#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1woa s LYS 4 N 0.00 4.30 0.70 5.56 2.20 -1.26 -5.00 119.74 126.24 1woa s LYS 4 Ca 0.00 1.50 -0.16 0.00 -0.36 0.00 0.00 55.97 56.95 1woa s LYS 4 Cb 0.00 -3.64 0.02 0.00 -1.51 0.00 0.00 37.83 32.70 1woa s LYS 4 CO 0.00 -0.55 1.25 0.71 -0.36 0.00 0.00 175.35 176.40 1woa s TYR 5 N 2.84 2.03 -0.07 4.03 2.02 -1.26 -4.83 117.35 122.11 1woa s TYR 5 Ca 0.50 1.55 0.01 0.00 -0.37 0.00 0.00 57.07 58.76 1woa s TYR 5 Cb -0.19 -3.58 0.02 0.00 -0.40 0.00 0.00 41.96 37.81 1woa s TYR 5 CO 0.14 -2.78 -0.08 0.12 -1.57 0.00 0.00 175.55 171.38 1woa s PHE 6 N -1.71 1.21 -0.19 2.71 5.36 -0.54 -1.34 117.98 123.47 1woa s PHE 6 Ca 0.78 -0.47 -0.00 0.00 -0.96 0.00 0.00 56.93 56.27 1woa s PHE 6 Cb -0.33 -0.98 0.05 0.00 -0.34 0.00 0.00 43.02 41.42 1woa s PHE 6 CO 0.43 -0.32 -0.04 0.08 -1.46 0.00 0.00 175.22 173.91 1woa s VAL 7 N 1.13 1.15 -0.02 3.12 1.01 0.12 -1.64 120.40 125.27 1woa s VAL 7 Ca -0.07 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.13 1woa s VAL 7 Cb -0.14 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1woa s VAL 7 CO -0.01 0.01 -0.06 0.00 0.00 0.00 0.00 175.10 175.04 1woa s ALA 8 N 1.59 3.06 -0.34 5.51 0.00 0.46 -1.29 121.76 130.75 1woa s ALA 8 Ca -0.02 -0.97 -0.05 0.00 0.00 0.00 0.00 51.96 50.93 1woa s ALA 8 Cb -0.17 -1.20 0.05 0.00 0.00 0.00 0.00 23.12 21.81 1woa s ALA 8 CO -0.07 0.61 0.08 0.00 0.00 0.00 0.00 175.76 176.38 1woa s ALA 9 N -0.96 2.99 -0.70 0.00 0.00 0.19 -0.31 121.76 122.95 1woa s ALA 9 Ca 0.16 -1.84 -0.16 0.00 0.00 0.00 0.00 51.96 50.12 1woa s ALA 9 Cb -0.11 -2.18 0.16 0.00 0.00 0.00 0.00 23.12 20.99 1woa s ALA 9 CO 0.06 -1.37 0.70 1.21 0.00 0.00 0.00 175.76 176.36 1woa s ASN 10 N 1.43 6.46 0.02 0.00 3.84 0.03 0.26 114.94 126.98 1woa s ASN 10 Ca -0.02 -2.13 0.12 0.00 0.21 0.00 0.00 52.86 51.05 1woa s ASN 10 Cb -0.20 -2.24 0.53 0.00 -0.55 0.00 0.00 41.25 38.79 1woa s ASN 10 CO 0.01 -0.80 1.39 0.79 -2.79 0.00 0.00 177.10 175.70 1woa n TRP 11 N 5.02 0.05 -3.30 0.43 8.01 -0.94 -4.52 117.44 122.19 1woa n TRP 11 Ca 0.02 0.02 0.00 0.00 -1.31 0.00 0.00 57.50 56.23 1woa n TRP 11 Cb 0.44 -0.54 0.00 0.00 -2.01 0.00 0.00 31.31 29.20 1woa n TRP 11 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1woa n LYS 12 N -1.55 0.00 -3.14 -0.99 5.02 -1.26 -3.20 118.16 113.04 1woa n LYS 12 Ca 0.03 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.88 1woa n LYS 12 Cb 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.15 1woa n LYS 12 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1woa s ASN 14 N 0.14 -0.02 0.00 0.00 0.01 -1.19 -5.16 114.94 108.72 1woa s ASN 14 Ca 0.32 -0.60 0.00 0.00 -0.71 0.00 0.00 52.86 51.87 1woa s ASN 14 Cb -0.03 0.41 0.00 0.00 0.41 0.00 0.00 41.25 42.04 1woa s ASN 14 CO 0.00 -0.82 0.00 0.61 -1.51 0.00 0.00 177.10 175.38 1woa n GLY 15 N -0.16 2.97 3.16 0.66 0.00 -1.26 -4.77 105.19 105.78 1woa n GLY 15 Ca -0.13 -1.76 -0.11 0.00 0.00 0.00 0.00 46.02 44.01 1woa n GLY 15 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1woa s THR 16 N -2.08 0.69 0.35 2.61 -4.23 -1.26 -5.02 115.64 106.70 1woa s THR 16 Ca 0.00 -1.79 0.11 0.00 -1.18 0.00 0.00 61.69 58.83 1woa s THR 16 Cb 0.00 -1.51 0.34 0.00 1.34 0.00 0.00 72.50 72.67 1woa s THR 16 CO 0.00 -0.78 1.79 -0.07 -0.54 0.00 0.00 174.62 175.02 1woa h LEU 17 N 3.22 0.62 -0.03 4.79 3.38 -2.00 -1.99 115.31 123.31 1woa h LEU 17 Ca -0.35 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.65 1woa h LEU 17 Cb 1.17 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1woa h LEU 17 CO 0.60 0.20 -0.16 -0.08 0.09 0.00 0.00 178.44 179.10 1woa h GLU 18 N 0.59 0.15 -0.73 1.13 4.81 -2.00 -2.89 114.58 115.65 1woa h GLU 18 Ca 0.56 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.66 1woa h GLU 18 Cb 1.11 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.48 1woa h GLU 18 CO -0.32 0.80 0.46 0.66 -0.73 0.00 0.00 179.01 179.88 1woa h SER 19 N -0.45 0.86 -0.60 1.04 4.64 -1.87 -2.07 113.55 115.11 1woa h SER 19 Ca -0.01 -0.03 -0.07 0.00 -0.47 0.00 0.00 61.79 61.20 1woa h SER 19 Cb 0.83 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.68 1woa h SER 19 CO 0.03 0.64 0.10 0.40 -0.87 0.00 0.00 176.83 177.13 1woa h ILE 20 N 1.00 1.26 -0.37 0.95 2.04 -1.42 0.18 117.51 121.14 1woa h ILE 20 Ca 0.27 -1.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 1woa h ILE 20 Cb -0.08 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1woa h ILE 20 CO -0.05 0.37 0.20 0.50 0.00 0.00 0.00 178.15 179.17 1woa h LYS 21 N 0.96 0.51 -0.26 2.37 3.64 -1.17 -0.25 116.57 122.37 1woa h LYS 21 Ca 0.19 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1woa h LYS 21 Cb 0.42 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1woa h LYS 21 CO 0.01 0.42 0.09 1.03 -2.27 0.00 0.00 179.45 178.73 1woa h SER 22 N 0.46 0.37 -0.15 4.20 0.87 -1.04 -2.07 113.55 116.19 1woa h SER 22 Ca 0.13 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 1woa h SER 22 Cb 0.06 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 1woa h SER 22 CO -0.02 0.46 0.07 0.25 -0.53 0.00 0.00 176.83 177.07 1woa h LEU 23 N 0.26 0.20 -1.48 2.23 5.85 -0.44 -2.71 115.31 119.22 1woa h LEU 23 Ca 0.08 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 1woa h LEU 23 Cb 0.22 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1woa h LEU 23 CO -0.00 0.27 -0.03 0.71 -0.34 0.00 0.00 178.44 179.04 1woa h THR 24 N 0.12 1.15 -0.75 1.05 1.35 -1.05 -1.52 112.91 113.26 1woa h THR 24 Ca 0.05 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.32 1woa h THR 24 Cb 0.12 1.03 -0.04 0.00 -1.73 0.00 0.00 68.15 67.53 1woa h THR 24 CO -0.01 0.19 0.47 -1.13 -0.25 0.00 0.00 175.52 174.79 1woa h ASN 25 N 0.29 0.88 0.12 5.36 -0.73 -1.07 0.20 115.58 120.63 1woa h ASN 25 Ca 0.07 -0.04 -0.01 0.00 1.87 0.00 0.00 56.30 58.19 1woa h ASN 25 Cb 0.25 -0.22 0.00 0.00 0.27 0.00 0.00 38.32 38.62 1woa h ASN 25 CO 0.01 0.66 -0.06 0.28 -0.37 0.00 0.00 177.43 177.95 1woa h SER 26 N 1.02 -0.14 -0.71 1.15 0.02 -1.03 -3.25 113.55 110.61 1woa h SER 26 Ca 0.27 -0.38 0.12 0.00 -0.84 0.00 0.00 61.79 60.96 1woa h SER 26 Cb -0.07 0.04 -0.08 0.00 0.14 0.00 0.00 62.40 62.42 1woa h SER 26 CO -0.05 0.35 0.31 -0.26 -1.14 0.00 0.00 176.83 176.03 1woa h PHE 27 N -0.67 0.54 -0.71 3.45 -1.00 -0.94 -1.61 116.94 115.99 1woa h PHE 27 Ca -0.02 0.03 0.11 0.00 2.81 0.00 0.00 57.97 60.90 1woa h PHE 27 Cb 0.51 -0.13 -0.05 0.00 3.61 0.00 0.00 35.95 39.89 1woa h PHE 27 CO 0.08 0.13 0.47 -0.91 -1.61 0.00 0.00 178.31 176.47 1woa h ASN 28 N 0.50 0.50 -0.81 2.17 2.35 -0.67 -2.39 115.58 117.22 1woa h ASN 28 Ca 0.37 0.01 0.01 0.00 -0.55 0.00 0.00 56.30 56.14 1woa h ASN 28 Cb 0.49 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 38.73 1woa h ASN 28 CO -0.34 0.29 0.53 0.78 -1.65 0.00 0.00 177.43 177.05 1woa h ASN 29 N 0.55 0.93 -2.49 5.81 2.35 -1.32 -3.42 115.58 117.99 1woa h ASN 29 Ca 0.33 -0.03 -0.53 0.00 -0.55 0.00 0.00 56.30 55.52 1woa h ASN 29 Cb 0.55 -0.23 0.04 0.00 0.05 0.00 0.00 38.32 38.73 1woa h ASN 29 CO -0.11 0.68 1.08 -0.11 -1.65 0.00 0.00 177.43 177.32 1woa n LEU 30 N -4.41 3.97 -4.55 1.61 7.94 -0.90 -4.94 117.00 115.72 1woa n LEU 30 Ca 0.09 1.00 -0.40 0.00 -1.11 0.00 0.00 56.01 55.59 1woa n LEU 30 Cb 0.03 -1.54 -0.10 0.00 0.53 0.00 0.00 43.42 42.35 1woa n LEU 30 CO 0.37 0.15 -0.00 -0.62 -1.11 0.00 0.00 177.39 176.17 1woa s ASP 31 N 2.47 6.16 0.07 1.96 2.15 -1.26 -5.06 116.67 123.16 1woa s ASP 31 Ca 0.81 -0.22 -0.12 0.00 0.43 0.00 0.00 52.55 53.45 1woa s ASP 31 Cb -0.50 -2.18 0.01 0.00 -0.30 0.00 0.00 42.92 39.95 1woa s ASP 31 CO 0.37 -0.30 0.28 0.72 -0.17 0.00 0.00 175.17 176.07 1woa s PHE 32 N 1.96 -0.04 -0.38 -5.34 -0.71 -1.26 -5.13 117.98 107.08 1woa s PHE 32 Ca 0.11 -0.22 -0.22 0.00 -1.04 0.00 0.00 56.93 55.56 1woa s PHE 32 Cb -0.17 0.07 0.01 0.00 -1.21 0.00 0.00 43.02 41.72 1woa s PHE 32 CO 0.11 -0.54 0.70 0.34 -1.34 0.00 0.00 175.22 174.49 1woa s ASP 33 N -2.42 6.44 0.20 1.98 -1.08 -1.26 -4.93 116.67 115.60 1woa s ASP 33 Ca -0.01 0.10 0.21 0.00 -0.52 0.00 0.00 52.55 52.33 1woa s ASP 33 Cb 0.01 -2.35 0.89 0.00 -1.46 0.00 0.00 42.92 40.01 1woa s ASP 33 CO -0.07 -0.71 1.64 -0.81 0.52 0.00 0.00 175.17 175.74 1woa n PRO 34 N 6.29 0.15 0.09 4.34 -0.04 -1.26 -1.80 135.00 142.77 1woa n PRO 34 Ca 0.00 0.40 0.13 0.00 -0.04 0.00 0.00 63.50 63.99 1woa n PRO 34 Cb 0.48 -1.79 0.31 0.00 -0.04 0.00 0.00 33.50 32.47 1woa n PRO 34 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1woa n SER 35 N -2.06 