 -0.80 0.86 2.86 -1.99 -2.06 114.93 114.44 2v6a h MET 87 Ca 0.08 -0.10 -0.05 0.00 -2.06 0.00 0.00 59.70 57.57 2v6a h MET 87 Cb 0.11 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.67 2v6a h MET 87 CO -0.01 0.52 0.32 1.96 1.06 0.00 0.00 176.91 180.76 2v6a h GLN 88 N 0.44 1.20 -0.12 1.72 4.20 -1.79 -1.19 115.11 119.57 2v6a h GLN 88 Ca 0.09 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 2v6a h GLN 88 Cb 0.35 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2v6a h GLN 88 CO 0.01 0.97 0.05 0.28 -0.67 0.00 0.00 178.83 179.47 2v6a h VAL 89 N 1.17 1.15 -0.98 -0.54 2.07 -1.44 -2.03 116.25 115.65 2v6a h VAL 89 Ca 0.27 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.36 2v6a h VAL 89 Cb 0.21 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 2v6a h VAL 89 CO -0.02 0.13 0.64 -0.07 0.02 0.00 0.00 177.57 178.27 2v6a h LEU 90 N 0.05 1.13 -1.03 2.57 3.38 -1.27 -1.08 115.31 119.05 2v6a h LEU 90 Ca 0.04 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2v6a h LEU 90 Cb 0.16 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2v6a h LEU 90 CO -0.00 0.82 0.21 0.03 0.09 0.00 0.00 178.44 179.59 2v6a h ARG 91 N 1.33 0.91 -0.16 1.13 3.08 -1.08 -2.25 114.38 117.33 2v6a h ARG 91 Ca 0.36 -0.16 -0.13 0.00 0.07 0.00 0.00 59.98 60.12 2v6a h ARG 91 Cb -0.15 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.74 2v6a h ARG 91 CO -0.08 0.77 -0.46 0.93 -1.07 0.00 0.00 179.97 180.06 2v6a h GLU 92 N 0.89 0.41 -0.42 0.04 4.39 -0.59 -0.93 114.58 118.38 2v6a h GLU 92 Ca 0.20 -0.22 0.05 0.00 0.34 0.00 0.00 59.36 59.72 2v6a h GLU 92 Cb 0.22 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.84 2v6a h GLU 92 CO -0.01 0.79 0.17 0.82 -1.16 0.00 0.00 179.01 179.62 2v6a h ILE 93 N 0.33 0.91 -0.40 3.13 2.04 -0.89 0.10 117.51 122.74 2v6a h ILE 93 Ca 0.02 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.76 2v6a h ILE 93 Cb 0.94 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 2v6a h ILE 93 CO 0.08 0.06 0.26 0.58 0.00 0.00 0.00 178.15 179.13 2v6a h VAL 94 N 0.35 1.11 -0.49 1.67 2.07 -1.13 -1.62 116.25 118.21 2v6a h VAL 94 Ca 0.19 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.45 2v6a h VAL 94 Cb 0.15 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 2v6a h VAL 94 CO -0.17 0.11 0.18 0.00 0.02 0.00 0.00 177.57 177.71 2v6a h ALA 95 N 1.13 0.64 -0.03 1.67 0.00 -0.74 -0.79 119.26 121.13 2v6a h ALA 95 Ca 0.15 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2v6a h ALA 95 Cb -0.04 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2v6a h ALA 95 CO -0.03 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.48 2v6a h THR 97 N -0.21 1.21 -0.38 0.00 1.35 -1.25 -0.93 112.91 112.70 2v6a h THR 97 Ca 0.01 -0.99 -0.15 0.00 -0.55 0.00 0.00 66.41 64.74 2v6a h THR 97 Cb 0.28 1.