#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 3.60 -0.13 2.03 1.01 -1.26 -4.86 120.40 120.79 2v6a s VAL 3 Ca 0.00 -0.44 -0.29 0.00 0.00 0.00 0.00 61.98 61.25 2v6a s VAL 3 Cb 0.00 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 2v6a s VAL 3 CO 0.00 0.45 1.41 0.86 0.00 0.00 0.00 175.10 177.82 2v6a s TRP 4 N 0.93 2.52 0.13 5.22 -0.11 -1.26 -0.64 118.94 125.73 2v6a s TRP 4 Ca -0.00 0.71 -0.30 0.00 1.22 0.00 0.00 56.10 57.72 2v6a s TRP 4 Cb -0.15 -3.66 -0.07 0.00 -1.50 0.00 0.00 33.47 28.09 2v6a s TRP 4 CO 0.01 -2.50 1.25 -0.08 -4.62 0.00 0.00 176.95 171.01 2v6a s THR 5 N 3.71 3.64 -1.75 5.86 -1.32 0.24 -4.91 115.64 121.10 2v6a s THR 5 Ca 0.62 1.26 0.28 0.00 -1.21 0.00 0.00 61.69 62.64 2v6a s THR 5 Cb -0.26 -3.81 0.43 0.00 -1.51 0.00 0.00 72.50 67.35 2v6a s THR 5 CO 0.20 0.15 1.79 -0.81 -2.21 0.00 0.00 174.62 173.73 2v6a n PRO 6 N 3.28 0.81 -3.72 7.08 -0.04 -1.26 -4.71 135.00 136.44 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 -2.43 5.22 -1.43 0.52 1.01 -1.26 -4.47 120.40 117.56 2v6a s VAL 7 Ca 0.29 0.13 -0.02 0.00 0.00 0.00 0.00 61.98 62.38 2v6a s VAL 7 Cb 0.20 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 33.17 2v6a s VAL 7 CO 0.47 0.37 0.46 0.59 0.00 0.00 0.00 175.10 176.99 2v6a n ASN 8 N 4.14 -0.62 -2.22 3.32 5.03 -1.26 -4.88 115.26 118.77 2v6a n ASN 8 Ca -0.15 -1.00 -0.14 0.00 0.87 0.00 0.00 54.58 54.16 2v6a n ASN 8 Cb 0.52 -3.05 0.04 0.00 -1.02 0.00 0.00 39.78 36.27 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 3.53 -4.77 6.41 4.05 -1.07 -2.26 115.26 118.20 2v6a n ASN 9 Ca -0.28 -3.12 -0.39 0.00 0.45 0.00 0.00 54.58 51.24 2v6a n ASN 9 Cb 0.67 -0.40 -0.01 0.00 1.23 0.00 0.00 39.78 41.28 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 -3.56 3.94 0.52 1.20 -0.14 -0.02 -4.84 119.74 116.84 2v6a s LYS 10 Ca 0.42 2.08 0.03 0.00 -1.36 0.00 0.00 55.97 57.15 2v6a s LYS 10 Cb 0.38 -2.70 0.03 0.00 -1.68 0.00 0.00 37.83 33.86 2v6a s LYS 10 CO 0.00 -0.50 0.29 -1.33 -0.76 0.00 0.00 175.35 173.05 2v6a n MET 11 N 0.04 0.73 -2.74 1.68 2.81 -1.26 -4.68 117.12 113.71 2v6a n MET 11 Ca 0.04 -3.40 -0.04 0.00 -1.81 0.00 0.00 57.70 52.50 2v6a n MET 11 Cb 0.44 0.52 0.07 0.00 -0.71 0.00 0.00 33.22 33.54 2v6a n MET 11 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2v6a n PHE 12 N -1.60 0.09 -4.69 2.03 3.01 -1.26 -5.12 117.46 109.92 2v6a n PHE 12 Ca -0.07 -2.21 0.00 0.00 1.01 0.00 0.00 57.45 56.18 2v6a n PHE 12 Cb 0.61 0.32 0.00 0.00 -0.01 0.00 0.00 39.48 40.40 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 -0.64 0.00 -1.68 -1.08 -0.58 -1.26 -4.57 120.64 110.83 2v6a n GLU 13 Ca 0.01 0.00 -0.46 0.00 -0.42 0.00 0.00 57.16 56.30 2v6a n GLU 13 Cb 0.83 0.00 -0.04 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 0.26 -0.80 2.62 -1.04 -1.26 -1.63 114.28 112.43 2v6a n THR 14 Ca 0.00 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 2v6a n THR 14 Cb 0.00 -1.79 0.00 0.00 -1.82 0.00 0.00 70.33 66.72 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 4.94 0.00 0.38 -1.42 0.99 -1.26 -4.57 117.46 116.52 2v6a n PHE 15 Ca 0.19 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.76 2v6a n PHE 15 Cb 0.31 0.00 0.51 0.00 -1.00 0.00 0.00 39.48 39.30 2v6a n PHE 15 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 2v6a n SER 16 N 0.00 0.71 -0.58 4.37 7.64 -0.64 -2.23 113.62 122.88 2v6a n SER 16 Ca 0.00 0.68 0.13 0.00 1.01 0.00 0.00 58.87 60.69 2v6a n SER 16 Cb 0.00 -0.83 0.30 0.00 -1.01 0.00 0.00 64.21 62.66 2v6a n SER 16 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2v6a n TYR 17 N -2.29 0.00 -3.06 1.43 4.02 -1.26 -4.87 117.16 111.12 2v6a n TYR 17 Ca 0.02 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.72 2v6a n TYR 17 Cb 0.23 -0.02 0.01 0.00 -0.02 0.00 0.00 39.34 39.53 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 -2.16 3.67 0.72 7.72 1.43 -0.95 -5.08 118.68 124.03 2v6a s LEU 18 Ca 0.30 -0.17 -0.16 0.00 -1.03 0.00 0.00 54.13 53.07 2v6a s LEU 18 Cb 0.20 -2.80 0.02 0.00 0.03 0.00 0.00 46.19 43.64 2v6a s LEU 18 CO 0.39 -0.74 1.11 -2.65 0.23 0.00 0.00 176.35 174.69 2v6a n PRO 19 N -1.92 0.61 -1.66 1.29 -0.02 -1.26 -4.88 135.00 127.16 2v6a n PRO 19 Ca 0.05 0.27 -0.44 0.00 -2.02 0.00 0.00 63.50 61.36 2v6a n PRO 19 Cb 0.59 -2.35 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 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 -2.15 1.84 -2.01 0.52 -0.02 -1.26 -4.86 135.00 127.06 2v6a n PRO 20 Ca 0.14 