#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dah s LEU 7 N 0.00 4.06 0.10 0.99 2.96 -1.26 0.45 118.68 125.98 3dah s LEU 7 Ca 0.00 1.36 0.08 0.00 -0.22 0.00 0.00 54.13 55.36 3dah s LEU 7 Cb 0.00 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.12 3dah s LEU 7 CO 0.00 -0.79 -0.22 -0.04 -1.32 0.00 0.00 176.35 173.99 3dah s MET 8 N 3.49 1.19 -0.08 1.98 -1.94 0.24 -4.96 119.30 119.22 3dah s MET 8 Ca 0.48 -1.16 0.01 0.00 -1.71 0.00 0.00 55.69 53.31 3dah s MET 8 Cb -0.16 -1.47 0.02 0.00 2.01 0.00 0.00 34.83 35.23 3dah s MET 8 CO 0.12 0.35 -0.08 0.08 -0.01 0.00 0.00 175.02 175.48 3dah s VAL 9 N -1.11 0.89 0.25 -6.03 1.01 -1.26 -0.45 120.40 113.70 3dah s VAL 9 Ca 0.07 -0.28 0.11 0.00 0.00 0.00 0.00 61.98 61.89 3dah s VAL 9 Cb -0.10 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 3dah s VAL 9 CO 0.04 0.32 -0.13 -0.36 0.00 0.00 0.00 175.10 174.97 3dah s PHE 10 N 1.19 2.46 0.11 5.22 0.08 -0.24 -0.56 117.98 126.24 3dah s PHE 10 Ca -0.06 -0.29 0.04 0.00 0.12 0.00 0.00 56.93 56.74 3dah s PHE 10 Cb -0.14 -1.11 -0.04 0.00 -0.57 0.00 0.00 43.02 41.16 3dah s PHE 10 CO -0.02 0.63 -0.10 -0.08 -0.10 0.00 0.00 175.22 175.56 3dah s THR 11 N -2.23 0.99 0.00 0.64 -1.32 -1.26 -0.88 115.64 111.58 3dah s THR 11 Ca 0.28 -1.79 0.00 0.00 -1.21 0.00 0.00 61.69 58.97 3dah s THR 11 Cb -0.06 -1.54 0.00 0.00 -1.51 0.00 0.00 72.50 69.39 3dah s THR 11 CO 0.16 -0.64 0.00 0.61 -2.21 0.00 0.00 174.62 172.53 3dah n GLY 12 N 0.28 1.00 0.11 6.08 0.00 -1.18 -4.95 105.19 106.53 3dah n GLY 12 Ca -0.14 -1.93 0.14 0.00 0.00 0.00 0.00 46.02 44.08 3dah n GLY 12 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3dah n ASN 13 N -1.16 0.54 -0.25 1.61 5.03 -1.26 -4.08 115.26 115.69 3dah n ASN 13 Ca 0.00 -0.48 -0.07 0.00 0.87 0.00 0.00 54.58 54.90 3dah n ASN 13 Cb 0.00 -0.03 0.05 0.00 -1.02 0.00 0.00 39.78 38.78 3dah n ASN 13 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3dah h ALA 14 N 3.47 0.91 -0.60 5.41 0.00 -1.91 -3.39 119.26 123.15 3dah h ALA 14 Ca 0.00 -0.20 -0.30 0.00 0.00 0.00 0.00 54.91 54.40 3dah h ALA 14 Cb 0.42 -0.27 -0.29 0.00 0.00 0.00 0.00 17.79 17.65 3dah h ALA 14 CO 0.00 0.56 -0.83 0.27 0.00 0.00 0.00 179.25 179.26 3dah n ASN 15 N -4.33 -0.08 0.19 0.00 2.04 -1.26 -4.65 115.26 107.16 3dah n ASN 15 Ca 0.05 -2.65 0.03 0.00 -0.44 0.00 0.00 54.58 51.58 3dah n ASN 15 Cb 0.20 0.18 0.37 0.00 -2.53 0.00 0.00 39.78 38.01 3dah n ASN 15 CO 0.00 0.00 0.00 1.55 -0.44 0.00 0.00 177.26 178.37 3dah h PRO 16 N 2.59 0.00 -0.27 -0.53 0.13 -1.77 -2.54 132.00 129.60 3dah h PRO 16 Ca -0.17 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.92 3dah h PRO 16 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 3dah h PRO 16 CO 0.25 0.37 0.02 0.00 -0.23 0.00 0.00 178.00 178.41 3dah h ALA 17 N 1.63 0.37 -0.88 -0.56 0.00 -1.94 -2.64 119.26 115.24 3dah h ALA 17 Ca -0.00 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 54.76 3dah h ALA 17 Cb 0.68 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 3dah h ALA 17 CO 0.05 0.09 0.55 1.25 0.00 0.00 0.00 179.25 181.18 3dah h LEU 18 N 0.27 0.85 -1.24 0.00 5.85 -1.84 -2.05 115.31 117.15 3dah h LEU 18 Ca 0.08 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 3dah h LEU 18 Cb 0.39 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 3dah h LEU 18 CO 0.01 0.53 0.12 0.00 -0.34 0.00 0.00 178.44 178.76 3dah h ALA 19 N 1.43 1.39 -0.31 1.25 0.00 -1.32 -1.59 119.26 120.10 3dah h ALA 19 Ca 0.39 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 3dah h ALA 19 Cb 0.21 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3dah h ALA 19 CO -0.19 0.44 -0.18 1.96 0.00 0.00 0.00 179.25 181.29 3dah h GLN 20 N 0.63 0.56 -0.32 0.00 1.08 -1.02 -2.00 115.11 114.04 3dah h GLN 20 Ca 0.15 -0.19 -0.15 0.00 -1.45 0.00 0.00 58.65 57.01 3dah h GLN 20 Cb 0.22 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 3dah h GLN 20 CO -0.01 0.71 -0.41 0.93 -0.95 0.00 0.00 178.83 179.11 3dah h GLU 21 N 0.51 0.78 -0.08 1.46 5.08 -1.10 -2.24 114.58 118.99 3dah h GLU 21 Ca 0.08 -0.41 -0.00 0.00 -1.00 0.00 0.00 59.36 58.03 3dah h GLU 21 Cb 0.60 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 3dah h GLU 21 CO 0.04 1.04 0.03 0.28 -1.00 0.00 0.00 179.01 179.40 3dah h VAL 22 N 0.64 1.13 -0.10 3.13 2.07 -1.01 -2.70 116.25 119.41 3dah h VAL 22 Ca 0.05 -0.40 -0.11 0.00 0.82 0.00 0.00 66.70 67.06 3dah h VAL 22 Cb 0.97 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 3dah h VAL 22 CO 0.09 0.11 -0.43 -0.37 0.02 0.00 0.00 177.57 176.99 3dah h VAL 23 N -0.03 1.32 0.03 2.57 -1.51 -1.42 -1.74 116.25 115.47 3dah h VAL 23 Ca 0.03 -1.57 0.03 0.00 -1.23 0.00 0.00 66.70 63.95 3dah h VAL 23 Cb 0.16 1.73 -0.05 0.00 -2.13 0.00 0.00 31.29 30.99 3dah h VAL 23 CO -0.00 0.47 -0.35 0.50 -1.23 0.00 0.00 177.57 176.96 3dah h LYS 24 N 0.19 -0.50 -0.93 5.19 3.64 -1.34 0.13 116.57 122.95 3dah h LYS 24 Ca 0.01 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3dah h LYS 24 Cb 0.85 0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.73 3dah h LYS 24 CO 0.07 -0.33 0.60 0.82 -2.27 0.00 0.00 179.45 178.34 3dah h ILE 25 N -0.52 1.16 0.00 2.00 2.04 -1.35 -2.35 117.51 118.49 3dah h ILE 25 Ca 0.05 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.51 3dah h ILE 25 Cb 0.59 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 3dah h ILE 25 CO -0.26 0.21 0.00 -0.07 0.00 0.00 0.00 178.15 178.03 3dah h LEU 26 N 1.17 0.00 0.50 1.44 3.38 -0.80 -3.47 115.31 117.53 3dah h LEU 26 Ca 0.37 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.25 3dah h LEU 26 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3dah h LEU 26 CO -0.12 0.00 -0.11 0.61 0.09 0.00 0.00 178.44 178.91 3dah n GLY 27 N 0.26 0.39 3.38 0.83 0.00 0.39 -5.06 105.19 105.39 3dah n GLY 27 Ca 0.02 -0.75 -0.20 0.00 0.00 0.00 0.00 46.02 45.08 3dah n GLY 27 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3dah s ILE 28 N -2.21 1.97 0.65 -0.61 -4.36 -0.80 -5.05 121.20 110.79 3dah s ILE 28 Ca 0.00 -2.25 -0.11 0.00 -0.26 0.00 0.00 60.65 58.03 3dah s ILE 28 Cb 0.00 -2.10 -0.02 0.00 1.25 0.00 0.00 42.46 41.58 3dah s ILE 28 CO 0.00 -0.51 1.05 -2.16 0.24 0.00 0.00 174.94 173.55 3dah s PRO 29 N -3.53 3.35 0.06 0.37 0.04 -1.26 -4.26 135.00 129.76 3dah s PRO 29 Ca 0.24 0.73 -0.30 0.00 0.04 0.00 0.00 61.00 61.71 3dah s PRO 29 Cb -0.02 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 3dah s PRO 29 CO 0.09 -0.75 1.14 -1.17 0.04 0.00 0.00 177.00 176.36 3dah s LEU 30 N -5.28 4.38 0.32 -3.56 2.96 -1.26 -4.67 118.68 111.57 3dah s LEU 30 Ca 0.56 1.94 -0.29 0.00 -0.22 0.00 0.00 54.13 56.12 3dah s LEU 30 Cb -0.12 -3.58 -0.12 0.00 0.50 0.00 0.00 46.19 42.88 3dah s LEU 30 CO 0.54 -0.41 1.48 0.61 -1.32 0.00 0.00 176.35 177.25 3dah n GLY 31 N 3.07 1.08 3.70 7.98 0.00 0.28 -4.97 105.19 116.33 3dah n GLY 31 Ca 0.08 0.39 -0.40 0.00 0.00 0.00 0.00 46.02 46.09 3dah n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dah s LYS 32 N -1.29 4.36 -0.15 1.61 -2.85 -1.26 -4.72 119.74 115.44 3dah s LYS 32 Ca 0.59 0.76 -0.16 0.00 -1.00 0.00 0.00 55.97 56.16 3dah s LYS 32 Cb -0.52 -3.48 0.04 0.00 -2.06 0.00 0.00 37.83 31.81 3dah s LYS 32 CO 0.56 -0.01 0.44 0.00 0.10 0.00 0.00 175.35 176.44 3dah s ALA 33 N 1.10 -1.10 -0.21 0.59 0.00 -1.26 -0.30 121.76 120.59 3dah s ALA 33 Ca 0.34 1.17 -0.24 0.00 0.00 0.00 0.00 51.96 53.23 3dah s ALA 33 Cb -0.17 -0.63 -0.01 0.00 0.00 0.00 0.00 23.12 22.31 3dah s ALA 33 CO 0.15 -0.22 0.79 1.41 0.00 0.00 0.00 175.76 177.88 3dah s MET 34 N 0.04 4.23 -0.27 0.00 1.75 0.58 -4.93 119.30 120.69 3dah s MET 34 Ca -0.02 0.90 0.01 0.00 -1.25 0.00 0.00 55.69 55.33 3dah s MET 34 Cb -0.03 -3.61 0.08 0.00 2.84 0.00 0.00 34.83 34.11 3dah s MET 34 CO 0.01 -0.39 -0.00 0.08 -0.65 0.00 0.00 175.02 174.07 3dah s VAL 35 N 2.40 1.55 0.00 10.11 1.01 -1.26 -0.75 120.40 133.46 3dah s VAL 35 Ca 0.35 -1.49 0.00 0.00 0.00 0.00 0.00 61.98 60.84 3dah s VAL 35 Cb -0.16 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.27 3dah s VAL 35 CO 0.10 -0.32 0.00 -0.24 0.00 0.00 0.00 175.10 174.64 3dah n SER 36 N 4.62 0.00 -3.98 3.32 2.88 0.94 -4.87 113.62 116.53 3dah n SER 36 Ca -0.07 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.38 3dah n SER 36 Cb 0.43 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.78 3dah n SER 36 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 3dah s ARG 37 N 1.56 0.31 0.88 -1.46 1.81 -1.26 -1.66 118.95 119.12 3dah s ARG 37 Ca 0.00 -0.60 -0.13 0.00 -1.72 0.00 0.00 55.73 53.27 3dah s ARG 37 Cb 0.00 0.11 0.13 0.00 -0.45 0.00 0.00 34.95 34.73 3dah s ARG 37 CO 0.00 -0.05 1.22 -0.06 -0.68 0.00 0.00 175.30 175.73 3dah s PHE 38 N -1.44 2.43 0.30 -0.53 0.08 0.33 -4.74 117.98 114.41 3dah s PHE 38 Ca -0.16 0.62 0.02 0.00 0.12 0.00 0.00 56.93 57.53 3dah s PHE 38 Cb -0.10 -3.68 0.58 0.00 -0.57 0.00 0.00 43.02 39.25 3dah s PHE 38 CO -0.01 -2.15 1.87 1.03 -0.10 0.00 0.00 175.22 175.86 3dah h SER 39 N -1.32 0.88 0.59 1.36 0.87 -2.02 -1.32 113.55 112.59 3dah h SER 39 Ca -0.46 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 3dah h SER 39 Cb 1.30 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 3dah h SER 39 CO 0.56 0.51 0.00 -0.90 -0.53 0.00 0.00 176.83 176.47 3dah n ASP 40 N -4.55 0.00 0.00 6.23 5.75 -1.26 -4.90 116.55 117.82 3dah n ASP 40 Ca 0.16 0.19 0.00 0.00 -0.01 0.00 0.00 54.79 55.13 3dah n ASP 40 Cb 0.31 -0.38 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 3dah n ASP 40 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dah n GLY 41 N 0.77 0.72 3.80 6.12 0.00 -0.50 -5.07 105.19 111.02 3dah n GLY 41 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 3dah n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dah s GLU 42 N -0.77 3.75 0.06 1.61 2.02 -1.26 -4.78 118.70 119.32 3dah s GLU 42 Ca 0.00 1.35 -0.30 0.00 0.02 0.00 0.00 54.97 56.03 3dah s GLU 42 Cb 0.00 -2.09 -0.05 0.00 0.10 0.00 0.00 34.13 32.09 3dah s GLU 42 CO 0.00 -0.47 1.13 0.42 0.02 0.00 0.00 175.26 176.36 3dah s ILE 43 N -2.03 4.25 -0.22 -1.63 1.01 -1.26 -0.51 121.20 120.82 3dah s ILE 43 Ca 0.67 1.65 -0.03 0.00 0.00 0.00 0.00 60.65 62.93 3dah s ILE 43 Cb -0.16 -4.05 -0.01 0.00 0.01 0.00 0.00 42.46 38.25 3dah s ILE 43 CO 0.22 0.14 -0.06 -1.58 0.00 0.00 0.00 174.94 173.66 3dah s GLN 44 N 0.90 3.33 -0.02 2.79 0.74 -0.66 -4.82 119.66 