#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 4.42 0.69 5.56 2.20 -1.26 -5.01 119.74 126.33 1woa s LYS 4 Ca 0.00 1.34 -0.16 0.00 -0.36 0.00 0.00 55.97 56.79 1woa s LYS 4 Cb 0.00 -3.54 0.02 0.00 -1.51 0.00 0.00 37.83 32.80 1woa s LYS 4 CO 0.00 -0.29 1.20 0.71 -0.36 0.00 0.00 175.35 176.61 1woa s TYR 5 N 1.93 2.20 -0.07 4.03 2.02 -1.26 -4.84 117.35 121.36 1woa s TYR 5 Ca 0.47 1.57 0.02 0.00 -0.37 0.00 0.00 57.07 58.76 1woa s TYR 5 Cb -0.18 -3.44 0.02 0.00 -0.40 0.00 0.00 41.96 37.95 1woa s TYR 5 CO 0.18 -2.42 -0.10 0.12 -1.57 0.00 0.00 175.55 171.76 1woa s PHE 6 N -1.92 1.31 -0.22 2.71 5.36 -0.66 -1.13 117.98 123.43 1woa s PHE 6 Ca 0.74 -0.50 -0.01 0.00 -0.96 0.00 0.00 56.93 56.21 1woa s PHE 6 Cb -0.29 -1.01 0.06 0.00 -0.34 0.00 0.00 43.02 41.45 1woa s PHE 6 CO 0.42 -0.30 -0.00 0.08 -1.46 0.00 0.00 175.22 173.96 1woa s VAL 7 N 0.90 0.99 -0.04 3.12 1.01 0.11 -1.74 120.40 124.74 1woa s VAL 7 Ca -0.11 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 60.99 1woa s VAL 7 Cb -0.15 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1woa s VAL 7 CO 0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 175.10 174.93 1woa s ALA 8 N 1.64 3.26 -0.32 5.51 0.00 0.45 -1.46 121.76 130.85 1woa s ALA 8 Ca -0.03 -0.88 -0.04 0.00 0.00 0.00 0.00 51.96 51.01 1woa s ALA 8 Cb -0.18 -1.40 0.05 0.00 0.00 0.00 0.00 23.12 21.59 1woa s ALA 8 CO -0.08 0.62 0.05 0.00 0.00 0.00 0.00 175.76 176.36 1woa s ALA 9 N -0.98 2.93 -0.68 0.00 0.00 0.17 -0.41 121.76 122.79 1woa s ALA 9 Ca 0.16 -1.77 -0.14 0.00 0.00 0.00 0.00 51.96 50.21 1woa s ALA 9 Cb -0.11 -2.11 0.17 0.00 0.00 0.00 0.00 23.12 21.07 1woa s ALA 9 CO 0.06 -1.32 0.62 1.21 0.00 0.00 0.00 175.76 176.34 1woa s ASN 10 N 1.34 6.42 0.00 0.00 2.47 -0.07 0.72 114.94 125.82 1woa s ASN 10 Ca -0.03 -2.28 0.13 0.00 0.42 0.00 0.00 52.86 51.10 1woa s ASN 10 Cb -0.20 -2.19 0.58 0.00 -1.45 0.00 0.00 41.25 38.00 1woa s ASN 10 CO 0.01 -0.69 1.42 0.79 -3.72 0.00 0.00 177.10 174.91 1woa n TRP 11 N 4.54 0.00 -2.98 0.43 8.01 -0.96 -4.51 117.44 121.98 1woa n TRP 11 Ca 0.01 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.20 1woa n TRP 11 Cb 0.43 -0.48 0.00 0.00 -2.01 0.00 0.00 31.31 29.25 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 -1.48 0.00 -3.11 -0.99 5.02 -1.26 -3.16 118.16 113.17 1woa n LYS 12 Ca 0.04 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.89 1woa n LYS 12 Cb 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.17 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 0.13 0.01 0.00 0.00 0.01 -1.19 -5.16 114.94 108.74 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 -0.02 0.39 0.00 0.00 0.41 0.00 0.00 41.25 42.03 1woa s ASN 14 CO 0.01 -0.80 0.00 0.61 -1.51 0.00 0.00 177.10 175.41 1woa n GLY 15 N -0.13 3.03 3.05 0.66 0.00 -1.26 -4.76 105.19 105.78 1woa n GLY 15 Ca -0.14 -1.82 -0.08 0.00 0.00 0.00 0.00 46.02 43.98 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 -2.37 0.17 0.38 2.61 -4.23 -1.26 -5.02 115.64 105.92 1woa s THR 16 Ca 0.00 -1.42 0.17 0.00 -1.18 0.00 0.00 61.69 59.26 1woa s THR 16 Cb 0.00 -1.01 0.38 0.00 1.34 0.00 0.00 72.50 73.21 1woa s THR 16 CO 0.00 -0.78 1.76 -0.07 -0.54 0.00 0.00 174.62 174.99 1woa h LEU 17 N 3.73 0.49 0.00 4.79 3.38 -2.00 -1.95 115.31 123.77 1woa h LEU 17 Ca -0.33 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 1woa h LEU 17 Cb 1.17 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1woa h LEU 17 CO 0.56 0.08 -0.00 -0.08 0.09 0.00 0.00 178.44 179.09 1woa h GLU 18 N 0.43 -0.00 -0.66 1.13 4.81 -2.00 -2.85 114.58 115.44 1woa h GLU 18 Ca 0.61 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.87 1woa h GLU 18 Cb 1.47 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.81 1woa h GLU 18 CO -0.34 0.72 0.44 0.66 -0.73 0.00 0.00 179.01 179.76 1woa h SER 19 N -0.73 0.71 -0.56 1.04 4.64 -1.86 -1.93 113.55 114.85 1woa h SER 19 Ca -0.00 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.21 1woa h SER 19 Cb 0.72 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 1woa h SER 19 CO 0.00 0.49 -0.03 0.40 -0.87 0.00 0.00 176.83 176.82 1woa h ILE 20 N 0.82 1.26 -0.65 0.95 2.04 -1.43 0.11 117.51 120.62 1woa h ILE 20 Ca 0.26 -1.18 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 1woa h ILE 20 Cb 0.02 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1woa h ILE 20 CO -0.07 0.42 0.35 0.50 0.00 0.00 0.00 178.15 179.36 1woa h LYS 21 N 0.94 0.90 -0.12 2.37 3.64 -1.12 -0.32 116.57 122.86 1woa h LYS 21 Ca 0.16 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1woa h LYS 21 Cb 0.58 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1woa h LYS 21 CO 0.03 0.68 -0.02 1.03 -2.27 0.00 0.00 179.45 178.91 1woa h SER 22 N 0.88 0.22 -0.28 4.20 0.87 -1.14 -2.40 113.55 115.90 1woa h SER 22 Ca 0.23 -0.35 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 1woa h SER 22 Cb 0.04 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 61.93 1woa h SER 22 CO -0.04 0.51 0.18 0.25 -0.53 0.00 0.00 176.83 177.21 1woa h LEU 23 N -0.08 0.33 -1.40 2.23 5.85 -0.59 -2.56 115.31 119.09 1woa h LEU 23 Ca 0.03 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1woa h LEU 23 Cb 0.41 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1woa h LEU 23 CO 0.01 0.26 -0.07 0.71 -0.34 0.00 0.00 178.44 179.00 1woa h THR 24 N 0.38 1.17 -0.97 1.05 1.35 -1.09 -1.56 112.91 113.23 1woa h THR 24 Ca 0.10 -0.71 0.03 0.00 -0.55 0.00 0.00 66.41 65.28 1woa h THR 24 Cb -0.02 1.10 -0.05 0.00 -1.73 0.00 0.00 68.15 67.44 1woa h THR 24 CO -0.02 0.23 0.64 -1.13 -0.25 0.00 0.00 175.52 174.99 1woa h ASN 25 N 0.30 1.08 0.40 5.36 -0.73 -1.03 0.23 115.58 121.20 1woa h ASN 25 Ca 0.06 -0.02 -0.02 0.00 1.87 0.00 0.00 56.30 58.20 1woa h ASN 25 Cb 0.32 -0.25 0.00 0.00 0.27 0.00 0.00 38.32 38.66 1woa h ASN 25 CO 0.01 0.75 -0.19 0.28 -0.37 0.00 0.00 177.43 177.91 1woa h SER 26 N 1.25 -0.46 -0.76 1.15 0.02 -1.10 -3.15 113.55 110.50 1woa h SER 26 Ca 0.38 -0.12 0.16 0.00 -0.84 0.00 0.00 61.79 61.37 1woa h SER 26 Cb -0.05 0.12 -0.11 0.00 0.14 0.00 0.00 62.40 62.50 1woa h SER 26 CO -0.11 -0.06 0.22 -0.26 -1.14 0.00 0.00 176.83 175.49 1woa h PHE 27 N -0.95 0.36 -0.80 3.45 -1.00 -0.97 -0.65 116.94 116.37 1woa h PHE 27 Ca -0.06 0.04 0.11 0.00 2.81 0.00 0.00 57.97 60.87 1woa h PHE 27 Cb 0.55 -0.04 -0.06 0.00 3.61 0.00 0.00 35.95 40.01 1woa h PHE 27 CO 0.02 -0.06 0.52 -0.91 -1.61 0.00 0.00 178.31 176.28 1woa h ASN 28 N 0.31 0.63 -0.87 2.17 2.35 -0.56 -2.56 115.58 117.05 1woa h ASN 28 Ca 0.43 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 56.23 1woa h ASN 28 Cb 0.74 -0.11 -0.05 0.00 0.05 0.00 0.00 38.32 38.96 1woa h ASN 28 CO -0.50 0.36 0.57 0.78 -1.65 0.00 0.00 177.43 177.00 1woa h ASN 29 N 0.69 0.96 -2.48 5.81 2.35 -1.06 -3.43 115.58 118.42 1woa h ASN 29 Ca 0.38 -0.02 -0.54 0.00 -0.55 0.00 0.00 56.30 55.57 1woa h ASN 29 Cb 0.53 -0.23 0.05 0.00 0.05 0.00 0.00 38.32 38.72 1woa h ASN 29 CO -0.15 0.68 0.98 -0.11 -1.65 0.00 0.00 177.43 177.18 1woa n LEU 30 N -4.43 3.74 -4.51 1.61 7.94 -0.97 -4.95 117.00 115.43 1woa n LEU 30 Ca 0.11 1.05 -0.41 0.00 -1.11 0.00 0.00 56.01 55.64 1woa n LEU 30 Cb 0.07 -1.52 -0.10 0.00 0.53 0.00 0.00 43.42 42.40 1woa n LEU 30 CO 0.36 0.04 -0.05 -0.62 -1.11 0.00 0.00 177.39 176.01 1woa s ASP 31 N 1.56 6.11 0.06 1.96 2.15 -1.26 -5.06 116.67 122.19 1woa s ASP 31 Ca 0.78 -0.50 -0.11 0.00 0.43 0.00 0.00 52.55 53.15 1woa s ASP 31 Cb -0.56 -2.17 0.01 0.00 -0.30 0.00 0.00 42.92 39.91 1woa s ASP 31 CO 0.36 -0.34 0.24 0.72 -0.17 0.00 0.00 175.17 175.98 1woa s PHE 32 N 1.82 0.01 -0.36 -5.34 -0.71 -1.26 -5.13 117.98 107.02 1woa s PHE 32 Ca 0.08 -0.26 -0.21 0.00 -1.04 0.00 0.00 56.93 55.50 1woa s PHE 32 Cb -0.17 0.02 0.01 0.00 -1.21 0.00 0.00 43.02 41.66 1woa s PHE 32 CO 0.11 -0.49 0.68 0.34 -1.34 0.00 0.00 175.22 174.52 1woa s ASP 33 N -2.29 6.46 0.36 1.98 -1.08 -1.26 -4.93 116.67 115.91 1woa s ASP 33 Ca -0.02 0.19 0.27 0.00 -0.52 0.00 0.00 52.55 52.46 1woa s ASP 33 Cb 0.00 -2.35 1.16 0.00 -1.46 0.00 0.00 42.92 40.28 1woa s ASP 33 CO -0.06 -0.64 1.81 1.55 0.52 0.00 0.00 175.17 178.35 1woa h PRO 34 N 8.48 0.00 0.00 4.34 0.13 -1.87 -1.79 132.00 141.29 1woa h PRO 34 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1woa h PRO 34 