0.79 -0.01 3.54 3.41 -1.26 -3.68 113.62 114.36 1woa n SER 35 Ca 0.02 0.41 0.07 0.00 -0.26 0.00 0.00 58.87 59.12 1woa n SER 35 Cb 0.20 -0.45 -0.11 0.00 -0.26 0.00 0.00 64.21 63.59 1woa n SER 35 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1woa n LYS 36 N -2.23 0.76 -3.82 4.33 5.02 -0.74 -5.01 118.16 116.47 1woa n LYS 36 Ca 0.05 -0.11 -0.12 0.00 -2.02 0.00 0.00 58.31 56.10 1woa n LYS 36 Cb 0.44 -1.32 -0.12 0.00 -0.02 0.00 0.00 35.03 34.01 1woa n LYS 36 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1woa s LEU 37 N -3.79 1.30 -0.22 -0.35 2.96 -0.85 -4.35 118.68 113.40 1woa s LEU 37 Ca -0.04 0.26 -0.07 0.00 -0.22 0.00 0.00 54.13 54.07 1woa s LEU 37 Cb 0.10 0.69 -0.03 0.00 0.50 0.00 0.00 46.19 47.44 1woa s LEU 37 CO 0.60 -0.14 0.06 -1.81 -1.32 0.00 0.00 176.35 173.75 1woa s ASP 38 N -0.23 5.34 -0.12 3.68 1.01 -0.45 -4.38 116.67 121.51 1woa s ASP 38 Ca -0.03 -0.08 -0.00 0.00 0.71 0.00 0.00 52.55 53.15 1woa s ASP 38 Cb -0.03 -1.93 0.03 0.00 1.01 0.00 0.00 42.92 42.00 1woa s ASP 38 CO 0.01 0.07 -0.08 -0.69 0.21 0.00 0.00 175.17 174.69 1woa s VAL 39 N 1.02 1.06 -0.00 -1.27 1.01 -1.26 0.16 120.40 121.11 1woa s VAL 39 Ca 0.04 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 61.73 1woa s VAL 39 Cb -0.14 -1.10 -0.02 0.00 0.00 0.00 0.00 36.38 35.12 1woa s VAL 39 CO 0.03 0.33 -0.22 -0.69 0.00 0.00 0.00 175.10 174.56 1woa s VAL 40 N 1.69 1.71 -0.17 2.92 1.01 -0.41 -1.44 120.40 125.70 1woa s VAL 40 Ca 0.04 -0.99 -0.00 0.00 0.00 0.00 0.00 61.98 61.03 1woa s VAL 40 Cb -0.13 -1.43 0.00 0.00 0.00 0.00 0.00 36.38 34.82 1woa s VAL 40 CO -0.08 0.42 -0.15 -0.69 0.00 0.00 0.00 175.10 174.60 1woa s VAL 41 N -0.57 2.57 -0.54 2.92 1.01 -0.15 0.54 120.40 126.18 1woa s VAL 41 Ca 0.08 -0.79 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 1woa s VAL 41 Cb -0.08 -2.10 0.14 0.00 0.00 0.00 0.00 36.38 34.34 1woa s VAL 41 CO -0.00 0.51 0.38 -0.36 0.00 0.00 0.00 175.10 175.63 1woa s PHE 42 N 1.08 3.49 0.79 5.22 0.40 0.14 -2.37 117.98 126.75 1woa s PHE 42 Ca -0.00 -2.28 -0.05 0.00 -0.60 0.00 0.00 56.93 54.00 1woa s PHE 42 Cb -0.14 -3.37 0.15 0.00 0.51 0.00 0.00 43.02 40.17 1woa s PHE 42 CO -0.05 -0.94 1.09 -1.25 0.70 0.00 0.00 175.22 174.77 1woa s PRO 43 N 0.75 1.34 0.37 0.24 0.04 -1.24 -2.22 135.00 134.27 1woa s PRO 43 Ca 0.11 -0.98 -0.27 0.00 0.04 0.00 0.00 61.00 59.91 1woa s PRO 43 Cb -0.22 -2.20 -0.09 0.00 0.04 0.00 0.00 34.50 32.03 1woa s PRO 43 CO -0.03 -1.75 1.20 0.08 0.04 0.00 0.00 177.00 176.53 1woa s VAL 44 N -3.36 3.07 0.22 -0.36 1.01 -1.26 -4.27 120.40 115.45 1woa s VAL 44 Ca 0.69 0.96 -0.17 0.00 0.00 0.00 0.00 61.98 63.46 1woa s VAL 44 Cb -0.04 -3.57 0.22 0.00 0.00 0.00 0.00 36.38 32.99 1woa s VAL 44 CO 0.47 0.14 1.58 0.77 0.00 0.00 0.00 175.10 178.06 1woa h SER 45 N 2.95 -1.11 0.27 3.32 4.64 -1.94 0.48 113.55 122.16 1woa h SER 45 Ca -0.49 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1woa h SER 45 Cb 1.23 0.60 0.00 0.00 -0.31 0.00 0.00 62.40 63.92 1woa h SER 45 CO 0.64 -0.29 0.00 1.33 -0.87 0.00 0.00 176.83 177.64 1woa n VAL 46 N -5.47 1.41 0.78 0.95 0.24 -1.26 -1.26 118.33 113.72 1woa n VAL 46 Ca 0.08 0.35 0.08 0.00 -2.04 0.00 0.00 64.34 62.82 1woa n VAL 46 Cb 0.38 -1.21 -0.03 0.00 -1.47 0.00 0.00 33.84 31.51 1woa n VAL 46 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1woa n HIS 47 N -1.49 0.00 0.02 6.34 -0.00 0.16 -4.70 115.22 115.55 1woa n HIS 47 Ca 0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.63 1woa n HIS 47 Cb 0.09 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.03 1woa n HIS 47 CO 0.00 0.00 0.00 -0.92 -0.00 0.00 0.00 176.34 175.42 1woa h TYR 48 N 1.35 -1.00 -0.09 4.41 3.20 -0.23 -0.30 116.97 124.31 1woa h TYR 48 Ca 0.00 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.94 1woa h TYR 48 Cb 0.53 0.45 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 1woa h TYR 48 CO 0.00 -0.43 -0.09 -0.44 -1.64 0.00 0.00 178.16 175.55 1woa h ASP 49 N -0.45 -0.29 -0.06 -2.11 5.19 -1.84 -0.54 116.42 116.32 1woa h ASP 49 Ca 0.08 0.06 0.04 0.00 -0.62 0.00 0.00 57.03 56.59 1woa h ASP 49 Cb 0.58 0.14 -0.05 0.00 0.18 0.00 0.00 39.33 40.18 1woa h ASP 49 CO -0.35 -0.13 -0.29 -0.74 -3.12 0.00 0.00 179.24 174.61 1woa h HIS 50 N -0.12 -0.80 -0.47 4.55 2.76 -1.80 -1.24 115.15 118.03 1woa h HIS 50 Ca 0.07 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 1woa h HIS 50 Cb 0.21 0.36 -0.02 0.00 1.55 0.00 0.00 27.41 29.52 1woa h HIS 50 CO -0.20 -0.38 0.30 1.15 -1.30 0.00 0.00 177.93 177.50 1woa h THR 51 N -0.41 1.13 -0.88 6.26 2.02 -0.89 -2.73 112.91 117.42 1woa h THR 51 Ca 0.08 -0.24 0.06 0.00 0.77 0.00 0.00 66.41 67.07 1woa h THR 51 Cb 0.52 0.46 -0.05 0.00 -1.74 0.00 0.00 68.15 67.33 1woa h THR 51 CO -0.29 0.12 0.57 -0.09 0.37 0.00 0.00 175.52 176.20 1woa h ARG 52 N 0.63 0.98 0.00 6.66 9.65 -0.66 0.04 114.38 131.68 1woa h ARG 52 Ca 0.17 -0.06 -0.06 0.00 -1.10 0.00 0.00 59.98 58.93 1woa h ARG 52 Cb -0.06 -0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 28.29 1woa h ARG 52 CO -0.04 0.65 -0.29 0.87 2.80 0.00 0.00 179.97 183.96 1woa h LYS 53 N 1.01 0.00 0.04 0.20 1.57 -0.95 -3.26 116.57 115.18 1woa h LYS 53 Ca 0.37 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.84 1woa h LYS 53 Cb 0.16 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.43 1woa h LYS 53 CO -0.13 0.29 -1.76 -0.07 -0.57 0.00 0.00 179.45 177.21 1woa h LEU 54 N 0.00 0.12 -9.64 2.94 3.38 -0.98 -3.46 115.31 107.66 1woa h LEU 54 Ca -0.00 -0.26 -0.52 0.00 0.09 0.00 0.00 57.88 57.19 1woa h LEU 54 Cb 0.83 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 1woa h LEU 54 CO 0.04 1.23 0.28 -0.76 0.09 0.00 0.00 178.44 179.32 1woa s LEU 55 N -6.37 4.55 0.69 1.67 1.43 -0.11 -4.89 118.68 115.65 1woa s LEU 55 Ca -0.09 1.74 -0.12 0.00 -1.03 0.00 0.00 54.13 54.63 1woa s LEU 55 Cb 0.08 -3.46 0.01 0.00 0.03 0.00 0.00 46.19 42.84 1woa s LEU 55 CO 0.81 0.07 1.06 -1.10 0.23 0.00 0.00 176.35 177.42 1woa s GLN 56 N -0.56 2.91 0.49 1.70 -0.21 -1.26 -4.89 119.66 117.84 1woa s GLN 56 Ca 0.41 1.04 0.34 0.00 0.02 0.00 0.00 55.36 57.17 1woa s GLN 56 Cb -0.23 -1.98 1.47 0.00 1.00 0.00 0.00 33.01 33.26 1woa s GLN 56 CO 0.28 -1.12 1.71 0.77 -2.12 0.00 0.00 175.29 174.81 1woa h SER 57 N -0.55 0.14 -0.07 5.90 0.02 -1.96 0.12 113.55 117.15 1woa h SER 57 Ca -0.44 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 60.57 1woa h SER 57 Cb 1.22 0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.78 1woa h SER 57 CO 0.56 -0.02 0.07 0.07 -1.14 0.00 0.00 176.83 176.37 1woa h LYS 58 N 0.10 0.00 -5.82 3.45 2.10 -1.96 -3.40 116.57 111.04 1woa h LYS 58 Ca 0.70 0.00 -0.60 0.00 -2.00 0.00 0.00 60.65 58.75 1woa h LYS 58 Cb 2.47 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 33.73 1woa h LYS 58 CO -0.16 0.00 -0.22 -0.06 -2.00 0.00 0.00 179.45 177.01 1woa s PHE 59 N -4.72 3.61 0.28 0.07 0.40 0.40 -4.71 117.98 113.32 1woa s PHE 59 Ca -0.05 0.87 0.02 0.00 -0.60 0.00 0.00 56.93 57.17 1woa s PHE 59 Cb 0.16 -2.36 -0.03 0.00 0.51 0.00 0.00 43.02 41.30 1woa s PHE 59 CO 0.57 0.44 0.45 -1.12 0.70 0.00 0.00 175.22 176.26 1woa s SER 60 N -0.32 6.32 0.15 1.36 0.01 -0.52 -4.84 113.70 115.86 1woa s SER 60 Ca 0.22 0.29 0.02 0.00 1.31 0.00 0.00 55.95 57.80 1woa s SER 60 Cb -0.15 -1.96 -0.04 0.00 0.21 0.00 0.00 66.02 64.07 1woa s SER 60 CO 0.10 -0.17 -0.03 0.42 0.41 0.00 0.00 173.24 173.98 1woa s THR 61 N -2.11 0.77 0.19 1.44 -4.23 -1.26 -0.97 115.64 109.47 1woa s THR 61 Ca 0.37 -1.98 -0.22 0.00 -1.18 0.00 0.00 61.69 58.68 1woa s THR 61 Cb -0.10 -1.97 0.07 0.00 1.34 0.00 0.00 72.50 71.84 1woa s THR 61 CO 0.32 -0.62 1.01 -0.83 -0.54 0.00 0.00 174.62 173.97 1woa s GLY 62 N -3.14 0.08 0.10 3.99 0.00 -1.00 -3.17 107.32 104.18 1woa s GLY 62 Ca 0.20 -0.29 0.05 0.00 0.00 0.00 0.00 44.72 44.68 1woa s GLY 62 CO 0.01 1.85 -0.00 -0.26 0.00 0.00 0.00 173.10 174.70 1woa s ILE 63 N -2.34 3.96 -0.99 0.90 -4.36 -0.81 -3.71 121.20 113.84 1woa s ILE 63 Ca 0.20 -1.05 0.11 0.00 -0.26 0.00 0.00 60.65 59.65 1woa s ILE 63 Cb -0.03 -2.90 0.09 0.00 1.25 0.00 0.00 42.46 40.88 1woa s ILE 63 CO 0.05 0.09 1.35 0.00 0.24 0.00 0.00 174.94 176.68 1woa n GLN 64 N 0.50 0.00 -3.52 0.37 6.02 -1.26 -1.58 117.38 117.91 1woa n GLN 64 Ca -0.11 0.32 -0.13 0.00 -0.01 0.00 0.00 57.00 57.07 1woa n GLN 64 Cb 0.52 -1.51 -0.04 0.00 1.02 0.00 0.00 30.24 30.23 1woa n GLN 64 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1woa s ASN 65 N -3.02 -0.50 0.02 1.08 3.04 -1.25 -4.28 114.94 110.02 1woa s