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.85 2v6a n PRO 20 Cb 0.49 -2.18 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 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 -0.26 4.36 0.91 2.45 1.43 -1.26 -5.01 118.68 121.29 2v6a s LEU 21 Ca 0.60 2.43 -0.12 0.00 -1.03 0.00 0.00 54.13 56.01 2v6a s LEU 21 Cb -0.64 -3.57 0.14 0.00 0.03 0.00 0.00 46.19 42.15 2v6a s LEU 21 CO 0.58 -0.82 1.10 0.42 0.23 0.00 0.00 176.35 177.86 2v6a s THR 22 N 2.16 2.46 0.36 5.49 -4.23 -1.26 -4.79 115.64 115.83 2v6a s THR 22 Ca 0.70 0.15 0.03 0.00 -1.18 0.00 0.00 61.69 61.40 2v6a s THR 22 Cb -0.39 -2.74 0.27 0.00 1.34 0.00 0.00 72.50 70.99 2v6a s THR 22 CO 0.31 -0.19 2.01 0.44 -0.54 0.00 0.00 174.62 176.64 2v6a h ASP 23 N -1.55 0.69 -0.56 3.99 3.32 -1.99 0.16 116.42 120.49 2v6a h ASP 23 Ca -0.51 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.48 2v6a h ASP 23 Cb 1.30 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.66 2v6a h ASP 23 CO 0.58 0.49 0.16 -0.08 -1.72 0.00 0.00 179.24 178.67 2v6a h GLU 24 N 0.81 0.88 -0.49 3.56 4.81 -1.99 -0.94 114.58 121.22 2v6a h GLU 24 Ca 0.24 -0.20 -0.13 0.00 -0.13 0.00 0.00 59.36 59.14 2v6a h GLU 24 Cb -0.03 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 2v6a h GLU 24 CO -0.06 0.81 -0.20 1.96 -0.73 0.00 0.00 179.01 180.79 2v6a h GLN 25 N 0.79 1.01 -0.37 1.92 4.20 -1.67 -1.41 115.11 119.57 2v6a h GLN 25 Ca 0.18 -0.42 -0.02 0.00 0.06 0.00 0.00 58.65 58.44 2v6a h GLN 25 Cb 0.30 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 2v6a h GLN 25 CO -0.00 1.10 0.14 0.82 -0.67 0.00 0.00 178.83 180.22 2v6a h ILE 26 N 0.87 1.19 -0.58 2.54 2.04 -0.91 -2.11 117.51 120.55 2v6a h ILE 26 Ca 0.12 -0.60 0.02 0.00 1.00 0.00 0.00 64.86 65.39 2v6a h ILE 26 Cb 0.78 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 2v6a h ILE 26 CO 0.06 0.21 0.38 0.00 0.00 0.00 0.00 178.15 178.81 2v6a h ALA 27 N 0.99 1.64 -0.52 1.87 0.00 -1.02 -1.12 119.26 121.10 2v6a h ALA 27 Ca 0.12 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2v6a h ALA 27 Cb 0.20 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2v6a h ALA 27 CO -0.01 0.32 -0.07 0.00 0.00 0.00 0.00 179.25 179.49 2v6a h ALA 28 N 1.65 0.71 -0.76 0.00 0.00 -0.99 -0.14 119.26 119.73 2v6a h ALA 28 Ca 0.22 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2v6a h ALA 28 Cb -0.01 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2v6a h ALA 28 CO -0.05 0.59 0.27 1.96 0.00 0.00 0.00 179.25 182.02 2v6a h GLN 29 N 0.84 1.15 -0.68 0.00 1.08 -0.78 -1.70 115.11 115.02 2v6a h GLN 29 Ca 0.14 -0.22 -0.06 0.00 -1.45 0.00 0.00 58.65 57.05 2v6a h GLN 29 Cb 0.63 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.85 2v6a h GLN 29 CO 0.04 0.95 0.18 0.28 -0.95 0.00 0.00 178.83 179.34 2v6a h VAL 30 N 1.12 1.26 -0.89 -0.54 2.07 -0.93 -1.85 116.25 116.48 2v6a h VAL 30 Ca 0.25 -0.92 0.09 0.00 0.82 0.00 0.00 66.70 66.94 2v6a h VAL 30 Cb 0.25 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 30.52 2v6a h VAL 30 CO -0.02 0.35 0.54 0.44 0.02 0.00 0.00 177.57 178.91 2v6a h ASP 31 N 1.00 0.81 -0.70 0.57 3.32 -0.70 -2.03 116.42 118.69 2v6a h ASP 31 Ca 0.21 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 2v6a h ASP 31 Cb 0.34 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 2v6a h ASP 31 CO -0.00 0.48 0.25 0.22 -1.72 0.00 0.00 179.24 178.47 2v6a h TYR 32 N 0.93 1.10 -0.25 4.55 3.20 -0.88 0.12 116.97 125.73 2v6a h TYR 32 Ca 0.41 -0.10 0.02 0.00 3.14 0.00 0.00 58.73 62.21 2v6a h TYR 32 Cb 0.30 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 2v6a h TYR 32 CO -0.03 0.86 0.10 0.82 -1.64 0.00 0.00 178.16 178.27 2v6a h ILE 33 N 1.01 0.95 -0.30 1.81 2.04 -0.79 -2.59 117.51 119.64 2v6a h ILE 33 Ca 0.23 -0.08 -0.09 0.00 1.00 0.00 0.00 64.86 65.93 2v6a h ILE 33 Cb 0.26 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 2v6a h ILE 33 CO -0.01 0.04 -0.15 0.58 0.00 0.00 0.00 178.15 178.61 2v6a h VAL 34 N 0.22 1.29 -0.47 1.67 2.07 -1.11 -1.91 116.25 118.01 2v6a h VAL 34 Ca 0.11 -1.25 0.11 0.00 0.82 0.00 0.00 66.70 66.49 2v6a h VAL 34 Cb 0.07 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 2v6a h VAL 34 CO -0.10 0.40 0.33 0.00 0.02 0.00 0.00 177.57 178.21 2v6a h ALA 35 N 0.76 2.22 -0.02 1.67 0.00 -0.70 -1.90 119.26 121.29 2v6a h ALA 35 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2v6a h ALA 35 Cb 0.67 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2v6a h ALA 35 CO 0.04 -0.34 -0.19 0.09 0.00 0.00 0.00 179.25 178.86 