121.92 3dah s GLN 44 Ca 0.56 -0.65 0.04 0.00 0.05 0.00 0.00 55.36 55.36 3dah s GLN 44 Cb -0.27 -2.97 -0.01 0.00 1.10 0.00 0.00 33.01 30.87 3dah s GLN 44 CO 0.29 -0.20 -0.12 0.08 -0.55 0.00 0.00 175.29 174.79 3dah s VAL 45 N 1.46 1.00 -0.10 1.34 1.01 -1.26 -0.04 120.40 123.81 3dah s VAL 45 Ca 0.06 -0.52 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 3dah s VAL 45 Cb -0.14 -0.86 0.05 0.00 0.00 0.00 0.00 36.38 35.44 3dah s VAL 45 CO -0.04 0.29 0.22 -0.70 0.00 0.00 0.00 175.10 174.87 3dah s GLU 46 N -0.11 0.13 -0.24 2.72 2.12 0.07 -4.97 118.70 118.41 3dah s GLU 46 Ca 0.01 0.60 -0.26 0.00 0.36 0.00 0.00 54.97 55.68 3dah s GLU 46 Cb -0.07 -0.13 0.00 0.00 0.26 0.00 0.00 34.13 34.19 3dah s GLU 46 CO 0.00 -0.24 0.90 0.42 -0.54 0.00 0.00 175.26 175.80 3dah s ILE 47 N 1.93 4.77 -0.26 -3.70 -1.09 -1.26 -0.31 121.20 121.28 3dah s ILE 47 Ca -0.02 1.70 0.13 0.00 -2.23 0.00 0.00 60.65 60.22 3dah s ILE 47 Cb -0.12 -4.19 0.75 0.00 -1.58 0.00 0.00 42.46 37.33 3dah s ILE 47 CO -0.08 -0.13 1.72 0.00 -1.23 0.00 0.00 174.94 175.22 3dah n GLN 48 N 6.14 4.22 -3.80 2.79 6.02 0.58 -4.88 117.38 128.46 3dah n GLN 48 Ca 0.08 -3.11 -0.10 0.00 -0.01 0.00 0.00 57.00 53.86 3dah n GLN 48 Cb 0.47 -2.19 -0.05 0.00 1.02 0.00 0.00 30.24 29.49 3dah n GLN 48 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 3dah s GLU 49 N -2.86 1.20 0.02 -1.09 -1.05 -1.24 -4.89 118.70 108.78 3dah s GLU 49 Ca 0.53 -0.94 -0.30 0.00 -0.15 0.00 0.00 54.97 54.10 3dah s GLU 49 Cb 0.41 0.45 -0.08 0.00 -0.44 0.00 0.00 34.13 34.48 3dah s GLU 49 CO 0.14 -0.47 1.80 1.21 0.95 0.00 0.00 175.26 178.88 3dah s ASN 50 N -2.89 6.54 0.00 0.83 3.84 -1.26 -4.90 114.94 117.10 3dah s ASN 50 Ca 0.10 2.51 0.05 0.00 0.21 0.00 0.00 52.86 55.73 3dah s ASN 50 Cb 0.01 -2.54 0.13 0.00 -0.55 0.00 0.00 41.25 38.31 3dah s ASN 50 CO -0.04 -0.98 1.05 1.33 -2.79 0.00 0.00 177.10 175.66 3dah n VAL 51 N 5.32 0.82 -1.55 -5.21 0.24 -1.26 -5.02 118.33 111.67 3dah n VAL 51 Ca 0.18 -0.91 -0.49 0.00 -2.04 0.00 0.00 64.34 61.08 3dah n VAL 51 Cb 0.41 0.61 -0.06 0.00 -1.47 0.00 0.00 33.84 33.33 3dah n VAL 51 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 3dah n ARG 52 N 0.05 1.53 -0.97 7.34 0.63 -1.26 -1.15 116.66 122.84 3dah n ARG 52 Ca 0.05 0.47 0.00 0.00 -0.92 0.00 0.00 57.85 57.46 3dah n ARG 52 Cb 0.30 -2.65 0.00 0.00 0.45 0.00 0.00 32.46 30.56 3dah n ARG 52 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3dah n GLY 53 N 5.73 0.72 3.87 5.14 0.00 0.44 -4.82 105.19 116.28 3dah n GLY 53 Ca 0.34 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.05 3dah n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dah s LYS 54 N -0.15 3.66 -0.51 1.61 -0.14 -0.30 -3.86 119.74 120.04 3dah s LYS 54 Ca 0.00 0.64 -0.22 0.00 -1.36 0.00 0.00 55.97 55.03 3dah s LYS 54 Cb 0.00 -2.18 0.04 0.00 -1.68 0.00 0.00 37.83 34.01 3dah s LYS 54 CO 0.00 -0.40 0.77 0.34 -0.76 0.00 0.00 175.35 175.30 3dah s ASP 55 N -3.90 6.30 -0.15 2.83 -1.08 0.17 -0.32 116.67 120.52 3dah s ASP 55 Ca 0.54 -0.53 -0.02 0.00 -0.52 0.00 0.00 52.55 52.02 3dah s ASP 55 Cb -0.11 -2.36 -0.02 0.00 -1.46 0.00 0.00 42.92 38.97 3dah s ASP 55 CO 0.46 -1.01 -0.08 -0.69 0.52 0.00 0.00 175.17 174.37 3dah s VAL 56 N 3.25 3.41 -0.12 1.11 1.01 0.34 -0.59 120.40 128.81 3dah s VAL 56 Ca 0.24 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.68 3dah s VAL 56 Cb -0.15 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 3dah s VAL 56 CO 0.17 0.50 -0.08 -0.36 0.00 0.00 0.00 175.10 175.32 3dah s PHE 57 N 0.54 2.91 -0.28 5.22 2.99 0.40 -0.47 117.98 129.30 3dah s PHE 57 Ca -0.06 -0.30 -0.02 0.00 0.00 0.00 0.00 56.93 56.55 3dah s PHE 57 Cb -0.15 -1.83 0.04 0.00 0.00 0.00 0.00 43.02 41.07 3dah s PHE 57 CO 0.03 0.03 -0.02 0.08 -0.00 0.00 0.00 175.22 175.34 3dah s VAL 58 N -0.04 3.03 -0.48 -0.44 1.01 0.35 -1.07 120.40 122.75 3dah s VAL 58 Ca -0.01 -1.15 -0.21 0.00 0.00 0.00 0.00 61.98 60.60 3dah s VAL 58 Cb -0.14 -2.63 0.04 0.00 0.00 0.00 0.00 36.38 33.65 3dah s VAL 58 CO 0.03 0.05 0.73 -0.22 0.00 0.00 0.00 175.10 175.69 3dah s LEU 59 N 1.31 4.49 -0.28 3.92 2.96 -0.06 -0.49 118.68 130.52 3dah s LEU 59 Ca -0.02 -0.44 0.01 0.00 -0.22 0.00 0.00 54.13 53.46 3dah s LEU 59 Cb -0.18 -2.72 0.17 0.00 0.50 0.00 0.00 46.19 43.96 3dah s LEU 59 CO -0.02 -0.93 0.50 -1.58 -1.32 0.00 0.00 176.35 173.00 3dah s GLN 60 N 3.09 0.48 0.50 1.98 2.00 -0.41 -3.11 119.66 124.19 3dah s GLN 60 Ca 0.24 0.55 -0.21 0.00 -2.00 0.00 0.00 55.36 53.93 3dah s GLN 60 Cb -0.15 0.03 -0.06 0.00 0.80 0.00 0.00 33.01 33.63 3dah s GLN 60 CO 0.18 -0.86 1.17 -1.12 -0.50 0.00 0.00 175.29 174.16 3dah s SER 61 N 2.70 5.90 -0.92 6.67 0.01 -1.26 -4.32 113.70 122.48 3dah s SER 61 Ca 0.13 2.30 -0.01 0.00 1.31 0.00 0.00 55.95 59.69 3dah s SER 61 Cb -0.13 -2.60 0.33 0.00 0.21 0.00 0.00 66.02 63.84 3dah s SER 61 CO -0.24 -1.11 1.78 0.35 0.41 0.00 0.00 173.24 174.44 3dah n THR 62 N -0.86 4.98 -2.24 1.44 -2.24 -0.84 -4.80 114.28 109.73 3dah n THR 62 Ca 0.09 -5.42 -0.27 0.00 -2.27 0.00 0.00 64.05 56.19 3dah n THR 62 Cb 0.49 -1.44 0.13 0.00 -2.10 0.00 0.00 70.33 67.42 3dah n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dah n ALA 64 N -3.24 0.37 -2.33 0.00 0.00 -1.26 -2.64 120.51 111.41 3dah n ALA 64 Ca 0.14 0.43 -0.43 0.00 0.00 0.00 0.00 53.44 53.58 3dah n ALA 64 Cb 0.60 -2.18 -0.02 0.00 0.00 0.00 0.00 19.45 17.85 3dah n ALA 64 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3dah s PRO 65 N -0.34 3.89 0.09 0.00 0.04 -1.26 -5.03 135.00 132.39 3dah s PRO 65 Ca 0.71 1.38 -0.27 0.00 0.04 0.00 0.00 61.00 62.85 3dah s PRO 65 Cb -0.73 -3.92 -0.15 0.00 0.04 0.00 0.00 34.50 29.74 3dah s PRO 65 CO 0.50 -1.16 1.68 1.15 0.04 0.00 0.00 177.00 179.21 3dah h THR 66 N 6.01 0.65 -0.51 1.26 2.02 -1.78 -0.96 112.91 119.59 3dah h THR 66 Ca -0.28 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 66.81 3dah h THR 66 Cb 1.11 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 3dah h THR 66 CO 1.02 0.00 -0.02 0.78 0.37 0.00 0.00 175.52 177.67 3dah h ASN 67 N -0.42 0.91 0.23 4.18 -0.26 -1.92 -0.35 115.58 117.96 3dah h ASN 67 Ca -0.02 -0.32 0.00 0.00 -0.56 0.00 0.00 56.30 55.40 3dah h ASN 67 Cb 0.35 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.35 3dah h ASN 67 CO 0.02 1.01 -0.20 0.44 -1.06 0.00 0.00 177.43 177.64 3dah h ASP 68 N 0.79 -0.54 -0.72 5.81 3.45 -1.91 -0.72 116.42 122.58 3dah h ASP 68 Ca 0.14 0.05 0.04 0.00 0.43 0.00 0.00 57.03 57.69 3dah h ASP 68 Cb 0.56 0.18 -0.04 0.00 -0.56 0.00 0.00 39.33 39.47 3dah h ASP 68 CO 0.03 -0.31 0.47 0.78 -1.57 0.00 0.00 179.24 178.65 3dah h ASN 69 N -0.46 0.74 -0.39 6.45 2.35 -1.06 0.10 115.58 123.31 3dah h ASN 69 Ca -0.01 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.65 3dah h ASN 69 Cb 0.42 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 3dah h ASN 69 CO -0.03 0.51 -0.09 0.25 -1.65 0.00 0.00 177.43 176.41 3dah h LEU 70 N 0.86 0.76 -0.61 1.61 5.85 -0.91 -2.24 115.31 120.63 3dah h LEU 70 Ca 0.29 -0.36 -0.15 0.00 0.84 0.00 0.00 57.88 58.50 3dah h LEU 70 Cb 0.08 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 3dah h LEU 70 CO -0.08 0.94 -0.66 0.24 -0.34 0.00 0.00 178.44 178.54 3dah h MET 71 N 0.57 0.17 -0.01 1.25 2.86 -0.74 0.97 114.93 120.00 3dah h MET 71 Ca 0.10 -0.13 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 3dah h MET 71 Cb 0.61 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 3dah h MET 71 CO 0.04 0.77 -0.12 0.93 1.06 0.00 0.00 176.91 179.59 3dah h GLU 72 N 0.12 -0.19 -0.07 1.72 5.08 -0.79 -0.96 114.58 119.49 3dah h GLU 72 Ca -0.01 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 3dah h GLU 72 Cb 1.18 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 3dah h GLU 72 CO 0.10 -0.13 -0.16 1.25 -1.00 0.00 0.00 179.01 179.08 3dah h LEU 73 N -0.20 -0.47 -0.69 1.33 5.85 -1.07 -0.29 115.31 119.77 3dah h LEU 73 Ca 0.05 0.08 0.12 0.00 0.84 0.00 0.00 57.88 58.97 3dah h LEU 73 Cb 0.25 0.21 -0.09 0.00 0.37 0.00 0.00 40.66 41.41 3dah h LEU 73 CO -0.12 -0.21 0.25 0.24 -0.34 0.00 0.00 178.44 178.26 3dah h MET 74 N -0.22 0.40 0.01 1.25 2.86 -0.68 -1.47 114.93 117.08 3dah h MET 74 Ca 0.08 -0.02 -0.19 0.00 -2.06 0.00 0.00 59.70 57.50 3dah h MET 74 Cb 0.33 -0.09 0.02 0.00 0.06 0.00 0.00 31.60 31.91 3dah h MET 74 CO -0.20 0.27 -0.74 0.82 1.06 0.00 0.00 176.91 178.11 3dah h ILE 75 N 0.41 1.39 -0.70 -1.22 2.04 -0.89 -2.59 117.51 115.96 3dah h ILE 75 Ca 0.37 -2.15 0.07 0.00 1.00 0.00 0.00 64.86 64.15 3dah h ILE 75 Cb 0.52 2.57 -0.06 0.00 -0.74 0.00 0.00 36.82 39.10 3dah h ILE 75 CO -0.37 0.64 0.37 0.24 0.00 0.00 0.00 178.15 179.03 3dah h MET 76 N 0.02 0.64 -0.26 2.37 2.86 -0.94 -1.27 114.93 118.36 3dah h MET 76 Ca -0.09 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.53 3dah h MET 76 Cb 1.44 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 32.93 3dah h MET 76 CO 0.14 0.42 0.12 0.28 1.06 0.00 0.00 176.91 178.94 3dah h VAL 77 N 0.66 0.99 -0.73 -2.22 2.07 -1.23 -1.15 116.25 114.64 3dah h VAL 77 Ca 0.33 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.74 3dah h VAL 77 Cb 0.27 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 3dah h VAL 77 CO -0.22 0.05 0.41 -0.78 0.02 0.00 0.00 177.57 177.05 3dah h ASP 78 N 0.27 0.90 -0.68 0.57 3.58 -1.07 -0.00 116.42 119.98 3dah h ASP 78 Ca 0.11 -0.09 -0.03 0.00 0.42 0.00 0.00 57.03 57.44 3dah h ASP 78 Cb 0.04 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 40.83 3dah h ASP 78 CO -0.08 0.73 0.30 0.00 -2.88 0.00 0.00 179.24 177.31 3dah h ALA 79 N 1.21 0.88 -0.58 -0.78 0.00 -1.02 -0.31 119.26 118.67 3dah h ALA 79 Ca 0.26 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 3dah h ALA 79 Cb 0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3dah h ALA 79 CO -0.04 0.47 -0.00 -0.07 0.00 0.00 0.00 179.25 179.60 3dah h LEU 80 N 0.96 1.01 -0.17 0.00 3.38 -0.93 -0.64 115.31 118.92 3dah h LEU 80 Ca 0.23 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3dah h LEU 80 Cb 0.16 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3dah h LEU 80 CO -0.02 1.07 0.08 0.50 0.09 0.00 0.00 178.44 180.15 3dah h LYS 81 N 0.92 0.25 0.00 1.13 3.64 -0.80 -1.22 116.57 120.48 3dah h LYS 81 Ca 0.16 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 3dah h LYS 81 Cb 0.56 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.33 3dah