ASN 65 Ca 0.05 0.38 0.01 0.00 0.04 0.00 0.00 52.86 53.34 1woa s ASN 65 Cb 0.07 0.44 -0.01 0.00 -1.54 0.00 0.00 41.25 40.21 1woa s ASN 65 CO 0.20 -0.58 -0.04 0.54 -3.04 0.00 0.00 177.10 174.19 1woa s VAL 66 N -1.89 0.22 0.54 -5.21 0.11 -1.26 -4.88 120.40 108.04 1woa s VAL 66 Ca -0.03 -0.64 -0.19 0.00 -2.93 0.00 0.00 61.98 58.19 1woa s VAL 66 Cb -0.00 -0.29 -0.06 0.00 -1.53 0.00 0.00 36.38 34.49 1woa s VAL 66 CO 0.00 -0.27 1.08 -0.55 -3.33 0.00 0.00 175.10 172.04 1woa s SER 67 N -0.97 5.88 0.01 3.54 0.15 0.49 -4.94 113.70 117.87 1woa s SER 67 Ca -0.08 2.02 0.26 0.00 0.70 0.00 0.00 55.95 58.84 1woa s SER 67 Cb -0.07 -2.56 0.61 0.00 -1.71 0.00 0.00 66.02 62.29 1woa s SER 67 CO -0.00 -1.10 1.49 2.29 1.20 0.00 0.00 173.24 177.11 1woa n LYS 68 N -1.42 0.03 -3.49 5.44 2.85 -1.26 -4.57 118.16 115.74 1woa n LYS 68 Ca 0.10 0.01 -0.20 0.00 -1.05 0.00 0.00 58.31 57.18 1woa n LYS 68 Cb 0.52 -1.52 -0.02 0.00 -0.65 0.00 0.00 35.03 33.36 1woa n LYS 68 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1woa s PHE 69 N -3.02 2.88 0.00 5.58 0.08 -1.26 -4.76 117.98 117.48 1woa s PHE 69 Ca 0.11 -0.35 0.00 0.00 0.12 0.00 0.00 56.93 56.81 1woa s PHE 69 Cb 0.17 -2.07 0.00 0.00 -0.57 0.00 0.00 43.02 40.56 1woa s PHE 69 CO 0.67 -0.07 0.00 0.41 -0.10 0.00 0.00 175.22 176.13 1woa n GLY 70 N -1.58 1.74 3.63 4.36 0.00 -1.26 -4.59 105.19 107.49 1woa n GLY 70 Ca 0.02 -2.04 -0.37 0.00 0.00 0.00 0.00 46.02 43.63 1woa n GLY 70 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1woa n ASN 71 N -0.78 0.86 0.00 1.61 4.13 -1.26 -4.87 115.26 114.95 1woa n ASN 71 Ca 0.00 0.77 0.00 0.00 1.68 0.00 0.00 54.58 57.03 1woa n ASN 71 Cb 0.00 -1.41 0.00 0.00 -1.54 0.00 0.00 39.78 36.83 1woa n ASN 71 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1woa n GLY 72 N 1.22 0.59 3.14 7.41 0.00 -1.26 -5.00 105.19 111.30 1woa n GLY 72 Ca 0.14 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.00 1woa n GLY 72 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1woa n SER 73 N 1.80 2.98 -3.23 1.61 7.64 -1.26 -4.70 113.62 118.46 1woa n SER 73 Ca 0.00 -2.72 -0.25 0.00 1.01 0.00 0.00 58.87 56.91 1woa n SER 73 Cb 0.00 -1.34 -0.07 0.00 -1.01 0.00 0.00 64.21 61.79 1woa n SER 73 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1woa n TYR 74 N 8.38 0.16 -1.61 1.43 4.01 -1.26 -5.10 117.16 123.17 1woa n TYR 74 Ca 0.49 -3.63 -0.56 0.00 -0.16 0.00 0.00 57.90 54.03 1woa n TYR 74 Cb 0.41 -0.36 -0.07 0.00 -0.31 0.00 0.00 39.34 39.01 1woa n TYR 74 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1woa n THR 75 N 1.38 0.07 -0.03 -0.72 -1.04 -1.26 -1.53 114.28 111.15 1woa n THR 75 Ca 0.22 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.22 1woa n THR 75 Cb 0.51 -0.69 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 1woa n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1woa n GLY 76 N 2.79 1.30 3.95 3.41 0.00 -1.26 -5.05 105.19 110.34 1woa n GLY 76 Ca 0.22 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 1woa n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1woa s GLU 77 N -0.55 3.35 -0.10 1.61 0.41 -0.58 -5.10 118.70 117.74 1woa s GLU 77 Ca 0.00 -0.41 0.01 0.00 -0.41 0.00 0.00 54.97 54.16 1woa s GLU 77 Cb 0.00 -2.64 0.02 0.00 -1.78 0.00 0.00 34.13 29.72 1woa s GLU 77 CO 0.00 0.03 -0.13 0.08 -0.49 0.00 0.00 175.26 174.75 1woa s VAL 78 N -2.37 1.31 0.34 2.63 1.01 -1.26 -5.03 120.40 117.02 1woa s VAL 78 Ca 0.42 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.88 1woa s VAL 78 Cb -0.10 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 1woa s VAL 78 CO 0.36 0.40 0.54 -0.94 0.00 0.00 0.00 175.10 175.47 1woa s SER 79 N 1.10 6.30 0.39 3.32 1.04 -1.26 -0.38 113.70 124.22 1woa s SER 79 Ca -0.05 0.46 0.09 0.00 0.48 0.00 0.00 55.95 56.92 1woa s SER 79 Cb -0.14 -2.03 0.85 0.00 0.10 0.00 0.00 66.02 64.79 1woa s SER 79 CO -0.02 -0.28 1.98 0.00 0.98 0.00 0.00 173.24 175.89 1woa h ALA 80 N 0.84 1.81 -0.08 5.32 0.00 -1.81 -0.57 119.26 124.77 1woa h ALA 80 Ca -0.50 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 1woa h ALA 80 Cb 1.22 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1woa h ALA 80 CO 0.62 0.08 0.04 0.93 0.00 0.00 0.00 179.25 180.92 1woa h GLU 81 N 0.61 0.11 -0.63 0.00 3.07 -1.93 0.20 114.58 116.01 1woa h GLU 81 Ca 0.28 -0.02 0.04 0.00 -0.50 0.00 0.00 59.36 59.16 1woa h GLU 81 Cb 0.31 -0.02 -0.05 0.00 -0.84 0.00 0.00 28.75 28.16 1woa h GLU 81 CO -0.09 0.21 0.37 0.82 -1.40 0.00 0.00 179.01 178.93 1woa h ILE 82 N -0.01 1.03 0.19 3.13 1.08 -1.74 -1.41 117.51 119.78 1woa h ILE 82 Ca 0.03 -0.25 -0.00 0.00 -0.39 0.00 0.00 64.86 64.25 1woa h ILE 82 Cb 0.14 0.25 -0.01 0.00 -3.07 0.00 0.00 36.82 34.13 1woa h ILE 82 CO -0.00 0.13 -0.13 0.00 -0.69 0.00 0.00 178.15 177.45 1woa h ALA 83 N 1.30 -0.30 -0.61 1.87 0.00 -0.75 -2.57 119.26 118.19 1woa h ALA 83 Ca 0.27 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.22 1woa h ALA 83 Cb 0.09 0.18 -0.07 0.00 0.00 0.00 0.00 17.79 17.98 1woa h ALA 83 CO -0.13 -0.68 0.24 -0.22 0.00 0.00 0.00 179.25 178.46 1woa h LYS 84 N -0.32 0.42 -0.36 0.00 3.64 -0.22 -1.57 116.57 118.17 1woa h LYS 84 Ca -0.01 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1woa h LYS 84 Cb 0.28 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1woa h LYS 84 CO -0.00 0.28 0.24 0.22 -2.27 0.00 0.00 179.45 177.92 1woa h ASP 85 N 0.43 0.36 0.14 4.20 3.58 -1.05 -0.29 116.42 123.79 1woa h ASP 85 Ca 0.31 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.75 1woa h ASP 85 Cb 0.37 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.33 1woa h ASP 85 CO -0.30 0.26 -0.12 0.18 -2.88 0.00 0.00 179.24 176.38 1woa n LEU 86 N -4.49 1.12 -1.21 2.28 4.77 -0.71 -4.95 117.00 113.81 1woa n LEU 86 Ca 0.03 -0.32 -0.12 0.00 -0.03 0.00 0.00 56.01 55.57 1woa n LEU 86 Cb 0.11 -0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1woa n LEU 86 CO 0.35 0.20 -0.14 0.59 -1.33 0.00 0.00 177.39 177.05 1woa n ASN 87 N -0.35 -4.10 -4.76 -1.43 3.02 -0.12 -4.98 115.26 102.54 1woa n ASN 87 Ca 0.16 0.11 -0.41 0.00 -0.03 0.00 0.00 54.58 54.41 1woa n ASN 87 Cb 0.33 -3.07 -0.02 0.00 -0.61 0.00 0.00 39.78 36.42 1woa n ASN 87 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1woa s ILE 88 N -2.55 2.50 -0.20 2.41 1.09 -0.83 -4.93 121.20 118.68 1woa s ILE 88 Ca 0.00 0.45 -0.11 0.00 -1.10 0.00 0.00 60.65 59.89 1woa s ILE 88 Cb 0.00 -3.29 -0.20 0.00 -1.06 0.00 0.00 42.46 37.91 1woa s ILE 88 CO 0.00 0.09 0.08 1.21 -0.10 0.00 0.00 174.94 176.22 1woa n GLU 89 N 1.54 0.65 -4.50 2.79 2.13 -1.20 -4.64 120.64 117.41 1woa n GLU 89 Ca 0.04 0.34 -0.25 0.00 0.66 0.00 0.00 57.16 57.94 1woa n GLU 89 Cb 0.40 -1.65 -0.10 0.00 0.27 0.00 0.00 31.44 30.36 1woa n GLU 89 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 1woa s TYR 90 N -2.48 2.41 -0.02 4.31 1.51 -1.19 -1.22 117.35 120.67 1woa s TYR 90 Ca -0.30 -0.46 -0.08 0.00 -1.01 0.00 0.00 57.07 55.22 1woa s TYR 90 Cb 0.08 -1.34 0.01 0.00 -0.11 0.00 0.00 41.96 40.60 1woa s TYR 90 CO 0.63 0.59 0.18 0.14 -1.11 0.00 0.00 175.55 175.99 1woa s VAL 91 N -2.58 0.06 -0.08 0.71 -7.23 -0.78 -1.93 120.40 108.57 1woa s VAL 91 Ca 0.32 -0.47 -0.11 0.00 -1.81 0.00 0.00 61.98 59.91 1woa s VAL 91 Cb 0.01 -0.42 -0.05 0.00 0.56 0.00 0.00 36.38 36.48 1woa s VAL 91 CO 0.17 -0.26 0.26 -0.63 -0.31 0.00 0.00 175.10 174.33 1woa s ILE 92 N -0.97 5.30 -0.04 -0.62 1.01 -0.61 -0.78 121.20 124.48 1woa s ILE 92 Ca -0.11 0.49 0.02 0.00 0.00 0.00 0.00 60.65 61.05 1woa s ILE 92 Cb -0.06 -3.55 0.01 0.00 0.01 0.00 0.00 42.46 38.88 1woa s ILE 92 CO 0.02 0.57 -0.07 -0.63 0.00 0.00 0.00 174.94 174.83 1woa s ILE 93 N -0.84 0.71 -0.52 2.92 1.01 0.86 -3.95 121.20 121.38 1woa s ILE 93 Ca 0.18 -0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.57 1woa s ILE 93 Cb -0.14 -0.67 0.00 0.00 0.01 0.00 0.00 42.46 41.66 1woa s ILE 93 CO 0.07 0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.87 1woa n GLY 94 N 3.71 0.60 3.71 6.18 0.00 -1.26 0.22 105.19 118.35 1woa n GLY 94 Ca -0.22 -0.78 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 1woa n GLY 94 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1woa n HIS 95 N -3.18 2.45 -0.08 1.61 -0.00 -1.26 -4.43 115.22 110.33 1woa n HIS 95 Ca -0.06 0.44 0.19 0.00 0.46 0.00 0.00 57.72 58.76 1woa n HIS 95 Cb 0.28 -2.48 0.62 0.00 -0.12 0.00 0.00 29.99 28.29 1woa n HIS 95 CO 0.00 0.00 0.00 0.27 0.46 0.00 0.00 176.34 177.07 1woa h PHE 96 N 3.55 0.18 0.00 1.57 -0.00 -1.94 0.12 116.94 120.42 1woa h PHE 96 