#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dah n GLY 6 N 0.00 2.88 3.74 0.44 0.00 -1.26 -5.01 105.19 105.98 3dah n GLY 6 Ca 0.00 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 3dah n GLY 6 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dah s LEU 7 N 0.00 4.42 -0.01 0.99 2.96 -1.26 -0.68 118.68 125.10 3dah s LEU 7 Ca 0.00 2.43 -0.00 0.00 -0.22 0.00 0.00 54.13 56.34 3dah s LEU 7 Cb 0.00 -3.61 0.01 0.00 0.50 0.00 0.00 46.19 43.08 3dah s LEU 7 CO 0.00 -0.52 0.02 -0.04 -1.32 0.00 0.00 176.35 174.49 3dah s MET 8 N -0.33 0.01 -0.12 1.98 -1.94 -0.23 -4.92 119.30 113.75 3dah s MET 8 Ca 0.56 0.06 0.03 0.00 -1.71 0.00 0.00 55.69 54.63 3dah s MET 8 Cb -0.37 -0.04 0.00 0.00 2.01 0.00 0.00 34.83 36.43 3dah s MET 8 CO 0.40 -0.04 -0.22 0.08 -0.01 0.00 0.00 175.02 175.23 3dah s VAL 9 N 0.24 2.11 0.35 -6.03 1.01 -1.26 -0.59 120.40 116.22 3dah s VAL 9 Ca -0.02 -0.98 0.09 0.00 0.00 0.00 0.00 61.98 61.07 3dah s VAL 9 Cb -0.03 -1.82 -0.06 0.00 0.00 0.00 0.00 36.38 34.47 3dah s VAL 9 CO -0.01 0.55 -0.05 -0.36 0.00 0.00 0.00 175.10 175.24 3dah s PHE 10 N 0.57 2.46 -0.03 5.22 0.08 -0.10 -0.32 117.98 125.87 3dah s PHE 10 Ca -0.13 -0.51 -0.15 0.00 0.12 0.00 0.00 56.93 56.26 3dah s PHE 10 Cb -0.17 -1.47 0.03 0.00 -0.57 0.00 0.00 43.02 40.83 3dah s PHE 10 CO 0.04 0.53 0.32 -0.08 -0.10 0.00 0.00 175.22 175.93 3dah s THR 11 N -2.60 0.05 0.00 0.64 -1.32 -1.26 -0.68 115.64 110.47 3dah s THR 11 Ca 0.34 -0.42 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 3dah s THR 11 Cb 0.03 -0.62 0.00 0.00 -1.51 0.00 0.00 72.50 70.40 3dah s THR 11 CO 0.18 -0.23 0.00 0.61 -2.21 0.00 0.00 174.62 172.97 3dah n GLY 12 N 1.40 1.62 1.02 6.08 0.00 -1.25 -4.91 105.19 109.14 3dah n GLY 12 Ca -0.21 -1.69 0.09 0.00 0.00 0.00 0.00 46.02 44.21 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 0.00 3.45 -0.09 1.61 4.13 -1.26 -4.47 115.26 118.62 3dah n ASN 13 Ca 0.00 -1.99 -0.12 0.00 1.68 0.00 0.00 54.58 54.15 3dah n ASN 13 Cb 0.00 -0.35 -0.04 0.00 -1.54 0.00 0.00 39.78 37.84 3dah n ASN 13 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3dah h ALA 14 N 3.28 0.38 -0.43 5.41 0.00 -1.91 -3.41 119.26 122.58 3dah h ALA 14 Ca 0.00 -0.33 -0.29 0.00 0.00 0.00 0.00 54.91 54.29 3dah h ALA 14 Cb 0.87 -0.09 -0.21 0.00 0.00 0.00 0.00 17.79 18.36 3dah h ALA 14 CO 0.00 0.27 -0.61 0.27 0.00 0.00 0.00 179.25 179.19 3dah n ASN 15 N -4.43 -1.46 -0.06 0.00 6.94 -1.26 -4.66 115.26 110.33 3dah n ASN 15 Ca -0.04 -3.29 0.06 0.00 -0.02 0.00 0.00 54.58 51.28 3dah n ASN 15 Cb 0.38 1.16 0.42 0.00 -2.36 0.00 0.00 39.78 39.37 3dah n ASN 15 CO 0.00 0.00 0.00 -0.65 -1.03 0.00 0.00 177.26 175.58 3dah h PRO 16 N 2.82 0.57 -0.24 -0.53 0.11 -1.80 -2.82 132.00 130.11 3dah h PRO 16 Ca -0.10 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.83 3dah h PRO 16 Cb 1.12 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3dah h PRO 16 CO 0.18 0.38 -0.44 0.00 -0.21 0.00 0.00 178.00 177.91 3dah h ALA 17 N 1.70 0.38 -0.76 -0.75 0.00 -1.97 -2.40 119.26 115.46 3dah h ALA 17 Ca 0.21 -0.47 0.07 0.00 0.00 0.00 0.00 54.91 54.71 3dah h ALA 17 Cb 0.10 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 3dah h ALA 17 CO -0.05 0.51 0.44 1.25 0.00 0.00 0.00 179.25 181.40 3dah h LEU 18 N 0.45 0.67 -0.28 0.00 5.85 -1.86 -1.69 115.31 118.45 3dah h LEU 18 Ca 0.01 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 3dah h LEU 18 Cb 1.04 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 3dah h LEU 18 CO 0.10 0.42 0.16 0.00 -0.34 0.00 0.00 178.44 178.78 3dah h ALA 19 N 1.38 0.36 -0.55 1.25 0.00 -1.39 0.20 119.26 120.51 3dah h ALA 19 Ca 0.34 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.25 3dah h ALA 19 Cb 0.21 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 3dah h ALA 19 CO -0.19 -0.12 0.26 0.37 0.00 0.00 0.00 179.25 179.57 3dah h GLN 20 N 0.34 0.48 -0.48 0.00 5.75 -1.22 -1.79 115.11 118.20 3dah h GLN 20 Ca 0.10 -0.03 -0.08 0.00 -0.15 0.00 0.00 58.65 58.49 3dah h GLN 20 Cb 0.05 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.47 3dah h GLN 20 CO -0.02 0.32 -0.03 0.93 -2.65 0.00 0.00 178.83 177.38 3dah h GLU 21 N 0.49 0.81 -0.09 1.69 4.39 -0.97 -2.05 114.58 118.86 3dah h GLU 21 Ca 0.26 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 3dah h GLU 21 Cb 0.21 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 28.77 3dah h GLU 21 CO -0.20 0.84 0.03 0.28 -1.16 0.00 0.00 179.01 178.80 3dah h VAL 22 N 0.75 1.14 -0.01 3.13 2.07 -0.56 -2.49 116.25 120.29 3dah h VAL 22 Ca 0.14 -0.43 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 3dah h VAL 22 Cb 0.50 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 3dah h VAL 22 CO 0.03 0.13 -0.32 -0.37 0.02 0.00 0.00 177.57 177.05 3dah h VAL 23 N -0.02 1.24 -0.39 2.57 -1.51 -1.31 -1.62 116.25 115.21 3dah h VAL 23 Ca 0.03 -1.13 0.02 0.00 -1.23 0.00 0.00 66.70 64.39 3dah h VAL 23 Cb 0.17 1.60 -0.03 0.00 -2.13 0.00 0.00 31.29 30.90 3dah h VAL 23 CO -0.00 0.32 0.22 0.11 -1.23 0.00 0.00 177.57 176.99 3dah h LYS 24 N 0.01 0.43 -0.06 5.19 1.57 -1.22 0.16 116.57 122.65 3dah h LYS 24 Ca -0.00 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 3dah h LYS 24 Cb 0.58 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 3dah h LYS 24 CO 0.04 0.29 -0.36 0.82 -0.57 0.00 0.00 179.45 179.67 3dah h ILE 25 N 0.45 1.28 0.00 1.86 2.04 -1.09 -2.97 117.51 119.08 3dah h ILE 25 Ca 0.16 -1.33 -0.03 0.00 1.00 