2v6a n ASN 36 N -4.44 2.36 -0.66 0.00 3.02 -0.98 -4.97 115.26 109.59 2v6a n ASN 36 Ca 0.08 -1.70 -0.07 0.00 -0.03 0.00 0.00 54.58 52.86 2v6a n ASN 36 Cb 0.42 0.18 -0.02 0.00 -0.61 0.00 0.00 39.78 39.75 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 1.36 0.53 3.91 7.41 0.00 -0.71 -5.03 105.19 112.66 2v6a n GLY 37 Ca 0.13 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.30 3.25 -0.39 1.61 0.51 -0.77 -4.97 118.94 115.88 2v6a s TRP 38 Ca 0.00 0.69 -0.13 0.00 -2.12 0.00 0.00 56.10 54.54 2v6a s TRP 38 Cb 0.00 -2.80 0.02 0.00 -0.81 0.00 0.00 33.47 29.88 2v6a s TRP 38 CO 0.00 -0.90 0.25 0.42 -0.51 0.00 0.00 176.95 176.22 2v6a s ILE 39 N -3.05 4.93 0.48 2.03 1.01 -0.20 -4.70 121.20 121.70 2v6a s ILE 39 Ca 0.55 -0.75 -0.20 0.00 0.00 0.00 0.00 60.65 60.25 2v6a s ILE 39 Cb -0.11 -3.74 -0.08 0.00 0.01 0.00 0.00 42.46 38.54 2v6a s ILE 39 CO 0.46 -0.27 1.05 -2.84 0.00 0.00 0.00 174.94 173.34 2v6a s PRO 40 N 1.62 3.79 -0.08 2.79 0.02 -1.26 -0.78 135.00 141.09 2v6a s PRO 40 Ca 0.04 1.40 -0.23 0.00 0.02 0.00 0.00 61.00 62.23 2v6a s PRO 40 Cb -0.19 -2.12 0.05 0.00 0.02 0.00 0.00 34.50 32.26 2v6a s PRO 40 CO 0.08 -0.45 0.52 0.00 -0.33 0.00 0.00 177.00 176.83 2v6a s LEU 42 N -0.83 3.45 0.06 0.00 1.43 -1.26 -0.68 118.68 120.84 2v6a s LEU 42 Ca -0.09 -0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.00 2v6a s LEU 42 Cb -0.03 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 44.19 2v6a s LEU 42 CO 0.06 0.28 -0.09 -1.61 0.23 0.00 0.00 176.35 175.22 2v6a s GLU 43 N -1.54 0.64 0.11 1.70 2.02 -0.57 -0.71 118.70 120.36 2v6a s GLU 43 Ca 0.19 -0.90 -0.07 0.00 0.02 0.00 0.00 54.97 54.22 2v6a s GLU 43 Cb -0.11 -0.37 -0.01 0.00 0.10 0.00 0.00 34.13 33.73 2v6a s GLU 43 CO 0.10 0.06 0.17 -0.59 0.02 0.00 0.00 175.26 175.02 2v6a s PHE 44 N -1.75 0.36 -0.12 1.61 -0.12 0.18 -0.95 117.98 117.18 2v6a s PHE 44 Ca -0.05 -0.78 -0.18 0.00 -0.05 0.00 0.00 56.93 55.87 2v6a s PHE 44 Cb -0.07 -0.16 0.04 0.00 -0.63 0.00 0.00 43.02 42.21 2v6a s PHE 44 CO -0.00 -0.57 0.47 0.00 -0.05 0.00 0.00 175.22 175.07 2v6a s ALA 45 N -3.92 -1.17 0.78 1.99 0.00 -0.30 -0.94 121.76 118.19 2v6a s ALA 45 Ca 0.11 1.09 -0.11 0.00 0.00 0.00 0.00 51.96 53.05 2v6a s ALA 45 Cb 0.05 -0.46 0.07 0.00 0.00 0.00 0.00 23.12 22.78 2v6a s ALA 45 CO -0.06 -0.26 1.12 -1.83 0.00 0.00 0.00 175.76 174.73 2v6a s GLU 46 N -0.35 2.06 0.30 0.00 -1.05 -1.26 -0.67 118.70 117.72 2v6a s GLU 46 Ca -0.05 1.33 0.03 0.00 -0.15 0.00 0.00 54.97 56.13 2v6a s GLU 46 Cb -0.03 -1.86 0.60 0.00 -0.44 0.00 0.00 34.13 32.40 2v6a s GLU 46 CO 0.03 -1.81 1.84 0.00 0.95 0.00 0.00 175.26 176.27 2v6a h ALA 47 N -1.05 1.58 0.00 -0.84 0.00 -1.97 -0.03 119.26 116.95 2v6a h ALA 47 Ca -0.44 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2v6a h ALA 47 Cb 1.25 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2v6a h ALA 47 CO 0.49 0.17 0.00 -0.25 0.00 0.00 0.00 179.25 179.67 2v6a n ASP 48 N -4.61 0.39 -0.36 0.00 8.00 -1.26 -2.58 116.55 116.13 2v6a n ASP 48 Ca 0.19 0.62 0.04 0.00 0.71 0.00 0.00 54.79 56.35 2v6a n ASP 48 Cb 0.38 -0.69 0.10 0.00 -0.02 0.00 0.00 41.12 40.89 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 -1.95 2.78 0.09 -1.24 4.76 -0.04 -4.77 118.16 117.78 2v6a n LYS 49 Ca 0.02 -1.97 -0.22 0.00 -2.87 0.00 0.00 58.31 53.26 2v6a n LYS 49 Cb 0.15 -1.25 -0.15 0.00 -1.84 0.00 0.00 35.03 31.94 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 1.01 0.08 -3.44 7.82 0.00 -1.30 -3.45 119.26 119.99 2v6a h ALA 50 Ca 0.00 -1.05 -0.66 0.00 0.00 0.00 0.00 54.91 53.20 2v6a h ALA 50 Cb 0.74 0.33 -0.14 0.00 0.00 0.00 0.00 17.79 18.72 2v6a h ALA 50 CO 0.02 0.95 -0.67 0.71 0.00 0.00 0.00 179.25 180.26 2v6a s TYR 51 N -2.59 2.97 0.37 0.00 1.51 -1.26 -4.96 117.35 113.39 2v6a s TYR 51 Ca -0.12 -0.00 -0.25 0.00 -1.01 0.00 0.00 57.07 55.68 2v6a s TYR 51 Cb 0.05 -1.59 -0.12 0.00 -0.11 0.00 0.00 41.96 40.19 2v6a s TYR 51 CO 0.88 0.44 0.97 1.33 -1.11 0.00 0.00 175.55 178.07 2v6a n VAL 52 N 1.13 2.21 -4.19 0.71 0.24 -1.26 -4.73 118.33 112.45 2v6a n VAL 52 Ca -0.13 -0.50 -0.16 0.00 -2.04 0.00 0.00 64.34 61.51 2v6a n VAL 52 Cb 0.52 -1.06 -0.07 0.00 -1.47 0.00 0.00 33.84 31.77 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 1.04 0.00 -1.34 1.04 -0.59 -4.97 113.70 108.20 2v6a s SER 53 Ca 0.61 -1.55 0.03 0.00 0.48 0.00 0.00 55.95 55.52 2v6a s SER 53 Cb -0.61 0.56 0.06 0.00 0.10 0.00 0.00 66.02 66.14 2v6a s SER 53 CO 0.58 -1.11 0.87 0.59 0.98 0.00 0.00 173.24 175.15 