Ca -0.46 0.01 -0.02 0.00 -0.00 0.00 0.00 57.97 57.49 1woa h PHE 96 Cb 1.26 -0.06 -0.00 0.00 -0.00 0.00 0.00 35.95 37.15 1woa h PHE 96 CO 0.54 0.07 -0.11 0.93 -0.00 0.00 0.00 178.31 179.74 1woa h GLU 97 N 0.16 0.00 0.02 6.09 5.08 -1.99 0.24 114.58 124.17 1woa h GLU 97 Ca 0.32 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.41 1woa h GLU 97 Cb 1.04 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.25 1woa h GLU 97 CO -0.05 0.11 -1.48 0.00 -1.00 0.00 0.00 179.01 176.59 1woa h ARG 98 N 0.00 0.04 0.00 2.33 3.08 -1.12 -2.37 114.38 116.33 1woa h ARG 98 Ca -0.00 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 59.88 1woa h ARG 98 Cb 0.28 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1woa h ARG 98 CO 0.01 0.74 -0.50 0.00 -1.07 0.00 0.00 179.97 179.16 1woa h ARG 99 N 0.01 0.00 0.00 0.04 3.08 -0.88 -1.27 114.38 115.36 1woa h ARG 99 Ca -0.20 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.83 1woa h ARG 99 Cb 1.94 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.99 1woa h ARG 99 CO 0.10 0.50 -0.27 -0.22 -1.07 0.00 0.00 179.97 179.01 1woa h LYS 100 N 0.00 0.00 0.00 0.04 3.64 -0.61 -3.18 116.57 116.46 1woa h LYS 100 Ca -0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1woa h LYS 100 Cb 0.93 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1woa h LYS 100 CO 0.06 0.22 -0.43 1.88 -2.27 0.00 0.00 179.45 178.91 1woa h TYR 101 N -1.00 0.00 -0.05 1.91 0.05 -1.55 -3.36 116.97 112.97 1woa h TYR 101 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1woa h TYR 101 Cb 0.41 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.15 1woa h TYR 101 CO -0.02 0.12 0.00 1.19 -1.05 0.00 0.00 178.16 178.40 1woa n PHE 102 N -3.00 0.07 -4.07 4.88 3.72 -0.51 -5.01 117.46 113.54 1woa n PHE 102 Ca 0.02 -0.49 -0.33 0.00 -0.05 0.00 0.00 57.45 56.60 1woa n PHE 102 Cb 0.59 -0.05 -0.01 0.00 -0.94 0.00 0.00 39.48 39.08 1woa n PHE 102 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1woa n HIS 103 N -0.34 -1.94 -2.36 1.38 8.25 -1.06 -4.91 115.22 114.25 1woa n HIS 103 Ca 0.02 0.83 -0.42 0.00 -0.26 0.00 0.00 57.72 57.89 1woa n HIS 103 Cb 0.27 -3.45 -0.03 0.00 1.12 0.00 0.00 29.99 27.91 1woa n HIS 103 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 1woa s GLU 104 N -6.75 4.36 0.41 -0.41 2.12 -1.13 -4.99 118.70 112.31 1woa s GLU 104 Ca 0.61 1.82 0.08 0.00 0.36 0.00 0.00 54.97 57.84 1woa s GLU 104 Cb -0.32 -3.46 -0.00 0.00 0.26 0.00 0.00 34.13 30.61 1woa s GLU 104 CO 0.89 -0.41 0.49 0.95 -0.54 0.00 0.00 175.26 176.63 1woa s THR 105 N 1.74 2.98 0.61 -1.70 -4.23 -1.26 -4.48 115.64 109.30 1woa s THR 105 Ca 0.60 -1.13 0.32 0.00 -1.18 0.00 0.00 61.69 60.30 1woa s THR 105 Cb -0.29 -3.04 0.37 0.00 1.34 0.00 0.00 72.50 70.88 1woa s THR 105 CO 0.26 -0.02 2.24 0.44 -0.54 0.00 0.00 174.62 177.01 1woa h ASP 106 N 0.81 0.00 -0.14 3.99 3.32 -1.98 0.16 116.42 122.58 1woa h ASP 106 Ca -0.41 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.51 1woa h ASP 106 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1woa h ASP 106 CO 0.50 0.00 -0.41 -0.08 -1.72 0.00 0.00 179.24 177.54 1woa h GLU 107 N 0.00 0.52 -0.48 3.56 4.57 -1.94 -2.07 114.58 118.75 1woa h GLU 107 Ca 0.02 -0.38 0.01 0.00 -1.18 0.00 0.00 59.36 57.84 1woa h GLU 107 Cb 0.12 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 1woa h GLU 107 CO -0.00 1.00 0.30 -0.44 -1.18 0.00 0.00 179.01 178.68 1woa h ASP 108 N 0.15 0.50 -0.40 1.04 3.32 -1.13 -1.64 116.42 118.24 1woa h ASP 108 Ca -0.01 -0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.10 1woa h ASP 108 Cb 1.03 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.41 1woa h ASP 108 CO 0.09 0.35 0.09 0.58 -1.72 0.00 0.00 179.24 178.63 1woa h VAL 109 N 0.60 0.80 0.18 -1.35 2.07 -1.08 0.17 116.25 117.64 1woa h VAL 109 Ca 0.18 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.63 1woa h VAL 109 Cb -0.02 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1woa h VAL 109 CO -0.07 0.04 -0.15 -0.09 0.02 0.00 0.00 177.57 177.32 1woa h ARG 110 N 0.22 -0.33 -0.56 1.57 2.43 -0.91 -0.33 114.38 116.47 1woa h ARG 110 Ca 0.19 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 1woa h ARG 110 Cb 0.23 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1woa h ARG 110 CO -0.25 -0.22 0.29 0.93 -1.51 0.00 0.00 179.97 179.21 1woa h GLU 111 N -0.35 0.79 -0.20 0.20 5.08 -1.04 -0.78 114.58 118.28 1woa h GLU 111 Ca -0.00 -0.10 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1woa h GLU 111 Cb 0.32 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1woa h GLU 111 CO -0.02 0.62 0.12 0.87 -1.00 0.00 0.00 179.01 179.60 1woa h LYS 112 N 0.76 0.24 -0.84 2.33 1.57 -0.52 -0.00 116.57 120.11 1woa h LYS 112 Ca 0.20 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.04 1woa h LYS 112 Cb 0.07 -0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.26 1woa h LYS 112 CO -0.03 0.16 0.50 1.25 -0.57 0.00 0.00 179.45 180.77 1woa h LEU 113 N 0.25 0.76 -0.20 2.94 5.85 -0.70 0.09 115.31 124.30 1woa h LEU 113 Ca 0.08 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1woa h LEU 113 Cb -0.01 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1woa h LEU 113 CO -0.03 0.47 0.07 -0.61 -0.34 0.00 0.00 178.44 178.00 1woa h GLN 114 N 0.89 0.31 -0.93 1.25 4.15 -0.61 -0.21 115.11 119.96 1woa h GLN 114 Ca 0.38 -0.06 0.01 0.00 0.77 0.00 0.00 58.65 59.75 1woa h GLN 114 Cb 0.25 -0.05 -0.05 0.00 0.21 0.00 0.00 27.48 27.84 1woa h GLN 114 CO -0.20 0.39 0.61 0.00 -1.93 0.00 0.00 178.83 177.70 1woa h ALA 115 N 0.91 1.19 0.11 3.38 0.00 -0.47 -1.40 119.26 122.96 1woa h ALA 115 Ca 0.07 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1woa h ALA 115 Cb 0.20 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1woa h ALA 115 CO -0.00 0.56 -0.05 0.77 0.00 0.00 0.00 179.25 180.52 1woa h SER 116 N 1.25 -0.12 -0.80 0.00 0.02 -0.61 -2.91 113.55 110.38 1woa h SER 116 Ca 0.35 -0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 1woa h SER 116 Cb -0.12 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.41 1woa h SER 116 CO -0.08 0.09 0.43 -0.07 -1.14 0.00 0.00 176.83 176.06 1woa h LEU 117 N -0.34 1.01 -2.31 5.07 3.38 -0.89 -1.45 115.31 119.79 1woa h LEU 117 Ca -0.01 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1woa h LEU 117 Cb 0.28 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1woa h LEU 117 CO 0.02 0.83 0.01 0.50 0.09 0.00 0.00 178.44 179.89 1woa h LYS 118 N 1.13 0.00 -0.46 1.13 3.64 -1.18 -1.80 116.57 119.03 1woa h LYS 118 Ca 0.28 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1woa h LYS 118 Cb 0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1woa h LYS 118 CO -0.04 0.00 0.00 0.09 -2.27 0.00 0.00 179.45 177.23 1woa n ASN 119 N -4.07 4.72 -3.28 4.20 3.02 -0.63 -4.96 115.26 114.27 1woa n ASN 119 Ca -0.03 -2.81 -0.21 0.00 -0.03 0.00 0.00 54.58 51.50 1woa n ASN 119 Cb 0.10 -0.59 0.07 0.00 -0.61 0.00 0.00 39.78 38.75 1woa n ASN 119 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1woa n ASN 120 N 0.31 -5.47 -4.75 6.41 4.13 -0.68 -4.79 115.26 110.42 1woa n ASN 120 Ca 0.24 -0.50 -0.31 0.00 1.68 0.00 0.00 54.58 55.69 1woa n ASN 120 Cb 0.98 -4.60 -0.07 0.00 -1.54 0.00 0.00 39.78 34.56 1woa n ASN 120 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1woa s LEU 121 N -6.59 3.73 0.10 3.41 1.43 -0.70 -5.03 118.68 115.03 1woa s LEU 121 Ca 0.46 0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 53.46 1woa s LEU 121 Cb -0.20 -2.31 -0.06 0.00 0.03 0.00 0.00 46.19 43.65 1woa s LEU 121 CO 0.66 0.22 0.45 -0.54 0.23 0.00 0.00 176.35 177.37 1woa s LYS 122 N -2.05 3.85 -0.05 1.70 1.02 -0.35 -4.31 119.74 119.54 1woa s LYS 122 Ca 0.25 0.30 0.06 0.00 0.02 0.00 0.00 55.97 56.60 1woa s LYS 122 Cb -0.12 -2.99 -0.01 0.00 -0.52 0.00 0.00 37.83 34.19 1woa s LYS 122 CO 0.17 0.54 -0.23 0.00 -0.92 0.00 0.00 175.35 174.92 1woa s ALA 123 N -1.39 1.98 -0.54 5.17 0.00 -0.21 -1.86 121.76 124.91 1woa s ALA 123 Ca 0.34 -0.96 -0.10 0.00 0.00 0.00 0.00 51.96 51.24 1woa s ALA 123 Cb -0.15 -0.61 0.14 0.00 0.00 0.00 0.00 23.12 22.50 1woa s ALA 123 CO 0.18 0.39 0.43 0.08 0.00 0.00 0.00 175.76 176.84 1woa s VAL 124 N -0.16 4.47 -0.14 0.00 1.01 0.04 0.52 120.40 126.15 1woa s VAL 124 Ca -0.02 -1.94 -0.17 0.00 0.00 0.00 0.00 61.98 59.85 1woa s VAL 124 Cb -0.13 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1woa s VAL 124 CO 0.03 -0.83 0.42 -0.69 0.00 0.00 0.00 175.10 174.02 1woa s VAL 125 N 1.12 5.22 0.03 2.92 1.01 0.38 -0.10 120.40 130.98 