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.12 2v6a h THR 97 CO 0.00 0.29 -0.35 0.50 -0.25 0.00 0.00 175.52 175.71 2v6a h LYS 98 N 0.11 0.88 -0.08 4.72 3.64 -1.02 -2.66 116.57 122.16 2v6a h LYS 98 Ca 0.02 -0.44 -0.15 0.00 -1.27 0.00 0.00 60.65 58.81 2v6a h LYS 98 Cb 0.50 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 2v6a h LYS 98 CO 0.04 1.08 -0.62 0.00 -2.27 0.00 0.00 179.45 177.68 2v6a h ALA 99 N 0.87 0.80 -2.15 5.00 0.00 -0.81 -3.36 119.26 119.60 2v6a h ALA 99 Ca 0.07 -0.55 -0.59 0.00 0.00 0.00 0.00 54.91 53.84 2v6a h ALA 99 Cb 0.92 -0.08 -0.41 0.00 0.00 0.00 0.00 17.79 18.22 2v6a h ALA 99 CO 0.09 0.73 -0.78 1.19 0.00 0.00 0.00 179.25 180.48 2v6a n PHE 100 N -3.87 2.18 0.38 0.00 3.01 -0.40 -4.95 117.46 113.81 2v6a n PHE 100 Ca -0.03 -3.94 0.13 0.00 1.01 0.00 0.00 57.45 54.62 2v6a n PHE 100 Cb 0.63 -0.48 0.53 0.00 -0.01 0.00 0.00 39.48 40.16 2v6a n PHE 100 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2v6a h PRO 101 N 4.17 0.00 -0.30 -1.08 0.13 -1.63 -2.64 132.00 130.64 2v6a h PRO 101 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2v6a h PRO 101 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2v6a h PRO 101 CO 0.70 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.22 2v6a n ASP 102 N -2.42 2.96 -4.94 1.44 8.00 -1.26 -4.62 116.55 115.71 2v6a n ASP 102 Ca 0.02 -1.87 -0.26 0.00 0.71 0.00 0.00 54.79 53.39 2v6a n ASP 102 Cb 0.25 -0.19 -0.03 0.00 -0.02 0.00 0.00 41.12 41.13 2v6a n ASP 102 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2v6a s ALA 103 N -1.18 3.85 0.25 2.24 0.00 -1.00 -4.44 121.76 121.48 2v6a s ALA 103 Ca 0.28 -0.92 -0.30 0.00 0.00 0.00 0.00 51.96 51.03 2v6a s ALA 103 Cb 0.16 -1.94 -0.09 0.00 0.00 0.00 0.00 23.12 21.25 2v6a s ALA 103 CO 0.23 0.38 1.10 0.71 0.00 0.00 0.00 175.76 178.17 2v6a s TYR 104 N -1.91 3.59 -0.03 0.00 1.51 0.10 -4.01 117.35 116.60 2v6a s TYR 104 Ca 0.37 1.67 0.01 0.00 -1.01 0.00 0.00 57.07 58.12 2v6a s TYR 104 Cb -0.11 -3.28 0.02 0.00 -0.11 0.00 0.00 41.96 38.48 2v6a s TYR 104 CO 0.30 -0.56 -0.04 0.08 -1.11 0.00 0.00 175.55 174.21 2v6a s VAL 105 N -0.93 0.48 0.04 0.71 1.01 -0.46 -1.16 120.40 120.09 2v6a s VAL 105 Ca 0.46 -0.12 0.07 0.00 0.00 0.00 0.00 61.98 62.38 2v6a s VAL 105 Cb -0.31 -0.49 -0.02 0.00 0.00 0.00 0.00 36.38 35.55 2v6a s VAL 105 CO 0.39 0.20 -0.20 0.00 0.00 0.00 0.00 175.10 175.49 2v6a s ARG 106 N 0.71 1.32 -0.18 2.72 1.70 0.05 -0.26 118.95 125.01 2v6a s ARG 106 Ca -0.09 -0.91 -0.13 0.00 -0.47 0.00 0.00 55.73 54.13 2v6a s ARG 106 Cb -0.12 -1.42 -0.05 0.00 -0.57 0.00 0.00 34.95 32.79 2v6a s ARG 106 CO -0.00 0.36 0.26 -1.17 -1.08 0.00 0.00 175.30 173.67 2v6a s LEU 107 N -1.17 4.21 0.28 -1.89 2.96 -0.30 -1.52 118.68 121.25 2v6a s LEU 107 Ca 0.07 0.42 0.04 0.00 -0.22 0.00 0.00 54.13 54.44 2v6a s LEU 107 Cb -0.09 -2.32 -0.06 0.00 0.50 0.00 0.00 46.19 44.23 2v6a s LEU 107 CO 0.02 0.09 0.02 0.68 -1.32 0.00 0.00 176.35 175.83 2v6a s VAL 108 N 0.60 1.16 -0.00 1.68 -7.23 0.23 -1.35 120.40 115.49 2v6a s VAL 108 Ca 0.14 -2.03 -0.06 0.00 -1.81 0.00 0.00 61.98 58.23 2v6a s VAL 108 Cb -0.13 -2.56 0.00 0.00 0.56 0.00 0.00 36.38 34.25 2v6a s VAL 108 CO 0.03 -0.17 0.11 0.00 -0.31 0.00 0.00 175.10 174.77 2v6a s ALA 109 N -3.33 -0.26 0.01 1.32 0.00 -0.99 -0.80 121.76 117.72 2v6a s ALA 109 Ca 0.33 -0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.22 2v6a s ALA 109 Cb 0.07 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 2v6a s ALA 109 CO 0.12 -0.17 -0.10 -0.06 0.00 0.00 0.00 175.76 175.54 2v6a s PHE 110 N -1.13 2.78 -0.27 0.00 0.08 0.05 -0.31 117.98 119.17 2v6a s PHE 110 Ca -0.12 -0.11 -0.07 0.00 0.12 0.00 0.00 56.93 56.74 2v6a s PHE 110 Cb -0.07 -1.56 -0.01 0.00 -0.57 0.00 0.00 43.02 40.81 2v6a s PHE 110 CO 0.01 0.33 0.07 0.34 -0.10 0.00 0.00 175.22 175.87 2v6a s ASP 111 N -1.40 5.09 0.00 1.36 -1.08 -0.42 -1.01 116.67 119.20 2v6a s ASP 111 Ca 0.16 -0.46 0.28 0.00 -0.52 0.00 0.00 52.55 52.02 2v6a s ASP 111 Cb -0.11 -1.90 1.14 0.00 -1.46 0.00 0.00 42.92 40.60 2v6a s ASP 111 CO 0.07 -0.11 1.85 -0.46 0.52 0.00 0.00 175.17 177.03 2v6a n ASN 112 N 4.90 0.14 -0.04 -0.34 6.94 -1.26 -0.87 115.26 124.73 2v6a n ASN 112 Ca -0.15 0.16 -0.19 0.00 -0.02 0.00 0.00 54.58 54.38 2v6a n ASN 112 Cb 0.50 -0.29 -0.13 0.00 -2.36 0.00 0.00 39.78 37.50 2v6a n ASN 112 CO 0.00 0.00 0.00 1.56 -1.03 0.00 0.00 177.26 177.79 2v6a h GLN 113 N 0.06 0.11 0.00 -3.83 1.08 -1.95 -3.29 115.11 107.30 2v6a h GLN 113 Ca 0.00 -0.20 -0.02 0.00 -1.45 0.00 0.00 58.65 56.99 2v6a h GLN 113 Cb 0.46 0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.96 2v6a h GLN 113 