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1woa h PRO 34 CO 0.86 0.00 -0.06 -1.13 -0.23 0.00 0.00 178.00 177.44 1woa n SER 35 N -2.51 0.57 -0.01 1.44 3.41 -1.26 -3.57 113.62 111.69 1woa n SER 35 Ca 0.01 0.50 0.06 0.00 -0.26 0.00 0.00 58.87 59.18 1woa n SER 35 Cb 0.23 -0.61 -0.10 0.00 -0.26 0.00 0.00 64.21 63.46 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 -2.02 0.49 -3.81 4.33 5.02 -0.73 -5.01 118.16 116.43 1woa n LYS 36 Ca 0.06 -0.11 -0.13 0.00 -2.02 0.00 0.00 58.31 56.11 1woa n LYS 36 Cb 0.40 -1.31 -0.13 0.00 -0.02 0.00 0.00 35.03 33.97 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 -3.97 1.37 -0.24 -0.35 2.96 -0.86 -4.27 118.68 113.31 1woa s LEU 37 Ca -0.05 0.27 -0.12 0.00 -0.22 0.00 0.00 54.13 54.01 1woa s LEU 37 Cb 0.08 0.44 -0.05 0.00 0.50 0.00 0.00 46.19 47.17 1woa s LEU 37 CO 0.55 -0.06 0.23 -1.81 -1.32 0.00 0.00 176.35 173.94 1woa s ASP 38 N 0.25 6.18 -0.14 3.68 1.01 -0.28 -4.42 116.67 122.94 1woa s ASP 38 Ca -0.01 0.19 -0.00 0.00 0.71 0.00 0.00 52.55 53.43 1woa s ASP 38 Cb -0.03 -2.14 0.03 0.00 1.01 0.00 0.00 42.92 41.79 1woa s ASP 38 CO -0.01 -0.01 -0.06 -0.69 0.21 0.00 0.00 175.17 174.61 1woa s VAL 39 N 1.33 1.06 -0.02 -1.27 1.01 -1.26 0.08 120.40 121.34 1woa s VAL 39 Ca 0.10 -0.47 0.07 0.00 0.00 0.00 0.00 61.98 61.68 1woa s VAL 39 Cb -0.14 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 1woa s VAL 39 CO 0.07 0.24 -0.21 -0.69 0.00 0.00 0.00 175.10 174.50 1woa s VAL 40 N 1.67 1.67 -0.17 2.92 1.01 -0.53 -1.40 120.40 125.58 1woa s VAL 40 Ca 0.03 -0.91 -0.01 0.00 0.00 0.00 0.00 61.98 61.09 1woa s VAL 40 Cb -0.14 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 1woa s VAL 40 CO -0.08 0.47 -0.11 -0.69 0.00 0.00 0.00 175.10 174.70 1woa s VAL 41 N -0.49 3.06 -0.57 2.92 1.01 0.07 0.45 120.40 126.84 1woa s VAL 41 Ca 0.08 -0.63 -0.05 0.00 0.00 0.00 0.00 61.98 61.37 1woa s VAL 41 Cb -0.08 -2.32 0.15 0.00 0.00 0.00 0.00 36.38 34.12 1woa s VAL 41 CO -0.01 0.49 0.41 -0.36 0.00 0.00 0.00 175.10 175.63 1woa s PHE 42 N 0.87 3.49 0.85 5.22 0.40 0.22 -2.39 117.98 126.64 1woa s PHE 42 Ca -0.03 -2.39 -0.07 0.00 -0.60 0.00 0.00 56.93 53.83 1woa s PHE 42 Cb -0.15 -3.34 0.18 0.00 0.51 0.00 0.00 43.02 40.22 1woa s PHE 42 CO 0.00 -0.92 1.16 -1.25 0.70 0.00 0.00 175.22 174.92 1woa s PRO 43 N 0.52 1.06 0.40 0.24 0.04 -1.25 -2.25 135.00 133.75 1woa s PRO 43 Ca 0.13 -0.91 -0.25 0.00 0.04 0.00 0.00 61.00 60.01 1woa s PRO 43 Cb -0.21 -2.11 -0.08 0.00 0.04 0.00 0.00 34.50 32.14 1woa s PRO 43 CO -0.04 -1.98 1.15 0.08 0.04 0.00 0.00 177.00 176.25 1woa s VAL 44 N -3.51 3.22 0.19 -0.36 1.01 -1.26 -4.27 120.40 115.42 1woa s VAL 44 Ca 0.71 1.01 -0.21 0.00 0.00 0.00 0.00 61.98 63.50 1woa s VAL 44 Cb -0.04 -3.56 0.14 0.00 0.00 0.00 0.00 36.38 32.92 1woa s VAL 44 CO 0.49 0.08 1.58 0.77 0.00 0.00 0.00 175.10 178.02 1woa h SER 45 N 2.62 -1.24 0.20 3.32 4.64 -1.94 0.49 113.55 121.63 1woa h SER 45 Ca -0.49 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1woa h SER 45 Cb 1.23 0.62 0.00 0.00 -0.31 0.00 0.00 62.40 63.94 1woa h SER 45 CO 0.62 -0.30 0.00 1.33 -0.87 0.00 0.00 176.83 177.61 1woa n VAL 46 N -5.44 1.47 0.80 0.95 0.24 -1.26 -1.24 118.33 113.86 1woa n VAL 46 Ca 0.05 0.37 0.08 0.00 -2.04 0.00 0.00 64.34 62.80 1woa n VAL 46 Cb 0.36 -1.26 -0.05 0.00 -1.47 0.00 0.00 33.84 31.42 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 -1.47 0.00 0.01 6.34 -0.00 0.16 -4.71 115.22 115.56 1woa n HIS 47 Ca 0.02 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.61 1woa n HIS 47 Cb 0.07 0.00 -0.07 0.00 -0.00 0.00 0.00 29.99 29.99 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 0.96 -1.27 -0.19 4.41 3.20 -0.18 -0.12 116.97 123.79 1woa h TYR 48 Ca 0.00 0.05 0.04 0.00 3.14 0.00 0.00 58.73 61.96 1woa h TYR 48 Cb 0.50 0.57 -0.05 0.00 1.54 0.00 0.00 36.73 39.29 1woa h TYR 48 CO 0.00 -0.49 -0.10 -0.44 -1.64 0.00 0.00 178.16 175.49 1woa h ASP 49 N -0.53 -0.33 -0.06 -2.11 3.32 -1.84 -0.35 116.42 114.52 1woa h ASP 49 Ca 0.06 0.08 0.04 0.00 0.02 0.00 0.00 57.03 57.23 1woa h ASP 49 Cb 0.65 0.18 -0.05 0.00 0.22 0.00 0.00 39.33 40.32 1woa h ASP 49 CO -0.38 -0.13 -0.26 -0.74 -1.72 0.00 0.00 179.24 176.00 1woa h HIS 50 N -0.08 -0.71 -0.37 4.55 2.76 -1.78 -1.20 115.15 118.32 1woa h HIS 50 Ca 0.11 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.31 1woa h HIS 50 Cb 0.24 0.32 -0.02 0.00 1.55 0.00 0.00 27.41 29.50 1woa h HIS 50 CO -0.25 -0.35 0.24 1.15 -1.30 0.00 0.00 177.93 177.41 1woa h THR 51 N -0.37 1.08 -0.82 6.26 2.02 -0.80 -2.63 112.91 117.64 1woa h THR 51 Ca 0.08 -0.17 0.06 0.00 0.77 0.00 0.00 66.41 67.16 1woa h THR 51 Cb 0.48 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 67.40 1woa h THR 51 CO -0.27 0.09 0.54 -0.09 0.37 0.00 0.00 175.52 176.16 1woa h ARG 52 N 0.48 0.89 0.00 6.66 9.65 -0.69 0.11 114.38 131.48 1woa h ARG 52 Ca 0.14 -0.05 -0.12 0.00 -1.10 0.00 0.00 59.98 58.85 1woa h ARG 52 Cb -0.04 -0.20 -0.02 0.00 -1.39 0.00 0.00 29.97 28.32 1woa h ARG 52 CO -0.04 0.59 -0.56 0.87 2.80 0.00 0.00 179.97 183.63 1woa h LYS 53 N 0.91 0.00 0.09 0.20 1.57 -0.89 -3.27 116.57 115.18 1woa h LYS 53 Ca 0.35 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.83 1woa h LYS 53 Cb 0.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1woa h LYS 53 CO -0.12 0.56 -1.58 -0.07 -0.57 0.00 0.00 179.45 177.66 1woa h LEU 54 N 0.00 0.31 -9.55 2.94 3.38 -0.98 -3.46 115.31 107.96 1woa h LEU 54 Ca -0.01 -0.47 -0.52 0.00 0.09 0.00 0.00 57.88 56.97 1woa h LEU 54 Cb 1.00 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1woa h LEU 54 CO 0.07 1.40 0.36 -0.76 0.09 0.00 0.00 178.44 179.61 1woa s LEU 55 N -6.83 4.48 0.70 1.67 1.43 -0.06 -4.90 118.68 115.16 1woa s LEU 55 Ca -0.09 1.78 -0.14 0.00 -1.03 0.00 0.00 54.13 54.65 1woa s LEU 55 Cb 0.07 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.73 1woa s LEU 55 CO 0.84 -0.09 1.12 -1.10 0.23 0.00 0.00 176.35 177.35 1woa s GLN 56 N 0.12 2.55 0.48 1.70 -0.21 -1.26 -4.88 119.66 118.15 1woa s GLN 56 Ca 0.48 1.40 0.32 0.00 0.02 0.00 0.00 55.36 57.58 1woa s GLN 56 Cb -0.23 -1.92 1.42 0.00 1.00 0.00 0.00 33.01 33.29 1woa s GLN 56 CO 0.30 -1.45 1.71 0.77 -2.12 0.00 0.00 175.29 174.50 1woa h SER 57 N -0.29 0.19 -0.15 5.90 0.02 -1.95 0.70 113.55 117.96 1woa h SER 57 Ca -0.46 0.06 0.04 0.00 -0.84 0.00 0.00 61.79 60.59 1woa h SER 57 Cb 1.25 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.82 1woa h SER 57 CO 0.53 -0.03 0.16 0.07 -1.14 0.00 0.00 176.83 176.42 1woa h LYS 58 N 0.13 0.00 -5.85 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 58.74 1woa h LYS 58 Cb 2.36 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 33.63 1woa h LYS 58 CO -0.20 0.00 -0.22 -0.06 -2.00 0.00 0.00 179.45 176.96 1woa s PHE 59 N -4.69 3.63 0.26 0.07 0.40 0.24 -4.71 117.98 113.19 1woa s PHE 59 Ca -0.05 0.88 0.01 0.00 -0.60 0.00 0.00 56.93 57.18 1woa s PHE 59 Cb 0.16 -2.33 -0.04 0.00 0.51 0.00 0.00 43.02 41.32 1woa s PHE 59 CO 0.57 0.48 0.44 -1.12 0.70 0.00 0.00 175.22 176.28 1woa s SER 60 N -0.46 6.33 0.16 1.36 0.01 -0.49 -4.86 113.70 115.75 1woa s SER 60 Ca 0.22 0.32 0.03 0.00 1.31 0.00 0.00 55.95 57.83 1woa s SER 60 Cb -0.15 -1.97 -0.05 0.00 0.21 0.00 0.00 66.02 64.06 1woa s SER 60 CO 0.11 -0.14 -0.06 0.42 0.41 0.00 0.00 173.24 173.97 1woa s THR 61 N -2.06 1.00 0.31 1.44 -4.23 -1.26 -0.75 115.64 110.09 1woa s THR 61 Ca 0.38 -2.03 -0.18 0.00 -1.18 0.00 0.00 61.69 58.68 1woa s THR 61 Cb -0.10 -1.95 0.07 0.00 1.34 0.00 0.00 72.50 71.86 1woa s THR 61 CO 0.31 -0.65 0.90 -0.83 -0.54 0.00 0.00 174.62 173.81 1woa s GLY 62 N -3.17 0.31 0.11 3.99 0.00 -1.01 -3.19 107.32 104.36 1woa s GLY 62 Ca 0.19 -0.63 0.07 0.00 0.00 0.00 0.00 44.72 44.35 1woa s GLY 62 CO 0.02 0.90 -0.09 -0.26 0.00 0.00 0.00 173.10 173.67 1woa s ILE 63 N -2.11 3.42 -0.58 0.90 -4.36 -0.84 -3.81 121.20 113.82 1woa s ILE 63 Ca 0.19 -1.27 0.19 0.00 -0.26 0.00 0.00 60.65 59.50 1woa s ILE 63 Cb -0.04 -2.61 0.19 0.00 1.25 0.00 0.00 42.46 41.25 1woa s ILE 63 CO 0.09 0.10 1.59 0.00 0.24 0.00 0.00 174.94 176.96 1woa n GLN 64 N 0.64 0.13 -3.53 0.37 6.02 -1.26 -1.89 117.38 117.85 1woa n GLN 64 Ca -0.13 0.43 -0.16 0.00 -0.01 0.00 0.00 57.00 57.13 1woa n GLN 64 Cb 0.52 -1.78 -0.06 0.00 1.02 0.00 0.00 30.24 29.95 