2v6a n ASN 54 N -1.20 1.83 -0.21 7.02 3.02 -1.26 -0.89 115.26 123.56 2v6a n ASN 54 Ca 0.04 -1.61 0.08 0.00 -0.03 0.00 0.00 54.58 53.05 2v6a n ASN 54 Cb 0.63 -0.04 0.36 0.00 -0.61 0.00 0.00 39.78 40.12 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 0.63 0.72 0.00 3.52 9.09 -1.98 -1.35 114.58 125.21 2v6a h GLU 55 Ca 0.00 -0.04 -0.01 0.00 0.05 0.00 0.00 59.36 59.36 2v6a h GLU 55 Cb 0.38 -0.16 -0.00 0.00 -1.65 0.00 0.00 28.75 27.31 2v6a h GLU 55 CO 0.00 0.48 -0.02 0.77 0.05 0.00 0.00 179.01 180.28 2v6a h SER 56 N 0.74 0.00 0.20 3.06 0.02 -2.00 -2.91 113.55 112.66 2v6a h SER 56 Ca 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.30 2v6a h SER 56 Cb 0.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.92 2v6a h SER 56 CO -0.13 0.02 0.00 0.00 -1.14 0.00 0.00 176.83 175.59 2v6a n ALA 57 N -2.11 1.21 0.21 3.77 0.00 -0.51 -1.26 120.51 121.82 2v6a n ALA 57 Ca -0.00 0.16 0.17 0.00 0.00 0.00 0.00 53.44 53.77 2v6a n ALA 57 Cb 0.28 -1.32 0.82 0.00 0.00 0.00 0.00 19.45 19.23 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 0.52 -0.01 0.00 2.10 -1.70 -1.54 117.51 116.88 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 0.10 0.86 0.00 0.00 -1.09 0.00 0.00 36.82 36.68 2v6a h ILE 58 CO 0.00 0.00 -0.17 0.54 -1.08 0.00 0.00 178.15 177.44 2v6a n ARG 59 N -3.88 1.05 -3.67 2.19 1.74 -0.39 -4.95 116.66 108.74 2v6a n ARG 59 Ca 0.01 -0.58 -0.28 0.00 -0.77 0.00 0.00 57.85 56.23 2v6a n ARG 59 Cb 0.31 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 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 -2.35 3.48 0.00 -1.55 2.99 -0.58 -5.11 117.98 114.85 2v6a s PHE 60 Ca 0.29 0.39 0.00 0.00 0.00 0.00 0.00 56.93 57.61 2v6a s PHE 60 Cb 0.20 -1.89 0.00 0.00 0.00 0.00 0.00 43.02 41.33 2v6a s PHE 60 CO 0.46 0.38 0.00 0.41 -0.00 0.00 0.00 175.22 176.47 2v6a n GLY 61 N -0.56 0.19 2.29 4.36 0.00 -1.26 -4.89 105.19 105.31 2v6a n GLY 61 Ca -0.04 -1.39 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 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 6.92 -0.82 1.61 7.64 -1.26 -4.34 113.62 123.37 2v6a n SER 62 Ca 0.00 -2.81 0.05 0.00 1.01 0.00 0.00 58.87 57.12 2v6a n SER 62 Cb 0.00 -1.39 0.13 0.00 -1.01 0.00 0.00 64.21 61.93 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 2.20 1.30 0.50 0.44 0.24 -1.26 -4.80 118.33 116.95 2v6a n VAL 63 Ca 0.57 -2.18 0.13 0.00 -2.04 0.00 0.00 64.34 60.82 2v6a n VAL 63 Cb 0.54 0.21 0.44 0.00 -1.47 0.00 0.00 33.84 33.55 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 0.81 0.00 -1.46 -1.34 0.02 -1.95 -3.44 113.55 106.19 2v6a h SER 64 Ca -0.07 0.00 -0.75 0.00 -0.84 0.00 0.00 61.79 60.12 2v6a h SER 64 Cb 1.32 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.88 2v6a h SER 64 CO 0.03 0.00 0.78 0.00 -1.14 0.00 0.00 176.83 176.50 2v6a n LEU 66 N 4.65 -1.36 -4.60 0.00 4.77 -1.26 -4.98 117.00 114.22 2v6a n LEU 66 Ca 0.26 0.19 -0.35 0.00 -0.03 0.00 0.00 56.01 56.08 2v6a n LEU 66 Cb 0.11 -2.40 -0.10 0.00 -2.33 0.00 0.00 43.42 38.69 2v6a n LEU 66 CO 0.79 -0.35 -0.25 -0.47 -1.33 0.00 0.00 177.39 175.79 2v6a s TYR 67 N -2.65 3.22 -0.01 -1.77 5.04 0.38 -5.10 117.35 116.45 2v6a s TYR 67 Ca 0.00 -0.01 -0.03 0.00 -2.44 0.00 0.00 57.07 54.59 2v6a s TYR 67 Cb 0.00 -2.13 0.00 0.00 0.35 0.00 0.00 41.96 40.18 2v6a s TYR 67 CO 0.00 0.04 0.07 0.71 -1.34 0.00 0.00 175.55 175.04 2v6a s TYR 68 N 0.69 0.02 0.60 4.97 2.02 -1.26 -4.98 117.35 119.40 2v6a s TYR 68 Ca 0.04 -0.03 -0.12 0.00 -0.37 0.00 0.00 57.07 56.59 2v6a s TYR 68 Cb -0.13 -0.04 -0.05 0.00 -0.40 0.00 0.00 41.96 41.35 2v6a s TYR 68 CO 0.02 -0.14 1.01 -0.51 -1.57 0.00 0.00 175.55 174.36 2v6a s ASP 69 N -0.65 6.30 -0.20 2.29 1.01 -0.07 -4.34 116.67 121.00 2v6a s ASP 69 Ca -0.07 1.42 0.00 0.00 0.71 0.00 0.00 52.55 54.61 2v6a s ASP 69 Cb -0.04 -2.47 0.00 0.00 1.01 0.00 0.00 42.92 41.42 2v6a s ASP 69 CO 0.00 -0.81 0.00 0.59 0.21 0.00 0.00 175.17 175.16 2v6a n ASN 70 N -2.53 -3.70 -0.03 0.27 3.02 -1.26 -1.54 115.26 109.50 2v6a n ASN 70 Ca 0.06 0.05 -0.15 0.00 -0.03 0.00 0.00 54.58 54.50 2v6a n ASN 70 Cb 0.54 -1.37 -0.10 0.00 -0.61 0.00 0.00 39.78 38.25 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 0.47 0.31 -6.58 3.52 3.08 -1.90 -3.41 114.38 109.87 2v6a h ARG 71 Ca -0.04 -0.26 -0.53 0.00 0.07 0.00 0.00 59.98 59.22 2v6a h ARG 71 Cb 0.28 0.06 0.03 0.00 0.08 0.00 0.00 29.97 30.42 2v6a h ARG 71 CO 0.06 0.92 0.72 0.71 -1.07 0.00 0.00 179.97 181.31 2v6a s TYR 72 N -3.55 3.23 0.17 3.04 2.02 -1.26 -5.04 117.35 115.96 2v6a s TYR 72 Ca -0.14 0.99 0.02 0.00 -0.37 0.00 0.00 57.07 57.56 2v6a s TYR 72 Cb 0.03 -3.69 0.02 0.00 -0.40 0.00 0.00 41.96 37.92 2v6a s TYR 72 CO 0.77 -2.36 0.14 0.91 -1.57 0.00 0.00 175.55 173.44 2v6a n TRP 73 N 3.62 -1.35 -3.86 2.71 7.02 -1.26 -5.05 117.44 119.26 2v6a n TRP 73 Ca 0.10 -0.72 -0.36 0.00 -1.02 0.00 0.00 57.50 55.50 2v6a n TRP 73 Cb 0.42 -0.14 -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 -0.78 5.33 0.12 -0.99 2.01 -0.12 -4.88 115.64 116.33 2v6a s THR 74 Ca 0.10 0.15 -0.31 0.00 0.31 0.00 0.00 61.69 61.95 2v6a s THR 74 Cb -0.01 -3.37 -0.07 0.00 0.01 0.00 0.00 72.50 69.06 2v6a s THR 74 CO 0.07 0.53 1.25 -0.32 -0.69 0.00 0.00 174.62 175.46 2v6a s MET 75 N -0.32 4.42 -0.40 4.92 1.75 -1.26 -0.65 119.30 127.76 2v6a s MET 75 Ca 0.11 1.89 -0.25 0.00 -1.25 0.00 0.00 55.69 56.18 2v6a s MET 75 Cb -0.12 -3.28 0.02 0.00 2.84 0.00 0.00 34.83 34.29 2v6a s MET 75 CO 0.01 -0.25 0.91 -0.46 -0.65 0.00 0.00 175.02 174.58 2v6a s TRP 76 N 0.70 3.02 0.00 4.11 -0.11 0.11 -4.90 118.94 121.87 2v6a s TRP 76 Ca 0.58 0.60 0.00 0.00 1.22 0.00 0.00 56.10 58.50 2v6a s TRP 76 Cb -0.33 -3.76 0.00 0.00 -1.50 0.00 0.00 33.47 27.89 2v6a s TRP 76 CO 0.32 -0.93 0.00 1.63 -4.62 0.00 0.00 176.95 173.35 2v6a n LYS 77 N 6.90 0.00 -4.28 5.86 5.02 -1.26 -4.52 118.16 125.88 2v6a n LYS 77 Ca 0.06 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.20 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 2.50 0.57 -0.35 1.43 -1.26 -5.10 118.68 116.47 2v6a s LEU 78 Ca 0.00 -1.04 -0.20 0.00 -1.03 0.00 0.00 54.13 51.86 2v6a s LEU 78 Cb 0.00 -0.42 -0.05 0.00 0.03 0.00 0.00 46.19 45.75 2v6a s LEU 78 CO 0.00 -0.32 1.16 -2.65 0.23 0.00 0.00 176.35 174.78 2v6a n PRO 79 N -0.27 1.26 -2.15 1.29 -0.02 -1.26 -4.85 135.00 129.01 2v6a n PRO 79 Ca -0.09 0.48 -0.42 0.00 -2.02 0.00 0.00 63.50 61.45 2v6a n PRO 79 Cb 0.61 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 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 -1.03 3.77 -1.72 -0.52 2.81 0.59 -4.96 117.12 116.06 2v6a n MET 80 Ca 0.12 -3.36 -0.42 0.00 -1.81 0.00 0.00 57.70 52.23 2v6a n MET 80 Cb 0.46 -2.89 -0.03 0.00 -0.71 0.00 0.00 33.22 30.05 2v6a n MET 80 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2v6a n PHE 81 N 3.58 2.75 -0.33 2.03 3.72 -1.26 -1.80 117.46 126.15 2v6a n PHE 81 Ca 0.48 0.06 0.00 0.00 -0.05 0.00 0.00 57.45 57.93 2v6a n PHE 81 Cb 0.33 -2.67 0.00 0.00 -0.94 0.00 0.00 39.48 36.21 2v6a n PHE 81 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2v6a n GLY 82 N 3.85 1.84 3.68 1.37 0.00 -1.26 -5.00 105.19 109.67 2v6a n GLY 82 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 5.99 2.05 -3.82 0.00 1.74 -1.26 -4.94 116.66 116.43 2v6a n ARG 84 Ca 0.16 -1.37 -0.36 0.00 -0.77 0.00 0.00 57.85 55.51 2v6a n ARG 84 Cb 0.42 -0.92 -0.12 0.00 -1.02 0.00 0.00 32.46 30.81 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 -0.97 5.14 0.52 0.55 2.15 -1.26 -4.99 116.67 117.81 2v6a s ASP 85 Ca 0.03 -1.53 0.16 0.00 0.43 0.00 0.00 52.55 51.64 2v6a s ASP 85 Cb 0.03 -1.80 1.26 0.00 -0.30 0.00 0.00 42.92 42.11 2v6a s ASP 85 CO 0.00 -0.39 2.14 1.55 -0.17 0.00 0.00 175.17 178.31 2v6a h PRO 86 N 8.08 0.02 -0.14 4.34 0.13 -1.94 -1.69 132.00 140.80 2v6a h PRO 86 Ca -0.19 -0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.87 2v6a h PRO 86 Cb 1.06 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 2v6a h PRO 86 CO 0.62 0.02 -0.23 0.52 -0.23 0.00 0.00 178.00 178.69 2v6a h MET 87 N 0.03 0.25 -0.73 0.86 2.86 -1.99 -2.10 114.93 114.10 2v6a h MET 87 Ca 0.02 -0.08 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 2v6a h MET 87 Cb 0.03 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 2v6a h MET 87 CO -0.00 0.47 0.24 1.96 1.06 0.00 0.00 176.91 180.64 2v6a h GLN 88 N 0.22 1.12 -0.11 1.72 4.20 -1.74 -1.13 115.11 119.39 2v6a h GLN 88 Ca 0.04 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.51 2v6a h GLN 88 Cb 0.54 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2v6a h GLN 88 CO 0.04 0.95 0.06 0.28 -0.67 0.00 0.00 178.83 179.49 2v6a h VAL 89 N 1.07 1.11 -0.97 -0.54 2.07 -1.45 -2.07 116.25 115.47 2v6a h VAL 89 Ca 0.24 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2v6a h VAL 89 Cb 0.29 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 2v6a h VAL 89 CO -0.01 0.10 0.61 -0.07 0.02 0.00 0.00 177.57 178.23 2v6a h LEU 90 N 0.06 1.15 -1.18 2.57 3.38 -1.28 -1.44 115.31 118.57 2v6a h LEU 90 Ca 0.04 