CO 0.00 1.09 -0.09 0.87 -0.95 0.00 0.00 178.83 179.76 2v6a h LYS 114 N -0.72 0.00 -6.09 1.46 1.57 -2.01 -3.48 116.57 107.30 2v6a h LYS 114 Ca -0.17 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.29 2v6a h LYS 114 Cb 1.37 0.00 0.05 0.00 0.08 0.00 0.00 32.23 33.72 2v6a h LYS 114 CO -0.00 0.09 -0.72 0.94 -0.57 0.00 0.00 179.45 179.19 2v6a n GLN 115 N -3.15 -1.36 -3.56 3.15 7.27 -0.05 -5.03 117.38 114.65 2v6a n GLN 115 Ca 0.02 0.84 -0.15 0.00 0.07 0.00 0.00 57.00 57.77 2v6a n GLN 115 Cb 0.47 -4.17 -0.06 0.00 2.41 0.00 0.00 30.24 28.90 2v6a n GLN 115 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2v6a s VAL 116 N -3.21 0.02 0.18 1.69 0.11 -0.91 -5.01 120.40 113.26 2v6a s VAL 116 Ca 0.22 -0.14 -0.31 0.00 -2.93 0.00 0.00 61.98 58.82 2v6a s VAL 116 Cb -0.08 -0.95 -0.10 0.00 -1.53 0.00 0.00 36.38 33.72 2v6a s VAL 116 CO 0.84 -0.08 1.52 -1.58 -3.33 0.00 0.00 175.10 172.47 2v6a s GLN 117 N -1.90 4.24 -0.00 1.54 0.74 -1.26 -1.30 119.66 121.71 2v6a s GLN 117 Ca -0.08 2.31 0.08 0.00 0.05 0.00 0.00 55.36 57.73 2v6a s GLN 117 Cb -0.01 -3.16 -0.10 0.00 1.10 0.00 0.00 33.01 30.84 2v6a s GLN 117 CO 0.03 -0.55 0.31 1.51 -0.55 0.00 0.00 175.29 176.04 2v6a n ILE 118 N 3.62 0.00 -3.69 -2.34 0.13 0.58 -4.90 119.36 112.76 2v6a n ILE 118 Ca 0.12 -0.27 -0.09 0.00 -1.10 0.00 0.00 62.75 61.40 2v6a n ILE 118 Cb 0.39 0.81 -0.03 0.00 -0.84 0.00 0.00 39.64 39.97 2v6a n ILE 118 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2v6a s MET 119 N -2.01 1.50 0.00 9.51 0.23 -1.21 -4.99 119.30 122.33 2v6a s MET 119 Ca 0.01 -0.80 0.00 0.00 -1.03 0.00 0.00 55.69 53.88 2v6a s MET 119 Cb 0.06 0.57 0.00 0.00 -1.53 0.00 0.00 34.83 33.93 2v6a s MET 119 CO 0.35 -0.66 0.00 0.41 -2.03 0.00 0.00 175.02 173.09 2v6a n GLY 120 N -0.40 1.67 3.45 3.16 0.00 -1.26 -2.35 105.19 109.47 2v6a n GLY 120 Ca -0.10 -0.08 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 2v6a n GLY 120 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2v6a s PHE 121 N -1.29 -0.52 0.20 1.61 -0.71 -0.45 -4.39 117.98 112.42 2v6a s PHE 121 Ca 0.00 0.41 -0.30 0.00 -1.04 0.00 0.00 56.93 56.00 2v6a s PHE 121 Cb 0.00 0.54 -0.08 0.00 -1.21 0.00 0.00 43.02 42.26 2v6a s PHE 121 CO 0.00 -0.76 1.15 -1.17 -1.34 0.00 0.00 175.22 173.10 2v6a s LEU 122 N -2.48 4.48 -0.00 -1.99 2.96 -1.26 -1.15 118.68 119.23 2v6a s LEU 122 Ca 0.00 2.19 0.04 0.00 -0.22 0.00 0.00 54.13 56.14 2v6a s LEU 122 Cb -0.01 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 