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 -3.84 -0.58 0.05 1.08 3.04 -1.26 -4.23 114.94 109.20 1woa s ASN 65 Ca 0.03 0.63 0.03 0.00 0.04 0.00 0.00 52.86 53.60 1woa s ASN 65 Cb 0.08 0.48 -0.02 0.00 -1.54 0.00 0.00 41.25 40.24 1woa s ASN 65 CO 0.30 -0.54 -0.10 0.54 -3.04 0.00 0.00 177.10 174.26 1woa s VAL 66 N -1.18 0.74 0.52 -5.21 0.11 -1.26 -4.90 120.40 109.22 1woa s VAL 66 Ca -0.09 -1.08 -0.18 0.00 -2.93 0.00 0.00 61.98 57.70 1woa s VAL 66 Cb -0.00 -0.76 -0.07 0.00 -1.53 0.00 0.00 36.38 34.02 1woa s VAL 66 CO 0.08 -0.27 1.03 -0.55 -3.33 0.00 0.00 175.10 172.05 1woa s SER 67 N -1.50 6.24 0.05 3.54 0.15 0.46 -4.95 113.70 117.70 1woa s SER 67 Ca -0.06 1.83 0.25 0.00 0.70 0.00 0.00 55.95 58.67 1woa s SER 67 Cb -0.09 -2.54 0.44 0.00 -1.71 0.00 0.00 66.02 62.11 1woa s SER 67 CO 0.01 -0.85 1.37 2.29 1.20 0.00 0.00 173.24 177.26 1woa n LYS 68 N -1.36 0.14 -3.27 5.44 2.85 -1.26 -4.56 118.16 116.13 1woa n LYS 68 Ca 0.09 0.04 -0.18 0.00 -1.05 0.00 0.00 58.31 57.20 1woa n LYS 68 Cb 0.53 -1.58 -0.00 0.00 -0.65 0.00 0.00 35.03 33.33 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 -3.08 2.94 0.00 5.58 0.08 -1.26 -4.77 117.98 117.47 1woa s PHE 69 Ca 0.09 -0.32 0.00 0.00 0.12 0.00 0.00 56.93 56.81 1woa s PHE 69 Cb 0.16 -2.17 0.00 0.00 -0.57 0.00 0.00 43.02 40.43 1woa s PHE 69 CO 0.71 -0.20 0.00 0.41 -0.10 0.00 0.00 175.22 176.04 1woa n GLY 70 N -1.72 1.46 3.67 4.36 0.00 -1.26 -4.59 105.19 107.10 1woa n GLY 70 Ca 0.04 -1.98 -0.34 0.00 0.00 0.00 0.00 46.02 43.74 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 -0.24 0.93 0.00 1.61 3.02 -1.26 -4.86 115.26 114.45 1woa n ASN 71 Ca 0.00 0.62 0.00 0.00 -0.03 0.00 0.00 54.58 55.17 1woa n ASN 71 Cb 0.00 -1.48 0.00 0.00 -0.61 0.00 0.00 39.78 37.69 1woa n ASN 71 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1woa n GLY 72 N 0.74 0.93 3.14 7.41 0.00 -1.26 -4.98 105.19 111.16 1woa n GLY 72 Ca 0.13 -1.88 -0.41 0.00 0.00 0.00 0.00 46.02 43.87 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 1.76 2.95 -3.22 1.61 7.64 -1.26 -4.68 113.62 118.42 1woa n SER 73 Ca 0.00 -2.72 -0.24 0.00 1.01 0.00 0.00 58.87 56.92 1woa n SER 73 Cb 0.00 -1.33 -0.07 0.00 -1.01 0.00 0.00 64.21 61.81 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 8.35 0.37 -1.63 1.43 4.01 -1.26 -5.11 117.16 123.33 1woa n TYR 74 Ca 0.49 -3.69 -0.57 0.00 -0.16 0.00 0.00 57.90 53.98 1woa n TYR 74 Cb 0.41 -0.39 -0.07 0.00 -0.31 0.00 0.00 39.34 38.98 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 1.15 0.08 0.00 -0.72 -1.04 -1.26 -1.33 114.28 111.16 1woa n THR 75 Ca 0.23 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.22 1woa n THR 75 Cb 0.53 -0.72 0.00 0.00 -1.82 0.00 0.00 70.33 68.31 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 2.96 1.05 3.94 3.41 0.00 -1.26 -5.05 105.19 110.25 1woa n GLY 76 Ca 0.23 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.69 3.47 -0.09 1.61 0.41 -0.44 -5.09 118.70 117.87 1woa s GLU 77 Ca 0.00 -0.34 0.01 0.00 -0.41 0.00 0.00 54.97 54.22 1woa s GLU 77 Cb 0.00 -2.66 0.02 0.00 -1.78 0.00 0.00 34.13 29.71 1woa s GLU 77 CO 0.00 0.13 -0.11 0.08 -0.49 0.00 0.00 175.26 174.88 1woa s VAL 78 N -2.33 1.14 0.31 2.63 1.01 -1.26 -5.03 120.40 116.87 1woa s VAL 78 Ca 0.40 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1woa s VAL 78 Cb -0.10 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 1woa s VAL 78 CO 0.36 0.37 0.51 -0.94 0.00 0.00 0.00 175.10 175.41 1woa s SER 79 N 1.19 6.32 0.38 3.32 1.04 -1.26 -0.40 113.70 124.29 1woa s SER 79 Ca -0.04 0.44 0.07 0.00 0.48 0.00 0.00 55.95 56.89 1woa s SER 79 Cb -0.14 -2.03 0.78 0.00 0.10 0.00 0.00 66.02 64.74 1woa s SER 79 CO -0.03 -0.23 1.99 0.00 0.98 0.00 0.00 173.24 175.95 1woa h ALA 80 N 1.06 1.72 -0.22 5.32 0.00 -1.81 -0.52 119.26 124.80 1woa h ALA 80 Ca -0.49 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1woa h ALA 80 Cb 1.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1woa h ALA 80 CO 0.63 0.19 0.11 0.93 0.00 0.00 0.00 179.25 181.11 1woa h GLU 81 N 0.69 0.32 -0.73 0.00 3.07 -1.93 0.21 114.58 116.22 1woa h GLU 81 Ca 0.27 -0.05 -0.05 0.00 -0.50 0.00 0.00 59.36 59.04 1woa h GLU 81 Cb 0.18 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.00 1woa h GLU 81 CO -0.08 0.33 0.27 0.82 -1.40 0.00 0.00 179.01 178.95 1woa h ILE 82 N 0.23 1.25 -0.19 3.13 2.04 -1.76 -1.77 117.51 120.45 1woa h ILE 82 Ca 0.08 -0.81 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 1woa h ILE 82 Cb 0.11 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 1woa h ILE 82 CO -0.01 0.33 0.11 0.00 0.00 0.00 0.00 178.15 178.57 1woa h ALA 83 N 1.23 0.24 -0.28 1.87 0.00 -0.65 -2.60 119.26 119.07 1woa h ALA 83 Ca 0.24 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.14 1woa h ALA 83 Cb 0.23 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1woa h ALA 83 CO -0.02 -0.23 0.03 -0.22 0.00 0.00 0.00 179.25 178.81 1woa h LYS 84 N 0.21 0.12 -0.74 0.00 3.64 -0.24 -1.91 116.57 117.65 1woa h LYS 84 Ca 0.07 -0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.59 1woa h LYS 84 Cb 0.06 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.80 1woa h LYS 84 CO -0.01 0.08 0.50 0.22 -2.27 0.00 0.00 179.45 177.96 1woa h ASP 85 N 0.12 0.36 -0.06 4.20 1.82 -1.12 0.20 116.42 121.94 1woa h ASP 85 Ca 0.13 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.79 1woa h ASP 85 Cb 0.15 -0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.11 1woa h ASP 85 CO -0.20 0.18 0.00 0.18 -1.61 0.00 0.00 179.24 177.80 1woa n LEU 86 N -4.47 1.25 -1.70 2.28 4.77 -0.80 -4.92 117.00 113.41 1woa n LEU 86 Ca 0.14 -0.46 -0.16 0.00 -0.03 0.00 0.00 56.01 55.50 1woa n LEU 86 Cb 0.54 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 1woa n LEU 86 CO 0.33 0.23 -0.20 0.59 -1.33 0.00 0.00 177.39 177.02 1woa n ASN 87 N -0.00 -4.85 -4.72 -1.43 3.02 0.69 -4.96 115.26 103.01 1woa n ASN 87 Ca 0.18 0.08 -0.42 0.00 -0.03 0.00 0.00 54.58 54.40 1woa n ASN 87 Cb 0.29 -3.92 -0.03 0.00 -0.61 0.00 0.00 39.78 35.52 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 -2.76 3.30 -0.16 2.41 1.01 -0.79 -4.95 121.20 119.27 1woa s ILE 88 Ca 0.00 0.96 -0.19 0.00 0.00 0.00 0.00 60.65 61.42 1woa s ILE 88 Cb 0.00 -3.62 -0.23 0.00 0.01 0.00 0.00 42.46 38.62 1woa s ILE 88 CO 0.00 0.09 0.41 -0.08 0.00 0.00 0.00 174.94 175.36 1woa h GLU 89 N 6.46 0.11 -5.99 2.79 4.81 -1.89 -3.42 114.58 117.45 1woa h GLU 89 Ca -0.43 -0.18 -0.60 0.00 -0.13 0.00 0.00 59.36 58.02 1woa h GLU 89 Cb 1.21 0.07 -0.12 0.00 0.63 0.00 0.00 28.75 30.54 1woa h GLU 89 CO 0.84 1.09 -0.66 0.71 -0.73 0.00 0.00 179.01 180.26 1woa s TYR 90 N -2.40 2.46 -0.02 0.92 1.51 -1.19 -0.99 117.35 117.63 1woa s TYR 90 Ca -0.24 -0.46 -0.11 0.00 -1.01 0.00 0.00 57.07 55.25 1woa s TYR 90 Cb 0.04 -1.40 0.02 0.00 -0.11 0.00 0.00 41.96 40.51 1woa s TYR 90 CO 0.68 0.55 0.25 0.14 -1.11 0.00 0.00 175.55 176.06 1woa s VAL 91 N -2.56 0.06 -0.14 0.71 -7.23 -0.74 -1.99 120.40 108.50 1woa s VAL 91 Ca 0.33 -0.46 -0.09 0.00 -1.81 0.00 0.00 61.98 59.95 1woa s VAL 91 Cb 0.01 -0.52 -0.05 0.00 0.56 0.00 0.00 36.38 36.39 1woa s VAL 91 CO 0.18 -0.25 0.17 -0.63 -0.31 0.00 0.00 175.10 174.25 1woa s ILE 92 N -1.09 5.42 -0.05 -0.62 1.01 -0.79 -0.74 121.20 124.35 1woa s ILE 92 Ca -0.12 0.28 0.03 0.00 0.00 0.00 0.00 60.65 60.85 1woa s ILE 92 Cb -0.05 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 38.95 1woa s ILE 92 CO 0.03 0.53 -0.14 -0.63 0.00 0.00 0.00 174.94 174.72 1woa s ILE 93 N -0.39 1.24 -0.45 2.92 1.09 0.50 -4.01 121.20 122.10 1woa s ILE 93 Ca 0.13 -0.59 0.00 0.00 -1.10 0.00 0.00 60.65 59.09 1woa s ILE 93 Cb -0.12 -1.09 0.00 0.00 -1.06 0.00 0.00 42.46 40.19 1woa s ILE 93 CO 0.02 0.37 0.00 0.61 -0.10 0.00 0.00 174.94 175.84 1woa n GLY 94 N 3.36 0.58 3.72 6.18 0.00 -1.26 -0.18 105.19 117.59 1woa n GLY 94 Ca -0.19 -0.83 -0.43 0.00 0.00 0.00 0.00 46.02 44.57 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 -3.16 2.66 -0.23 1.61 -0.00 -1.26 -4.43 115.22 110.41 1woa n HIS 95 Ca -0.05 0.28 0.28 0.00 0.46 0.00 0.00 57.72 58.69 1woa n HIS 95 Cb 0.25 -2.57 0.67 0.00 -0.12 0.00 0.00 29.99 28.22 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 4.88 0.16 0.00 1.57 -0.00 -1.94 0.36 116.94 121.97 1woa h PHE 96 Ca -0.46 0.01 -0.04 0.00 -0.00 0.00 0.00 57.97 57.47 1woa h PHE 96 Cb 1.24 -0.05 -0.01 0.00 -0.00 0.00 0.00 35.95 37.13 1woa h PHE 96 CO 0.58 0.03 -0.20 0.93 -0.00 0.00 0.00 178.31 179.65 1woa h GLU 97 N 0.10 0.00 0.03 6.09 5.08 -1.99 0.39 114.58 124.29 1woa h GLU 97 Ca 0.48 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.59 1woa h GLU 97 Cb 1.72 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.95 1woa h GLU 97 CO -0.06 0.20 -1.30 0.00 -1.00 0.00 0.00 179.01 176.85 1woa h ARG 98 N 0.00 0.07 -0.07 2.33 3.08 -0.64 -2.15 114.38 117.01 1woa h ARG 98 Ca -0.00 -0.12 -0.12 0.00 0.07 0.00 0.00 59.98 59.81 1woa h ARG 98 Cb 0.38 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 1woa h ARG 98 CO 0.03 0.91 -0.52 0.00 -1.07 0.00 0.00 179.97 179.32 1woa h ARG 99 N 0.02 0.18 0.00 0.04 3.08 -0.84 -1.12 114.38 115.74 1woa h ARG 99 Ca -0.13 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 1woa h ARG 99 Cb 1.89 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.95 1woa h ARG 99 CO 0.13 0.66 -0.06 -0.22 -1.07 0.00 0.00 179.97 179.41 1woa h LYS 100 N 0.14 0.00 0.00 0.04 3.64 -0.28 -3.16 116.57 116.95 1woa h LYS 100 Ca 0.00 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.27 1woa h LYS 100 Cb 0.97 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1woa h LYS 100 CO 0.08 0.33 -0.78 1.88 -2.27 0.00 0.00 179.45 178.68 1woa h TYR 101 N -1.00 0.00 -0.15 1.91 0.05 -1.51 -3.36 116.97 112.91 1woa h TYR 101 Ca -0.01 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.77 1woa h TYR 101 Cb 0.36 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.10 1woa h TYR 101 CO 0.08 0.49 0.00 1.19 -1.05 0.00 0.00 178.16 178.86 1woa n PHE 102 N -3.09 0.28 -4.17 4.88 3.72 -0.44 -5.00 117.46 113.63 1woa n PHE 102 Ca -0.01 -0.61 -0.34 0.00 -0.05 0.00 0.00 57.45 56.43 1woa n PHE 102 Cb 0.75 -0.09 -0.02 0.00 -0.94 0.00 0.00 39.48 39.18 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 -0.28 -1.76 -2.37 1.38 8.25 -1.09 -4.90 115.22 114.45 1woa n HIS 103 Ca 0.09 0.80 -0.42 0.00 -0.26 0.00 0.00 57.72 57.92 1woa n HIS 103 Cb 0.44 -3.13 -0.03 0.00 1.12 0.00 0.00 29.99 28.40 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 -6.87 4.39 0.41 -0.41 2.12 -1.15 -4.99 118.70 112.20 1woa s GLU 104 Ca 0.62 1.83 0.08 0.00 0.36 0.00 0.00 54.97 57.85 1woa s GLU 104 Cb -0.33 -3.37 -0.00 0.00 0.26 0.00 0.00 34.13 30.68 1woa s GLU 104 CO 0.92 -0.33 0.48 0.95 -0.54 0.00 0.00 175.26 176.73 1woa s THR 105 N 1.29 2.96 0.62 -1.70 -4.23 -1.26 -4.50 115.64 108.82 1woa s THR 105 Ca 0.60 -1.15 0.35 0.00 -1.18 0.00 0.00 61.69 60.30 1woa s THR 105 Cb -0.30 -3.03 0.38 0.00 1.34 0.00 0.00 72.50 70.89 1woa s THR 105 CO 0.28 -0.02 2.27 0.44 -0.54 0.00 0.00 174.62 177.05 1woa h ASP 106 N 0.83 0.00 -0.12 3.99 3.32 -1.98 0.12 116.42 122.59 1woa h ASP 106 Ca -0.41 0.00 -0.12 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 0.51 0.00 -0.41 -0.08 -1.72 0.00 0.00 179.24 177.54 1woa h GLU 107 N 0.00 0.48 -0.75 3.56 4.57 -1.94 -2.29 114.58 118.21 1woa h GLU 107 Ca 0.01 -0.37 0.03 0.00 -1.18 0.00 0.00 59.36 57.86 1woa h GLU 107 Cb 0.09 0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 28.69 1woa h GLU 107 CO -0.00 0.99 0.47 -0.44 -1.18 0.00 0.00 179.01 178.85 1woa h ASP 108 N 0.08 0.78 -0.16 1.04 3.32 -1.19 -1.30 116.42 118.99 1woa h ASP 108 Ca -0.02 -0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.06 1woa h ASP 108 Cb 1.04 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.40 1woa h ASP 108 CO 0.09 0.53 0.01 0.58 -1.72 0.00 0.00 179.24 178.73 1woa h VAL 109 N 0.92 0.90 0.06 -1.35 2.07 -1.17 0.25 116.25 117.93 1woa h VAL 109 Ca 0.30 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.81 1woa h VAL 109 Cb 0.03 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1woa h VAL 109 CO -0.12 0.01 -0.11 -0.09 0.02 0.00 0.00 177.57 177.28 1woa h ARG 110 N 0.06 -0.21 -0.58 1.57 2.43 -0.93 -0.01 114.38 116.71 1woa h ARG 110 Ca 0.07 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1woa h ARG 110 Cb 0.08 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 1woa h ARG 110 CO -0.12 -0.14 0.35 0.93 -1.51 0.00 0.00 179.97 179.49 1woa h GLU 111 N -0.22 0.78 -0.35 0.20 5.08 -1.05 -0.24 114.58 118.78 1woa h GLU 111 Ca 0.02 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1woa h GLU 111 Cb 0.24 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1woa h GLU 111 CO -0.06 0.55 0.21 0.87 -1.00 0.00 0.00 179.01 179.58 1woa h LYS 112 N 0.78 0.48 -0.73 2.33 1.57 -0.31 -0.61 116.57 120.07 1woa h LYS 112 Ca 0.21 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.97 1woa h LYS 112 Cb -0.03 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.14 1woa h LYS 112 CO -0.04 0.37 0.46 1.25 -0.57 0.00 0.00 179.45 180.92 1woa h LEU 113 N 0.45 0.76 -0.12 2.94 5.85 -0.66 -0.61 115.31 123.92 1woa h LEU 113 Ca 0.12 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1woa h LEU 113 Cb 0.02 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1woa h LEU 113 CO -0.02 0.53 0.06 -0.61 -0.34 0.00 0.00 178.44 178.06 1woa h GLN 114 N 0.90 0.18 -0.78 1.25 4.15 -0.60 -0.38 115.11 119.84 1woa h GLN 114 Ca 0.29 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.73 1woa h GLN 114 Cb 0.01 -0.03 -0.05 0.00 0.21 0.00 0.00 27.48 27.62 1woa h GLN 114 CO -0.11 0.23 0.48 0.00 -1.93 0.00 0.00 178.83 177.50 1woa h ALA 115 N 0.94 1.04 0.29 3.38 0.00 -0.80 -1.30 119.26 122.81 1woa h ALA 115 Ca 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1woa h ALA 115 Cb 0.10 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1woa h ALA 115 CO -0.01 0.25 -0.14 0.77 0.00 0.00 0.00 179.25 180.13 1woa h SER 116 N 0.92 -0.33 -0.83 0.00 0.02 -0.64 -2.83 113.55 109.85 1woa h SER 116 Ca 0.32 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.25 1woa h SER 116 Cb 0.08 0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.67 1woa h SER 116 CO -0.14 -0.20 0.51 -0.07 -1.14 0.00 0.00 176.83 175.79 1woa h LEU 117 N -0.44 0.99 -2.18 5.07 3.38 -0.89 -1.65 115.31 119.59 1woa h LEU 117 Ca -0.04 -0.06 0.04 0.00 0.09 0.00 0.00 57.88 57.91 1woa h LEU 117 Cb 0.33 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1woa h LEU 117 CO 0.07 0.76 0.12 0.50 0.09 0.00 0.00 178.44 179.98 1woa h LYS 118 N 1.14 0.00 -0.50 1.13 3.64 -1.15 -1.77 116.57 119.05 1woa h LYS 118 Ca 0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1woa h LYS 118 Cb -0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1woa h LYS 118 CO -0.06 0.00 0.00 0.09 -2.27 0.00 0.00 179.45 177.21 1woa n ASN 119 N -4.14 5.13 -3.58 4.20 3.02 -0.70 -4.96 115.26 114.23 1woa n ASN 119 Ca 0.00 -2.89 -0.22 0.00 -0.03 0.00 0.00 54.58 51.44 1woa n ASN 119 Cb 0.24 -0.63 0.07 0.00 -0.61 0.00 0.00 39.78 38.85 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 0.38 -4.24 -4.66 6.41 4.13 -0.67 -4.78 115.26 111.84 1woa n ASN 120 Ca 0.26 -0.61 -0.31 0.00 1.68 0.00 0.00 54.58 55.59 1woa n ASN 120 Cb 1.08 -4.88 -0.09 0.00 -1.54 0.00 0.00 39.78 34.35 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 -6.91 3.38 0.05 3.41 1.43 -0.73 -5.01 118.68 114.29 1woa s LEU 121 Ca 0.33 -0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 53.14 1woa s LEU 121 Cb -0.15 -2.06 -0.06 0.00 0.03 0.00 0.00 46.19 43.95 1woa s LEU 121 CO 0.75 0.21 0.42 -0.54 0.23 0.00 0.00 176.35 177.42 1woa s LYS 122 N -2.03 3.85 -0.04 1.70 1.02 -0.16 -4.31 119.74 119.77 1woa s LYS 122 Ca 0.23 0.31 0.07 0.00 0.02 0.00 0.00 55.97 56.60 1woa s LYS 122 Cb -0.11 -3.08 -0.01 0.00 -0.52 0.00 0.00 37.83 34.10 1woa s LYS 122 CO 0.15 0.61 -0.25 0.00 -0.92 0.00 0.00 175.35 174.94 1woa s ALA 123 N -1.27 2.09 -0.49 5.17 0.00 -0.31 -1.79 121.76 125.17 1woa s ALA 123 Ca 0.30 -1.05 -0.09 0.00 0.00 0.00 0.00 51.96 51.11 1woa s ALA 123 Cb -0.15 -0.59 0.12 0.00 0.00 0.00 0.00 23.12 22.50 1woa s ALA 123 CO 0.16 0.46 0.36 0.08 0.00 0.00 0.00 175.76 176.83 1woa s VAL 124 N -0.38 4.24 -0.16 0.00 1.01 0.08 0.48 120.40 125.67 1woa s VAL 124 Ca 0.04 -1.84 -0.16 0.00 0.00 0.00 0.00 61.98 60.01 1woa s VAL 124 Cb -0.11 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 1woa s VAL 124 CO 0.01 -0.79 0.41 -0.69 0.00 0.00 0.00 175.10 174.04 1woa s VAL 125 N 1.29 5.22 0.03 2.92 1.01 0.38 -0.37 120.40 130.88 1woa s