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2v6a h LEU 90 Cb 0.11 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2v6a h LEU 90 CO -0.01 0.86 0.38 0.03 0.09 0.00 0.00 178.44 179.79 2v6a h ARG 91 N 1.33 0.94 -0.24 1.13 3.08 -1.06 -2.21 114.38 117.35 2v6a h ARG 91 Ca 0.35 -0.10 -0.13 0.00 0.07 0.00 0.00 59.98 60.17 2v6a h ARG 91 Cb -0.10 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.75 2v6a h ARG 91 CO -0.07 0.69 -0.40 0.93 -1.07 0.00 0.00 179.97 180.05 2v6a h GLU 92 N 0.95 0.57 -0.28 0.04 4.39 -0.60 -1.08 114.58 118.57 2v6a h GLU 92 Ca 0.24 -0.29 0.04 0.00 0.34 0.00 0.00 59.36 59.69 2v6a h GLU 92 Cb 0.02 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 2v6a h GLU 92 CO -0.04 0.87 0.07 0.82 -1.16 0.00 0.00 179.01 179.57 2v6a h ILE 93 N 0.47 0.89 -0.40 3.13 2.04 -0.96 0.12 117.51 122.80 2v6a h ILE 93 Ca 0.04 -0.06 0.05 0.00 1.00 0.00 0.00 64.86 65.89 2v6a h ILE 93 Cb 0.90 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 37.63 2v6a h ILE 93 CO 0.08 0.03 0.12 0.58 0.00 0.00 0.00 178.15 178.96 2v6a h VAL 94 N 0.18 0.85 -0.64 1.67 2.07 -1.18 -1.58 116.25 117.63 2v6a h VAL 94 Ca 0.13 -0.09 -0.06 0.00 0.82 0.00 0.00 66.70 67.49 2v6a h VAL 94 Cb 0.12 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 2v6a h VAL 94 CO -0.15 0.05 0.15 0.00 0.02 0.00 0.00 177.57 177.64 2v6a h ALA 95 N 1.27 0.84 0.03 1.67 0.00 -0.72 -0.56 119.26 121.80 2v6a h ALA 95 Ca 0.19 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2v6a h ALA 95 Cb 0.19 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2v6a h ALA 95 CO -0.21 0.56 -0.01 0.00 0.00 0.00 0.00 179.25 179.59 2v6a h THR 97 N -0.41 1.18 -0.40 0.00 1.35 -1.28 -0.86 112.91 112.49 2v6a h THR 97 Ca -0.00 -0.77 -0.08 0.00 -0.55 0.00 0.00 66.41 65.01 2v6a h THR 97 Cb 0.38 1.17 -0.01 0.00 -1.73 0.00 0.00 68.15 67.96 2v6a h THR 97 CO 0.01 0.24 -0.05 0.50 -0.25 0.00 0.00 175.52 175.97 2v6a h LYS 98 N 0.26 0.74 -0.22 4.72 3.64 -1.03 -2.61 116.57 122.06 2v6a h LYS 98 Ca 0.05 -0.26 -0.11 0.00 -1.27 0.00 0.00 60.65 59.07 2v6a h LYS 98 Cb 0.36 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 2v6a h LYS 98 CO 0.02 0.86 -0.31 0.00 -2.27 0.00 0.00 179.45 177.74 2v6a h ALA 99 N 0.86 1.05 -2.11 5.00 0.00 -0.90 -3.36 119.26 119.80 2v6a h ALA 99 Ca 0.11 -0.38 -0.58 0.00 0.00 0.00 0.00 54.91 54.06 2v6a h ALA 99 Cb 0.56 -0.11 -0.41 0.00 0.00 0.00 0.00 17.79 17.83 2v6a h ALA 99 CO 0.03 0.58 -0.82 1.19 0.00 0.00 0.00 179.25 180.23 2v6a n PHE 100 N -4.08 1.94 0.36 0.00 3.01 -0.37 -4.95 117.46 113.37 2v6a n PHE 100 Ca -0.01 -3.90 0.12 0.00 1.01 0.00 0.00 57.45 54.67 2v6a n PHE 100 Cb 0.44 -0.47 0.52 0.00 -0.01 0.00 0.00 39.48 39.97 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 4.02 0.00 -0.33 -1.08 0.13 -1.62 -2.73 132.00 130.39 2v6a h PRO 101 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2v6a h PRO 101 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 2v6a h PRO 101 CO 0.68 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.20 2v6a n ASP 102 N -2.31 2.90 -4.93 1.44 8.00 -1.26 -4.63 116.55 115.75 2v6a n ASP 102 Ca 0.02 -1.89 -0.27 0.00 0.71 0.00 0.00 54.79 53.36 2v6a n ASP 102 Cb 0.21 -0.21 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 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 -1.04 3.86 0.26 2.24 0.00 -1.03 -4.39 121.76 121.66 2v6a s ALA 103 Ca 0.26 -0.87 -0.29 0.00 0.00 0.00 0.00 51.96 51.05 2v6a s ALA 103 Cb 0.14 -1.95 -0.09 0.00 0.00 0.00 0.00 23.12 21.22 2v6a s ALA 103 CO 0.19 0.46 1.14 0.71 0.00 0.00 0.00 175.76 178.26 2v6a s TYR 104 N -1.84 3.48 -0.03 0.00 1.51 0.15 -3.95 117.35 116.68 2v6a s TYR 104 Ca 0.38 1.61 0.01 0.00 -1.01 0.00 0.00 57.07 58.06 2v6a s TYR 104 Cb -0.11 -3.36 0.01 0.00 -0.11 0.00 0.00 41.96 38.39 2v6a s TYR 104 CO 0.29 -0.84 -0.05 0.08 -1.11 0.00 0.00 175.55 173.92 2v6a s VAL 105 N -0.92 0.52 0.05 0.71 1.01 -0.42 -1.15 120.40 120.20 2v6a s VAL 105 Ca 0.47 -0.18 0.06 0.00 0.00 0.00 0.00 61.98 62.33 2v6a s VAL 105 Cb -0.33 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.52 2v6a s VAL 105 CO 0.42 0.19 -0.18 0.00 0.00 0.00 0.00 175.10 175.53 2v6a s ARG 106 N 0.51 1.18 -0.17 2.72 1.70 -0.12 -0.06 118.95 124.71 2v6a s ARG 106 Ca -0.07 -0.88 -0.13 0.00 -0.47 0.00 0.00 55.73 54.19 2v6a s ARG 106 Cb -0.10 -1.26 -0.05 0.00 -0.57 0.00 0.00 34.95 32.97 2v6a s ARG 106 CO 0.00 0.32 0.26 -1.17 -1.08 0.00 0.00 175.30 173.62 2v6a s LEU 107 N -1.21 4.24 0.27 -1.89 2.96 -0.46 -1.51 