h LYS 81 CO 0.03 0.30 -0.07 0.00 -2.27 0.00 0.00 179.45 177.44 3dah h ARG 82 N 0.13 0.00 -0.53 1.90 3.08 -0.99 -1.31 114.38 116.67 3dah h ARG 82 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3dah h ARG 82 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 3dah h ARG 82 CO -0.01 0.07 0.00 0.00 -1.07 0.00 0.00 179.97 178.97 3dah n ALA 83 N -2.13 2.72 -3.43 0.04 0.00 -0.25 -4.94 120.51 112.52 3dah n ALA 83 Ca 0.01 -0.65 -0.20 0.00 0.00 0.00 0.00 53.44 52.60 3dah n ALA 83 Cb 0.39 -1.01 0.07 0.00 0.00 0.00 0.00 19.45 18.90 3dah n ALA 83 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3dah n SER 84 N 0.35 -5.54 -4.75 0.00 7.64 -0.49 -3.99 113.62 106.83 3dah n SER 84 Ca 0.11 -0.47 -0.40 0.00 1.01 0.00 0.00 58.87 59.13 3dah n SER 84 Cb 0.43 -4.39 0.02 0.00 -1.01 0.00 0.00 64.21 59.26 3dah n SER 84 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dah n ALA 85 N -4.60 1.78 -0.11 -0.43 0.00 -0.49 -0.42 120.51 116.24 3dah n ALA 85 Ca -0.01 0.22 -0.04 0.00 0.00 0.00 0.00 53.44 53.61 3dah n ALA 85 Cb 0.56 -2.36 0.16 0.00 0.00 0.00 0.00 19.45 17.81 3dah n ALA 85 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3dah h GLY 86 N 2.03 0.87 -5.03 0.00 0.00 -0.78 -3.42 103.07 96.74 3dah h GLY 86 Ca -0.50 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.24 3dah h GLY 86 CO 0.60 0.52 0.14 -1.60 0.00 0.00 0.00 176.54 176.20 3dah s ARG 87 N -5.02 0.80 -0.14 4.80 3.52 -0.81 -4.94 118.95 117.16 3dah s ARG 87 Ca -0.10 1.00 0.01 0.00 -0.13 0.00 0.00 55.73 56.52 3dah s ARG 87 Cb 0.15 0.37 0.02 0.00 -1.56 0.00 0.00 34.95 33.92 3dah s ARG 87 CO 0.81 -0.10 -0.17 0.42 -0.81 0.00 0.00 175.30 175.44 3dah s ILE 88 N 0.51 1.75 -0.09 4.11 1.01 -1.26 -0.50 121.20 126.72 3dah s ILE 88 Ca -0.01 -0.77 0.03 0.00 0.00 0.00 0.00 60.65 59.90 3dah s ILE 88 Cb -0.05 -1.59 -0.01 0.00 0.01 0.00 0.00 42.46 40.82 3dah s ILE 88 CO -0.02 0.49 -0.18 -0.89 0.00 0.00 0.00 174.94 174.34 3dah s THR 89 N 1.14 2.63 -0.40 2.92 2.01 0.38 -0.58 115.64 123.74 3dah s THR 89 Ca -0.02 -0.84 -0.13 0.00 0.31 0.00 0.00 61.69 61.01 3dah s THR 89 Cb -0.14 -2.04 0.03 0.00 0.01 0.00 0.00 72.50 70.36 3dah s THR 89 CO -0.06 0.56 0.27 0.00 -0.69 0.00 0.00 174.62 174.69 3dah s ALA 90 N 0.01 3.40 -0.51 7.40 0.00 -0.68 -0.50 121.76 130.88 3dah s ALA 90 Ca -0.06 -1.75 -0.20 0.00 0.00 0.00 0.00 51.96 49.95 3dah s ALA 90 Cb -0.15 -2.78 0.05 0.00 0.00 0.00 0.00 23.12 20.24 3dah s ALA 90 CO 0.05 -1.46 0.68 0.00 0.00 0.00 0.00 175.76 175.03 3dah s ALA 91 N 1.62 3.34 -0.71 0.00 0.00 0.35 -1.41 121.76 124.95 3dah s ALA 91 Ca 0.04 -1.64 0.05 0.00 0.00 0.00 0.00 51.96 50.40 3dah s ALA 91 Cb -0.19 -3.42 0.19 0.00 0.00 0.00 0.00 23.12 19.69 3dah s ALA 91 CO 0.08 -2.07 0.57 -0.89 0.00 0.00 0.00 175.76 173.45 3dah n ILE 92 N 5.72 1.91 -0.10 0.00 5.41 0.12 -1.29 119.36 131.13 3dah n ILE 92 Ca -0.05 -4.96 -0.06 0.00 1.00 0.00 0.00 62.75 58.68 3dah n ILE 92 Cb 0.46 -2.19 0.00 0.00 -0.71 0.00 0.00 39.64 37.20 3dah n ILE 92 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 3dah h PRO 93 N 5.21 -0.14 -5.00 0.38 0.11 -1.82 -3.35 132.00 127.39 3dah h PRO 93 Ca 0.16 0.01 -0.63 0.00 0.11 0.00 0.00 66.00 65.65 3dah h PRO 93 Cb 0.74 0.03 -0.17 0.00 0.11 0.00 0.00 31.00 31.71 3dah h PRO 93 CO 0.75 -0.09 -0.53 -0.47 -0.21 0.00 0.00 178.00 177.45 3dah s TYR 94 N -6.13 3.24 -0.54 0.65 5.04 -1.26 -1.27 117.35 117.08 3dah s TYR 94 Ca -0.14 0.09 -0.19 0.00 -2.44 0.00 0.00 57.07 54.39 3dah s TYR 94 Cb 0.14 -2.30 0.08 0.00 0.35 0.00 0.00 41.96 40.22 3dah s TYR 94 CO 0.70 -0.08 0.67 0.12 -1.34 0.00 0.00 175.55 175.62 3dah s PHE 95 N 1.38 3.01 0.41 4.97 5.36 -1.26 -1.99 117.98 129.87 3dah s PHE 95 Ca 0.07 -0.69 -0.27 0.00 -0.96 0.00 0.00 56.93 55.08 3dah s PHE 95 Cb -0.15 -3.75 -0.10 0.00 -0.34 0.00 0.00 43.02 38.69 3dah s PHE 95 CO 0.07 -1.16 1.46 0.41 -1.46 0.00 0.00 175.22 174.55 3dah n GLY 96 N 5.22 1.11 2.83 13.12 0.00 -1.20 -2.68 105.19 123.59 3dah n GLY 96 Ca -0.07 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3dah n GLY 96 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3dah n TYR 97 N 0.15 0.00 -0.01 1.61 4.01 -1.26 -4.89 117.16 116.77 3dah n TYR 97 Ca 0.03 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.88 3dah n TYR 97 Cb 0.40 -0.08 0.53 0.00 -0.31 0.00 0.00 39.34 39.88 3dah n TYR 97 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dah h ALA 98 N 0.00 2.01 0.00 -0.72 0.00 -1.89 -1.09 119.26 117.57 3dah h ALA 98 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dah h ALA 98 Cb 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3dah h ALA 98 CO 0.00 -0.11 0.00 0.54 0.00 0.00 0.00 179.25 179.68 3dah n ARG 99 N -4.47 0.02 -3.29 0.00 1.74 -1.26 -3.69 116.66 105.71 3dah n ARG 99 Ca 0.07 0.22 -0.39 0.00 -0.77 0.00 0.00 57.85 56.98 3dah n ARG 99 Cb 0.30 -1.54 -0.03 0.00 -1.02 0.00 0.00 32.46 30.17 3dah n ARG 99 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 3dah n GLN 100 N -1.58 3.53 -0.06 5.56 -0.06 -0.41 -4.77 117.38 119.58 3dah n GLN 100 Ca 0.04 -4.54 0.04 0.00 -2.00 0.00 0.00 57.00 50.54 3dah n GLN 100 Cb 0.21 -2.45 0.07 0.00 -4.06 0.00 0.00 30.24 24.01 3dah n GLN 100 CO 0.00 0.00 0.00 -0.40 -0.20 0.00 0.00 177.06 176.46 3dah n ASP 101 N 1.72 2.14 -3.59 1.69 5.75 -1.24 -1.44 116.55 121.59 3dah n ASP 101 Ca 0.25 -1.65 -0.08 0.00 -0.01 0.00 0.00 54.79 53.31 3dah n ASP 101 Cb 0.36 -0.08 -0.01 0.00 -1.03 0.00 0.00 41.12 40.37 3dah n ASP 101 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3dah s ARG 102 N -0.83 1.92 -0.54 0.11 1.70 -1.26 -5.02 118.95 115.03 3dah s ARG 102 Ca 0.13 -1.13 -0.01 0.00 -0.47 0.00 0.00 55.73 54.25 3dah s ARG 102 Cb 0.08 0.61 0.14 0.00 -0.57 0.00 0.00 34.95 35.21 3dah s ARG 102 CO 0.11 -0.88 0.33 1.03 -1.08 0.00 0.00 175.30 174.80 3dah s ARG 103 N -3.45 2.27 0.17 3.89 0.52 -1.26 -4.70 118.95 116.39 3dah s ARG 103 Ca 0.13 -2.32 -0.32 0.00 -0.52 0.00 0.00 55.73 52.70 3dah s ARG 103 Cb -0.06 -3.60 -0.10 0.00 0.52 0.00 0.00 34.95 31.71 3dah s ARG 103 CO 0.08 -1.12 1.58 -2.14 0.02 0.00 0.00 175.30 173.72 3dah s PRO 104 N 0.28 4.21 -1.54 3.54 0.02 -1.26 -2.17 135.00 138.08 3dah s PRO 104 Ca 0.14 2.38 -0.14 0.00 0.02 0.00 0.00 61.00 63.40 3dah s PRO 104 Cb -0.22 -3.15 0.09 0.00 0.02 0.00 0.00 34.50 31.25 3dah s PRO 104 CO -0.03 -0.61 0.91 0.54 -0.33 0.00 0.00 177.00 177.48 3dah n ARG 105 N 3.91 -5.07 -2.77 5.54 1.74 -1.26 -0.96 116.66 117.78 3dah n ARG 105 Ca 0.14 0.57 -0.16 0.00 -0.77 0.00 0.00 57.85 57.63 3dah n ARG 105 Cb 0.38 -5.43 -0.00 0.00 -1.02 0.00 0.00 32.46 26.39 3dah n ARG 105 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3dah n SER 106 N -2.76 -3.77 -4.75 0.55 7.64 -0.92 -4.93 113.62 104.67 3dah n SER 106 Ca 0.04 -0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.53 3dah n SER 106 Cb 0.52 -3.18 0.04 0.00 -1.01 0.00 0.00 64.21 60.59 3dah n SER 106 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dah s ALA 107 N -2.71 2.86 -1.32 -0.43 0.00 -0.14 -4.86 121.76 115.16 3dah s ALA 107 Ca 0.14 1.36 -0.13 0.00 0.00 0.00 0.00 51.96 53.34 3dah s ALA 107 Cb -0.07 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 3dah s ALA 107 CO 0.18 -1.39 2.38 0.54 0.00 0.00 0.00 175.76 177.47 3dah n ARG 108 N -0.97 2.76 -4.11 0.00 1.74 -1.26 -4.72 116.66 110.10 3dah n ARG 108 Ca 0.10 -2.19 -0.25 0.00 -0.77 0.00 0.00 57.85 54.74 3dah n ARG 108 Cb 0.45 -2.96 -0.07 0.00 -1.02 0.00 0.00 32.46 28.85 3dah n ARG 108 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3dah s VAL 109 N 3.23 2.32 0.33 1.55 -7.23 -1.26 -5.15 120.40 114.20 3dah s VAL 109 Ca 0.54 -1.69 -0.05 0.00 -1.81 0.00 0.00 61.98 58.98 3dah s VAL 109 Cb 0.15 -3.00 -0.05 0.00 0.56 0.00 0.00 36.38 34.04 3dah s VAL 109 CO -0.04 -0.00 0.60 0.00 -0.31 0.00 0.00 175.10 175.35 3dah s ALA 110 N -2.59 3.58 -1.02 1.32 0.00 -1.26 -4.91 121.76 116.87 3dah s ALA 110 Ca 0.41 -0.55 -0.12 0.00 0.00 0.00 0.00 51.96 51.70 3dah s ALA 110 Cb 0.04 -2.35 0.24 0.00 0.00 0.00 0.00 23.12 21.04 3dah s ALA 110 CO 0.23 0.13 1.05 0.42 0.00 0.00 0.00 175.76 177.58 3dah s ILE 111 N -2.21 5.67 0.35 0.00 1.01 -1.26 -4.79 121.20 119.98 3dah s ILE 111 Ca 0.45 -2.89 0.07 0.00 0.00 0.00 0.00 60.65 58.27 3dah s ILE 111 Cb -0.10 -4.62 0.15 0.00 0.01 0.00 0.00 42.46 37.89 3dah s ILE 111 CO 0.32 -1.22 1.87 0.28 0.00 0.00 0.00 174.94 176.20 3dah h SER 112 N 7.24 0.35 0.04 3.58 0.02 -1.73 -1.28 113.55 121.76 3dah h SER 112 Ca 0.17 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 3dah h SER 112 Cb 0.94 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.38 3dah h SER 112 CO 0.97 0.49 -0.05 0.00 -1.14 0.00 0.00 176.83 177.10 3dah h ALA 113 N 1.55 1.89 0.11 3.77 0.00 -1.25 -1.49 119.26 123.84 3dah h ALA 113 Ca 0.07 -0.06 -0.28 0.00 0.00 0.00 0.00 54.91 54.65 3dah h ALA 113 Cb 0.40 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.19 3dah h ALA 113 CO 0.02 0.09 -1.19 -0.22 0.00 0.00 0.00 179.25 177.94 3dah h LYS 114 N 0.02 0.44 -0.45 0.00 1.63 -1.48 -1.56 116.57 115.17 3dah h LYS 114 Ca 0.01 -0.62 -0.00 0.00 -0.85 0.00 0.00 60.65 59.19 3dah h LYS 114 Cb 0.10 0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 31.92 3dah h LYS 114 CO 0.01 1.26 0.28 0.28 -3.45 0.00 0.00 179.45 177.83 3dah h VAL 115 N 0.18 1.13 -0.32 2.00 2.07 -1.00 -0.98 116.25 119.33 3dah h VAL 115 Ca -0.15 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 3dah h VAL 115 Cb 1.88 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 3dah h VAL 115 CO 0.21 0.13 0.11 0.58 0.02 0.00 0.00 177.57 178.62 3dah h VAL 116 N 0.60 1.20 -0.17 2.57 2.07 -1.30 0.16 116.25 121.38 3dah h VAL 116 Ca 0.16 -0.64 0.05 0.00 0.82 0.00 0.00 66.70 67.10 3dah h VAL 116 Cb -0.02 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.70 3dah h VAL 116 CO -0.03 0.22 -0.26 0.00 0.02 0.00 0.00 177.57 177.51 3dah h ALA 117 N 0.95 -0.23 -0.79 1.67 0.00 -1.08 -0.96 119.26 118.82 3dah h ALA 117 Ca 0.10 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.08 3dah h ALA 117 Cb 0.23 0.52 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 3dah h ALA 117 CO -0.00 -0.72 0.52 -0.91 0.00 0.00 0.00 179.25 178.14 3dah h ASN 118 N -0.31 0.87 -0.05 0.00 -0.26 -0.91 -2.03 115.58 112.90 3dah h ASN 118 Ca 0.11 -0.02 -0.00 0.00 -0.56 0.00 0.00 56.30 55.83 3dah h ASN 118 Cb 0.48 -0.21 -0.00 0.00 -1.06 0.00 0.00 38.32 37.53 3dah h ASN 118 CO -0.35 0.61 0.02 0.24 -1.06 0.00 0.00 177.43 176.90 3dah h MET 119 N 1.02 0.06 -0.69 0.81 2.86 0.03 -1.71 114.93 117.32 3dah h MET 119 Ca 0.30 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.89 3dah h MET 119 Cb -0.04 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 3dah h MET 119 CO -0.08 0.13 0.27 -0.07 1.06 0.00 0.00 176.91 178.23 3dah h LEU 120 N -0.02 0.94 -0.51 1.22 3.38 -0.96 -1.99 115.31 117.36 3dah h LEU 120 Ca 0.02 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.71 3dah h LEU 120 Cb 0.09 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 3dah h LEU 120 CO -0.00 0.84 -0.27 -0.33 0.09 0.00 0.00 178.44 178.77 3dah h GLU 121 N 1.00 0.92 0.00 1.13 5.08 -1.24 -2.15 114.58 119.32 3dah h GLU 121 Ca 0.23 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 3dah h GLU 121 Cb 0.20 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3dah h GLU 121 CO -0.02 1.07 0.00 0.97 -1.00 0.00 0.00 179.01 180.04 3dah h ILE 122 N 0.78 0.00 0.00 3.13 2.10 -1.07 -2.70 117.51 119.75 3dah h ILE 122 Ca 0.09 -0.71 -0.08 0.00 1.08 0.00 0.00 64.86 65.25 3dah h ILE 122 Cb 0.84 1.68 -0.01 0.00 -1.09 0.00 0.00 36.82 38.24 3dah h ILE 122 CO 0.07 0.00 -0.36 0.00 -1.08 0.00 0.00 178.15 176.79 3dah h ALA 123 N 2.10 0.85 0.00 0.18 0.00 -1.17 -3.47 119.26 117.75 3dah h ALA 123 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3dah h ALA 123 Cb 0.76 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3dah h ALA 123 CO 0.00 0.45 0.00 0.41 0.00 0.00 0.00 179.25 180.11 3dah n GLY 124 N 0.72 1.51 3.71 0.00 0.00 -1.02 -4.27 105.19 105.84 3dah n GLY 124 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3dah n GLY 124 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dah s VAL 125 N -2.00 2.52 -0.06 1.61 1.01 -0.83 -4.72 120.40 117.93 3dah s VAL 125 Ca 0.00 0.31 0.22 0.00 0.00 0.00 0.00 61.98 62.51 3dah s VAL 125 Cb 0.00 -3.20 -0.29 0.00 0.00 0.00 0.00 36.38 32.89 3dah s VAL 125 CO 0.00 0.02 0.53 -0.62 0.00 0.00 0.00 175.10 175.03 3dah n GLU 126 N 4.33 0.65 -3.49 2.72 1.02 0.25 -4.62 120.64 121.51 3dah n GLU 126 Ca 0.15 -0.15 -0.12 0.00 -0.02 0.00 0.00 57.16 57.03 3dah n GLU 126 Cb 0.38 -1.56 -0.03 0.00 -0.02 0.00 0.00 31.44 30.21 3dah n GLU 126 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 3dah s ARG 127 N -3.44 0.99 -0.06 3.49 1.70 -1.22 -4.21 118.95 116.20 3dah s ARG 127 Ca -0.07 -0.19 0.04 0.00 -0.47 0.00 0.00 55.73 55.04 3dah s ARG 127 Cb 0.13 0.46 -0.02 0.00 -0.57 0.00 0.00 34.95 34.95 3dah s ARG 127 CO 0.89 -0.40 -0.17 0.42 -1.08 0.00 0.00 175.30 174.96 3dah s ILE 128 N -2.68 2.77 -0.13 4.99 -1.09 0.07 -1.69 121.20 123.44 3dah s ILE 128 Ca -0.00 -0.82 0.01 0.00 -2.23 0.00 0.00 60.65 57.60 3dah s ILE 128 Cb -0.01 -2.07 -0.01 0.00 -1.58 0.00 0.00 42.46 38.79 3dah s ILE 128 CO -0.05 0.58 -0.15 -0.63 -1.23 0.00 0.00 174.94 173.45 3dah s ILE 129 N -0.47 2.81 0.20 2.92 1.01 -0.50 -0.13 121.20 127.04 3dah s ILE 129 Ca 0.06 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 59.97 3dah s ILE 129 Cb -0.12 -2.17 -0.05 0.00 0.01 0.00 0.00 42.46 40.14 3dah s ILE 129 CO 0.01 0.53 0.07 0.28 0.00 0.00 0.00 174.94 175.83 3dah s THR 130 N 0.48 0.39 -0.09 2.92 -1.32 0.46 0.15 115.64 118.64 3dah s THR 130 Ca -0.10 -1.98 0.03 0.00 -1.21 0.00 0.00 61.69 58.42 3dah s THR 130 Cb -0.16 -2.38 0.01 0.00 -1.51 0.00 0.00 72.50 68.45 3dah s THR 130 CO 0.05 -0.19 -0.18 -0.32 -2.21 0.00 0.00 174.62 171.77 3dah s MET 131 N -4.04 2.36 -1.44 7.08 1.75 -0.39 -0.62 119.30 124.01 3dah s MET 131 Ca 0.32 -0.64 -0.06 0.00 -1.25 0.00 0.00 55.69 54.06 3dah s MET 131 Cb 0.07 -1.86 0.01 0.00 2.84 0.00 0.00 34.83 35.88 3dah s MET 131 CO 0.09 0.08 0.25 -0.25 -0.65 0.00 0.00 175.02 174.54 3dah n ASP 132 N 3.74 -0.45 -4.60 1.11 8.00 0.41 -4.67 116.55 120.09 3dah n ASP 132 Ca -0.21 -1.20 -0.50 0.00 0.71 0.00 0.00 54.79 53.59 3dah n ASP 132 Cb 0.52 -2.08 -0.05 0.00 -0.02 0.00 0.00 41.12 39.49 3dah n ASP 132 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3dah n LEU 133 N -4.59 1.85 -0.16 0.64 7.94 -1.26 -4.86 117.00 116.55 3dah n LEU 133 Ca -0.28 1.12 0.06 0.00 -1.11 0.00 0.00 56.01 55.80 3dah n LEU 133 Cb 0.67 -1.24 0.35 0.00 0.53 0.00 0.00 43.42 43.74 3dah n LEU 133 CO 0.80 -1.01 1.21 -0.74 -1.11 0.00 0.00 177.39 176.55 3dah h HIS 134 N 4.34 0.75 -3.36 1.96 -0.00 -1.90 -3.40 115.15 113.53 3dah h HIS 134 Ca -0.46 0.02 -0.25 0.00 -0.00 0.00 0.00 60.37 59.68 3dah h HIS 134 Cb 1.33 -0.25 -0.31 0.00 -0.00 0.00 0.00 27.41 28.17 3dah h HIS 134 CO 0.58 0.41 -0.63 0.00 -0.00 0.00 0.00 177.93 178.29 3dah s ALA 135 N -5.66 -0.18 0.51 5.26 0.00 -1.26 -5.04 121.76 115.40 3dah s ALA 135 Ca -0.10 0.52 0.17 0.00 0.00 0.00 0.00 51.96 52.56 3dah s ALA 135 Cb 0.19 -0.36 1.27 0.00 0.00 0.00 0.00 23.12 24.22 3dah s ALA 135 CO 0.77 -0.13 2.11 -0.44 0.00 0.00 0.00 175.76 178.07 3dah h ASP 136 N 7.04 0.03 0.51 0.00 3.32 -2.01 -2.56 116.42 122.76 3dah h ASP 136 Ca -0.41 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.64 3dah h ASP 136 Cb 1.15 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.69 3dah h ASP 136 CO 0.44 0.02 0.00 1.56 -1.72 0.00 0.00 179.24 179.54 3dah h GLN 137 N 0.04 0.00 0.00 3.56 7.50 -1.97 -2.51 115.11 121.73 3dah h GLN 137 Ca 0.07 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.21 3dah h GLN 137 Cb 0.22 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.75 3dah h GLN 137 CO -0.00 0.00 -0.05 0.82 -1.50 0.00 0.00 178.83 178.10 3dah h ILE 138 N 0.00 0.17 -0.81 2.54 2.04 -1.86 -2.57 117.51 117.02 3dah h ILE 138 Ca 0.00 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 3dah h ILE 138 Cb 0.26 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 3dah h ILE 138 CO 0.00 0.05 0.44 1.56 0.00 0.00 0.00 178.15 180.20 3dah h GLN 139 N 0.00 1.13 0.00 2.37 4.20 -1.67 -1.65 115.11 119.49 3dah h GLN 139 Ca -0.00 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.58 3dah h GLN 139 Cb 0.37 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 27.92 3dah h GLN 139 CO 0.01 0.83 0.00 0.41 -0.67 0.00 0.00 178.83 179.40 3dah n GLY 140 N -1.17 -0.67 0.16 3.46 0.00 -0.97 -2.28 105.19 103.72 3dah n GLY 140 Ca 0.08 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.12 3dah n GLY 140 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3dah h PHE 141 N 0.00 0.00 -3.05 1.61 0.04 -1.41 -3.45 116.94 110.68 3dah h PHE 141 Ca 0.00 0.00 -0.65 0.00 2.80 0.00 0.00 57.97 60.12 3dah h PHE 141 Cb 0.04 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.11 3dah h PHE 141 CO 0.00 0.00 -0.56 -0.06 -0.60 0.00 0.00 178.31 177.09 3dah s PHE 142 N -3.15 3.33 -1.37 -0.55 0.08 -0.97 -4.65 117.98 110.70 3dah s PHE 142 Ca 0.09 0.22 0.15 0.00 0.12 0.00 0.00 56.93 57.51 3dah s PHE 142 Cb 0.09 -1.74 0.36 0.00 -0.57 0.00 0.00 43.02 41.16 3dah s PHE 142 CO 0.63 0.57 1.28 -0.25 -0.10 0.00 0.00 175.22 177.34 3dah n ASP 143 N 1.03 3.07 -4.64 1.36 8.00 -1.26 -4.96 116.55 119.15 3dah n ASP 143 Ca -0.12 -1.93 -0.23 0.00 0.71 0.00 0.00 54.79 53.22 3dah n ASP 143 Cb 0.52 -0.26 -0.07 0.00 -0.02 0.00 0.00 41.12 41.29 3dah n ASP 143 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 3dah s ILE 144 N -1.05 3.32 0.32 0.53 -4.36 -1.26 -5.10 121.20 113.60 3dah s ILE 144 Ca 0.29 -1.94 -0.29 0.00 -0.26 0.00 0.00 60.65 58.44 3dah s ILE 144 Cb 0.16 -2.81 -0.12 0.00 1.25 0.00 0.00 42.46 40.94 3dah s ILE 144 CO 0.21 -0.36 1.55 -2.65 0.24 0.00 0.00 174.94 173.93 3dah n PRO 145 N -0.89 2.65 -4.34 0.37 -0.02 -1.26 -4.87 135.00 126.65 3dah n PRO 145 Ca -0.06 0.94 -0.29 0.00 -2.02 0.00 0.00 63.50 62.06 3dah n PRO 145 Cb 0.59 -2.70 -0.17 0.00 -0.02 0.00 0.00 33.50 31.21 3dah n PRO 145 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3dah s VAL 146 N -0.35 1.58 -0.30 -1.45 1.01 -1.26 -0.75 120.40 118.88 3dah s VAL 146 Ca 0.61 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.86 3dah s VAL 146 Cb -0.50 -1.45 0.03 0.00 0.00 0.00 0.00 36.38 34.45 3dah s VAL 146 CO 0.53 0.46 0.04 -1.81 0.00 0.00 0.00 175.10 174.33 3dah s ASP 147 N 1.13 4.97 -0.32 3.32 1.01 0.81 -4.98 116.67 122.61 3dah s ASP 147 Ca -0.03 -0.93 -0.12 0.00 0.71 0.00 0.00 52.55 52.18 3dah s ASP 147 Cb -0.14 -1.81 -0.02 0.00 1.01 0.00 0.00 42.92 41.96 3dah s ASP 147 CO -0.05 -0.22 0.21 0.21 0.21 0.00 0.00 175.17 175.53 3dah s ASN 148 N 1.40 5.93 0.00 0.27 2.47 -1.26 -0.40 114.94 123.35 3dah s ASN 148 Ca -0.00 -0.37 0.00 0.00 0.42 0.00 0.00 52.86 52.91 3dah s ASN 148 Cb -0.18 -2.10 -0.04 0.00 -1.45 0.00 0.00 41.25 37.48 3dah s ASN 148 CO 0.01 -0.19 0.06 0.27 -3.72 0.00 0.00 177.10 173.52 3dah s ILE 149 N 1.70 4.58 -0.17 -5.21 -4.36 0.21 -4.91 121.20 113.04 3dah s ILE 149 Ca 0.06 -0.48 -0.12 0.00 -0.26 0.00 0.00 60.65 59.85 3dah s ILE 149 Cb -0.17 -3.09 -0.05 0.00 1.25 0.00 0.00 42.46 40.40 3dah s ILE 149 CO 0.10 0.34 0.23 -0.31 0.24 0.00 0.00 174.94 175.53 3dah s TYR 150 N -1.18 3.44 -2.23 1.37 2.02 -1.26 -0.44 117.35 119.07 3dah s TYR 150 Ca 0.22 0.49 0.19 0.00 -0.37 0.00 0.00 57.07 57.61 3dah s TYR 150 Cb -0.12 -2.27 0.66 0.00 -0.40 0.00 0.00 41.96 39.83 3dah s TYR 150 CO 0.14 0.26 1.49 0.00 -1.57 0.00 0.00 175.55 175.87 3dah n ALA 151 N 3.53 2.50 -0.23 3.71 0.00 -1.26 -4.40 120.51 124.36 3dah n ALA 151 Ca -0.14 -0.56 0.03 0.00 0.00 0.00 0.00 53.44 52.77 3dah n ALA 151 Cb 0.52 -1.06 0.15 0.00 0.00 0.00 0.00 19.45 19.06 3dah n ALA 151 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3dah h THR 152 N 2.29 0.63 -0.74 0.00 2.02 -1.99 -0.81 112.91 114.30 3dah h THR 152 Ca 0.00 -0.11 0.14 0.00 0.77 0.00 0.00 66.41 67.21 3dah h THR 152 Cb 0.51 0.27 -0.09 0.00 -1.74 0.00 0.00 68.15 67.10 3dah h THR 152 CO 0.00 0.06 0.29 -0.65 0.37 0.00 0.00 175.52 175.59 3dah h PRO 153 N 0.32 0.43 -0.29 6.66 0.11 -1.98 0.23 132.00 137.48 3dah h PRO 153 Ca 0.36 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.45 3dah h PRO 153 Cb 0.56 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 3dah h PRO 153 CO -0.42 0.28 0.19 0.82 -0.21 0.00 0.00 178.00 178.66 3dah h ILE 154 N 0.44 1.07 -0.19 4.15 2.04 -1.48 0.15 117.51 123.69 3dah h ILE 154 Ca 0.40 -0.13 -0.13 0.00 1.00 0.00 0.00 64.86 66.00 3dah h ILE 154 Cb 0.60 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 3dah h ILE 154 CO -0.40 0.07 -0.40 -0.07 0.00 0.00 0.00 