VAL 125 Ca 0.06 0.78 0.03 0.00 0.00 0.00 0.00 61.98 62.85 1woa s VAL 125 Cb -0.26 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1woa s VAL 125 CO -0.01 0.31 -0.02 0.00 0.00 0.00 0.00 175.10 175.38 1woa s PHE 127 N -1.13 -0.48 0.00 0.00 -0.12 -0.87 -4.61 117.98 110.77 1woa s PHE 127 Ca 0.21 0.34 0.00 0.00 -0.05 0.00 0.00 56.93 57.43 1woa s PHE 127 Cb -0.11 0.54 0.00 0.00 -0.63 0.00 0.00 43.02 42.82 1woa s PHE 127 CO 0.12 -0.73 0.00 0.41 -0.05 0.00 0.00 175.22 174.97 1woa n GLY 128 N -0.24 1.20 3.93 1.99 0.00 -1.26 -0.22 105.19 110.60 1woa n GLY 128 Ca -0.14 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 44.86 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 0.92 1.61 1.03 -1.26 -4.83 118.70 117.67 1woa s GLU 129 Ca 0.00 -0.40 -0.14 0.00 0.03 0.00 0.00 54.97 54.47 1woa s GLU 129 Cb 0.00 -2.85 0.18 0.00 -0.80 0.00 0.00 34.13 30.66 1woa s GLU 129 CO 0.00 0.41 1.27 -1.54 -1.33 0.00 0.00 175.26 174.06 1woa s SER 130 N -3.25 3.41 0.13 0.83 1.04 -1.26 -2.29 113.70 112.31 1woa s SER 130 Ca 0.38 0.24 -0.12 0.00 0.48 0.00 0.00 55.95 56.93 1woa s SER 130 Cb -0.11 -0.37 -0.07 0.00 0.10 0.00 0.00 66.02 65.58 1woa s SER 130 CO 0.29 -2.54 1.44 0.25 0.98 0.00 0.00 173.24 173.66 1woa h LEU 131 N -1.44 0.98 -0.51 2.42 5.85 -1.87 -2.28 115.31 118.47 1woa h LEU 131 Ca -0.44 -0.49 -0.02 0.00 0.84 0.00 0.00 57.88 57.77 1woa h LEU 131 Cb 1.25 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 1woa h LEU 131 CO 0.41 1.28 0.22 -0.08 -0.34 0.00 0.00 178.44 179.93 1woa h GLU 132 N 0.70 0.74 0.00 1.25 4.81 -1.98 -2.09 114.58 118.01 1woa h GLU 132 Ca 0.04 -0.12 -0.09 0.00 -0.13 0.00 0.00 59.36 59.06 1woa h GLU 132 Cb 1.05 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 1woa h GLU 132 CO 0.10 0.64 -0.41 1.96 -0.73 0.00 0.00 179.01 180.58 1woa h GLN 133 N 0.67 0.00 -0.29 1.92 4.20 -1.93 -2.66 115.11 117.02 1woa h GLN 133 Ca 0.17 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.71 1woa h GLN 133 Cb 0.16 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 1woa h GLN 133 CO -0.02 0.41 -0.48 -0.09 -0.67 0.00 0.00 178.83 177.98 1woa h ARG 134 N 0.00 0.84 0.00 1.46 2.43 -1.05 -0.12 114.38 117.94 1woa h ARG 134 Ca -0.00 -0.51 -0.05 0.00 -0.81 0.00 0.00 59.98 58.60 1woa h ARG 134 Cb 0.77 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 1woa h ARG 134 CO 0.05 1.15 -0.25 0.93 -1.51 0.00 0.00 179.97 180.34 1woa h GLU 135 N 0.62 0.00 -0.17 0.20 5.08 -1.22 0.18 114.58 119.27 1woa h GLU 135 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1woa h GLU 135 Cb 1.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1woa h GLU 135 CO 0.11 0.25 0.00 1.04 -1.00 0.00 0.00 179.01 179.41 1woa n GLN 136 N -4.02 1.49 -3.69 2.33 6.02 -1.02 -4.90 117.38 113.58 1woa n GLN 136 Ca -0.02 -0.75 -0.27 0.00 -0.01 0.00 0.00 57.00 55.96 1woa n GLN 136 Cb 0.32 -1.25 0.05 0.00 1.02 0.00 0.00 30.24 30.38 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 0.04 -5.57 -0.93 1.08 3.02 0.05 -4.88 115.26 108.08 1woa n ASN 137 Ca 0.11 -0.63 0.10 0.00 -0.03 0.00 0.00 54.58 54.13 1woa n ASN 137 Cb 0.20 -4.42 0.16 0.00 -0.61 0.00 0.00 39.78 35.12 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 -4.74 2.18 -0.30 3.52 5.02 -0.08 -4.73 118.16 119.03 1woa n LYS 138 Ca 0.02 -2.02 -0.09 0.00 -2.02 0.00 0.00 58.31 54.20 1woa n LYS 138 Cb 0.55 -1.42 -0.06 0.00 -0.02 0.00 0.00 35.03 34.08 1woa n LYS 138 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1woa h THR 139 N 3.74 0.03 -0.75 -0.18 2.02 -1.85 0.13 112.91 116.04 1woa h THR 139 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1woa h THR 139 Cb 0.86 0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 1woa h THR 139 CO 0.00 0.00 0.34 0.40 0.37 0.00 0.00 175.52 176.63 1woa h ILE 140 N -0.15 1.25 -0.13 3.11 5.03 -1.96 -1.78 117.51 122.89 1woa h ILE 140 Ca 0.18 -0.73 0.02 0.00 -0.12 0.00 0.00 64.86 64.21 1woa h ILE 140 Cb 0.52 0.32 -0.02 0.00 -3.03 0.00 0.00 36.82 34.62 1woa h ILE 140 CO -0.81 0.30 0.03 -0.08 -0.68 0.00 0.00 178.15 176.91 1woa h GLU 141 N 1.07 0.08 0.20 2.37 4.81 -1.51 -1.11 114.58 120.49 1woa h GLU 141 Ca 0.26 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 1woa h GLU 141 Cb 0.15 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.52 1woa h GLU 141 CO -0.03 0.05 -0.09 0.28 -0.73 0.00 0.00 179.01 178.49 1woa h VAL 142 N 0.08 0.83 -0.48 0.32 2.07 -0.63 -2.44 116.25 116.00 1woa h VAL 142 Ca 0.06 -0.10 0.06 0.00 0.82 0.00 0.00 66.70 67.54 1woa h VAL 142 Cb 0.05 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 1woa h VAL 142 CO -0.07 0.02 0.19 0.40 0.02 0.00 0.00 177.57 178.13 1woa h ILE 143 N -0.31 0.86 -0.46 4.57 2.04 -1.23 -1.07 117.51 121.90 1woa h ILE 143 Ca -0.03 -0.13 0.06 0.00 1.00 0.00 0.00 64.86 65.76 1woa h ILE 143 Cb 0.24 0.46 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 1woa h ILE 143 CO 0.04 0.07 0.17 0.74 0.00 0.00 0.00 178.15 179.17 1woa h THR 144 N 0.37 0.87 0.37 -0.27 2.02 -1.13 0.13 112.91 115.26 1woa h THR 144 Ca 0.23 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 1woa h THR 144 Cb 0.22 0.49 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1woa h THR 144 CO -0.22 0.06 -0.22 0.50 0.37 0.00 0.00 175.52 176.01 1woa h LYS 145 N 0.35 -0.55 -0.66 6.66 3.64 -0.87 0.18 116.57 125.32 1woa h LYS 145 Ca 0.21 0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.67 1woa h LYS 145 Cb 0.20 0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.10 1woa h LYS 145 CO -0.21 -0.37 0.40 1.96 -2.27 0.00 0.00 179.45 178.96 1woa h GLN 146 N -0.57 0.75 -0.09 1.90 4.20 -0.87 -2.41 115.11 118.02 1woa h GLN 146 Ca -0.04 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 1woa h GLN 146 Cb 0.47 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 1woa h GLN 146 CO 0.04 0.49 -0.03 0.28 -0.67 0.00 0.00 178.83 178.94 1woa h VAL 147 N 0.77 1.31 0.00 -0.54 2.07 -0.62 -2.55 116.25 116.68 1woa h VAL 147 Ca 0.27 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1woa h VAL 147 Cb 0.07 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1woa h VAL 147 CO -0.13 0.28 0.00 0.29 0.02 0.00 0.00 177.57 178.04 1woa n LYS 148 N -4.76 0.12 0.06 1.57 5.02 0.63 -1.43 118.16 119.38 1woa n LYS 148 Ca -0.07 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.34 1woa n LYS 148 Cb 0.25 -1.32 0.12 0.00 -0.02 0.00 0.00 35.03 34.06 1woa n LYS 148 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1woa h ALA 149 N 1.88 0.52 0.00 7.82 0.00 -0.99 -3.42 119.26 125.07 1woa h ALA 149 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1woa h ALA 149 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1woa h ALA 149 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 179.25 181.22 1woa n PHE 150 N -2.19 0.00 -0.28 0.00 1.16 -0.55 -4.61 117.46 111.00 1woa n PHE 150 Ca 0.02 0.00 0.28 0.00 -1.87 0.00 0.00 57.45 55.88 1woa n PHE 150 Cb 0.46 0.00 0.64 0.00 -1.61 0.00 0.00 39.48 38.97 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 0.51 0.00 1.97 3.04 -1.50 0.34 116.25 120.62 1woa h VAL 151 Ca 0.00 -0.06 -0.03 0.00 -1.01 0.00 0.00 66.70 65.60 1woa h VAL 151 Cb 0.00 0.33 -0.00 0.00 -2.01 0.00 0.00 31.29 29.60 1woa h VAL 151 CO 0.00 0.03 -0.14 -2.24 -1.01 0.00 0.00 177.57 174.21 1woa h ASP 152 N 0.17 0.00 0.71 3.17 2.03 -1.88 -2.42 116.42 118.20 1woa h ASP 152 Ca 0.53 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.83 1woa h ASP 152 Cb 1.76 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.26 1woa h ASP 152 CO -0.12 0.14 0.00 0.18 -1.03 0.00 0.00 179.24 178.41 1woa n LEU 153 N -3.44 0.00 -4.65 0.15 4.77 0.11 -4.76 117.00 109.19 1woa n LEU 153 Ca -0.01 0.43 -0.43 0.00 -0.03 0.00 0.00 56.01 55.98 1woa n LEU 153 Cb 0.31 -0.43 -0.02 0.00 -2.33 0.00 0.00 43.42 40.95 1woa n LEU 153 CO 0.30 -0.08 1.08 -0.63 -1.33 0.00 0.00 177.39 176.73 1woa s ILE 154 N -2.86 4.28 -0.23 -0.08 1.01 -0.91 -4.88 121.20 117.53 1woa s ILE 154 Ca 0.15 1.51 -0.10 0.00 0.00 0.00 0.00 60.65 62.21 1woa s ILE 154 Cb 0.16 -4.13 -0.10 0.00 0.01 0.00 0.00 42.46 38.39 1woa s ILE 154 CO 0.42 -0.31 -0.29 -0.90 0.00 0.00 0.00 174.94 173.86 1woa n ASP 155 N 7.03 1.68 -4.26 3.58 5.75 -1.26 -4.89 116.55 124.18 1woa n ASP 155 Ca 0.14 0.25 -0.37 0.00 -0.01 0.00 0.00 54.79 54.79 