1woa s VAL 125 Ca 0.08 0.81 0.04 0.00 0.00 0.00 0.00 61.98 62.91 1woa s VAL 125 Cb -0.24 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1woa s VAL 125 CO -0.01 0.33 -0.05 0.00 0.00 0.00 0.00 175.10 175.37 1woa s PHE 127 N -1.08 -0.49 0.00 0.00 -0.12 -0.87 -4.61 117.98 110.81 1woa s PHE 127 Ca 0.19 0.40 0.00 0.00 -0.05 0.00 0.00 56.93 57.47 1woa s PHE 127 Cb -0.11 0.53 0.00 0.00 -0.63 0.00 0.00 43.02 42.81 1woa s PHE 127 CO 0.10 -0.71 0.00 0.41 -0.05 0.00 0.00 175.22 174.97 1woa n GLY 128 N -0.15 1.20 3.94 1.99 0.00 -1.26 -0.53 105.19 110.38 1woa n GLY 128 Ca -0.14 -0.75 -0.26 0.00 0.00 0.00 0.00 46.02 44.87 1woa n GLY 128 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1woa s GLU 129 N -2.00 3.50 0.90 1.61 1.03 -1.26 -4.83 118.70 117.66 1woa s GLU 129 Ca 0.00 -0.40 -0.13 0.00 0.03 0.00 0.00 54.97 54.47 1woa s GLU 129 Cb 0.00 -2.81 0.18 0.00 -0.80 0.00 0.00 34.13 30.69 1woa s GLU 129 CO 0.00 0.36 1.25 -1.54 -1.33 0.00 0.00 175.26 174.00 1woa s SER 130 N -3.45 3.46 0.13 0.83 1.04 -1.26 -2.41 113.70 112.03 1woa s SER 130 Ca 0.38 0.21 -0.12 0.00 0.48 0.00 0.00 55.95 56.90 1woa s SER 130 Cb -0.10 -0.36 -0.07 0.00 0.10 0.00 0.00 66.02 65.59 1woa s SER 130 CO 0.30 -2.50 1.44 0.25 0.98 0.00 0.00 173.24 173.71 1woa h LEU 131 N -1.39 0.95 -0.52 2.42 5.85 -1.85 -2.14 115.31 118.63 1woa h LEU 131 Ca -0.43 -0.49 -0.03 0.00 0.84 0.00 0.00 57.88 57.77 1woa h LEU 131 Cb 1.25 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 1woa h LEU 131 CO 0.41 1.25 0.21 -0.08 -0.34 0.00 0.00 178.44 179.88 1woa h GLU 132 N 0.67 0.78 -0.05 1.25 4.81 -1.96 -2.12 114.58 117.95 1woa h GLU 132 Ca 0.04 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.04 1woa h GLU 132 Cb 1.02 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.26 1woa h GLU 132 CO 0.10 0.68 -0.40 1.96 -0.73 0.00 0.00 179.01 180.63 1woa h GLN 133 N 0.70 0.11 -0.32 1.92 4.20 -1.93 -2.63 115.11 117.17 1woa h GLN 133 Ca 0.17 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.70 1woa h GLN 133 Cb 0.20 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 1woa h GLN 133 CO -0.01 0.50 -0.31 -0.09 -0.67 0.00 0.00 178.83 178.25 1woa h ARG 134 N 0.10 0.77 -0.46 1.46 2.43 -1.07 -0.11 114.38 117.50 1woa h ARG 134 Ca 0.01 -0.40 -0.04 0.00 -0.81 0.00 0.00 59.98 58.74 1woa h ARG 134 Cb 0.75 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.29 1woa h ARG 134 CO 0.06 1.03 0.13 0.93 -1.51 0.00 0.00 179.97 180.60 1woa h GLU 135 N 0.54 0.68 0.00 0.20 5.08 -1.25 0.67 114.58 120.50 1woa h GLU 135 Ca 0.05 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1woa h GLU 135 Cb 0.88 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1woa h GLU 135 CO 0.08 0.60 0.00 1.04 -1.00 0.00 0.00 179.01 179.73 1woa n GLN 136 N -4.32 0.94 -3.29 2.33 6.02 -1.00 -4.86 117.38 113.19 1woa n GLN 136 Ca 0.03 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.78 1woa n GLN 136 Cb 0.19 -1.17 0.04 0.00 1.02 0.00 0.00 30.24 30.32 1woa n GLN 136 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1woa n ASN 137 N -0.67 -5.74 -0.87 1.08 3.02 0.23 -4.87 115.26 107.44 1woa n ASN 137 Ca 0.08 -0.41 0.12 0.00 -0.03 0.00 0.00 54.58 54.34 1woa n ASN 137 Cb 0.04 -4.61 0.08 0.00 -0.61 0.00 0.00 39.78 34.68 1woa n ASN 137 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1woa n LYS 138 N -4.29 2.10 -0.34 3.52 5.02 -0.07 -4.70 118.16 119.40 1woa n LYS 138 Ca -0.06 -1.75 -0.04 0.00 -2.02 0.00 0.00 58.31 54.44 1woa n LYS 138 Cb 0.59 -1.45 -0.01 0.00 -0.02 0.00 0.00 35.03 34.13 1woa n LYS 138 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1woa n THR 139 N 1.10 -0.50 -0.19 -0.18 -1.04 -1.24 -0.68 114.28 111.55 1woa n THR 139 Ca 0.13 2.03 -0.09 0.00 -2.04 0.00 0.00 64.05 64.08 1woa n THR 139 Cb 0.57 -2.62 0.01 0.00 -1.82 0.00 0.00 70.33 66.48 1woa n THR 139 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1woa h ILE 140 N 0.00 1.26 -0.34 12.58 1.08 -1.96 -1.67 117.51 128.46 1woa h ILE 140 Ca 0.23 -1.07 0.03 0.00 -0.39 0.00 0.00 64.86 63.66 1woa h ILE 140 Cb 0.45 0.89 -0.03 0.00 -3.07 0.00 0.00 36.82 35.05 1woa h ILE 140 CO -0.83 0.38 0.15 -0.08 -0.69 0.00 0.00 178.15 177.09 1woa h GLU 141 N 0.82 0.32 0.03 2.37 4.81 -1.23 -0.65 114.58 121.05 1woa h GLU 141 Ca 0.16 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1woa h GLU 141 Cb 0.50 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.81 1woa h GLU 141 CO 0.02 0.21 -0.01 0.28 -0.73 0.00 0.00 179.01 178.78 1woa h VAL 142 N 0.33 1.09 -0.42 0.32 2.07 -0.82 -2.48 116.25 116.33 1woa h VAL 142 Ca 0.15 -0.36 0.06 0.00 0.82 0.00 0.00 66.70 67.37 1woa h VAL 142 Cb 0.08 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.12 1woa h VAL 142 CO -0.12 0.09 0.11 0.40 0.02 0.00 0.00 177.57 178.08 1woa h ILE 143 N -0.19 0.81 -0.39 4.57 1.08 -1.12 -1.44 117.51 120.83 1woa h ILE 143 Ca -0.00 -0.09 0.05 0.00 -0.39 0.00 0.00 64.86 64.43 1woa h ILE 143 Cb 0.18 0.53 -0.04 0.00 -3.07 0.00 0.00 36.82 34.42 1woa h ILE 143 CO 0.01 0.05 0.13 0.74 -0.69 0.00 0.00 178.15 178.38 1woa h THR 144 N 0.25 0.88 0.41 -0.27 2.02 -1.06 0.01 112.91 115.15 1woa h THR 144 Ca 0.20 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 1woa h THR 144 Cb 0.23 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 1woa h THR 144 CO -0.24 0.05 -0.29 0.50 0.37 0.00 0.00 175.52 175.91 1woa h LYS 145 N 0.29 -0.66 -0.47 6.66 3.64 -0.95 0.14 116.57 125.22 1woa h LYS 145 Ca 0.18 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.65 1woa h LYS 145 Cb 0.16 0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.09 1woa h LYS 145 CO -0.19 -0.44 0.21 1.96 -2.27 0.00 0.00 179.45 178.73 1woa h GLN 146 N -0.68 0.41 -0.14 1.90 4.20 -1.04 -2.13 115.11 117.62 1woa h GLN 146 Ca -0.04 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1woa h GLN 146 Cb 0.58 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 1woa h GLN 146 CO 0.02 0.27 -0.00 0.28 -0.67 0.00 0.00 178.83 178.72 1woa h VAL 147 N 0.42 1.26 0.00 -0.54 2.07 -0.87 -2.42 116.25 116.17 1woa h VAL 147 Ca 0.22 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1woa h VAL 147 Cb 0.16 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1woa h VAL 147 CO -0.18 0.25 0.00 0.29 0.02 0.00 0.00 177.57 177.95 1woa n LYS 148 N -4.76 0.03 0.10 1.57 5.02 0.47 -1.39 118.16 119.21 1woa n LYS 148 Ca -0.05 0.27 0.13 0.00 -2.02 0.00 0.00 58.31 56.63 1woa n LYS 148 Cb 0.22 -1.50 0.36 0.00 -0.02 0.00 0.00 35.03 34.09 1woa n LYS 148 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1woa n ALA 149 N -1.29 2.39 -0.08 7.82 0.00 -0.83 -4.46 120.51 124.06 1woa n ALA 149 Ca 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1woa n ALA 149 Cb 0.02 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.05 1woa n ALA 149 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1woa n PHE 150 N -2.25 0.00 -0.22 0.00 1.16 -0.66 -4.67 117.46 110.82 1woa n PHE 150 Ca 0.05 0.00 0.30 0.00 -1.87 0.00 0.00 57.45 55.93 1woa n PHE 150 Cb 0.43 0.00 0.72 0.00 -1.61 0.00 0.00 39.48 39.02 1woa n PHE 150 CO 0.00 0.00 0.00 -0.24 -1.87 0.00 0.00 176.76 174.65 1woa h VAL 151 N 0.00 0.52 0.00 1.97 3.04 -1.45 0.80 116.25 121.13 1woa h VAL 151 Ca 0.00 -0.01 -0.04 0.00 -1.01 0.00 0.00 66.70 65.64 1woa h VAL 151 Cb 0.00 0.49 -0.01 0.00 -2.01 0.00 0.00 31.29 29.77 1woa h VAL 151 CO 0.00 0.00 -0.21 -2.24 -1.01 0.00 0.00 177.57 174.12 1woa h ASP 152 N 0.03 0.00 0.71 3.17 2.03 -1.85 -2.52 116.42 118.00 1woa h ASP 152 Ca 0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.76 1woa h ASP 152 Cb 1.81 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.31 1woa h ASP 152 CO -0.02 0.21 0.00 0.18 -1.03 0.00 0.00 179.24 178.58 1woa n LEU 153 N -3.77 0.00 -4.65 0.15 4.77 0.27 -4.78 117.00 109.00 1woa n LEU 153 Ca -0.02 0.46 -0.43 0.00 -0.03 0.00 0.00 56.01 56.00 1woa n LEU 153 Cb 0.32 -0.46 -0.02 0.00 -2.33 0.00 0.00 43.42 40.92 1woa n LEU 153 CO 0.33 -0.10 1.11 -0.63 -1.33 0.00 0.00 177.39 176.77 1woa s ILE 154 N -2.92 4.21 -0.22 -0.08 1.01 -0.95 -4.87 121.20 117.38 1woa s ILE 154 Ca 0.13 1.43 -0.08 0.00 0.00 0.00 0.00 60.65 62.12 1woa s ILE 154 Cb 0.15 -4.06 -0.10 0.00 0.01 0.00 0.00 42.46 38.45 1woa s ILE 154 CO 0.40 -0.28 -0.26 -0.90 0.00 0.00 0.00 174.94 173.90 1woa n ASP 155 N 7.08 1.73 -4.26 3.58 5.75 -1.26 -4.89 116.55 124.27 1woa n ASP 155 Ca 0.14 0.18 -0.37 0.00 -0.01 0.00 0.00 54.79 54.74 1woa n ASP 155 Cb 0.46 -0.57 -0.13 0.00 -1.03 0.00 0.00 41.12 39.85 1woa n ASP 155 