178.15 177.36 3dah h LEU 155 N 0.39 0.68 -0.93 1.44 3.38 -0.93 -2.40 115.31 116.93 3dah h LEU 155 Ca 0.11 -0.56 -0.10 0.00 0.09 0.00 0.00 57.88 57.42 3dah h LEU 155 Cb -0.04 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3dah h LEU 155 CO -0.02 1.11 -0.33 -0.07 0.09 0.00 0.00 178.44 179.21 3dah h LEU 156 N 0.27 0.38 -0.25 1.67 3.38 -0.59 -1.46 115.31 118.71 3dah h LEU 156 Ca 0.00 -0.14 0.06 0.00 0.09 0.00 0.00 57.88 57.89 3dah h LEU 156 Cb 1.00 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.59 3dah h LEU 156 CO 0.09 0.70 -0.12 1.23 0.09 0.00 0.00 178.44 180.42 3dah h GLY 157 N 1.09 0.09 0.82 0.83 0.00 -0.57 -1.49 103.07 103.84 3dah h GLY 157 Ca 0.04 0.15 -0.08 0.00 0.00 0.00 0.00 47.33 47.45 3dah h GLY 157 CO 0.06 -0.14 -0.18 -1.80 0.00 0.00 0.00 176.54 174.48 3dah h ASP 158 N -0.09 0.49 -0.78 0.19 3.58 -1.25 -2.81 116.42 115.76 3dah h ASP 158 Ca 0.14 -0.47 0.11 0.00 0.42 0.00 0.00 57.03 57.22 3dah h ASP 158 Cb 0.29 -0.14 -0.05 0.00 1.72 0.00 0.00 39.33 41.15 3dah h ASP 158 CO -0.31 0.86 0.51 0.25 -2.88 0.00 0.00 179.24 177.66 3dah h LEU 159 N 0.13 0.60 -0.25 2.28 5.85 -1.17 -1.62 115.31 121.14 3dah h LEU 159 Ca 0.03 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.62 3dah h LEU 159 Cb 0.71 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.64 3dah h LEU 159 CO 0.04 0.35 -0.45 0.03 -0.34 0.00 0.00 178.44 178.08 3dah h ARG 160 N 0.66 0.74 -0.76 1.25 3.08 -1.24 -3.08 114.38 115.03 3dah h ARG 160 Ca 0.36 -0.47 0.10 0.00 0.07 0.00 0.00 59.98 60.04 3dah h ARG 160 Cb 0.52 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.57 3dah h ARG 160 CO -0.14 1.09 0.50 -0.22 -1.07 0.00 0.00 179.97 180.13 3dah h LYS 161 N 0.47 0.66 0.00 0.04 3.64 -1.05 -1.89 116.57 118.44 3dah h LYS 161 Ca 0.01 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 3dah h LYS 161 Cb 1.05 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.72 3dah h LYS 161 CO 0.10 0.43 -0.06 1.96 -2.27 0.00 0.00 179.45 179.61 3dah h GLN 162 N 0.68 0.00 -6.70 1.90 1.08 -1.32 -3.48 115.11 107.26 3dah h GLN 162 Ca 0.35 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 57.02 3dah h GLN 162 Cb 0.46 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.90 3dah h GLN 162 CO -0.13 0.06 -0.99 -1.71 -0.95 0.00 0.00 178.83 175.12 3dah n ASN 163 N -3.19 -4.63 -4.71 1.46 2.85 -0.71 -4.92 115.26 101.42 3dah n ASN 163 Ca 0.00 -1.16 -0.42 0.00 -0.11 0.00 0.00 54.58 52.89 3dah n ASN 163 Cb 0.34 -2.17 -0.03 0.00 1.24 0.00 0.00 39.78 39.16 3dah n ASN 163 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 3dah s TYR 164 N -3.42 3.57 0.22 1.20 2.02 -1.26 -5.07 117.35 114.61 3dah s TYR 164 Ca 0.41 1.58 0.01 0.00 -0.37 0.00 0.00 57.07 58.70 3dah s TYR 164 Cb -0.21 -3.21 -0.04 0.00 -0.40 0.00 0.00 41.96 38.11 3dah s TYR 164 CO 0.93 -0.38 0.39 -1.25 -1.57 0.00 0.00 175.55 173.67 3dah s PRO 165 N 1.19 3.49 -0.81 -1.71 0.04 -1.26 -3.29 135.00 132.66 3dah s PRO 165 Ca 0.53 -0.45 -0.12 0.00 0.04 0.00 0.00 61.00 61.01 3dah s PRO 165 Cb -0.23 -2.84 0.21 0.00 0.04 0.00 0.00 34.50 31.68 3dah s PRO 165 CO 0.27 0.39 0.73 -0.51 0.04 0.00 0.00 177.00 177.92 3dah s ASP 166 N -3.42 6.54 0.11 6.66 1.11 -1.26 -4.08 116.67 122.33 3dah s ASP 166 Ca 0.37 -2.76 -0.34 0.00 0.18 0.00 0.00 52.55 50.00 3dah s ASP 166 Cb -0.10 -2.15 -0.18 0.00 1.07 0.00 0.00 42.92 41.55 3dah s ASP 166 CO 0.30 -0.53 0.96 -0.11 1.18 0.00 0.00 175.17 176.97 3dah n LEU 167 N 3.84 0.18 -3.76 1.23 7.94 -1.21 -3.96 117.00 121.27 3dah n LEU 167 Ca 0.13 1.15 -0.16 0.00 -1.11 0.00 0.00 56.01 56.02 3dah n LEU 167 Cb 0.45 -1.03 -0.16 0.00 0.53 0.00 0.00 43.42 43.21 3dah n LEU 167 CO 0.33 -1.98 -0.35 -0.22 -1.11 0.00 0.00 177.39 174.06 3dah s LEU 168 N 1.02 0.91 0.03 -1.96 0.20 0.15 -4.03 118.68 115.00 3dah s LEU 168 Ca 0.78 0.04 -0.27 0.00 0.69 0.00 0.00 54.13 55.37 3dah s LEU 168 Cb -1.04 -0.10 -0.05 0.00 -0.43 0.00 0.00 46.19 44.57 3dah s LEU 168 CO 0.55 -0.15 0.85 -0.69 -0.29 0.00 0.00 176.35 176.63 3dah s VAL 169 N 1.27 4.76 -0.12 1.68 1.01 -0.88 0.20 120.40 128.32 3dah s VAL 169 Ca -0.06 1.81 0.03 0.00 0.00 0.00 0.00 61.98 63.75 3dah s VAL 169 Cb -0.13 -4.20 -0.00 0.00 0.00 0.00 0.00 36.38 32.05 3dah s VAL 169 CO -0.03 0.29 -0.21 -0.69 0.00 0.00 0.00 175.10 174.46 3dah s VAL 170 N 0.35 2.33 -0.26 2.92 1.01 0.73 -1.33 120.40 126.16 3dah s VAL 170 Ca 0.44 -0.91 -0.20 0.00 0.00 0.00 0.00 61.98 61.30 3dah s VAL 170 Cb -0.21 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 3dah s VAL 170 CO 0.25 0.55 0.63 -0.55 0.00 0.00 0.00 175.10 175.98 3dah s SER 171 N 0.44 6.57 0.20 3.32 0.15 -0.11 -4.45 113.70 119.82 3dah s SER 171 Ca -0.15 0.68 -0.07 0.00 0.70 0.00 0.00 55.95 57.12 3dah s SER 171 Cb -0.17 -2.34 0.14 0.00 -1.71 0.00 0.00 66.02 61.95 3dah s SER 171 CO 0.06 -0.38 1.66 1.55 1.20 0.00 0.00 173.24 177.32 3dah h PRO 172 N 7.92 0.95 -4.84 5.44 0.13 -1.88 -0.54 132.00 139.18 3dah h PRO 172 Ca -0.27 -0.32 -0.30 0.00 -0.87 0.00 0.00 66.00 64.25 3dah h PRO 172 Cb 1.12 -0.08 -0.15 0.00 0.13 0.00 0.00 31.00 32.03 3dah h PRO 172 CO 0.78 0.98 -0.67 0.16 -0.23 0.00 0.00 178.00 179.02 3dah s ASP 173 N -6.64 1.32 0.00 1.44 -4.77 -1.23 -4.16 116.67 102.63 3dah s ASP 173 Ca -0.11 -1.16 0.00 0.00 -3.30 0.00 0.00 52.55 47.99 3dah s ASP 173 Cb 0.14 0.09 0.00 0.00 -1.09 0.00 0.00 42.92 42.06 3dah s ASP 173 CO 0.85 -0.54 0.29 1.33 0.70 0.00 0.00 175.17 177.80 3dah n VAL 174 N -0.25 0.11 0.00 2.11 0.24 -1.25 -3.76 118.33 115.52 3dah n VAL 174 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.23 3dah n VAL 174 Cb 0.63 -0.35 0.00 0.00 -1.47 0.00 0.00 33.84 32.65 3dah n VAL 174 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dah n GLY 175 N 0.37 1.18 2.18 7.63 0.00 -1.26 -4.58 105.19 110.71 3dah n GLY 175 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3dah n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dah n GLY 176 N 2.73 2.71 0.20 -0.02 0.00 -1.25 -4.06 105.19 105.50 3dah n GLY 176 Ca 0.00 -0.96 -0.15 0.00 0.00 0.00 0.00 46.02 44.91 3dah n GLY 176 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3dah h VAL 177 N 2.41 1.32 -0.47 1.61 2.07 -1.81 -1.75 116.25 119.63 3dah h VAL 177 Ca 0.24 -2.11 0.10 0.00 0.82 0.00 0.00 66.70 65.74 3dah h VAL 177 Cb 0.99 2.12 -0.09 0.00 -1.52 0.00 0.00 31.29 32.79 3dah h VAL 177 CO 0.52 0.65 -0.15 0.58 0.02 0.00 0.00 177.57 179.19 3dah h VAL 178 N 0.41 0.47 0.00 2.57 2.07 -1.95 -0.52 116.25 119.31 3dah h VAL 178 Ca -0.06 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.37 3dah h VAL 178 Cb 1.43 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 3dah h VAL 178 CO 0.16 0.00 -0.64 -0.09 0.02 0.00 0.00 177.57 177.01 3dah h ARG 179 N -0.04 0.00 -0.00 1.57 2.43 -1.88 -2.89 114.38 113.56 3dah h ARG 179 Ca 0.23 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.23 3dah h ARG 179 Cb 0.39 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 3dah h ARG 179 CO -0.51 0.35 -0.76 0.00 -1.51 0.00 0.00 179.97 177.55 3dah h ALA 180 N 1.59 0.74 -0.19 2.80 0.00 -0.89 -2.31 119.26 121.01 3dah h ALA 180 Ca -0.03 -0.68 -0.19 0.00 0.00 0.00 0.00 54.91 54.01 3dah h ALA 180 Cb 1.34 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 3dah h ALA 180 CO 0.05 0.92 -0.63 -0.09 0.00 0.00 0.00 179.25 179.50 3dah h ARG 181 N 0.02 0.67 -0.83 0.00 2.43 -1.07 -2.18 114.38 113.42 3dah h ARG 181 Ca -0.01 -0.47 -0.00 0.00 -0.81 0.00 0.00 59.98 58.69 3dah h ARG 181 Cb 1.34 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.92 3dah h ARG 181 CO 0.10 1.09 0.51 0.00 -1.51 0.00 0.00 179.97 180.16 3dah h ALA 182 N 0.80 1.05 -0.48 2.80 0.00 -1.37 0.18 119.26 122.23 3dah h ALA 182 Ca -0.01 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 3dah h ALA 182 Cb 1.22 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 3dah h ALA 182 CO 0.13 0.50 -0.23 1.25 0.00 0.00 0.00 179.25 180.90 3dah h LEU 183 N 1.13 1.03 -0.48 0.00 6.46 -1.36 -2.53 115.31 119.56 3dah h LEU 183 Ca 0.30 -0.40 -0.15 0.00 -0.12 0.00 0.00 57.88 57.51 3dah h LEU 183 Cb -0.06 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.58 3dah h LEU 183 CO -0.06 1.20 -0.36 0.00 -0.62 0.00 0.00 178.44 178.60 3dah h ALA 184 N 0.86 0.67 -0.82 1.25 0.00 -0.91 -1.38 119.26 118.92 3dah h ALA 184 Ca 0.11 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3dah h ALA 184 Cb 0.81 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 3dah h ALA 184 CO 0.07 0.67 0.53 -0.22 0.00 0.00 0.00 179.25 180.30 3dah h LYS 185 N 0.70 1.10 -0.06 0.00 3.64 -0.99 -1.19 116.57 119.78 3dah h LYS 185 Ca 0.06 -0.08 -0.20 0.00 -1.27 0.00 0.00 60.65 59.17 3dah h LYS 185 Cb 0.93 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 32.51 3dah h LYS 185 CO 0.09 0.74 -0.80 0.37 -2.27 0.00 0.00 179.45 177.58 3dah h GLN 186 N 1.12 0.42 -5.21 1.90 4.15 -1.03 -3.32 115.11 113.14 3dah h GLN 186 Ca 0.30 -0.38 -0.64 0.00 0.77 0.00 0.00 58.65 58.71 3dah h GLN 186 Cb -0.10 0.09 -0.21 0.00 0.21 0.00 0.00 27.48 27.47 3dah h GLN 186 CO -0.06 1.02 -0.64 -0.51 -1.93 0.00 0.00 178.83 176.71 3dah s LEU 187 N -7.90 3.39 -0.98 -2.39 1.43 -0.56 -5.01 118.68 106.65 3dah s LEU 187 Ca -0.06 -0.11 -0.17 0.00 -1.03 0.00 0.00 54.13 52.76 3dah s LEU 187 Cb 0.10 -1.85 0.16 0.00 0.03 0.00 0.00 46.19 44.63 3dah s LEU 187 CO 0.85 0.12 1.14 0.54 0.23 0.00 0.00 176.35 179.24 3dah s ASN 188 N 0.65 6.77 0.14 2.29 4.22 -1.15 -4.21 114.94 123.65 3dah s ASN 188 Ca -0.00 -2.40 0.02 0.00 -2.14 0.00 0.00 52.86 48.33 3dah s ASN 188 Cb -0.14 -2.36 -0.01 0.00 1.28 0.00 0.00 41.25 40.02 3dah s ASN 188 CO 0.02 -0.89 0.06 0.00 -2.04 0.00 0.00 177.10 174.24 3dah s ASP 190 N -1.87 5.56 0.02 0.00 1.01 -1.26 -4.63 116.67 115.52 3dah s ASP 190 Ca 0.08 1.11 0.08 0.00 0.71 0.00 0.00 52.55 54.53 3dah s ASP 190 Cb 0.00 -1.97 -0.02 0.00 1.01 0.00 0.00 42.92 41.94 3dah s ASP 190 CO 0.06 -1.24 -0.24 -0.22 0.21 0.00 0.00 175.17 173.73 3dah s LEU 191 N -5.29 2.13 0.04 1.23 0.20 -1.26 -2.08 118.68 113.65 3dah s LEU 191 Ca 0.57 -0.53 0.03 0.00 0.69 0.00 0.00 54.13 54.90 3dah s LEU 191 Cb -0.11 -1.21 -0.02 0.00 -0.43 0.00 0.00 46.19 44.42 3dah s LEU 191 CO 0.51 0.25 -0.11 0.00 -0.29 0.00 0.00 176.35 176.72 3dah s ALA 192 N -0.72 0.85 -0.05 5.97 0.00 -0.44 -4.82 121.76 122.55 3dah s ALA 192 Ca 0.10 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.35 