1woa n ASP 155 Cb 0.46 -0.65 -0.12 0.00 -1.03 0.00 0.00 41.12 39.78 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 -6.99 5.28 0.00 -1.12 3.84 -1.26 -4.98 114.94 109.71 1woa s ASN 156 Ca -0.32 -1.15 0.00 0.00 0.21 0.00 0.00 52.86 51.60 1woa s ASN 156 Cb 0.12 -1.85 0.00 0.00 -0.55 0.00 0.00 41.25 38.96 1woa s ASN 156 CO 0.41 -0.32 0.59 0.49 -2.79 0.00 0.00 177.10 175.49 1woa n PHE 157 N 4.79 0.00 0.04 0.43 3.01 -1.26 -2.11 117.46 122.36 1woa n PHE 157 Ca -0.12 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.41 1woa n PHE 157 Cb 0.44 -0.04 -0.11 0.00 -0.01 0.00 0.00 39.48 39.76 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 -0.18 1.50 -1.19 4.37 8.00 -1.26 -3.87 116.55 123.91 1woa n ASP 158 Ca 0.00 -0.06 0.12 0.00 0.71 0.00 0.00 54.79 55.56 1woa n ASP 158 Cb 0.11 1.64 0.24 0.00 -0.02 0.00 0.00 41.12 43.09 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 -1.98 3.54 -3.88 -2.24 5.03 -0.90 -4.84 115.26 109.99 1woa n ASN 159 Ca -0.02 -1.99 -0.25 0.00 0.87 0.00 0.00 54.58 53.19 1woa n ASN 159 Cb 0.38 -0.30 -0.17 0.00 -1.02 0.00 0.00 39.78 38.67 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 -1.40 0.79 -0.20 2.41 1.01 -1.25 -1.16 120.40 120.60 1woa s VAL 160 Ca 0.41 -0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.19 1woa s VAL 160 Cb 0.23 -0.84 -0.01 0.00 0.00 0.00 0.00 36.38 35.77 1woa s VAL 160 CO 0.32 0.32 -0.08 -0.63 0.00 0.00 0.00 175.10 175.03 1woa s ILE 161 N 1.56 3.19 0.11 2.22 1.09 0.18 -4.45 121.20 125.10 1woa s ILE 161 Ca 0.01 -0.57 -0.17 0.00 -1.10 0.00 0.00 60.65 58.81 1woa s ILE 161 Cb -0.13 -2.42 -0.07 0.00 -1.06 0.00 0.00 42.46 38.78 1woa s ILE 161 CO -0.05 0.46 0.57 -0.76 -0.10 0.00 0.00 174.94 175.06 1woa s LEU 162 N 1.20 4.44 -0.08 2.97 1.43 -0.66 -0.47 118.68 127.51 1woa s LEU 162 Ca 0.02 1.21 0.01 0.00 -1.03 0.00 0.00 54.13 54.34 1woa s LEU 162 Cb -0.14 -3.09 0.02 0.00 0.03 0.00 0.00 46.19 43.00 1woa s LEU 162 CO -0.02 0.19 -0.09 -0.69 0.23 0.00 0.00 176.35 175.97 1woa s VAL 163 N -1.28 0.95 -0.30 -1.59 1.01 0.52 0.42 120.40 120.13 1woa s VAL 163 Ca 0.33 -0.32 -0.16 0.00 0.00 0.00 0.00 61.98 61.84 1woa s VAL 163 Cb -0.18 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 1woa s VAL 163 CO 0.19 0.33 0.40 -0.47 0.00 0.00 0.00 175.10 175.55 1woa s TYR 164 N 1.12 3.23 -0.81 5.22 5.04 -0.29 -2.04 117.35 128.83 1woa s TYR 164 Ca -0.07 0.28 -0.05 0.00 -2.44 0.00 0.00 57.07 54.80 1woa s TYR 164 Cb -0.14 -2.65 0.20 0.00 0.35 0.00 0.00 41.96 39.72 1woa s TYR 164 CO -0.01 -0.33 0.68 -1.21 -1.34 0.00 0.00 175.55 173.34 1woa s GLU 165 N 2.12 3.15 -0.74 4.97 2.02 0.70 0.56 118.70 131.48 1woa s GLU 165 Ca 0.15 -2.88 -0.26 0.00 0.02 0.00 0.00 54.97 52.01 1woa s GLU 165 Cb -0.16 -4.00 -0.11 0.00 0.10 0.00 0.00 34.13 29.96 1woa s GLU 165 CO 0.11 -1.23 2.32 -1.25 0.02 0.00 0.00 175.26 175.22 1woa s PRO 166 N -0.64 1.88 0.23 0.39 0.04 -1.26 -4.21 135.00 131.42 1woa s PRO 166 Ca 0.22 0.56 -0.06 0.00 0.04 0.00 0.00 61.00 61.77 1woa s PRO 166 Cb -0.13 -4.77 0.37 0.00 0.04 0.00 0.00 34.50 30.02 1woa s PRO 166 CO -0.08 -3.99 1.78 -0.07 0.04 0.00 0.00 177.00 174.68 1woa h LEU 167 N 21.04 0.51 -0.63 -3.56 3.38 -1.78 -2.63 115.31 131.64 1woa h LEU 167 Ca -0.04 0.06 0.12 0.00 0.09 0.00 0.00 57.88 58.11 1woa h LEU 167 Cb 1.06 -0.03 -0.12 0.00 0.09 0.00 0.00 40.66 41.66 1woa h LEU 167 CO 1.08 0.28 -0.27 2.19 0.09 0.00 0.00 178.44 181.81 1woa h PHE 168 N 0.64 -0.69 0.00 1.13 -5.15 -1.74 0.73 116.94 111.87 1woa h PHE 168 Ca 0.37 0.07 -0.05 0.00 -0.20 0.00 0.00 57.97 58.16 1woa h PHE 168 Cb 0.40 0.40 -0.01 0.00 0.22 0.00 0.00 35.95 36.96 1woa h PHE 168 CO -0.10 -0.35 -0.23 0.00 -2.00 0.00 0.00 178.31 175.64 1woa h ALA 169 N 1.29 1.21 -1.70 12.09 0.00 -1.76 -3.38 119.26 127.02 1woa h ALA 169 Ca 0.28 -0.21 -0.60 0.00 0.00 0.00 0.00 54.91 54.38 1woa h ALA 169 Cb 0.53 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.18 1woa h ALA 169 CO -0.69 0.28 0.69 0.42 0.00 0.00 0.00 179.25 179.94 1woa s ILE 170 N -4.01 4.24 -0.12 0.00 1.01 0.25 -4.27 121.20 118.31 1woa s ILE 170 Ca -0.02 0.31 -0.00 0.00 0.00 0.00 0.00 60.65 60.94 1woa s ILE 170 Cb 0.12 -4.63 -0.00 0.00 0.01 0.00 0.00 42.46 37.96 1woa s ILE 170 CO 0.64 -1.28 0.10 0.61 0.00 0.00 0.00 174.94 175.00 1woa n GLY 171 N 5.17 0.39 0.00 6.18 0.00 -1.26 -4.93 105.19 110.73 1woa n GLY 171 Ca 0.02 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.34 0.00 -0.38 2.61 -2.24 -1.26 -5.00 114.28 106.67 1woa n THR 172 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1woa n THR 172 Cb 0.52 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 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 0.78 3.92 3.38 0.00 -1.26 -5.08 105.19 106.94 1woa n GLY 173 Ca 0.00 -0.24 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.70 3.05 -0.04 1.61 -0.14 -1.26 -5.13 119.74 117.13 1woa s LYS 174 Ca 0.00 -1.04 0.00 0.00 -1.36 0.00 0.00 55.97 53.57 1woa s LYS 174 Cb 0.00 -2.71 0.03 0.00 -1.68 0.00 0.00 37.83 33.47 1woa s LYS 174 CO 0.00 0.20 -0.00 0.99 -0.76 0.00 0.00 175.35 175.78 1woa s THR 175 N -2.16 0.24 -0.40 2.17 2.01 -1.26 -4.73 115.64 111.51 1woa s THR 175 Ca 0.40 0.09 -0.22 0.00 0.31 0.00 0.00 61.69 62.27 1woa s THR 175 Cb -0.08 -0.35 0.01 0.00 0.01 0.00 0.00 72.50 72.09 1woa s THR 175 CO 0.29 0.18 0.70 0.00 -0.69 0.00 0.00 174.62 175.10 1woa s ALA 176 N 1.25 3.39 0.49 7.40 0.00 -1.26 -5.02 121.76 128.02 1woa s ALA 176 Ca -0.06 -0.92 -0.18 0.00 0.00 0.00 0.00 51.96 50.80 1woa s ALA 176 Cb -0.13 -3.31 -0.09 0.00 0.00 0.00 0.00 23.12 19.59 1woa s ALA 176 CO -0.02 -1.60 0.98 0.95 0.00 0.00 0.00 175.76 176.07 1woa s THR 177 N 2.95 4.45 0.51 0.00 -4.23 -1.26 -4.86 115.64 113.19 1woa s THR 177 Ca 0.27 1.29 0.31 0.00 -1.18 0.00 0.00 61.69 62.38 1woa s THR 177 Cb -0.14 -3.67 0.50 0.00 1.34 0.00 0.00 72.50 70.54 1woa s THR 177 CO 0.18 -0.56 1.81 -0.65 -0.54 0.00 0.00 174.62 174.86 1woa h PRO 178 N 1.22 0.10 -0.03 3.99 0.11 -1.96 -0.51 132.00 134.92 1woa h PRO 178 Ca -0.48 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1woa h PRO 178 Cb 1.19 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1woa h PRO 178 CO 0.61 0.06 -0.04 1.05 -0.21 0.00 0.00 178.00 179.47 1woa h GLU 179 N 0.10 0.08 -0.08 1.05 9.09 -1.92 -1.51 114.58 121.38 1woa h GLU 179 Ca 0.55 -0.05 0.03 0.00 0.05 0.00 0.00 59.36 59.95 1woa h GLU 179 Cb 1.99 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 29.06 1woa h GLU 179 CO -0.08 0.60 -0.10 1.96 0.05 0.00 0.00 179.01 181.43 1woa h GLN 180 N -0.44 -0.13 -0.29 1.06 4.20 -1.49 -1.56 115.11 116.45 1woa h GLN 180 Ca 0.00 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.73 1woa h GLN 180 Cb 0.59 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.39 1woa h GLN 180 CO 0.01 -0.09 0.19 0.00 -0.67 0.00 0.00 178.83 178.27 1woa h ALA 181 N 0.92 0.37 -0.42 3.87 0.00 -1.42 -2.38 119.26 120.19 1woa h ALA 181 Ca 0.07 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.06 1woa h ALA 181 Cb 0.23 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1woa h ALA 181 CO -0.17 -0.17 0.29 0.37 0.00 0.00 0.00 179.25 179.57 1woa h GLN 182 N 0.38 0.14 0.31 0.00 5.75 -0.93 0.02 115.11 120.78 1woa h GLN 182 Ca 0.11 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.58 1woa h GLN 182 Cb -0.03 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.49 1woa h GLN 182 CO -0.03 0.09 -0.15 -0.07 -2.65 0.00 0.00 178.83 176.02 1woa h LEU 183 N 0.15 -0.35 -0.31 -2.39 3.38 -0.77 -2.48 115.31 112.54 1woa h LEU 183 Ca 0.20 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1woa h LEU 183 Cb 0.59 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1woa h LEU 183 CO -0.03 -0.00 0.15 0.58 0.09 0.00 0.00 178.44 179.23 1woa h VAL 184 N -0.73 0.98 -0.70 1.22 2.07 -1.20 -1.20 116.25 116.70 1woa h VAL 184 Ca -0.04 -0.11 0.18 0.00 0.82 0.00 0.00 66.70 67.55 1woa h VAL 184 Cb 0.49 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 1woa h VAL 184 CO 0.07 0.06 0.49 0.45 0.02 0.00 0.00 177.57 178.66 1woa h HIS 185 N 0.31 0.20 -0.12 1.57 3.86 -1.04 0.13 115.15 120.06 1woa h HIS 185 Ca 0.13 0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.24 1woa h HIS 185 Cb 0.05 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.46 1woa h