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1woa s ASN 156 N -6.74 5.10 0.00 -1.12 3.84 -1.26 -4.98 114.94 109.77 1woa s ASN 156 Ca -0.30 -1.04 0.00 0.00 0.21 0.00 0.00 52.86 51.73 1woa s ASN 156 Cb 0.11 -1.82 0.00 0.00 -0.55 0.00 0.00 41.25 38.98 1woa s ASN 156 CO 0.40 -0.26 0.62 0.49 -2.79 0.00 0.00 177.10 175.55 1woa n PHE 157 N 4.78 0.00 0.21 0.43 3.01 -1.26 -2.26 117.46 122.37 1woa n PHE 157 Ca -0.13 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.39 1woa n PHE 157 Cb 0.45 -0.06 -0.09 0.00 -0.01 0.00 0.00 39.48 39.77 1woa n PHE 157 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1woa n ASP 158 N -0.14 1.49 -1.03 4.37 8.00 -1.26 -3.70 116.55 124.29 1woa n ASP 158 Ca 0.00 -0.29 0.10 0.00 0.71 0.00 0.00 54.79 55.31 1woa n ASP 158 Cb 0.16 1.38 0.20 0.00 -0.02 0.00 0.00 41.12 42.84 1woa n ASP 158 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1woa n ASN 159 N -1.72 3.30 -3.85 -2.24 5.03 -0.96 -4.86 115.26 109.96 1woa n ASN 159 Ca -0.01 -1.94 -0.24 0.00 0.87 0.00 0.00 54.58 53.26 1woa n ASN 159 Cb 0.29 -0.26 -0.17 0.00 -1.02 0.00 0.00 39.78 38.62 1woa n ASN 159 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1woa s VAL 160 N -1.26 0.70 -0.20 2.41 1.01 -1.25 -1.05 120.40 120.76 1woa s VAL 160 Ca 0.35 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 62.20 1woa s VAL 160 Cb 0.20 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.80 1woa s VAL 160 CO 0.27 0.31 -0.07 -0.63 0.00 0.00 0.00 175.10 174.98 1woa s ILE 161 N 1.70 3.20 0.16 2.22 1.09 0.19 -4.43 121.20 125.32 1woa s ILE 161 Ca 0.03 -0.56 -0.17 0.00 -1.10 0.00 0.00 60.65 58.85 1woa s ILE 161 Cb -0.13 -2.43 -0.07 0.00 -1.06 0.00 0.00 42.46 38.77 1woa s ILE 161 CO -0.06 0.45 0.61 -0.76 -0.10 0.00 0.00 174.94 175.08 1woa s LEU 162 N 1.26 4.38 -0.07 2.97 1.43 -0.58 -0.47 118.68 127.58 1woa s LEU 162 Ca 0.03 1.22 0.01 0.00 -1.03 0.00 0.00 54.13 54.35 1woa s LEU 162 Cb -0.14 -3.29 0.02 0.00 0.03 0.00 0.00 46.19 42.80 1woa s LEU 162 CO -0.03 0.11 -0.08 -0.69 0.23 0.00 0.00 176.35 175.90 1woa s VAL 163 N -1.42 0.87 -0.30 -1.59 1.01 0.74 0.10 120.40 119.81 1woa s VAL 163 Ca 0.38 -0.27 -0.16 0.00 0.00 0.00 0.00 61.98 61.92 1woa s VAL 163 Cb -0.16 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1woa s VAL 163 CO 0.20 0.31 0.43 -0.47 0.00 0.00 0.00 175.10 175.57 1woa s TYR 164 N 1.14 3.23 -0.72 5.22 5.04 -0.01 -2.04 117.35 129.19 1woa s TYR 164 Ca -0.07 0.32 -0.04 0.00 -2.44 0.00 0.00 57.07 54.84 1woa s TYR 164 Cb -0.14 -2.71 0.19 0.00 0.35 0.00 0.00 41.96 39.65 1woa s TYR 164 CO -0.01 -0.35 0.58 -1.21 -1.34 0.00 0.00 175.55 173.21 1woa s GLU 165 N 2.19 2.91 -0.84 4.97 2.02 0.31 0.20 118.70 130.47 1woa s GLU 165 Ca 0.17 -2.70 -0.25 0.00 0.02 0.00 0.00 54.97 52.20 1woa s GLU 165 Cb -0.16 -3.90 -0.11 0.00 0.10 0.00 0.00 34.13 30.06 1woa s GLU 165 CO 0.11 -1.21 2.24 -1.25 0.02 0.00 0.00 175.26 175.17 1woa s PRO 166 N -0.34 1.92 0.22 0.39 0.04 -1.26 -4.21 135.00 131.75 1woa s PRO 166 Ca 0.20 0.19 -0.07 0.00 0.04 0.00 0.00 61.00 61.36 1woa s PRO 166 Cb -0.16 -4.89 0.33 0.00 0.04 0.00 0.00 34.50 29.82 1woa s PRO 166 CO -0.06 -4.11 1.78 -0.07 0.04 0.00 0.00 177.00 174.58 1woa h LEU 167 N 20.95 0.45 -0.94 -3.56 3.38 -1.80 -2.27 115.31 131.52 1woa h LEU 167 Ca 0.04 0.06 0.28 0.00 0.09 0.00 0.00 57.88 58.35 1woa h LEU 167 Cb 1.00 -0.02 -0.15 0.00 0.09 0.00 0.00 40.66 41.59 1woa h LEU 167 CO 1.08 0.26 0.39 2.19 0.09 0.00 0.00 178.44 182.45 1woa h PHE 168 N 0.60 0.62 0.10 1.13 -5.15 -1.71 -0.99 116.94 111.54 1woa h PHE 168 Ca 0.34 0.04 -0.21 0.00 -0.20 0.00 0.00 57.97 57.94 1woa h PHE 168 Cb 0.36 -0.12 0.02 0.00 0.22 0.00 0.00 35.95 36.43 1woa h PHE 168 CO -0.11 -0.20 -0.90 0.00 -2.00 0.00 0.00 178.31 175.10 1woa h ALA 169 N 1.82 -0.02 -1.98 12.09 0.00 -1.72 -3.41 119.26 126.04 1woa h ALA 169 Ca 0.65 -0.68 -0.58 0.00 0.00 0.00 0.00 54.91 54.29 1woa h ALA 169 Cb 1.40 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1woa h ALA 169 CO -0.64 0.46 1.42 0.42 0.00 0.00 0.00 179.25 180.91 1woa s ILE 170 N -2.83 3.14 -0.81 0.00 1.01 -0.38 -3.57 121.20 117.77 1woa s ILE 170 Ca -0.12 0.14 -0.03 0.00 0.00 0.00 0.00 60.65 60.64 1woa s ILE 170 Cb 0.03 -3.18 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 1woa s ILE 170 CO 0.86 -0.11 0.70 0.61 0.00 0.00 0.00 174.94 177.00 1woa n GLY 171 N 5.59 -0.47 0.00 6.18 0.00 -1.26 -4.93 105.19 110.30 1woa n GLY 171 Ca 0.27 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.52 1woa n GLY 171 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1woa n THR 172 N -2.94 0.00 -0.25 2.61 -2.24 -1.23 -5.00 114.28 105.23 1woa n THR 172 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1woa n THR 172 Cb 0.60 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 1woa n THR 172 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1woa n GLY 173 N 0.00 0.86 3.90 3.38 0.00 -1.26 -5.08 105.19 106.98 1woa n GLY 173 Ca 0.00 -0.12 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 1woa n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1woa s LYS 174 N -0.64 2.83 -0.03 1.61 -0.14 -1.26 -5.14 119.74 116.98 1woa s LYS 174 Ca 0.00 -1.22 -0.01 0.00 -1.36 0.00 0.00 55.97 53.38 1woa s LYS 174 Cb 0.00 -2.58 0.03 0.00 -1.68 0.00 0.00 37.83 33.60 1woa s LYS 174 CO 0.00 0.07 0.05 0.99 -0.76 0.00 0.00 175.35 175.69 1woa s THR 175 N -2.28 -0.08 -0.32 2.17 2.01 -1.26 -4.74 115.64 111.14 1woa s THR 175 Ca 0.43 0.28 -0.22 0.00 0.31 0.00 0.00 61.69 62.49 1woa s THR 175 Cb -0.07 -0.11 -0.00 0.00 0.01 0.00 0.00 72.50 72.33 1woa s THR 175 CO 0.28 0.12 0.70 0.00 -0.69 0.00 0.00 174.62 175.03 1woa s ALA 176 N 1.41 3.51 0.39 7.40 0.00 -1.26 -5.03 121.76 128.18 1woa s ALA 176 Ca -0.05 -0.59 -0.14 0.00 0.00 0.00 0.00 51.96 51.18 1woa s ALA 176 Cb -0.13 -3.21 -0.08 0.00 0.00 0.00 0.00 23.12 19.71 1woa s ALA 176 CO -0.03 -1.19 0.80 0.95 0.00 0.00 0.00 175.76 176.28 1woa s THR 177 N 2.80 4.68 0.51 0.00 -4.23 -1.26 -4.89 115.64 113.25 1woa s THR 177 Ca 0.28 0.89 0.34 0.00 -1.18 0.00 0.00 61.69 62.02 1woa s THR 177 Cb -0.14 -3.67 0.53 0.00 1.34 0.00 0.00 72.50 70.56 1woa s THR 177 CO 0.13 -0.39 1.78 -0.65 -0.54 0.00 0.00 174.62 174.96 1woa h PRO 178 N 1.68 0.07 -0.01 3.99 0.11 -1.96 -0.18 132.00 135.70 1woa h PRO 178 Ca -0.48 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1woa h PRO 178 Cb 1.18 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1woa h PRO 178 CO 0.64 0.05 -0.03 1.05 -0.21 0.00 0.00 178.00 179.49 1woa h GLU 179 N 0.08 0.05 -0.28 1.05 9.09 -1.92 -1.85 114.58 120.79 1woa h GLU 179 Ca 0.60 -0.03 0.05 0.00 0.05 0.00 0.00 59.36 60.03 1woa h GLU 179 Cb 2.20 0.01 -0.05 0.00 -1.65 0.00 0.00 28.75 29.26 1woa h GLU 179 CO -0.08 0.64 -0.04 1.96 0.05 0.00 0.00 179.01 181.54 1woa h GLN 180 N -0.54 0.03 -0.35 1.06 4.20 -1.43 -1.61 115.11 116.46 1woa h GLN 180 Ca -0.00 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1woa h GLN 180 Cb 0.64 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 1woa h GLN 180 CO 0.01 0.02 0.19 0.00 -0.67 0.00 0.00 178.83 178.38 1woa h ALA 181 N 1.27 0.45 -0.40 3.87 0.00 -1.43 -2.55 119.26 120.47 1woa h ALA 181 Ca 0.14 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.06 1woa h ALA 181 Cb 0.20 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1woa h ALA 181 CO -0.27 -0.01 0.28 0.37 0.00 0.00 0.00 179.25 179.62 1woa h GLN 182 N 0.44 0.12 0.16 0.00 5.75 -0.86 0.94 115.11 121.66 1woa h GLN 182 Ca 0.12 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.61 1woa h GLN 182 Cb 0.07 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.60 1woa h GLN 182 CO -0.02 0.08 -0.08 -0.07 -2.65 0.00 0.00 178.83 176.09 1woa h LEU 183 N 0.12 -0.18 -0.37 -2.39 3.38 -0.88 -2.38 115.31 112.61 1woa h LEU 183 Ca 0.19 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1woa h LEU 183 Cb 0.58 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 1woa h LEU 183 CO -0.02 0.20 0.16 0.58 0.09 0.00 0.00 178.44 179.45 1woa h VAL 184 N -0.60 1.18 -0.63 1.22 2.07 -1.27 -2.09 116.25 116.13 1woa h VAL 184 Ca -0.02 -0.55 0.17 0.00 0.82 0.00 0.00 66.70 67.12 1woa h VAL 184 Cb 0.45 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 1woa h VAL 184 CO 0.04 0.20 0.44 0.45 0.02 0.00 0.00 177.57 178.72 1woa h HIS 185 N 0.45 0.08 -0.09 1.57 3.86 -0.86 0.58 115.15 120.74 1woa h HIS 185 Ca 0.12 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.20 1woa h HIS 185 Cb 0.16 -0.03 0.01 0.00 1.06 0.00 0.00 27.41 