3dah s ALA 192 Cb -0.09 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 22.95 3dah s ALA 192 CO 0.01 0.11 -0.16 0.42 0.00 0.00 0.00 175.76 176.14 3dah s ILE 193 N -1.01 1.36 -0.12 0.00 1.01 -1.16 -0.94 121.20 120.34 3dah s ILE 193 Ca -0.03 -0.67 -0.03 0.00 0.00 0.00 0.00 60.65 59.92 3dah s ILE 193 Cb -0.08 -1.18 -0.03 0.00 0.01 0.00 0.00 42.46 41.18 3dah s ILE 193 CO 0.01 0.40 -0.03 -0.63 0.00 0.00 0.00 174.94 174.69 3dah s ILE 194 N 0.12 4.02 0.15 2.92 1.01 -0.21 -2.19 121.20 127.02 3dah s ILE 194 Ca -0.05 -0.33 -0.19 0.00 0.00 0.00 0.00 60.65 60.08 3dah s ILE 194 Cb -0.12 -2.72 0.05 0.00 0.01 0.00 0.00 42.46 39.68 3dah s ILE 194 CO 0.02 0.54 0.50 -0.62 0.00 0.00 0.00 174.94 175.39 3dah s ASP 195 N -0.19 -0.37 -0.14 3.58 3.68 -0.34 -3.50 116.67 119.39 3dah s ASP 195 Ca 0.04 -0.23 0.02 0.00 2.13 0.00 0.00 52.55 54.50 3dah s ASP 195 Cb -0.13 0.54 0.02 0.00 -1.45 0.00 0.00 42.92 41.90 3dah s ASP 195 CO 0.02 -0.94 -0.18 -1.59 0.13 0.00 0.00 175.17 172.61 3dah s LYS 196 N -3.80 2.63 -0.22 4.34 0.00 -1.26 -0.38 119.74 121.06 3dah s LYS 196 Ca 0.03 -0.70 -0.00 0.00 0.00 0.00 0.00 55.97 55.30 3dah s LYS 196 Cb 0.00 -2.23 0.02 0.00 0.00 0.00 0.00 37.83 35.62 3dah s LYS 196 CO -0.11 -0.11 -0.12 1.03 0.00 0.00 0.00 175.35 176.04 3dah s ARG 197 N 1.10 2.91 -0.75 1.78 0.52 -1.26 -4.93 118.95 118.33 3dah s ARG 197 Ca -0.02 -0.90 -0.26 0.00 -0.52 0.00 0.00 55.73 54.03 3dah s ARG 197 Cb -0.14 -2.80 0.04 0.00 0.52 0.00 0.00 34.95 32.57 3dah s ARG 197 CO -0.06 -0.31 1.23 0.50 0.02 0.00 0.00 175.30 176.69 3dah s ARG 198 N 1.31 3.21 -0.47 3.54 3.52 -1.26 -4.92 118.95 123.88 3dah s ARG 198 Ca 0.02 -0.43 -0.25 0.00 -0.13 0.00 0.00 55.73 54.93 3dah s ARG 198 Cb -0.15 -4.29 0.03 0.00 -1.56 0.00 0.00 34.95 28.98 3dah s ARG 198 CO -0.08 -2.09 0.92 0.54 -0.81 0.00 0.00 175.30 173.78 3dah s VAL 206 N 5.34 4.47 -0.18 7.11 0.11 -1.26 -5.24 120.40 130.75 3dah s VAL 206 Ca 0.33 0.71 -0.17 0.00 -2.93 0.00 0.00 61.98 59.93 3dah s VAL 206 Cb -0.09 -4.44 -0.13 0.00 -1.53 0.00 0.00 36.38 30.19 3dah s VAL 206 CO 0.12 -0.85 0.05 0.23 -3.33 0.00 0.00 175.10 171.32 3dah n MET 207 N 7.18 0.52 -3.17 1.54 2.00 -1.16 -4.89 117.12 119.14 3dah n MET 207 Ca 0.06 0.56 -0.39 0.00 0.00 0.00 0.00 57.70 57.92 3dah n MET 207 Cb 0.48 -1.72 -0.06 0.00 0.00 0.00 0.00 33.22 31.92 3dah n MET 207 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 3dah s ASN 208 N -6.43 7.00 -0.09 7.83 0.01 0.49 -4.94 114.94 118.81 3dah s ASN 208 Ca -0.24 1.19 0.01 0.00 -0.71 0.00 0.00 52.86 53.12 3dah s ASN 208 Cb 0.05 -2.38 0.02 0.00 0.41 0.00 0.00 41.25 39.35 3dah s ASN 208 CO 0.45 0.08 -0.10 -0.63 -1.51 0.00 0.00 177.10 175.38 3dah s ILE 209 N -0.13 1.13 -0.18 0.60 1.01 -1.26 -1.20 121.20 121.16 3dah s ILE 209 Ca 0.32 -0.41 -0.02 0.00 0.00 0.00 0.00 60.65 60.54 3dah s ILE 209 Cb -0.18 -1.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 3dah s ILE 209 CO 0.18 0.37 -0.09 -0.51 0.00 0.00 0.00 174.94 174.89 3dah s ILE 210 N 1.21 3.19 0.00 2.92 1.10 -0.93 -4.91 121.20 123.77 3dah s ILE 210 Ca -0.04 -0.58 0.00 0.00 -0.51 0.00 0.00 60.65 59.52 3dah s ILE 210 Cb -0.14 -2.40 0.00 0.00 0.15 0.00 0.00 42.46 40.07 3dah s ILE 210 CO -0.03 0.47 0.00 0.61 -2.11 0.00 0.00 174.94 173.88 3dah n GLY 211 N 4.24 2.74 3.75 1.50 0.00 -1.26 -3.01 105.19 113.14 3dah n GLY 211 Ca -0.18 -1.48 -0.40 0.00 0.00 0.00 0.00 46.02 43.96 3dah n GLY 211 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dah s GLU 212 N -5.17 4.48 0.00 1.61 8.01 -1.26 -4.90 118.70 121.47 3dah s GLU 212 Ca 0.00 1.05 0.14 0.00 0.01 0.00 0.00 54.97 56.17 3dah s GLU 212 Cb 0.00 -3.35 0.07 0.00 -4.31 0.00 0.00 34.13 26.54 3dah s GLU 212 CO 0.00 0.33 0.89 0.28 0.01 0.00 0.00 175.26 176.77 3dah n VAL 213 N 2.63 0.00 0.02 2.63 0.31 -1.26 -4.84 118.33 117.82 3dah n VAL 213 Ca -0.03 -0.44 -0.06 0.00 -0.01 0.00 0.00 64.34 63.80 3dah n VAL 213 Cb 0.50 1.25 -0.03 0.00 -0.91 0.00 0.00 33.84 34.64 3dah n VAL 213 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3dah h GLU 214 N 2.33 -0.22 -0.40 5.55 4.22 -1.84 -2.57 114.58 121.65 3dah h GLU 214 Ca 0.00 0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.46 3dah h GLU 214 Cb 0.55 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.85 3dah h GLU 214 CO 0.00 -0.15 0.00 0.41 -2.18 0.00 0.00 179.01 177.09 3dah n GLY 215 N -1.16 0.83 3.85 1.92 0.00 -1.26 -3.28 105.19 106.08 3dah n GLY 215 Ca -0.03 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.24 3dah n GLY 215 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dah s ARG 216 N -1.53 3.94 -0.37 1.61 1.81 -0.97 -4.50 118.95 118.94 3dah s ARG 216 Ca 0.25 0.43 -0.22 0.00 -1.72 0.00 0.00 55.73 54.47 3dah s ARG 216 Cb 0.13 -2.96 0.01 0.00 -0.45 0.00 0.00 34.95 31.68 3dah s ARG 216 CO 0.16 0.51 0.73 0.99 -0.68 0.00 0.00 175.30 177.01 3dah s THR 217 N -1.43 4.78 0.02 0.02 2.01 -1.25 -1.26 115.64 118.53 3dah s THR 217 Ca 0.36 0.72 -0.17 0.00 0.31 0.00 0.00 61.69 62.92 3dah s THR 217 Cb -0.15 -4.18 -0.06 0.00 0.01 0.00 0.00 72.50 68.13 3dah s THR 217 CO 0.19 -0.42 0.48 0.00 -0.69 0.00 0.00 174.62 174.17 3dah s VAL 219 N -1.00 1.56 -0.10 0.00 1.01 0.13 -0.80 120.40 121.21 3dah s VAL 219 Ca 0.26 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.49 3dah s VAL 219 Cb -0.18 -1.35 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 3dah s VAL 219 CO 0.15 0.45 -0.19 -0.63 0.00 0.00 0.00 175.10 174.88 3dah s ILE 220 N 0.14 2.51 -0.05 2.22 1.01 0.31 -0.19 121.20 127.15 3dah s ILE 220 Ca -0.07 -0.88 0.05 0.00 0.00 0.00 0.00 60.65 59.75 3dah s ILE 220 Cb -0.13 -1.99 -0.01 0.00 0.01 0.00 0.00 42.46 40.34 3dah s ILE 220 CO 0.04 0.55 -0.20 -0.32 0.00 0.00 0.00 174.94 175.01 3dah s MET 221 N 0.11 2.01 0.13 2.79 1.75 -1.26 -0.35 119.30 124.48 3dah s MET 221 Ca -0.09 -0.71 -0.05 0.00 -1.25 0.00 0.00 55.69 53.58 3dah s MET 221 Cb -0.16 -1.74 -0.02 0.00 2.84 0.00 0.00 34.83 35.75 3dah s MET 221 CO 0.06 0.30 0.15 -0.51 -0.65 0.00 0.00 175.02 174.37 3dah s ASP 222 N -0.07 0.20 0.17 1.11 1.01 -0.33 -5.00 116.67 113.76 3dah s ASP 222 Ca -0.03 -0.97 -0.08 0.00 0.71 0.00 0.00 52.55 52.18 3dah s ASP 222 Cb -0.12 0.34 0.04 0.00 1.01 0.00 0.00 42.92 44.20 3dah s ASP 222 CO 0.02 -0.78 1.52 0.44 0.21 0.00 0.00 175.17 176.59 3dah h ASP 223 N 2.76 0.88 -5.08 0.27 3.32 -1.90 -2.40 116.42 114.27 3dah h ASP 223 Ca -0.33 -0.39 -0.06 0.00 0.02 0.00 0.00 57.03 56.26 3dah h ASP 223 Cb 1.20 -0.25 -0.14 0.00 0.22 0.00 0.00 39.33 40.37 3dah h ASP 223 CO 0.55 1.16 -0.12 0.00 -1.72 0.00 0.00 179.24 179.11 3dah s MET 224 N -4.38 1.00 -0.09 3.56 0.23 -1.26 -0.80 119.30 117.56 3dah s MET 224 Ca -0.10 -0.68 0.02 0.00 -1.03 0.00 0.00 55.69 53.90 3dah s MET 224 Cb 0.12 0.44 0.01 0.00 -1.53 0.00 0.00 34.83 33.87 3dah s MET 224 CO 0.86 -0.37 -0.14 0.54 -2.03 0.00 0.00 175.02 173.87 3dah s VAL 225 N -3.55 1.39 0.00 5.16 0.11 -0.74 -4.91 120.40 117.86 3dah s VAL 225 Ca 0.02 -0.59 0.00 0.00 -2.93 0.00 0.00 61.98 58.47 3dah s VAL 225 Cb 0.02 -1.27 0.00 0.00 -1.53 0.00 0.00 36.38 33.60 3dah s VAL 225 CO -0.10 0.42 0.00 -0.67 -3.33 0.00 0.00 175.10 171.42 3dah n ASP 226 N 4.06 0.00 0.23 3.54 2.03 -1.26 -1.80 116.55 123.35 3dah n ASP 226 Ca -0.20 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.25 3dah n ASP 226 Cb 0.51 0.00 0.38 0.00 -0.72 0.00 0.00 41.12 41.30 3dah n ASP 226 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 3dah h THR 227 N 0.00 0.00 -0.08 5.18 1.35 -1.93 -2.26 112.91 115.17 3dah h THR 227 Ca 0.00 -0.76 -0.04 0.00 -0.55 0.00 0.00 66.41 65.06 3dah h THR 227 Cb 0.00 1.75 -0.01 0.00 -1.73 0.00 0.00 68.15 68.16 3dah h THR 227 CO 0.00 0.00 -0.03 0.00 -0.25 0.00 0.00 175.52 175.24 3dah n ALA 228 N -2.07 -0.03 -0.16 6.62 0.00 -1.26 -4.28 120.51 119.34 3dah n ALA 228 Ca 0.03 0.03 -0.03 0.00 0.00 0.00 0.00 53.44 53.46 3dah n ALA 228 Cb 0.43 -0.59 0.17 0.00 0.00 0.00 0.00 19.45 19.46 3dah n ALA 228 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3dah h GLY 229 N 0.00 0.96 0.33 0.00 0.00 -1.97 -1.48 103.07 100.91 3dah h GLY 229 Ca -0.04 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 46.71 3dah h GLY 229 CO 0.05 0.51 -0.19 -0.84 0.00 0.00 0.00 176.54 176.07 3dah h THR 230 N 0.87 1.61 -0.49 4.70 2.02 -1.99 -2.48 112.91 117.15 3dah h THR 230 Ca 0.19 -2.05 0.09 0.00 0.77 0.00 0.00 66.41 65.42 3dah h THR 230 Cb 0.27 2.95 -0.08 0.00 -1.74 0.00 0.00 68.15 69.55 3dah h THR 230 CO -0.01 0.55 0.03 -0.07 0.37 0.00 0.00 175.52 176.39 3dah h LEU 231 N -0.65 -0.14 -0.61 2.58 4.07 -1.96 0.08 115.31 118.67 3dah h LEU 231 Ca -0.03 0.11 -0.15 0.00 0.08 0.00 0.00 57.88 57.89 3dah h LEU 231 Cb 1.01 0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.92 3dah h LEU 231 CO 0.04 -0.04 -0.64 0.00 -1.08 0.00 0.00 178.44 176.71 3dah h LYS 233 N 0.15 0.43 -0.65 0.00 3.64 -1.15 -2.93 116.57 116.06 3dah h LYS 233 Ca -0.01 -0.26 0.04 0.00 -1.27 0.00 0.00 60.65 59.15 3dah h LYS 233 Cb 1.16 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.96 3dah h LYS 233 CO 0.10 0.85 0.39 0.00 -2.27 0.00 0.00 179.45 178.52 3dah h ALA 234 N 0.57 0.86 -0.84 5.00 0.00 -0.91 -2.64 119.26 121.29 3dah h ALA 234 Ca 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3dah h ALA 234 Cb 0.82 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 3dah h ALA 234 CO 0.06 0.11 0.47 0.00 0.00 0.00 0.00 179.25 179.88 3dah h ALA 235 N 1.31 1.08 0.10 0.00 0.00 -1.18 -2.01 119.26 118.56 3dah h ALA 235 Ca 0.27 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3dah h ALA 235 Cb 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3dah h ALA 235 CO -0.14 0.58 -0.05 1.96 0.00 0.00 0.00 179.25 181.61 3dah h GLN 236 N 1.17 -0.13 -0.83 0.00 4.20 -1.40 -2.13 115.11 115.99 3dah h GLN 236 Ca 0.30 0.01 0.20 0.00 0.06 0.00 0.00 58.65 59.22 3dah h GLN 236 Cb 0.02 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.78 3dah h GLN 236 CO -0.05 0.07 0.57 0.28 -0.67 0.00 0.00 178.83 179.03 3dah h VAL 237 N -0.32 0.67 -0.00 -0.54 2.07 -1.21 0.87 116.25 117.78 3dah h VAL 237 Ca -0.01 -0.08 -0.08 0.00 0.82 0.00 0.00 66.70 67.34 3dah h VAL 237 Cb 0.27 0.40 0.01 0.00 -1.52 0.00 0.00 31.29 30.44 3dah h VAL 237 CO 0.02 0.04 -0.33 -0.07 0.02 0.00 0.00 177.57 177.26 3dah h LEU 238 N 0.25 0.29 -1.81 2.57 3.38 -1.05 -2.41 115.31 116.53 3dah h LEU 