HIS 185 CO -0.10 0.07 -0.32 -0.22 0.86 0.00 0.00 177.93 178.21 1woa h LYS 186 N 0.16 0.44 -0.51 2.45 3.64 -0.75 -2.32 116.57 119.67 1woa h LYS 186 Ca 0.34 -0.31 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 1woa h LYS 186 Cb 1.12 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 1woa h LYS 186 CO -0.06 0.92 0.08 0.93 -2.27 0.00 0.00 179.45 179.05 1woa h GLU 187 N 0.03 0.81 0.05 1.90 4.39 -0.28 -1.44 114.58 120.04 1woa h GLU 187 Ca -0.01 -0.19 -0.00 0.00 0.34 0.00 0.00 59.36 59.51 1woa h GLU 187 Cb 0.94 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 1woa h GLU 187 CO 0.07 0.77 -0.02 0.82 -1.16 0.00 0.00 179.01 179.48 1woa h ILE 188 N 0.77 1.12 -0.16 3.13 2.04 -0.85 -1.29 117.51 122.26 1woa h ILE 188 Ca 0.16 -0.56 0.02 0.00 1.00 0.00 0.00 64.86 65.48 1woa h ILE 188 Cb 0.36 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.91 1woa h ILE 188 CO 0.01 0.14 0.11 -0.09 0.00 0.00 0.00 178.15 178.32 1woa h ARG 189 N -0.32 0.15 -0.14 2.37 2.43 -1.23 -1.00 114.38 116.65 1woa h ARG 189 Ca -0.01 -0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 58.98 1woa h ARG 189 Cb 0.28 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1woa h ARG 189 CO 0.01 0.10 -0.63 -0.22 -1.51 0.00 0.00 179.97 177.72 1woa h LYS 190 N 0.16 0.49 -0.47 0.20 3.64 -0.97 -0.96 116.57 118.65 1woa h LYS 190 Ca 0.07 -0.35 -0.05 0.00 -1.27 0.00 0.00 60.65 59.05 1woa h LYS 190 Cb 0.08 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 1woa h LYS 190 CO -0.01 0.96 0.11 0.82 -2.27 0.00 0.00 179.45 179.06 1woa h ILE 191 N 0.36 1.21 -0.18 2.00 2.04 -0.01 -0.55 117.51 122.38 1woa h ILE 191 Ca -0.01 -0.76 -0.08 0.00 1.00 0.00 0.00 64.86 65.01 1woa h ILE 191 Cb 1.18 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1woa h ILE 191 CO 0.11 0.28 -0.20 0.58 0.00 0.00 0.00 178.15 178.92 1woa h VAL 192 N 0.70 1.34 -0.19 1.67 2.07 -1.16 -2.57 116.25 118.11 1woa h VAL 192 Ca 0.16 -1.38 0.04 0.00 0.82 0.00 0.00 66.70 66.34 1woa h VAL 192 Cb 0.27 1.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.83 1woa h VAL 192 CO -0.00 0.41 -0.08 0.50 0.02 0.00 0.00 177.57 178.42 1woa h LYS 193 N 0.11 -0.06 0.00 1.57 3.64 -0.68 0.74 116.57 121.88 1woa h LYS 193 Ca 0.03 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1woa h LYS 193 Cb 0.75 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 1woa h LYS 193 CO 0.05 -0.04 -0.19 -0.44 -2.27 0.00 0.00 179.45 176.56 1woa h ASP 194 N -0.06 0.00 -0.00 4.20 3.32 -1.15 0.72 116.42 123.45 1woa h ASP 194 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1woa h ASP 194 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1woa h ASP 194 CO -0.23 0.19 -0.44 0.35 -1.72 0.00 0.00 179.24 177.39 1woa n THR 195 N -3.49 0.00 -0.20 0.35 -2.24 -0.92 -4.69 114.28 103.08 1woa n THR 195 Ca -0.01 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1woa n THR 195 Cb 0.36 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.63 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 0.15 2.10 0.17 0.00 0.00 0.24 -4.64 105.19 103.22 1woa n GLY 197 Ca 0.00 -1.92 -0.13 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 -0.33 -1.11 1.61 5.08 -1.90 -1.97 114.58 115.97 1woa h GLU 198 Ca 0.00 0.02 0.31 0.00 -1.00 0.00 0.00 59.36 58.69 1woa h GLU 198 Cb 0.00 0.07 -0.10 0.00 0.50 0.00 0.00 28.75 29.22 1woa h GLU 198 CO 0.00 0.02 0.71 0.87 -1.00 0.00 0.00 179.01 179.61 1woa h LYS 199 N -0.76 0.30 0.18 2.33 1.79 -1.96 0.90 116.57 119.34 1woa h LYS 199 Ca -0.03 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 1woa h LYS 199 Cb 0.50 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 1woa h LYS 199 CO 0.06 0.20 -0.08 1.96 -1.08 0.00 0.00 179.45 180.50 1woa h GLN 200 N 0.31 -0.23 -0.98 3.15 7.50 -1.81 -2.88 115.11 120.17 1woa h GLN 200 Ca 0.65 0.02 0.19 0.00 0.50 0.00 0.00 58.65 60.00 1woa h GLN 200 Cb 1.77 0.05 -0.10 0.00 0.05 0.00 0.00 27.48 29.26 1woa h GLN 200 CO -0.32 0.16 0.61 0.00 -1.50 0.00 0.00 178.83 177.78 1woa h ALA 201 N -0.46 1.80 0.00 3.87 0.00 -0.39 0.18 119.26 124.26 1woa h ALA 201 Ca -0.02 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1woa h ALA 201 Cb 0.49 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1woa h ALA 201 CO 0.04 -0.14 0.00 -0.91 0.00 0.00 0.00 179.25 178.24 1woa h ASN 202 N 0.70 0.00 0.18 0.00 2.35 -0.96 -3.32 115.58 114.52 1woa h ASN 202 Ca 0.55 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.95 1woa h ASN 202 Cb 0.94 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.25 1woa h ASN 202 CO -0.32 0.00 -2.14 1.67 -1.65 0.00 0.00 177.43 174.99 1woa n GLN 203 N -2.31 0.67 -2.36 0.81 7.27 0.52 -4.70 117.38 117.28 1woa n GLN 203 Ca 0.05 0.14 -0.38 0.00 0.07 0.00 0.00 57.00 56.88 1woa n GLN 203 Cb 0.40 -1.63 -0.03 0.00 2.41 0.00 0.00 30.24 31.39 1woa n GLN 203 CO 0.00 0.00 0.00 -1.50 0.07 0.00 0.00 177.06 175.63 1woa s ILE 204 N -2.54 3.29 -0.03 1.69 2.07 -0.46 -4.83 121.20 120.40 1woa s ILE 204 Ca -0.13 1.10 -0.15 0.00 -1.41 0.00 0.00 60.65 60.06 1woa s ILE 204 Cb 0.07 -3.62 -0.05 0.00 0.13 0.00 0.00 42.46 38.98 1woa s ILE 204 CO 0.79 0.11 0.41 -0.13 -1.91 0.00 0.00 174.94 174.21 1woa s ARG 205 N -2.20 4.01 -0.26 3.50 3.00 -1.26 -5.00 118.95 120.73 1woa s ARG 205 Ca 0.55 0.39 0.01 0.00 0.00 0.00 0.00 55.73 56.68 1woa s ARG 205 Cb -0.29 -3.27 0.07 0.00 0.00 0.00 0.00 34.95 31.46 1woa s ARG 205 CO 0.37 0.57 -0.03 0.42 0.00 0.00 0.00 175.30 176.64 1woa s ILE 206 N -0.69 1.58 0.44 1.52 1.01 -1.26 -1.66 121.20 122.15 1woa s ILE 206 Ca 0.23 -1.41 -0.06 0.00 0.00 0.00 0.00 60.65 59.42 1woa s ILE 206 Cb -0.16 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1woa s ILE 206 CO 0.12 -0.23 0.74 -0.76 0.00 0.00 0.00 174.94 174.82 1woa s LEU 207 N 1.34 3.73 -0.15 2.97 1.43 0.17 -2.08 118.68 126.08 1woa s LEU 207 Ca -0.02 0.90 -0.12 0.00 -1.03 0.00 0.00 54.13 53.86 1woa s LEU 207 Cb -0.19 -3.82 -0.05 0.00 0.03 0.00 0.00 46.19 42.16 1woa s LEU 207 CO -0.08 -0.49 0.23 -0.47 0.23 0.00 0.00 176.35 175.76 1woa s TYR 208 N -2.59 3.49 -0.86 0.29 5.04 -0.79 -1.13 117.35 120.80 1woa s TYR 208 Ca 0.47 0.54 0.11 0.00 -2.44 0.00 0.00 57.07 55.75 1woa s TYR 208 Cb -0.10 -2.21 -0.05 0.00 0.35 0.00 0.00 41.96 39.95 1woa s TYR 208 CO 0.41 0.37 0.61 0.41 -1.34 0.00 0.00 175.55 176.01 1woa n GLY 209 N 3.05 -0.09 0.35 8.97 0.00 0.19 -2.38 105.19 115.28 1woa n GLY 209 Ca -0.15 -0.32 -0.03 0.00 0.00 0.00 0.00 46.02 45.52 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 1.07 -3.33 3.68 -0.02 0.00 -1.25 -4.85 105.19 100.49 1woa n GLY 210 Ca 0.04 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.33 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 -2.02 6.55 -0.04 1.61 0.01 -1.26 -4.88 113.70 113.67 1woa s SER 211 Ca 0.07 2.53 0.06 0.00 1.31 0.00 0.00 55.95 59.92 1woa s SER 211 Cb -0.01 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.65 1woa s SER 211 CO 0.06 -0.95 -0.23 -0.69 0.41 0.00 0.00 173.24 171.84 1woa s VAL 212 N 3.22 1.85 0.30 3.43 1.01 -1.26 -5.01 120.40 123.94 1woa s VAL 212 Ca 0.78 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 61.77 1woa s VAL 212 Cb -0.40 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 1woa s VAL 212 CO 0.34 0.52 0.36 0.54 0.00 0.00 0.00 175.10 176.86 1woa s ASN 213 N -0.27 0.80 0.52 3.32 2.20 -1.26 -4.54 114.94 115.72 1woa s ASN 213 Ca 0.01 -1.45 0.35 0.00 -0.94 0.00 0.00 52.86 50.83 1woa s ASN 213 Cb -0.12 0.57 1.90 0.00 -2.00 0.00 0.00 41.25 41.61 1woa s ASN 213 CO 0.02 -1.13 2.07 0.71 -2.94 0.00 0.00 177.10 175.83 1woa h THR 214 N 2.24 0.00 0.01 0.54 1.35 -1.96 -2.27 112.91 112.83 1woa h THR 214 Ca -0.29 -0.00 -0.33 0.00 -0.55 0.00 0.00 66.41 65.24 1woa h THR 214 Cb 1.24 0.78 -0.05 0.00 -1.73 0.00 0.00 68.15 68.39 1woa h THR 214 CO 0.41 0.00 -2.03 1.21 -0.25 0.00 0.00 175.52 174.86 1woa n GLU 215 N -2.73 0.67 0.00 4.72 2.13 -1.26 -4.51 120.64 119.66 1woa n GLU 215 Ca -0.02 0.18 0.08 0.00 0.66 0.00 0.00 57.16 58.06 1woa n GLU 215 Cb 0.06 -1.67 -0.08 0.00 0.27 0.00 0.00 31.44 30.01 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 -3.01 0.90 -0.29 4.31 6.94 -1.11 -4.60 115.26 118.40 1woa n ASN 216 Ca -0.26 -0.95 0.00 0.00 -0.02 0.00 0.00 54.58 53.35 1woa n ASN 216 Cb 1.08 0.93 0.13 0.00 -2.36 0.00 0.00 39.78 