43.02 2v6a s LEU 122 CO -0.09 -0.29 0.12 1.33 -1.32 0.00 0.00 176.35 176.10 2v6a n VAL 123 N 2.27 0.00 -3.74 1.68 0.24 0.65 -4.88 118.33 114.55 2v6a n VAL 123 Ca 0.03 -0.25 -0.13 0.00 -2.04 0.00 0.00 64.34 61.96 2v6a n VAL 123 Cb 0.45 0.70 -0.10 0.00 -1.47 0.00 0.00 33.84 33.41 2v6a n VAL 123 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2v6a s GLN 124 N -1.83 0.43 0.17 7.34 0.74 -0.87 -4.96 119.66 120.69 2v6a s GLN 124 Ca -0.00 0.56 0.10 0.00 0.05 0.00 0.00 55.36 56.07 2v6a s GLN 124 Cb 0.03 0.18 -0.04 0.00 1.10 0.00 0.00 33.01 34.28 2v6a s GLN 124 CO 0.16 -0.07 -0.23 -0.98 -0.55 0.00 0.00 175.29 173.63 2v6a s ARG 125 N 0.36 1.39 0.46 1.67 1.70 -1.26 -1.36 118.95 121.91 2v6a s ARG 125 Ca -0.01 -1.42 -0.25 0.00 -0.47 0.00 0.00 55.73 53.58 2v6a s ARG 125 Cb -0.03 -1.67 -0.08 0.00 -0.57 0.00 0.00 34.95 32.60 2v6a s ARG 125 CO -0.01 0.36 1.42 -2.14 -1.08 0.00 0.00 175.30 173.85 2v6a s PRO 126 N -2.51 3.60 0.55 3.89 0.02 -1.26 -4.90 135.00 134.39 2v6a s PRO 126 Ca 0.17 2.40 0.28 0.00 0.02 0.00 0.00 61.00 63.86 2v6a s PRO 126 Cb -0.08 -2.60 1.58 0.00 0.02 0.00 0.00 34.50 33.42 2v6a s PRO 126 CO 0.08 -0.88 2.14 0.87 -0.33 0.00 0.00 177.00 178.88 2v6a h LYS 127 N 2.20 0.00 0.00 5.54 1.57 -1.90 -2.44 116.57 121.53 2v6a h LYS 127 Ca -0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 2v6a h LYS 127 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 2v6a h LYS 127 CO 0.61 0.07 0.00 0.25 -0.57 0.00 0.00 179.45 179.81 2v6a n THR 128 N -3.75 0.14 -1.84 -0.16 -2.24 -1.26 -4.88 114.28 100.29 2v6a n THR 128 Ca -0.02 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 2v6a n THR 128 Cb 0.18 -0.55 -0.03 0.00 -2.10 0.00 0.00 70.33 67.83 2v6a n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2v6a s ALA 129 N -3.01 3.81 -0.06 6.98 0.00 -0.92 -4.91 121.76 123.66 2v6a s ALA 129 Ca 0.13 1.48 0.08 0.00 0.00 0.00 0.00 51.96 53.66 2v6a s ALA 129 Cb 0.18 -3.65 0.13 0.00 0.00 0.00 0.00 23.12 19.78 2v6a s ALA 129 CO 0.52 -0.87 1.01 0.54 0.00 0.00 0.00 175.76 176.96 2v6a n ARG 130 N 3.43 1.01 -0.68 0.00 1.74 -1.26 -4.81 116.66 116.09 2v6a n ARG 130 Ca 0.13 -1.71 0.08 0.00 -0.77 0.00 0.00 57.85 55.58 2v6a n ARG 130 Cb 0.37 -1.01 0.34 0.00 -1.02 0.00 0.00 32.46 31.14 2v6a n ARG 130 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2v6a n ASP 131 N -0.70 4.88 -4.17 0.55 3.85 -1.26 -4.85 116.55 114.85 2v6a n ASP 131 Ca 0.07 -2.83 -0.11 0.00 -0.71 0.00 0.00 54.79 