238 Ca 0.42 -0.77 -0.02 0.00 0.09 0.00 0.00 57.88 57.60 3dah h LEU 238 Cb 1.25 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 3dah h LEU 238 CO -0.10 1.03 -0.08 0.11 0.09 0.00 0.00 178.44 179.48 3dah h LYS 239 N -0.41 0.02 0.00 1.13 6.56 -0.81 -0.16 116.57 122.89 3dah h LYS 239 Ca -0.04 -0.00 -0.08 0.00 -1.06 0.00 0.00 60.65 59.47 3dah h LYS 239 Cb 1.07 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.72 3dah h LYS 239 CO 0.06 0.10 -0.37 0.93 -2.06 0.00 0.00 179.45 178.11 3dah h GLU 240 N 0.02 0.00 -0.80 3.15 5.08 -0.83 -2.56 114.58 118.64 3dah h GLU 240 Ca 0.00 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.15 3dah h GLU 240 Cb 0.15 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.28 3dah h GLU 240 CO 0.01 0.37 0.27 0.54 -1.00 0.00 0.00 179.01 179.20 3dah n ARG 241 N -3.68 3.42 -0.26 2.33 5.12 -0.57 -4.94 116.66 118.08 3dah n ARG 241 Ca -0.01 -2.76 0.00 0.00 -1.93 0.00 0.00 57.85 53.15 3dah n ARG 241 Cb 0.47 -2.13 0.00 0.00 -1.16 0.00 0.00 32.46 29.64 3dah n ARG 241 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3dah n GLY 242 N -0.13 1.35 3.51 -0.13 0.00 -0.93 -3.62 105.19 105.24 3dah n GLY 242 Ca 0.38 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.92 3dah n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dah n ALA 243 N -0.54 -1.53 0.04 4.61 0.00 -0.18 -4.58 120.51 118.33 3dah n ALA 243 Ca 0.00 0.43 -0.12 0.00 0.00 0.00 0.00 53.44 53.76 3dah n ALA 243 Cb 0.00 -1.85 -0.09 0.00 0.00 0.00 0.00 19.45 17.52 3dah n ALA 243 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3dah h LYS 244 N 1.86 -0.16 -4.32 0.00 1.57 -1.30 -3.41 116.57 110.81 3dah h LYS 244 Ca -0.36 0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.29 3dah h LYS 244 Cb 1.38 0.04 -0.15 0.00 0.08 0.00 0.00 32.23 33.58 3dah h LYS 244 CO 0.61 0.32 -0.68 -0.65 -0.57 0.00 0.00 179.45 178.47 3dah s GLN 245 N -3.58 0.65 -0.06 3.15 -0.21 -1.23 -5.03 119.66 113.35 3dah s GLN 245 Ca -0.14 -1.23 0.00 0.00 0.02 0.00 0.00 55.36 54.02 3dah s GLN 245 Cb 0.01 0.12 0.02 0.00 1.00 0.00 0.00 33.01 34.16 3dah s GLN 245 CO 0.54 -0.09 -0.03 0.08 -2.12 0.00 0.00 175.29 173.67 3dah s VAL 246 N -3.79 0.52 -0.00 1.09 1.01 -1.26 -1.24 120.40 116.72 3dah s VAL 246 Ca 0.07 -0.05 0.07 0.00 0.00 0.00 0.00 61.98 62.07 3dah s VAL 246 Cb 0.07 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.84 3dah s VAL 246 CO -0.09 0.25 -0.21 -0.36 0.00 0.00 0.00 175.10 174.69 3dah s PHE 247 N 1.33 1.87 -0.12 5.22 0.08 0.02 -0.56 117.98 125.81 3dah s PHE 247 Ca -0.05 -0.36 0.03 0.00 0.12 0.00 0.00 56.93 56.68 3dah s PHE 247 Cb -0.13 -1.18 0.01 0.00 -0.57 0.00 0.00 43.02 41.14 3dah s PHE 247 CO -0.02 -0.01 -0.22 0.00 -0.10 0.00 0.00 175.22 174.87 3dah s ALA 248 N -0.55 2.19 -0.11 5.36 0.00 -0.17 -0.53 121.76 127.94 3dah s ALA 248 Ca 0.08 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 51.02 3dah s ALA 248 Cb -0.08 -0.91 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 3dah s ALA 248 CO -0.00 0.09 -0.13 0.71 0.00 0.00 0.00 175.76 176.43 3dah s TYR 249 N 0.64 2.80 -0.10 0.00 2.02 0.52 0.58 117.35 123.82 3dah s TYR 249 Ca -0.12 -0.46 -0.13 0.00 -0.37 0.00 0.00 57.07 55.98 3dah s TYR 249 Cb -0.16 -1.79 0.03 0.00 -0.40 0.00 0.00 41.96 39.64 3dah s TYR 249 CO 0.02 -0.07 0.35 0.00 -1.57 0.00 0.00 175.55 174.28 3dah s ALA 250 N 0.01 -0.88 -0.04 3.71 0.00 -0.45 -1.18 121.76 122.93 3dah s ALA 250 Ca -0.04 0.84 -0.25 0.00 0.00 0.00 0.00 51.96 52.51 3dah s ALA 250 Cb -0.14 -0.40 -0.20 0.00 0.00 0.00 0.00 23.12 22.38 3dah s ALA 250 CO 0.04 -0.20 1.13 1.15 0.00 0.00 0.00 175.76 177.88 3dah h THR 251 N 4.35 1.28 -3.67 0.00 2.02 -1.18 -3.24 112.91 112.48 3dah h THR 251 Ca -0.27 -1.24 -0.70 0.00 0.77 0.00 0.00 66.41 64.97 3dah h THR 251 Cb 1.18 2.08 -0.28 0.00 -1.74 0.00 0.00 68.15 69.39 3dah h THR 251 CO 0.31 0.30 -0.60 -1.00 0.37 0.00 0.00 175.52 174.91 3dah s HIS 252 N -3.88 3.25 -1.14 3.16 3.76 0.02 -2.36 115.29 118.10 3dah s HIS 252 Ca -0.15 -1.37 -0.17 0.00 -0.15 0.00 0.00 55.06 53.21 3dah s HIS 252 Cb 0.01 -2.30 0.12 0.00 1.11 0.00 0.00 32.58 31.52 3dah s HIS 252 CO 0.63 -0.72 1.44 -1.25 -0.85 0.00 0.00 174.74 173.98 3dah s PRO 253 N 1.42 3.89 -0.02 8.40 0.04 -1.26 -1.80 135.00 145.66 3dah s PRO 253 Ca -0.01 -2.06 -0.23 0.00 0.04 0.00 0.00 61.00 58.74 3dah s PRO 253 Cb -0.19 -5.18 -0.16 0.00 0.04 0.00 0.00 34.50 29.00 3dah s PRO 253 CO 0.03 -1.94 1.04 0.28 0.04 0.00 0.00 177.00 176.45 3dah h VAL 254 N 5.43 0.78 -5.91 -0.36 2.07 -1.66 -3.45 116.25 113.16 3dah h VAL 254 Ca 0.30 -0.89 -0.37 0.00 0.82 0.00 0.00 66.70 66.56 3dah h VAL 254 Cb 0.93 1.24 0.11 0.00 -1.52 0.00 0.00 31.29 32.04 3dah h VAL 254 CO 1.29 0.17 -0.85 0.18 0.02 0.00 0.00 177.57 178.38 3dah n LEU 255 N -5.01 -3.76 -5.02 2.57 4.77 -0.96 -4.98 117.00 104.60 3dah n LEU 255 Ca -0.08 -0.81 -0.20 0.00 -0.03 0.00 0.00 56.01 54.88 3dah n LEU 255 Cb 0.26 -2.79 0.06 0.00 -2.33 0.00 0.00 43.42 38.62 3dah n LEU 255 CO 0.28 0.35 0.36 -0.94 -1.33 0.00 0.00 177.39 176.10 3dah s SER 256 N -3.95 5.03 -1.18 -1.43 1.04 -0.89 -4.55 113.70 107.77 3dah s SER 256 Ca 0.21 -0.64 -0.03 0.00 0.48 0.00 0.00 55.95 55.97 3dah s SER 256 Cb -0.05 0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.10 3dah s SER 256 CO 0.80 -1.36 1.01 0.61 0.98 0.00 0.00 173.24 175.27 3dah n GLY 257 N -2.32 -0.37 3.77 7.32 0.00 -1.26 -2.80 105.19 109.54 3dah n GLY 257 Ca 0.14 0.12 -0.27 0.00 0.00 0.00 0.00 46.02 46.01 3dah n GLY 257 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dah n GLY 258 N -1.40 -0.48 0.20 -0.02 0.00 -1.26 -4.92 105.19 97.31 3dah n GLY 258 Ca -0.18 0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 3dah n GLY 258 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dah h ALA 259 N 0.97 0.46 -0.58 4.61 0.00 -1.70 -2.45 119.26 120.57 3dah h ALA 259 Ca -0.58 -0.30 0.08 0.00 0.00 0.00 0.00 54.91 54.11 3dah h ALA 259 Cb 1.37 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 3dah h ALA 259 CO 0.62 0.31 0.23 0.00 0.00 0.00 0.00 179.25 180.40 3dah h ALA 260 N 0.81 0.74 0.00 0.00 0.00 -1.88 0.29 119.26 119.22 3dah h ALA 260 Ca 0.08 0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 3dah h ALA 260 Cb 0.59 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3dah h ALA 260 CO 0.03 -0.17 -0.82 -0.44 0.00 0.00 0.00 179.25 177.86 3dah h ASP 261 N 0.42 0.02 -0.57 0.00 3.45 -1.94 0.53 116.42 118.33 3dah h ASP 261 Ca 0.28 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.71 3dah h ASP 261 Cb 0.31 -0.01 -0.03 0.00 -0.56 0.00 0.00 39.33 39.05 3dah h ASP 261 CO -0.27 0.83 0.30 -0.09 -1.57 0.00 0.00 179.24 178.44 3dah h ARG 262 N 0.01 0.80 -0.25 3.56 2.43 -0.93 -2.62 114.38 117.38 3dah h ARG 262 Ca -0.01 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 3dah h ARG 262 Cb 1.44 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 3dah h ARG 262 CO 0.11 0.62 0.14 0.82 -1.51 0.00 0.00 179.97 180.15 3dah h ILE 263 N 0.77 1.12 -0.93 1.20 1.08 -0.14 -2.62 117.51 117.98 3dah h ILE 263 Ca 0.20 -0.32 0.18 0.00 -0.39 0.00 0.00 64.86 64.53 3dah h ILE 263 Cb 0.07 0.88 -0.08 0.00 -3.07 0.00 0.00 36.82 34.62 3dah h ILE 263 CO -0.03 0.12 0.60 0.00 -0.69 0.00 0.00 178.15 178.15 3dah h ALA 264 N 1.01 1.96 -0.00 1.87 0.00 -0.74 -1.70 119.26 121.66 3dah h ALA 264 Ca 0.09 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3dah h ALA 264 Cb 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dah h ALA 264 CO -0.01 -0.26 -0.57 0.00 0.00 0.00 0.00 179.25 178.41 3dah n ALA 265 N -2.44 3.76 -1.74 0.00 0.00 -1.00 -4.99 120.51 114.09 3dah n ALA 265 Ca 0.20 -0.45 -0.29 0.00 0.00 0.00 0.00 53.44 52.89 3dah n ALA 265 Cb 0.60 -1.00 0.13 0.00 0.00 0.00 0.00 19.45 19.18 3dah n ALA 265 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3dah s SER 266 N -2.84 3.69 0.00 0.00 1.04 -0.64 -4.96 113.70 109.98 3dah s SER 266 Ca 0.14 0.73 0.30 0.00 0.48 0.00 0.00 55.95 57.59 3dah s SER 266 Cb 0.18 -1.14 1.74 0.00 0.10 0.00 0.00 66.02 66.89 3dah s SER 266 CO 0.69 -2.42 2.12 0.00 0.98 0.00 0.00 173.24 174.62 3dah n ALA 267 N -3.64 2.67 -2.38 5.32 0.00 -1.26 -4.86 120.51 116.36 3dah n ALA 267 Ca 0.09 -0.20 -0.42 0.00 0.00 0.00 0.00 53.44 52.92 3dah n ALA 267 Cb 0.60 -1.47 -0.04 0.00 0.00 0.00 0.00 19.45 18.55 3dah n ALA 267 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3dah s LEU 268 N -1.93 4.43 0.04 0.00 2.96 -1.26 -4.59 118.68 118.33 3dah s LEU 268 Ca 0.44 1.87 -0.04 0.00 -0.22 0.00 0.00 54.13 56.18 3dah s LEU 268 Cb 0.21 -3.58 -0.28 0.00 0.50 0.00 0.00 46.19 43.03 3dah s LEU 268 CO 0.34 -0.24 1.00 0.44 -1.32 0.00 0.00 176.35 176.57 3dah h ASP 269 N 6.07 0.41 -4.41 3.68 5.19 -1.16 -3.48 116.42 122.73 3dah h ASP 269 Ca -0.42 -0.50 -0.04 0.00 -0.62 0.00 0.00 57.03 55.45 3dah h ASP 269 Cb 1.21 -0.13 -0.21 0.00 0.18 0.00 0.00 39.33 40.38 3dah h ASP 269 CO 0.75 1.40 0.20 -0.70 -3.12 0.00 0.00 179.24 177.77 3dah s GLU 270 N -2.64 0.90 -0.27 3.56 2.12 -1.24 -4.82 118.70 116.32 3dah s GLU 270 Ca -0.06 0.59 -0.02 0.00 0.36 0.00 0.00 54.97 55.83 3dah s GLU 270 Cb 0.07 0.43 0.03 0.00 0.26 0.00 0.00 34.13 34.92 3dah s GLU 270 CO 0.87 -0.21 -0.03 -1.17 -0.54 0.00 0.00 175.26 174.19 3dah s LEU 271 N -0.43 3.49 -0.22 2.70 2.96 0.15 -1.00 118.68 126.34 3dah s LEU 271 Ca -0.05 -1.00 -0.09 0.00 -0.22 0.00 0.00 54.13 52.77 3dah s LEU 271 Cb -0.02 -1.70 -0.05 0.00 0.50 0.00 0.00 46.19 44.92 3dah s LEU 271 CO 0.05 -0.18 0.12 -0.69 -1.32 0.00 0.00 176.35 174.33 3dah s VAL 272 N 1.31 5.10 0.33 1.68 1.01 0.20 -1.13 120.40 128.90 3dah s VAL 272 Ca -0.02 0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.08 3dah s VAL 272 Cb -0.18 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 3dah s VAL 272 CO -0.03 0.39 0.09 0.68 0.00 0.00 0.00 175.10 176.24 3dah s VAL 273 N 0.82 0.83 0.49 2.92 -7.23 0.22 -1.34 120.40 117.11 3dah s VAL 273 Ca 0.06 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.26 3dah s VAL 273 Cb -0.13 -2.63 0.02 0.00 0.56 0.00 0.00 36.38 34.20 3dah s VAL 273 CO 0.02 0.00 0.69 -0.89 -0.31 0.00 0.00 175.10 174.61 3dah s THR 274 N -3.41 3.07 -0.47 5.32 2.01 -1.00 0.99 115.64 122.16 3dah s THR 274 Ca 0.34 -0.73 0.02 0.00 0.31 0.00 0.00 61.69 61.62 3dah s THR 274 Cb 0.07 -3.11 0.53 0.00 0.01 0.00 0.00 72.50 69.99 3dah s THR 274 CO 0.15 -0.07 1.89 -0.90 -0.69 0.00 0.00 174.62 175.00 3dah n ASP 275 N -2.14 4.99 -0.15 3.53 5.75 -0.03 -4.43 116.55 124.06 3dah n ASP 275 Ca 0.06 -3.50 -0.08 0.00 -0.01 0.00 0.00 54.79 51.26 3dah n ASP 275 Cb 0.59 -0.87 0.07 0.00 -1.03 0.00 0.00 41.12 39.88 3dah n ASP 275 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 3dah h THR 276 N 0.93 1.26 -3.67 2.12 1.35 -1.87 -3.38 112.91 109.65 3dah h THR 276 Ca 0.56 -1.18 -0.67 0.00 -0.55 0.00 0.00 66.41 64.57 3dah h THR 276 Cb 2.03 0.93 -0.35 0.00 -1.73 0.00 0.00 68.15 69.04 3dah h THR 276 CO 1.14 0.42 -0.77 -0.63 -0.25 0.00 0.00 175.52 175.42 3dah s ILE 277 N -4.89 2.49 0.55 6.82 1.01 -1.26 -4.85 121.20 121.06 3dah s ILE 277 Ca -0.11 -1.37 -0.20 0.00 0.00 0.00 0.00 60.65 58.98 3dah s ILE 277 Cb 0.14 -2.37 -0.07 0.00 0.01 0.00 0.00 42.46 40.17 3dah s ILE 277 CO 0.84 0.07 0.94 -0.81 0.00 0.00 0.00 174.94 175.98 3dah n PRO 278 N 4.55 1.01 -2.65 2.79 -0.04 -1.26 -4.72 135.00 134.68 3dah n PRO 278 Ca -0.15 0.38 -0.40 0.00 -0.04 0.00 0.00 63.50 63.29 3dah n PRO 278 Cb 0.44 -2.10 -0.05 0.00 -0.04 0.00 0.00 33.50 31.76 3dah n PRO 278 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dah s LEU 279 N -1.35 4.58 0.97 1.53 1.43 -1.26 -5.05 118.68 119.53 3dah s LEU 279 Ca 0.71 2.02 -0.14 0.00 -1.03 0.00 0.00 54.13 55.69 3dah s LEU 279 Cb -0.46 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.16 3dah s LEU 279 CO 0.51 -0.00 0.15 -1.20 0.23 0.00 0.00 176.35 176.03 3dah n SER 280 N 1.78 -2.81 0.11 2.29 7.64 -1.26 -4.76 113.62 116.61 3dah n SER 280 Ca -0.00 0.27 0.01 0.00 1.01 0.00 0.00 58.87 60.16 3dah n SER 280 Cb 0.47 -1.11 0.32 0.00 -1.01 0.00 0.00 64.21 62.88 3dah n SER 280 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dah h ALA 281 N -1.49 1.35 0.15 -0.43 0.00 -1.98 0.66 119.26 117.52 3dah h ALA 281 Ca -0.44 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.17 3dah h ALA 281 Cb 1.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3dah h ALA 281 CO 0.32 0.45 -0.07 0.93 0.00 0.00 0.00 179.25 180.88 3dah h GLU 282 N 0.22 -0.19 -0.64 0.00 3.07 -1.98 -2.42 114.58 112.63 3dah h GLU 282 Ca 0.04 0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 58.87 3dah h GLU 282 Cb 0.55 0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.47 3dah h GLU 282 CO 0.04 0.01 0.23 0.77 -1.40 0.00 0.00 179.01 178.66 3dah h SER 283 N -0.37 0.88 0.70 1.42 0.02 -1.84 -1.26 113.55 113.10 3dah h SER 283 Ca -0.02 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.78 3dah h SER 283 Cb 0.29 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 3dah h SER 283 CO 0.03 0.80 -0.06 -0.07 -1.14 0.00 0.00 176.83 176.39 3dah h LEU 284 N 0.93 0.00 -0.25 5.07 3.38 -0.91 -1.76 115.31 121.77 3dah h LEU 284 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3dah h LEU 284 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3dah h LEU 284 CO -0.01 0.06 -0.21 0.00 0.09 0.00 0.00 178.44 178.37 3dah n ALA 285 N -2.15 2.94 -2.75 1.53 0.00 -0.52 -4.77 120.51 114.79 3dah n ALA 285 Ca -0.01 -0.30 -0.44 0.00 0.00 0.00 0.00 53.44 52.69 3dah n ALA 285 Cb 0.27 -1.25 -0.07 0.00 0.00 0.00 0.00 19.45 18.40 3dah n ALA 285 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dah h PRO 287 N 8.91 0.00 0.00 0.00 0.13 -1.86 -1.95 132.00 137.23 3dah h PRO 287 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3dah h PRO 287 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3dah h PRO 287 CO 0.92 0.01 0.00 1.63 -0.23 0.00 0.00 178.00 180.33 3dah n LYS 288 N -3.46 0.10 -4.20 0.86 5.02 -1.26 -4.78 118.16 110.44 3dah n LYS 288 Ca -0.03 0.20 -0.34 0.00 -2.02 0.00 0.00 58.31 56.12 3dah n LYS 288 Cb 0.09 -1.65 -0.10 0.00 -0.02 0.00 0.00 35.03 33.35 3dah n LYS 288 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3dah s ILE 289 N -3.09 4.43 -0.01 -0.18 1.01 -0.73 0.34 121.20 122.96 3dah s ILE 289 Ca 0.09 -0.17 -0.00 0.00 0.00 0.00 0.00 60.65 60.57 3dah s ILE 289 Cb 0.13 -2.96 0.02 0.00 0.01 0.00 0.00 42.46 39.66 3dah s ILE 289 CO 0.45 0.50 0.03 -0.60 0.00 0.00 0.00 174.94 175.32 3dah s ARG 290 N 0.12 -0.01 0.05 2.79 3.52 -0.28 -4.92 118.95 120.22 3dah s ARG 290 Ca 0.02 0.12 0.01 0.00 -0.13 0.00 0.00 55.73 55.75 3dah s ARG 290 Cb -0.13 -0.12 -0.04 0.00 -1.56 0.00 0.00 34.95 33.10 3dah s ARG 290 CO 0.01 -0.09 0.14 0.00 -0.81 0.00 0.00 175.30 174.55 3dah s ALA 291 N 0.57 3.77 0.15 6.12 0.00 -1.26 -0.61 121.76 130.50 3dah s ALA 291 Ca -0.05 -0.91 0.11 0.00 0.00 0.00 0.00 51.96 51.11 3dah s ALA 291 Cb -0.07 -1.64 -0.04 0.00 0.00 0.00 0.00 23.12 21.37 3dah s ALA 291 CO -0.02 0.77 -0.24 -0.51 0.00 0.00 0.00 175.76 175.76 3dah s LEU 292 N -2.32 2.42 -0.28 0.00 1.43 0.28 -4.89 118.68 115.32 3dah s LEU 292 Ca 0.31 -0.76 -0.23 0.00 -1.03 0.00 0.00 54.13 52.41 3dah s LEU 292 Cb -0.13 -1.25 -0.00 0.00 0.03 0.00 0.00 46.19 44.84 3dah s LEU 292 CO 0.23 0.16 0.78 -0.55 0.23 0.00 0.00 176.35 177.20 3dah s SER 293 N -2.31 6.70 0.00 2.29 0.15 -1.26 -0.85 113.70 118.42 3dah s SER 293 Ca 0.17 0.77 0.25 0.00 0.70 0.00 0.00 55.95 57.83 3dah s SER 293 Cb -0.09 -2.41 0.67 0.00 -1.71 0.00 0.00 66.02 62.48 3dah s SER 293 CO 0.08 -0.56 1.53 -1.54 1.20 0.00 0.00 173.24 173.95 3dah n SER 294 N 6.09 2.20 -0.31 5.45 3.41 -1.26 -4.52 113.62 124.69 3dah n SER 294 Ca 0.04 -1.75 -0.05 0.00 -0.26 0.00 0.00 58.87 56.85 3dah n SER 294 Cb 0.48 -0.06 0.08 0.00 -0.26 0.00 0.00 64.21 64.44 3dah n SER 294 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dah h ALA 295 N 4.39 1.09 -0.60 7.33 0.00 -1.91 -2.29 119.26 127.26 3dah h ALA 295 Ca 0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 3dah h ALA 295 Cb 0.69 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3dah h ALA 295 CO 0.00 0.63 0.08 0.78 0.00 0.00 0.00 179.25 180.74 3dah h GLY 296 N 1.20 1.07 1.42 0.00 0.00 -1.92 0.12 103.07 104.96 3dah h GLY 296 Ca 0.30 -0.71 -0.12 0.00 0.00 0.00 0.00 47.33 46.80 3dah h GLY 296 CO -0.04 0.65 -0.32 -2.00 0.00 0.00 0.00 176.54 174.84 3dah h LEU 297 N 0.93 0.67 -0.06 3.11 5.85 -1.81 -1.94 115.31 122.06 3dah h LEU 297 Ca 0.18 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 3dah h LEU 297 Cb 0.44 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 3dah h LEU 297 CO 0.01 0.94 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.98 3dah h LEU 298 N 0.55 0.12 -0.56 2.25 4.07 -1.13 -2.69 115.31 117.93 3dah h LEU 298 Ca 0.06 -0.36 0.04 0.00 0.08 0.00 0.00 57.88 57.71 3dah h LEU 298 Cb 0.81 -0.03 -0.04 0.00 1.08 0.00 0.00 40.66 42.48 3dah h LEU 298 CO 0.07 0.45 0.31 0.00 -1.08 0.00 0.00 178.44 178.19 3dah h ALA 299 N 0.67 0.73 -0.92 1.53 0.00 -0.96 -1.05 119.26 119.26 3dah h ALA 299 Ca 0.02 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3dah h ALA 299 Cb 0.40 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 3dah h ALA 299 CO 0.01 -0.01 0.60 1.49 0.00 0.00 0.00 179.25 181.33 3dah h GLU 300 N 0.59 1.13 -0.31 0.00 4.81 -1.39 -0.82 114.58 118.60 3dah h GLU 300 Ca 0.24 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.36 3dah h GLU 300 Cb 0.12 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 3dah h GLU 300 CO -0.15 0.75 0.01 1.15 -0.73 0.00 0.00 179.01 180.04 3dah h THR 301 N 1.17 1.25 -0.40 0.32 2.02 -1.13 -1.69 112.91 114.45 3dah h THR 301 Ca 0.37 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.61 3dah h THR 301 Cb -0.01 1.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 3dah h THR 301 CO -0.12 0.30 0.22 -0.26 0.37 0.00 0.00 175.52 176.04 3dah h PHE 302 N 0.35 0.53 0.00 3.16 -1.00 -0.68 -1.61 116.94 117.70 3dah h PHE 302 Ca 0.09 0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.64 3dah h PHE 302 Cb 0.43 -0.17 0.02 0.00 3.61 0.00 0.00 35.95 39.83 3dah h PHE 302 CO 0.03 0.37 -0.91 0.77 -1.61 0.00 0.00 178.31 176.97 3dah h SER 303 N 0.56 0.79 -0.73 2.17 0.02 -1.03 -1.95 113.55 113.38 3dah h SER 303 Ca 0.15 -0.75 -0.01 0.00 -0.84 0.00 0.00 61.79 60.33 3dah h SER 303 Cb 0.01 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 3dah h SER 303 CO -0.02 1.44 0.40 -0.09 -1.14 0.00 0.00 176.83 177.42 3dah h ARG 304 N 0.23 1.02 -0.27 3.45 2.43 -0.98 -0.76 114.38 119.51 3dah h ARG 304 Ca -0.11 -0.12 -0.17 0.00 -0.81 0.00 0.00 59.98 58.77 3dah h ARG 304 Cb 1.58 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 30.93 3dah h ARG 304 CO 0.18 0.76 -0.50 0.82 -1.51 0.00 0.00 179.97 179.72 3dah h ILE 305 N 1.01 1.29 -0.64 1.20 2.04 -1.33 -2.83 117.51 118.25 3dah h ILE 305 Ca 0.26 -1.70 0.01 0.00 1.00 0.00 0.00 64.86 64.42 3dah h ILE 305 Cb 0.04 1.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 3dah h ILE 305 CO -0.04 0.55 0.42 -0.09 0.00 0.00 0.00 178.15 178.99 3dah h ARG 306 N 0.59 0.85 -0.66 2.37 1.12 -1.18 -2.33 114.38 115.13 3dah h ARG 306 Ca 0.03 -0.05 0.10 0.00 -1.11 0.00 0.00 59.98 58.94 3dah h ARG 306 Cb 1.07 -0.19 -0.08 0.00 -0.01 0.00 0.00 29.97 30.76 3dah h ARG 306 CO 0.11 0.57 0.27 0.00 -3.11 0.00 0.00 179.97 177.80 3dah h ARG 307 N 0.87 0.45 -0.92 0.20 3.08 -1.03 -2.19 114.38 114.84 3dah h ARG 307 Ca 0.23 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.25 3dah h ARG 307 Cb -0.09 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 29.81 3dah h ARG 307 CO -0.05 0.30 0.56 0.78 -1.07 0.00 0.00 179.97 180.49 3dah h GLY 308 N 0.46 1.34 2.00 0.04 0.00 -1.23 -2.78 103.07 102.90 3dah h GLY 308 Ca 0.34 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 3dah h GLY 308 CO -0.32 0.54 -0.14 -0.55 0.00 0.00 0.00 176.54 176.07 3dah h ASP 309 N 1.27 0.00 -0.12 0.19 3.32 -0.87 -2.35 116.42 117.86 3dah h ASP 309 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 3dah h ASP 309 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3dah h ASP 309 CO -0.06 0.14 0.00 -1.54 -1.72 0.00 0.00 179.24 176.06 3dah n SER 310 N -3.93 2.25 -0.08 6.45 3.41 -1.06 -3.95 113.62 116.73 3dah n SER 310 Ca -0.02 -1.76 -0.04 0.00 -0.26 0.00 0.00 58.87 56.78 3dah n SER 310 Cb 0.23 -0.07 0.17 0.00 -0.26 0.00 0.00 64.21 64.28 3dah n SER 310 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3dah h VAL 311 N 3.26 1.24 -0.01 -3.33 2.07 -1.36 -3.51 116.25 114.61 3dah h VAL 311 Ca 0.00 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.46 3dah h VAL 311 Cb 0.70 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 3dah h VAL 311 CO 0.00 0.37 0.00 0.23 0.02 0.00 0.00 177.57 178.19