39.57 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 0.90 0.16 0.46 0.00 0.02 -1.86 -0.02 113.55 113.21 1woa h SER 218 Ca 0.36 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1woa h SER 218 Cb 0.18 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1woa h SER 218 CO -0.18 0.20 0.00 0.77 -1.14 0.00 0.00 176.83 176.49 1woa h SER 219 N 0.10 0.00 0.00 3.07 4.64 -1.84 -2.29 113.55 117.23 1woa h SER 219 Ca 0.04 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.21 1woa h SER 219 Cb 0.08 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.15 1woa h SER 219 CO -0.01 0.00 -0.93 -0.07 -0.87 0.00 0.00 176.83 174.96 1woa h LEU 220 N 0.00 0.00 -2.25 5.97 3.38 -1.19 -3.37 115.31 117.86 1woa h LEU 220 Ca 0.00 -0.46 0.03 0.00 0.09 0.00 0.00 57.88 57.55 1woa h LEU 220 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1woa h LEU 220 CO 0.00 1.26 0.11 -0.29 0.09 0.00 0.00 178.44 179.61 1woa h ILE 221 N -1.00 0.61 -0.09 1.22 6.09 -0.89 -1.60 117.51 121.86 1woa h ILE 221 Ca -0.23 0.00 -0.04 0.00 -1.37 0.00 0.00 64.86 63.21 1woa h ILE 221 Cb 1.08 0.92 -0.01 0.00 0.47 0.00 0.00 36.82 39.27 1woa h ILE 221 CO -0.14 0.00 -0.14 1.56 -3.07 0.00 0.00 178.15 176.36 1woa h GLN 222 N 0.00 0.14 -6.68 2.19 1.08 -1.56 -3.45 115.11 106.82 1woa h GLN 222 Ca 0.05 -0.03 -0.58 0.00 -1.45 0.00 0.00 58.65 56.64 1woa h GLN 222 Cb 0.27 -0.02 0.14 0.00 -0.05 0.00 0.00 27.48 27.82 1woa h GLN 222 CO -0.00 0.29 0.10 1.04 -0.95 0.00 0.00 178.83 179.31 1woa n GLN 223 N -4.30 1.14 0.08 1.46 1.13 -0.60 -4.92 117.38 111.37 1woa n GLN 223 Ca -0.01 0.42 -0.12 0.00 -1.94 0.00 0.00 57.00 55.34 1woa n GLN 223 Cb 0.25 -2.04 -0.06 0.00 0.11 0.00 0.00 30.24 28.49 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 1.12 -0.16 -0.65 -1.09 4.39 -1.89 -3.11 114.58 113.18 1woa h GLU 224 Ca -0.46 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.25 1woa h GLU 224 Cb 1.35 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.04 1woa h GLU 224 CO 0.54 -0.11 0.00 -0.25 -1.16 0.00 0.00 179.01 178.03 1woa n ASP 225 N -5.19 3.80 -4.37 1.42 8.00 -1.26 -4.80 116.55 114.15 1woa n ASP 225 Ca -0.07 -2.44 -0.36 0.00 0.71 0.00 0.00 54.79 52.62 1woa n ASP 225 Cb 0.11 -0.54 -0.13 0.00 -0.02 0.00 0.00 41.12 40.55 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 -1.94 3.94 -1.15 0.53 1.01 -1.18 -4.67 121.20 117.75 1woa s ILE 226 Ca 0.37 -0.49 0.17 0.00 0.00 0.00 0.00 60.65 60.70 1woa s ILE 226 Cb 0.25 -2.92 0.57 0.00 0.01 0.00 0.00 42.46 40.37 1woa s ILE 226 CO 0.15 0.24 1.48 0.47 0.00 0.00 0.00 174.94 177.28 1woa n ASP 227 N 4.87 3.98 0.00 3.58 8.00 -0.89 -4.74 116.55 131.36 1woa n ASP 227 Ca -0.16 -2.29 0.00 0.00 0.71 0.00 0.00 54.79 53.05 1woa n ASP 227 Cb 0.50 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 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 0.88 0.66 3.52 0.44 0.00 -1.26 -1.65 105.19 107.79 1woa n GLY 228 Ca 0.21 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.70 0.34 -0.53 1.61 0.40 -0.71 -1.88 117.98 114.51 1woa s PHE 229 Ca 0.00 -0.69 -0.00 0.00 -0.60 0.00 0.00 56.93 55.64 1woa s PHE 229 Cb 0.00 0.14 0.14 0.00 0.51 0.00 0.00 43.02 43.81 1woa s PHE 229 CO 0.00 -0.92 0.31 -1.17 0.70 0.00 0.00 175.22 174.14 1woa s LEU 230 N -3.00 4.94 0.25 -0.37 2.96 -1.00 -0.41 118.68 122.05 1woa s LEU 230 Ca 0.20 -2.70 -0.30 0.00 -0.22 0.00 0.00 54.13 51.12 1woa s LEU 230 Cb 0.00 -1.77 -0.09 0.00 0.50 0.00 0.00 46.19 44.83 1woa s LEU 230 CO 0.06 -0.36 0.98 -0.69 -1.32 0.00 0.00 176.35 175.02 1woa s VAL 231 N 0.16 3.94 0.00 1.68 1.01 0.45 -4.73 120.40 122.91 1woa s VAL 231 Ca 0.15 1.94 0.00 0.00 0.00 0.00 0.00 61.98 64.07 1woa s VAL 231 Cb -0.22 -4.24 0.00 0.00 0.00 0.00 0.00 36.38 31.92 1woa s VAL 231 CO -0.03 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.14 1woa n GLY 232 N 1.45 0.29 0.39 4.51 0.00 -1.26 -0.89 105.19 109.67 1woa n GLY 232 Ca -0.02 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.17 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 0.51 -0.10 1.61 2.35 -1.92 0.31 115.58 118.34 1woa h ASN 233 Ca 0.00 0.05 0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1woa h ASN 233 Cb 0.00 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 1woa h ASN 233 CO 0.00 0.22 0.08 0.00 -1.65 0.00 0.00 177.43 176.08 1woa h ALA 234 N 1.61 2.02 0.00 -0.83 0.00 -1.89 0.05 119.26 120.22 1woa h ALA 234 Ca 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1woa h ALA 234 Cb 1.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1woa h ALA 234 CO -0.20 -0.13 0.00 -1.13 0.00 0.00 0.00 179.25 177.78 1woa n SER 235 N -4.39 0.00 -0.54 0.00 3.41 0.10 -2.26 113.62 109.94 1woa n SER 235 Ca -0.01 0.22 0.14 0.00 -0.26 0.00 0.00 58.87 58.96 1woa n SER 235 Cb 0.19 -0.37 0.46 0.00 -0.26 0.00 0.00 64.21 64.23 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 -1.37 1.69 -4.69 1.04 4.77 0.00 -4.89 117.00 113.55 1woa n LEU 236 Ca 0.07 -0.56 -0.25 0.00 -0.03 0.00 0.00 56.01 55.24 1woa n LEU 236 Cb 0.18 -0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.19 1woa n LEU 236 CO 0.16 0.28 -0.30 -0.54 -1.33 0.00 0.00 177.39 175.66 1woa s LYS 237 N -2.02 2.49 0.44 3.23 1.02 -0.96 -5.01 119.74 118.93 1woa s LYS 237 Ca 0.36 -1.15 0.23 0.00 0.02 0.00 0.00 55.97 55.43 1woa s LYS 237 Cb 0.21 -2.36 0.95 0.00 -0.52 0.00 0.00 37.83 36.11 1woa s LYS 237 CO 0.34 0.43 1.85 0.93 -0.92 0.00 0.00 175.35 177.97 1woa h GLU 238 N 2.33 0.00 0.00 1.68 5.08 -1.90 -2.34 114.58 119.43 1woa h GLU 238 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1woa h GLU 238 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1woa h GLU 238 CO 0.59 0.24 0.00 -1.13 -1.00 0.00 0.00 179.01 177.72 1woa n SER 239 N -3.48 0.00 0.25 1.42 3.41 -1.26 -2.49 113.62 111.47 1woa n SER 239 Ca -0.00 -0.26 0.09 0.00 -0.26 0.00 0.00 58.87 58.44 1woa n SER 239 Cb 0.41 -0.05 0.64 0.00 -0.26 0.00 0.00 64.21 64.96 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 -0.16 7.33 3.57 -1.58 -2.07 116.94 124.03 1woa h PHE 240 Ca 0.00 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.53 1woa h PHE 240 Cb 0.02 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 1woa h PHE 240 CO 0.00 0.12 0.11 -0.39 -2.23 0.00 0.00 178.31 175.92 1woa h VAL 241 N 0.00 0.96 -0.10 1.41 -1.51 -1.75 -0.24 116.25 115.03 1woa h VAL 241 Ca -0.00 -0.02 -0.11 0.00 -1.23 0.00 0.00 66.70 65.34 1woa h VAL 241 Cb 0.24 0.88 -0.01 0.00 -2.13 0.00 0.00 31.29 30.27 1woa h VAL 241 CO 0.02 0.01 -0.44 0.44 -1.23 0.00 0.00 177.57 176.37 1woa h ASP 242 N 0.07 0.23 0.22 4.19 3.32 -1.63 0.13 116.42 122.95 1woa h ASP 242 Ca 0.07 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 56.93 1woa h ASP 242 Cb 0.20 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1woa h ASP 242 CO -0.01 0.65 -0.36 0.40 -1.72 0.00 0.00 179.24 178.20 1woa h ILE 243 N 0.18 1.28 0.23 0.35 2.04 -1.14 -0.76 117.51 119.69 1woa h ILE 243 Ca 0.01 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.50 1woa h ILE 243 Cb 0.85 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 1woa h ILE 243 CO 0.07 0.41 -0.11 0.40 0.00 0.00 0.00 178.15 178.91 1woa h ILE 244 N 0.17 0.83 -0.97 -0.67 1.08 -0.92 -2.93 117.51 114.10 1woa h ILE 244 Ca 0.02 -0.67 0.23 0.00 -0.39 0.00 0.00 64.86 64.05 1woa h ILE 244 Cb 0.71 1.20 -0.08 0.00 -3.07 0.00 0.00 36.82 35.59 1woa h ILE 244 CO 0.05 0.14 0.64 0.11 -0.69 0.00 0.00 178.15 178.40 1woa h LYS 245 N -0.66 0.41 0.00 2.37 1.57 -0.72 0.37 116.57 119.89 1woa h LYS 245 Ca -0.03 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1woa h LYS 245 Cb 0.47 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1woa h LYS 245 CO 0.05 0.27 0.00 -1.13 -0.57 0.00 0.00 179.45 178.07 1woa n SER 246 N -4.56 0.49 -0.29 0.86 3.41 -0.32 -1.44 113.62 111.77 1woa n SER 246 Ca 0.22 0.70 0.04 0.00 -0.26 0.00 0.00 58.87 59.57 1woa n SER 246 Cb 0.77 -0.77 0.09 0.00 -0.26 0.00 0.00 64.21 64.04 1woa n SER 246 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1woa n ALA 247 N -1.73 2.19 1.38 7.33 0.00 0.13 -4.86 120.51 124.95 1woa n ALA 247 Ca -0.00 -1.42 0.14 0.00 0.00 0.00 0.00 53.44 52.15 1woa n ALA 247 Cb 0.08 -0.26 0.42 0.00 0.00 0.00 0.00 19.45 19.69 1woa n ALA 247 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17