28.61 1woa h HIS 185 CO -0.01 0.03 -0.49 -0.22 0.86 0.00 0.00 177.93 178.10 1woa h LYS 186 N 0.07 0.49 -0.54 2.45 3.64 -0.85 -2.62 116.57 119.21 1woa h LYS 186 Ca 0.30 -0.41 -0.07 0.00 -1.27 0.00 0.00 60.65 59.21 1woa h LYS 186 Cb 1.10 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 1woa h LYS 186 CO -0.02 1.04 0.08 0.93 -2.27 0.00 0.00 179.45 179.20 1woa h GLU 187 N 0.06 0.87 0.06 1.90 4.39 -0.43 -1.25 114.58 120.18 1woa h GLU 187 Ca -0.04 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.45 1woa h GLU 187 Cb 1.14 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.68 1woa h GLU 187 CO 0.10 0.82 -0.03 0.82 -1.16 0.00 0.00 179.01 179.56 1woa h ILE 188 N 0.82 1.08 -0.26 3.13 2.04 -1.02 -0.62 117.51 122.68 1woa h ILE 188 Ca 0.17 -0.46 0.04 0.00 1.00 0.00 0.00 64.86 65.62 1woa h ILE 188 Cb 0.39 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 1woa h ILE 188 CO 0.01 0.11 0.18 -0.09 0.00 0.00 0.00 178.15 178.36 1woa h ARG 189 N -0.28 0.15 -0.26 2.37 2.43 -1.27 -0.02 114.38 117.50 1woa h ARG 189 Ca -0.01 -0.01 -0.18 0.00 -0.81 0.00 0.00 59.98 58.97 1woa h ARG 189 Cb 0.25 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1woa h ARG 189 CO 0.01 0.10 -0.55 -0.22 -1.51 0.00 0.00 179.97 177.81 1woa h LYS 190 N 0.16 0.79 -0.35 0.20 3.64 -0.80 -1.34 116.57 118.87 1woa h LYS 190 Ca 0.11 -0.50 -0.06 0.00 -1.27 0.00 0.00 60.65 58.93 1woa h LYS 190 Cb 0.26 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1woa h LYS 190 CO -0.02 1.13 -0.05 0.82 -2.27 0.00 0.00 179.45 179.07 1woa h ILE 191 N 0.61 1.22 -0.09 2.00 2.04 0.55 -0.70 117.51 123.13 1woa h ILE 191 Ca 0.01 -0.91 -0.04 0.00 1.00 0.00 0.00 64.86 64.92 1woa h ILE 191 Cb 1.14 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 38.22 1woa h ILE 191 CO 0.12 0.31 -0.08 0.58 0.00 0.00 0.00 178.15 179.07 1woa h VAL 192 N 0.53 1.36 -0.11 1.67 2.07 -1.11 -2.57 116.25 118.09 1woa h VAL 192 Ca 0.11 -1.23 0.04 0.00 0.82 0.00 0.00 66.70 66.44 1woa h VAL 192 Cb 0.41 1.97 -0.05 0.00 -1.52 0.00 0.00 31.29 32.10 1woa h VAL 192 CO 0.02 0.35 -0.23 0.50 0.02 0.00 0.00 177.57 178.23 1woa h LYS 193 N -0.19 -0.29 0.00 1.57 3.64 -0.89 0.82 116.57 121.23 1woa h LYS 193 Ca 0.02 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1woa h LYS 193 Cb 0.59 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.47 1woa h LYS 193 CO 0.02 -0.19 -0.13 -0.44 -2.27 0.00 0.00 179.45 176.44 1woa h ASP 194 N -0.30 0.00 -0.01 4.20 3.32 -1.18 0.17 116.42 122.62 1woa h ASP 194 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1woa h ASP 194 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1woa h ASP 194 CO -0.28 0.13 -0.24 0.35 -1.72 0.00 0.00 179.24 177.48 1woa n THR 195 N -3.97 0.00 -0.06 0.35 -2.24 -0.84 -4.70 114.28 102.81 1woa n THR 195 Ca -0.02 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1woa n THR 195 Cb 0.22 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.59 1woa n THR 195 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1woa n GLY 197 N 0.09 2.32 0.13 0.00 0.00 0.60 -4.67 105.19 103.66 1woa n GLY 197 Ca 0.00 -1.93 -0.12 0.00 0.00 0.00 0.00 46.02 43.97 1woa n GLY 197 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1woa h GLU 198 N 0.00 -0.20 -1.09 1.61 5.08 -1.90 -1.94 114.58 116.14 1woa h GLU 198 Ca 0.00 0.01 0.30 0.00 -1.00 0.00 0.00 59.36 58.67 1woa h GLU 198 Cb 0.00 0.05 -0.10 0.00 0.50 0.00 0.00 28.75 29.20 1woa h GLU 198 CO 0.00 0.22 0.70 0.87 -1.00 0.00 0.00 179.01 179.80 1woa h LYS 199 N -0.74 0.32 0.12 2.33 1.79 -1.97 0.91 116.57 119.34 1woa h LYS 199 Ca -0.02 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 1woa h LYS 199 Cb 0.52 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 1woa h LYS 199 CO 0.04 0.21 -0.06 1.96 -1.08 0.00 0.00 179.45 180.52 1woa h GLN 200 N 0.33 -0.16 -0.97 3.15 7.50 -1.82 -2.83 115.11 120.31 1woa h GLN 200 Ca 0.63 0.01 0.19 0.00 0.50 0.00 0.00 58.65 59.98 1woa h GLN 200 Cb 1.71 0.04 -0.09 0.00 0.05 0.00 0.00 27.48 29.18 1woa h GLN 200 CO -0.31 0.32 0.61 0.00 -1.50 0.00 0.00 178.83 177.95 1woa h ALA 201 N -0.26 1.90 0.00 3.87 0.00 -0.28 0.25 119.26 124.74 1woa h ALA 201 Ca -0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1woa h ALA 201 Cb 0.55 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1woa h ALA 201 CO 0.03 -0.23 0.00 0.09 0.00 0.00 0.00 179.25 179.14 1woa n ASN 202 N -4.64 0.66 -0.08 0.00 3.02 0.15 -3.95 115.26 110.42 1woa n ASN 202 Ca 0.21 0.56 -0.21 0.00 -0.03 0.00 0.00 54.58 55.12 1woa n ASN 202 Cb 0.62 -0.74 -0.12 0.00 -0.61 0.00 0.00 39.78 38.92 1woa n ASN 202 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1woa n GLN 203 N -2.12 0.68 -1.72 3.52 7.27 0.67 -4.71 117.38 120.97 1woa n GLN 203 Ca 0.06 0.24 -0.39 0.00 0.07 0.00 0.00 57.00 56.98 1woa n GLN 203 Cb 0.41 -1.61 0.04 0.00 2.41 0.00 0.00 30.24 31.49 1woa n GLN 203 CO 0.00 0.00 0.00 1.51 0.07 0.00 0.00 177.06 178.64 1woa n ILE 204 N -3.56 3.65 -4.39 1.69 0.13 0.06 -4.85 119.36 112.10 1woa n ILE 204 Ca -0.41 -0.50 -0.34 0.00 -1.10 0.00 0.00 62.75 60.40 1woa n ILE 204 Cb 0.97 -1.56 -0.11 0.00 -0.84 0.00 0.00 39.64 38.11 1woa n ILE 204 CO 0.00 0.00 0.00 -0.13 2.80 0.00 0.00 176.55 179.22 1woa s ARG 205 N -2.77 3.31 -0.25 9.51 3.00 -1.26 -4.98 118.95 125.52 1woa s ARG 205 Ca 0.71 -0.46 0.00 0.00 0.00 0.00 0.00 55.73 55.98 1woa s ARG 205 Cb -0.43 -2.85 0.04 0.00 0.00 0.00 0.00 34.95 31.70 1woa s ARG 205 CO 0.50 0.48 -0.09 0.42 0.00 0.00 0.00 175.30 176.61 1woa s ILE 206 N -0.27 2.57 0.27 1.52 1.01 -1.26 -1.53 121.20 123.51 1woa s ILE 206 Ca 0.05 -1.23 -0.02 0.00 0.00 0.00 0.00 60.65 59.45 1woa s ILE 206 Cb -0.12 -2.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 1woa s ILE 206 CO 0.02 0.14 0.50 -0.76 0.00 0.00 0.00 174.94 174.84 1woa s LEU 207 N 1.25 4.10 -0.14 2.97 1.43 0.12 -1.85 118.68 126.55 1woa s LEU 207 Ca -0.02 0.55 -0.14 0.00 -1.03 0.00 0.00 54.13 53.49 1woa s LEU 207 Cb -0.17 -3.36 -0.05 0.00 0.03 0.00 0.00 46.19 42.64 1woa s LEU 207 CO -0.05 -0.17 0.31 -0.47 0.23 0.00 0.00 176.35 176.19 1woa s TYR 208 N -2.07 3.50 -0.61 0.29 5.04 -0.88 -0.83 117.35 121.78 1woa s TYR 208 Ca 0.41 0.65 0.06 0.00 -2.44 0.00 0.00 57.07 55.76 1woa s TYR 208 Cb -0.11 -2.32 0.15 0.00 0.35 0.00 0.00 41.96 40.03 1woa s TYR 208 CO 0.31 0.31 1.05 0.41 -1.34 0.00 0.00 175.55 176.29 1woa n GLY 209 N 3.12 2.02 0.54 8.97 0.00 0.13 -2.39 105.19 117.58 1woa n GLY 209 Ca -0.12 -0.22 -0.04 0.00 0.00 0.00 0.00 46.02 45.64 1woa n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1woa n GLY 210 N 0.16 -1.78 3.68 -0.02 0.00 -1.26 -4.81 105.19 101.17 1woa n GLY 210 Ca 0.06 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.09 1woa n GLY 210 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1woa s SER 211 N -1.82 6.44 -0.05 1.61 0.01 -1.26 -4.88 113.70 113.75 1woa s SER 211 Ca 0.11 2.71 0.05 0.00 1.31 0.00 0.00 55.95 60.13 1woa s SER 211 Cb -0.01 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.66 1woa s SER 211 CO 0.08 -1.01 -0.20 -0.69 0.41 0.00 0.00 173.24 171.82 1woa s VAL 212 N 3.28 1.69 0.30 3.43 1.01 -1.26 -5.02 120.40 123.83 1woa s VAL 212 Ca 0.83 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.95 1woa s VAL 212 Cb -0.45 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 1woa s VAL 212 CO 0.38 0.48 0.32 0.54 0.00 0.00 0.00 175.10 176.82 1woa s ASN 213 N -0.10 1.01 0.57 3.32 2.20 -1.26 -4.54 114.94 116.14 1woa s ASN 213 Ca -0.02 -1.54 0.38 0.00 -0.94 0.00 0.00 52.86 50.73 1woa s ASN 213 Cb -0.12 0.56 2.07 0.00 -2.00 0.00 0.00 41.25 41.75 1woa s ASN 213 CO 0.02 -1.10 2.16 0.71 -2.94 0.00 0.00 177.10 175.96 1woa h THR 214 N 2.23 0.00 0.02 0.54 1.35 -1.96 -2.22 112.91 112.87 1woa h THR 214 Ca -0.28 0.00 -0.34 0.00 -0.55 0.00 0.00 66.41 65.24 1woa h THR 214 Cb 1.24 0.84 -0.06 0.00 -1.73 0.00 0.00 68.15 68.45 1woa h THR 214 CO 0.40 0.00 -2.06 1.21 -0.25 0.00 0.00 175.52 174.82 1woa n GLU 215 N -2.84 0.67 0.00 4.72 2.13 -1.26 -4.53 120.64 119.53 1woa n GLU 215 Ca -0.03 0.17 0.08 0.00 0.66 0.00 0.00 57.16 58.05 1woa n GLU 215 Cb 0.07 -1.66 -0.06 0.00 0.27 0.00 0.00 31.44 30.06 1woa n GLU 215 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1woa n ASN 216 N -3.02 1.15 -0.36 4.31 6.94 -1.13 -4.58 115.26 118.57 1woa n ASN 216 Ca -0.27 -1.07 0.02 0.00 -0.02 0.00 0.00 54.58 53.23 1woa n ASN 216 Cb 1.08 0.79 0.17 0.00 -2.36 0.00 0.00 39.78 39.46 1woa n ASN 216 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1woa h