51.22 2v6a n ASP 131 Cb 0.58 -0.60 -0.10 0.00 -1.35 0.00 0.00 41.12 39.65 2v6a n ASP 131 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.20 176.91 2v6a s PHE 132 N -2.53 0.91 0.01 2.11 -0.12 -0.94 -0.91 117.98 116.51 2v6a s PHE 132 Ca 0.49 -0.98 0.07 0.00 -0.05 0.00 0.00 56.93 56.46 2v6a s PHE 132 Cb 0.36 -0.53 -0.03 0.00 -0.63 0.00 0.00 43.02 42.19 2v6a s PHE 132 CO 0.15 -0.22 -0.21 -0.65 -0.05 0.00 0.00 175.22 174.25 2v6a s GLN 133 N -3.88 2.10 0.76 1.99 -1.52 -1.16 -4.79 119.66 113.17 2v6a s GLN 133 Ca 0.15 -0.94 -0.14 0.00 -1.95 0.00 0.00 55.36 52.48 2v6a s GLN 133 Cb 0.06 -2.15 0.06 0.00 -0.22 0.00 0.00 33.01 30.76 2v6a s GLN 133 CO -0.03 0.55 1.18 -1.25 -0.25 0.00 0.00 175.29 175.50 2v6a s PRO 134 N -1.09 1.98 0.28 2.91 0.04 -1.26 -4.83 135.00 133.03 2v6a s PRO 134 Ca 0.12 1.66 0.02 0.00 0.04 0.00 0.00 61.00 62.85 2v6a s PRO 134 Cb -0.10 -1.83 0.66 0.00 0.04 0.00 0.00 34.50 33.27 2v6a s PRO 134 CO 0.02 -1.93 1.71 0.00 0.04 0.00 0.00 177.00 176.84 2v6a h ALA 135 N -0.61 1.34 0.00 8.56 0.00 -1.98 0.21 119.26 126.79 2v6a h ALA 135 Ca -0.46 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2v6a h ALA 135 Cb 1.28 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2v6a h ALA 135 CO 0.49 -0.30 0.00 0.27 0.00 0.00 0.00 179.25 179.71 2v6a n ASN 136 N -5.03 0.00 -0.29 0.00 6.94 -1.26 -2.83 115.26 112.78 2v6a n ASN 136 Ca 0.20 -0.43 0.03 0.00 -0.02 0.00 0.00 54.58 54.36 2v6a n ASN 136 Cb 0.59 -0.15 0.07 0.00 -2.36 0.00 0.00 39.78 37.93 2v6a n ASN 136 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2v6a n LYS 137 N -1.15 2.94 0.17 -3.83 5.02 0.05 -4.64 118.16 116.72 2v6a n LYS 137 Ca 0.15 -1.75 0.02 0.00 -2.02 0.00 0.00 58.31 54.72 2v6a n LYS 137 Cb 0.15 -1.12 0.28 0.00 -0.02 0.00 0.00 35.03 34.31 2v6a n LYS 137 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2v6a h ARG 138 N 0.93 0.00 -5.54 1.97 3.08 -1.42 -3.44 114.38 109.96 2v6a h ARG 138 Ca 0.00 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.61 2v6a h ARG 138 Cb 0.61 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.47 2v6a h ARG 138 CO 0.00 0.47 -0.77 -1.54 -1.07 0.00 0.00 179.97 177.07 2v6a s SER 139 N -6.66 2.12 0.00 7.04 1.04 -1.26 -0.55 113.70 115.43 2v6a s SER 139 Ca -0.01 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.62 2v6a s SER 139 Cb 0.12 -0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.16 2v6a s SER 139 CO 0.72 -0.11 0.15 1.33 0.98 0.00 0.00 173.24 176.31