118.68 121.08 2v6a s LEU 107 Ca 0.05 0.44 0.04 0.00 -0.22 0.00 0.00 54.13 54.44 2v6a s LEU 107 Cb -0.08 -2.31 -0.06 0.00 0.50 0.00 0.00 46.19 44.24 2v6a s LEU 107 CO 0.02 0.12 0.03 0.68 -1.32 0.00 0.00 176.35 175.87 2v6a s VAL 108 N 0.44 1.09 -0.01 1.68 -7.23 0.14 -1.39 120.40 115.12 2v6a s VAL 108 Ca 0.15 -2.03 -0.07 0.00 -1.81 0.00 0.00 61.98 58.22 2v6a s VAL 108 Cb -0.12 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.27 2v6a s VAL 108 CO 0.02 -0.17 0.14 0.00 -0.31 0.00 0.00 175.10 174.79 2v6a s ALA 109 N -3.38 -0.34 0.03 1.32 0.00 -1.00 -0.87 121.76 117.52 2v6a s ALA 109 Ca 0.33 -0.04 0.05 0.00 0.00 0.00 0.00 51.96 52.30 2v6a s ALA 109 Cb 0.07 0.05 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 2v6a s ALA 109 CO 0.12 -0.19 -0.12 -0.06 0.00 0.00 0.00 175.76 175.51 2v6a s PHE 110 N -1.17 2.73 -0.26 0.00 0.08 0.04 -0.34 117.98 119.07 2v6a s PHE 110 Ca -0.13 -0.14 -0.05 0.00 0.12 0.00 0.00 56.93 56.73 2v6a s PHE 110 Cb -0.07 -1.53 -0.00 0.00 -0.57 0.00 0.00 43.02 40.85 2v6a s PHE 110 CO 0.01 0.32 0.02 0.34 -0.10 0.00 0.00 175.22 175.81 2v6a s ASP 111 N -1.48 4.74 0.00 1.36 -1.08 -0.36 -1.03 116.67 118.81 2v6a s ASP 111 Ca 0.16 -0.54 0.29 0.00 -0.52 0.00 0.00 52.55 51.95 2v6a s ASP 111 Cb -0.11 -1.81 1.29 0.00 -1.46 0.00 0.00 42.92 40.83 2v6a s ASP 111 CO 0.07 -0.10 1.94 -0.46 0.52 0.00 0.00 175.17 177.15 2v6a n ASN 112 N 4.83 0.03 -0.03 -0.34 6.94 -1.26 -0.82 115.26 124.61 2v6a n ASN 112 Ca -0.16 0.28 -0.20 0.00 -0.02 0.00 0.00 54.58 54.48 2v6a n ASN 112 Cb 0.49 -0.41 -0.13 0.00 -2.36 0.00 0.00 39.78 37.38 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 0.01 0.14 0.00 -3.83 1.08 -1.95 -3.28 115.11 107.28 2v6a h GLN 113 Ca 0.00 -0.23 -0.01 0.00 -1.45 0.00 0.00 58.65 56.95 2v6a h GLN 113 Cb 0.44 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.95 2v6a h GLN 113 CO 0.00 1.11 -0.07 0.87 -0.95 0.00 0.00 178.83 179.79 2v6a h LYS 114 N -0.63 0.00 -6.12 1.46 1.57 -2.01 -3.48 116.57 107.36 2v6a h LYS 114 Ca -0.23 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.24 2v6a h LYS 114 Cb 1.47 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.81 2v6a h LYS 114 CO -0.01 0.07 -0.69 0.94 -0.57 0.00 0.00 179.45 179.19 2v6a n GLN 115 N -3.14 -1.36 -3.50 3.15 7.27 0.00 -5.03 117.38 114.77 2v6a n GLN 115 Ca 0.02 0.89 -0.16 0.00 0.07 0.00 0.00 57.00 57.82 2v6a n GLN 115 Cb 0.46 -4.04 -0.05 0.00 2.41 0.00 0.00 30.24 29.02 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 -3.15 0.00 0.14 1.69 0.11 -0.93 -5.01 120.40 113.24 2v6a s VAL 116 Ca 0.17 -0.01 -0.31 0.00 -2.93 0.00 0.00 61.98 58.89 2v6a s VAL 116 Cb -0.06 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.70 2v6a s VAL 116 CO 0.84 -0.00 1.50 -1.58 -3.33 0.00 0.00 175.10 172.53 2v6a s GLN 117 N -1.82 4.25 0.00 1.54 0.74 -1.26 -1.23 119.66 121.88 2v6a s GLN 117 Ca -0.08 2.24 0.07 0.00 0.05 0.00 0.00 55.36 57.65 2v6a s GLN 117 Cb -0.00 -3.23 -0.05 0.00 1.10 0.00 0.00 33.01 30.82 2v6a s GLN 117 CO 0.04 -0.55 0.38 0.44 -0.55 0.00 0.00 175.29 175.05 2v6a n ILE 118 N 4.03 0.00 -3.76 -2.34 -6.64 0.54 -4.91 119.36 106.29 2v6a n ILE 118 Ca 0.13 -0.36 -0.10 0.00 -1.77 0.00 0.00 62.75 60.65 2v6a n ILE 118 Cb 0.40 1.03 -0.04 0.00 -1.44 0.00 0.00 39.64 39.59 2v6a n ILE 118 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2v6a s MET 119 N -1.50 1.34 0.00 6.28 0.23 -1.20 -4.99 119.30 119.44 2v6a s MET 119 Ca 0.04 -0.89 0.00 0.00 -1.03 0.00 0.00 55.69 53.81 2v6a s MET 119 Cb 0.06 0.50 0.00 0.00 -1.53 0.00 0.00 34.83 33.86 2v6a s MET 119 CO 0.26 -0.56 0.00 0.41 -2.03 0.00 0.00 175.02 173.10 2v6a n GLY 120 N -0.32 1.68 3.49 3.16 0.00 -1.26 -2.37 105.19 109.57 2v6a n GLY 120 Ca -0.10 -0.18 -0.11 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.56 -0.45 0.19 1.61 -0.71 -0.49 -4.39 117.98 112.19 2v6a s PHE 121 Ca 0.00 0.43 -0.30 0.00 -1.04 0.00 0.00 56.93 56.02 2v6a s PHE 121 Cb 0.00 0.51 -0.08 0.00 -1.21 0.00 0.00 43.02 42.24 2v6a s PHE 121 CO 0.00 -0.62 1.19 -1.17 -1.34 0.00 0.00 175.22 173.29 2v6a s LEU 122 N -2.19 4.45 -0.00 -1.99 2.96 -1.26 -1.35 118.68 119.29 2v6a s LEU 122 Ca 0.01 2.24 0.06 0.00 -0.22 0.00 0.00 54.13 56.22 2v6a s LEU 122 Cb -0.01 -3.61 -0.08 0.00 0.50 0.00 0.00 46.19 42.99 2v6a s LEU 122 CO -0.06 -0.36 0.18 1.33 -1.32 0.00 0.00 176.35 176.12 2v6a n VAL 123 N 2.41 0.00 -3.73 1.68 0.24 0.92 -4.88 118.33 114.97 2v6a n VAL 123 Ca 0.04 -0.23 -0.13 0.00 -2.04 0.00 0.00 64.34 61.98 2v6a n VAL 123 