SER 218 N 1.20 0.34 0.50 0.00 0.02 -1.86 -0.41 113.55 113.33 1woa h SER 218 Ca 0.41 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1woa h SER 218 Cb 0.10 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1woa h SER 218 CO -0.15 0.45 0.00 -1.54 -1.14 0.00 0.00 176.83 174.45 1woa n SER 219 N -4.76 0.52 -0.09 3.07 3.41 -1.15 -2.14 113.62 112.47 1woa n SER 219 Ca -0.03 0.66 -0.16 0.00 -0.26 0.00 0.00 58.87 59.07 1woa n SER 219 Cb 0.16 -0.76 -0.08 0.00 -0.26 0.00 0.00 64.21 63.27 1woa n SER 219 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1woa n LEU 220 N -2.11 1.85 0.22 1.04 4.77 -0.91 -4.18 117.00 117.68 1woa n LEU 220 Ca 0.01 0.49 0.16 0.00 -0.03 0.00 0.00 56.01 56.65 1woa n LEU 220 Cb 0.16 -0.92 0.83 0.00 -2.33 0.00 0.00 43.42 41.16 1woa n LEU 220 CO 0.16 0.02 1.14 -0.29 -1.33 0.00 0.00 177.39 177.08 1woa h ILE 221 N -1.00 0.52 -0.10 -0.08 6.09 -1.02 -1.51 117.51 120.41 1woa h ILE 221 Ca -0.24 0.00 -0.06 0.00 -1.37 0.00 0.00 64.86 63.20 1woa h ILE 221 Cb 1.03 0.88 -0.01 0.00 0.47 0.00 0.00 36.82 39.20 1woa h ILE 221 CO -0.14 0.00 -0.20 1.56 -3.07 0.00 0.00 178.15 176.30 1woa h GLN 222 N 0.00 0.17 -6.71 2.19 1.08 -1.59 -3.45 115.11 106.80 1woa h GLN 222 Ca 0.07 -0.05 -0.58 0.00 -1.45 0.00 0.00 58.65 56.64 1woa h GLN 222 Cb 0.36 -0.02 0.14 0.00 -0.05 0.00 0.00 27.48 27.92 1woa h GLN 222 CO -0.00 0.37 0.13 1.04 -0.95 0.00 0.00 178.83 179.42 1woa n GLN 223 N -4.23 1.18 0.09 1.46 1.13 -0.57 -4.92 117.38 111.51 1woa n GLN 223 Ca -0.01 0.43 -0.12 0.00 -1.94 0.00 0.00 57.00 55.36 1woa n GLN 223 Cb 0.30 -2.08 -0.06 0.00 0.11 0.00 0.00 30.24 28.52 1woa n GLN 223 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1woa h GLU 224 N 1.13 -0.27 -0.65 -1.09 4.39 -1.89 -3.10 114.58 113.09 1woa h GLU 224 Ca -0.46 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.26 1woa h GLU 224 Cb 1.35 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 30.06 1woa h GLU 224 CO 0.54 -0.18 0.00 -0.25 -1.16 0.00 0.00 179.01 177.96 1woa n ASP 225 N -5.27 3.84 -4.38 1.42 8.00 -1.26 -4.80 116.55 114.10 1woa n ASP 225 Ca -0.06 -2.46 -0.37 0.00 0.71 0.00 0.00 54.79 52.61 1woa n ASP 225 Cb 0.19 -0.55 -0.13 0.00 -0.02 0.00 0.00 41.12 40.62 1woa n ASP 225 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1woa s ILE 226 N -1.96 4.01 -0.63 0.53 1.01 -1.17 -4.63 121.20 118.36 1woa s ILE 226 Ca 0.37 -0.47 0.16 0.00 0.00 0.00 0.00 60.65 60.70 1woa s ILE 226 Cb 0.26 -2.97 0.58 0.00 0.01 0.00 0.00 42.46 40.34 1woa s ILE 226 CO 0.15 0.22 1.50 0.47 0.00 0.00 0.00 174.94 177.27 1woa n ASP 227 N 4.88 4.21 0.00 3.58 8.00 -0.77 -4.73 116.55 131.71 1woa n ASP 227 Ca -0.16 -2.62 0.00 0.00 0.71 0.00 0.00 54.79 52.72 1woa n ASP 227 Cb 0.50 -0.51 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 1woa n ASP 227 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1woa n GLY 228 N 0.35 0.83 3.58 0.44 0.00 -1.26 -1.47 105.19 107.66 1woa n GLY 228 Ca 0.22 -1.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.31 1woa n GLY 228 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1woa s PHE 229 N -2.58 0.34 -0.56 1.61 0.40 -0.65 -2.07 117.98 114.47 1woa s PHE 229 Ca 0.00 -0.70 -0.00 0.00 -0.60 0.00 0.00 56.93 55.62 1woa s PHE 229 Cb 0.00 0.19 0.14 0.00 0.51 0.00 0.00 43.02 43.87 1woa s PHE 229 CO 0.00 -0.98 0.34 -1.17 0.70 0.00 0.00 175.22 174.11 1woa s LEU 230 N -3.01 4.94 0.27 -0.37 2.96 -1.01 -0.40 118.68 122.06 1woa s LEU 230 Ca 0.22 -2.79 -0.29 0.00 -0.22 0.00 0.00 54.13 51.04 1woa s LEU 230 Cb -0.01 -1.78 -0.09 0.00 0.50 0.00 0.00 46.19 44.81 1woa s LEU 230 CO 0.08 -0.34 1.02 -0.69 -1.32 0.00 0.00 176.35 175.10 1woa s VAL 231 N 0.03 3.78 0.00 1.68 1.01 0.57 -4.71 120.40 122.75 1woa s VAL 231 Ca 0.16 1.77 0.00 0.00 0.00 0.00 0.00 61.98 63.91 1woa s VAL 231 Cb -0.22 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.04 1woa s VAL 231 CO -0.03 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.09 1woa n GLY 232 N 1.28 0.28 0.38 4.51 0.00 -1.26 -0.79 105.19 109.59 1woa n GLY 232 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.15 1woa n GLY 232 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1woa h ASN 233 N 0.00 0.48 -0.45 1.61 2.35 -1.92 -0.32 115.58 117.33 1woa h ASN 233 Ca 0.00 0.03 0.04 0.00 -0.55 0.00 0.00 56.30 55.82 1woa h ASN 233 Cb 0.00 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1woa h ASN 233 CO 0.00 0.24 0.30 0.00 -1.65 0.00 0.00 177.43 176.32 1woa h ALA 234 N 1.63 1.87 0.00 -0.83 0.00 -1.89 -0.05 119.26 119.98 1woa h ALA 234 Ca 0.40 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1woa h ALA 234 Cb 0.82 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1woa h ALA 234 CO -0.15 0.06 0.00 -1.13 0.00 0.00 0.00 179.25 178.03 1woa n SER 235 N -4.48 0.00 -0.29 0.00 3.41 -0.13 -1.71 113.62 110.42 1woa n SER 235 Ca 0.05 0.44 0.13 0.00 -0.26 0.00 0.00 58.87 59.24 1woa n SER 235 Cb 0.20 -0.47 0.43 0.00 -0.26 0.00 0.00 64.21 64.11 1woa n SER 235 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1woa n LEU 236 N -1.47 1.09 -4.82 1.04 4.77 -0.03 -4.88 117.00 112.70 1woa n LEU 236 Ca 0.03 -0.30 -0.22 0.00 -0.03 0.00 0.00 56.01 55.50 1woa n LEU 236 Cb 0.13 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.08 1woa n LEU 236 CO 0.11 0.20 -0.17 -0.54 -1.33 0.00 0.00 177.39 175.65 1woa s LYS 237 N -2.38 2.89 0.36 3.23 1.02 -0.70 -5.01 119.74 119.16 1woa s LYS 237 Ca 0.28 -1.08 0.19 0.00 0.02 0.00 0.00 55.97 55.38 1woa s LYS 237 Cb 0.20 -2.54 0.56 0.00 -0.52 0.00 0.00 37.83 35.53 1woa s LYS 237 CO 0.47 0.39 1.67 0.93 -0.92 0.00 0.00 175.35 177.90 1woa h GLU 238 N 1.50 0.00 0.00 1.68 5.08 -1.90 -2.68 114.58 118.26 1woa h GLU 238 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1woa h GLU 238 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1woa h GLU 238 CO 0.61 0.39 0.00 -1.13 -1.00 0.00 0.00 179.01 177.88 1woa n SER 239 N -3.44 0.00 0.25 1.42 3.41 -1.26 -2.29 113.62 111.71 1woa n SER 239 Ca 0.00 -0.11 0.08 0.00 -0.26 0.00 0.00 58.87 58.58 1woa n SER 239 Cb 0.56 -0.09 0.62 0.00 -0.26 0.00 0.00 64.21 65.03 1woa n SER 239 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1woa h PHE 240 N 0.00 0.00 -0.18 7.33 3.57 -1.64 -1.96 116.94 124.05 1woa h PHE 240 Ca 0.00 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.55 1woa h PHE 240 Cb 0.02 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1woa h PHE 240 CO 0.00 0.10 0.13 -0.39 -2.23 0.00 0.00 178.31 175.92 1woa h VAL 241 N 0.00 0.91 -0.03 1.41 -1.51 -1.73 -0.40 116.25 114.91 1woa h VAL 241 Ca -0.00 0.00 -0.13 0.00 -1.23 0.00 0.00 66.70 65.34 1woa h VAL 241 Cb 0.19 0.91 -0.02 0.00 -2.13 0.00 0.00 31.29 30.24 1woa h VAL 241 CO 0.01 0.00 -0.57 0.44 -1.23 0.00 0.00 177.57 176.23 1woa h ASP 242 N 0.00 0.09 0.34 4.19 3.32 -1.61 -0.67 116.42 122.08 1woa h ASP 242 Ca 0.09 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 56.99 1woa h ASP 242 Cb 0.34 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1woa h ASP 242 CO -0.00 0.64 -0.41 0.40 -1.72 0.00 0.00 179.24 178.15 1woa h ILE 243 N 0.06 1.30 -0.12 0.35 2.04 -1.17 -1.53 117.51 118.44 1woa h ILE 243 Ca -0.00 -1.45 -0.08 0.00 1.00 0.00 0.00 64.86 64.32 1woa h ILE 243 Cb 1.02 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 1woa h ILE 243 CO 0.08 0.42 -0.25 0.40 0.00 0.00 0.00 178.15 178.80 1woa h ILE 244 N 0.08 1.38 -0.53 -0.67 2.04 -1.07 -2.99 117.51 115.75 1woa h ILE 244 Ca 0.01 -1.54 0.09 0.00 1.00 0.00 0.00 64.86 64.42 1woa h ILE 244 Cb 0.76 2.07 -0.03 0.00 -0.74 0.00 0.00 36.82 38.88 1woa h ILE 244 CO 0.06 0.45 0.36 0.11 0.00 0.00 0.00 178.15 179.13 1woa h LYS 245 N -0.03 0.31 0.00 2.37 1.57 -0.82 0.95 116.57 120.91 1woa h LYS 245 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1woa h LYS 245 Cb 0.85 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.09 1woa h LYS 245 CO 0.06 0.21 0.00 0.66 -0.57 0.00 0.00 179.45 179.80 1woa h SER 246 N 0.32 0.00 -0.32 0.86 4.64 -1.13 -1.60 113.55 116.33 1woa h SER 246 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1woa h SER 246 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1woa h SER 246 CO -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.90 1woa n ALA 247 N -1.91 2.18 1.45 5.18 0.00 0.31 -4.89 120.51 122.84 1woa n ALA 247 Ca -0.01 -1.11 0.14 0.00 0.00 0.00 0.00 53.44 52.46 1woa n ALA 247 Cb 0.12 -0.41 0.48 0.00 0.00 0.00 0.00 19.45 19.65 1woa n ALA 247 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17