Cb 0.45 0.62 -0.10 0.00 -1.47 0.00 0.00 33.84 33.34 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 -2.06 0.47 0.17 7.34 0.74 -0.88 -4.96 119.66 120.49 2v6a s GLN 124 Ca -0.00 0.61 0.11 0.00 0.05 0.00 0.00 55.36 56.13 2v6a s GLN 124 Cb 0.04 0.20 -0.04 0.00 1.10 0.00 0.00 33.01 34.31 2v6a s GLN 124 CO 0.24 -0.07 -0.25 -0.98 -0.55 0.00 0.00 175.29 173.68 2v6a s ARG 125 N 0.39 1.47 0.55 1.67 1.70 -1.26 -1.30 118.95 122.17 2v6a s ARG 125 Ca -0.01 -1.46 -0.21 0.00 -0.47 0.00 0.00 55.73 53.58 2v6a s ARG 125 Cb -0.04 -1.87 -0.05 0.00 -0.57 0.00 0.00 34.95 32.43 2v6a s ARG 125 CO -0.01 0.42 1.29 -1.25 -1.08 0.00 0.00 175.30 174.67 2v6a s PRO 126 N -2.43 3.16 0.53 3.89 0.04 -1.25 -4.90 135.00 134.05 2v6a s PRO 126 Ca 0.18 2.07 0.22 0.00 0.04 0.00 0.00 61.00 63.51 2v6a s PRO 126 Cb -0.09 -2.19 1.43 0.00 0.04 0.00 0.00 34.50 33.70 2v6a s PRO 126 CO 0.08 -1.12 2.15 0.87 0.04 0.00 0.00 177.00 179.03 2v6a h LYS 127 N 1.38 0.00 0.00 4.56 1.57 -1.90 -2.46 116.57 119.72 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 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 2v6a h LYS 127 CO 0.57 0.05 0.00 0.25 -0.57 0.00 0.00 179.45 179.74 2v6a n THR 128 N -4.17 0.55 -2.01 -0.16 -2.24 -1.26 -4.87 114.28 100.12 2v6a n THR 128 Ca -0.03 -0.02 -0.42 0.00 -2.27 0.00 0.00 64.05 61.31 2v6a n THR 128 Cb 0.13 -0.75 -0.03 0.00 -2.10 0.00 0.00 70.33 67.58 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 -3.11 3.69 -0.05 6.98 0.00 -0.93 -4.91 121.76 123.44 2v6a s ALA 129 Ca 0.10 1.31 0.07 0.00 0.00 0.00 0.00 51.96 53.43 2v6a s ALA 129 Cb 0.13 -3.58 0.10 0.00 0.00 0.00 0.00 23.12 19.77 2v6a s ALA 129 CO 0.49 -0.73 0.98 0.54 0.00 0.00 0.00 175.76 177.03 2v6a n ARG 130 N 3.40 1.45 -0.65 0.00 5.12 -1.26 -4.80 116.66 119.92 2v6a n ARG 130 Ca 0.11 -1.65 0.08 0.00 -1.93 0.00 0.00 57.85 54.47 2v6a n ARG 130 Cb 0.40 -1.02 0.35 0.00 -1.16 0.00 0.00 32.46 31.03 2v6a n ARG 130 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 2v6a n ASP 131 N -0.67 4.83 -4.14 0.55 3.85 -1.26 -4.85 116.55 114.86 2v6a n ASP 131 Ca 0.06 -2.65 -0.10 0.00 -0.71 0.00 0.00 54.79 51.39 2v6a n ASP 131 Cb 0.50 -0.59 -0.10 0.00 -1.35 0.00 0.00 41.12 39.58 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 -2.21 0.77 -0.01 2.11 -0.12 -0.96 -0.84 117.98 116.73 2v6a s PHE 132 Ca 0.49 -0.90 0.05 0.00 -0.05 0.00 0.00 56.93 56.52 2v6a s PHE 132 Cb 0.35 -0.47 -0.03 0.00 -0.63 0.00 0.00 43.02 42.24 2v6a s PHE 132 CO 0.19 -0.19 -0.14 -0.65 -0.05 0.00 0.00 175.22 174.38 2v6a s GLN 133 N -3.57 2.38 0.71 1.99 -1.52 -1.14 -4.80 119.66 113.70 2v6a s GLN 133 Ca 0.08 -0.79 -0.15 0.00 -1.95 0.00 0.00 55.36 52.55 2v6a s GLN 133 Cb 0.04 -2.34 0.03 0.00 -0.22 0.00 0.00 33.01 30.51 2v6a s GLN 133 CO -0.05 0.59 1.18 -1.25 -0.25 0.00 0.00 175.29 175.51 2v6a s PRO 134 N -1.10 2.33 0.30 2.91 0.04 -1.26 -4.83 135.00 133.39 2v6a s PRO 134 Ca 0.14 1.67 0.05 0.00 0.04 0.00 0.00 61.00 62.90 2v6a s PRO 134 Cb -0.11 -1.87 0.75 0.00 0.04 0.00 0.00 34.50 33.31 2v6a s PRO 134 CO 0.04 -1.67 1.74 0.00 0.04 0.00 0.00 177.00 177.15 2v6a h ALA 135 N -0.17 1.58 0.00 8.56 0.00 -1.98 0.29 119.26 127.54 2v6a h ALA 135 Ca -0.47 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2v6a h ALA 135 Cb 1.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2v6a h ALA 135 CO 0.51 -0.19 0.00 0.27 0.00 0.00 0.00 179.25 179.84 2v6a n ASN 136 N -4.89 0.00 -0.25 0.00 6.94 -1.26 -2.85 115.26 112.95 2v6a n ASN 136 Ca 0.23 -0.10 0.02 0.00 -0.02 0.00 0.00 54.58 54.72 2v6a n ASN 136 Cb 0.62 -0.25 0.06 0.00 -2.36 0.00 0.00 39.78 37.85 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 -1.25 2.85 0.19 -3.83 5.02 0.08 -4.64 118.16 116.57 2v6a n LYS 137 Ca 0.11 -1.69 0.03 0.00 -2.02 0.00 0.00 58.31 54.74 2v6a n LYS 137 Cb 0.16 -1.11 0.36 0.00 -0.02 0.00 0.00 35.03 34.43 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 0.80 0.00 -5.37 1.97 3.08 -1.42 -3.44 114.38 110.00 2v6a h ARG 138 Ca 0.00 0.00 -0.41 0.00 0.07 0.00 0.00 59.98 59.64 2v6a h ARG 138 Cb 0.58 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.44 2v6a h ARG 138 CO 0.00 0.38 -0.76 -1.54 -1.07 0.00 0.00 179.97 176.98 2v6a s SER 139 N -6.81 1.88 0.00 7.04 1.04 -1.26 -0.59 113.70 115.01 2v6a s SER 139 Ca -0.02 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.64 2v6a s SER 139 Cb 0.14 -0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.20 2v6a s SER 139 CO 0.71 -0.14 0.22 1.33 0.98 0.00 0.00 173.24 176.34