0.00 0.00 64.86 64.66 3dah h ILE 25 Cb 0.02 1.64 -0.00 0.00 -0.74 0.00 0.00 36.82 37.73 3dah h ILE 25 CO -0.08 0.39 -0.15 -0.07 0.00 0.00 0.00 178.15 178.24 3dah h LEU 26 N 0.11 0.00 0.00 1.44 3.38 -0.75 -3.47 115.31 116.02 3dah h LEU 26 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3dah h LEU 26 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3dah h LEU 26 CO 0.05 0.15 0.00 0.61 0.09 0.00 0.00 178.44 179.34 3dah n GLY 27 N 1.12 0.51 3.17 0.83 0.00 0.47 -5.06 105.19 106.24 3dah n GLY 27 Ca 0.03 -0.85 -0.16 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.00 1.03 0.75 -0.61 -4.36 -0.75 -5.05 121.20 110.21 3dah s ILE 28 Ca 0.00 -1.48 -0.11 0.00 -0.26 0.00 0.00 60.65 58.80 3dah s ILE 28 Cb 0.00 -1.22 0.04 0.00 1.25 0.00 0.00 42.46 42.54 3dah s ILE 28 CO 0.00 -0.40 1.08 -2.16 0.24 0.00 0.00 174.94 173.70 3dah s PRO 29 N -2.29 2.43 0.20 0.37 0.04 -1.26 -4.37 135.00 130.12 3dah s PRO 29 Ca 0.02 1.05 -0.30 0.00 0.04 0.00 0.00 61.00 61.81 3dah s PRO 29 Cb -0.06 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.47 3dah s PRO 29 CO 0.01 -1.49 1.28 -1.17 0.04 0.00 0.00 177.00 175.68 3dah s LEU 30 N -5.80 4.43 0.26 -3.56 2.96 -1.26 -4.66 118.68 111.04 3dah s LEU 30 Ca 0.60 2.37 -0.31 0.00 -0.22 0.00 0.00 54.13 56.57 3dah s LEU 30 Cb -0.16 -3.61 -0.13 0.00 0.50 0.00 0.00 46.19 42.79 3dah s LEU 30 CO 0.56 -0.49 1.51 0.61 -1.32 0.00 0.00 176.35 177.22 3dah n GLY 31 N 2.26 1.07 3.65 7.98 0.00 0.56 -4.94 105.19 115.78 3dah n GLY 31 Ca 0.05 0.49 -0.43 0.00 0.00 0.00 0.00 46.02 46.13 3dah n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dah s LYS 32 N -0.37 4.15 -0.15 1.61 -0.14 -1.26 -4.77 119.74 118.82 3dah s LYS 32 Ca 0.67 1.53 -0.17 0.00 -1.36 0.00 0.00 55.97 56.64 3dah s LYS 32 Cb -0.57 -3.78 0.04 0.00 -1.68 0.00 0.00 37.83 31.84 3dah s LYS 32 CO 0.48 -0.80 0.46 0.00 -0.76 0.00 0.00 175.35 174.72 3dah s ALA 33 N 3.69 -1.14 -0.36 5.17 0.00 -1.26 -0.45 121.76 127.42 3dah s ALA 33 Ca 0.54 1.21 -0.18 0.00 0.00 0.00 0.00 51.96 53.53 3dah s ALA 33 Cb -0.20 -0.65 -0.00 0.00 0.00 0.00 0.00 23.12 22.28 3dah s ALA 33 CO 0.16 -0.23 0.53 1.41 0.00 0.00 0.00 175.76 177.63 3dah s MET 34 N 0.03 3.60 -0.32 0.00 1.75 -0.31 -4.92 119.30 119.13 3dah s MET 34 Ca -0.02 -0.16 0.04 0.00 -1.25 0.00 0.00 55.69 54.30 3dah s MET 34 Cb -0.03 -3.82 0.09 0.00 2.84 0.00 0.00 34.83 33.91 3dah s MET 34 CO 0.01 -0.68 0.02 0.08 -0.65 0.00 0.00 175.02 173.81 3dah s VAL 35 N 2.45 2.18 0.00 10.11 1.01 -1.26 -1.86 120.40 133.04 3dah s VAL 35 Ca 0.19 -2.16 0.00 0.00 0.00 0.00 0.00 61.98 60.02 3dah s VAL 35 Cb -0.15 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.67 3dah s VAL 35 CO 0.14 -0.49 0.00 -0.24 0.00 0.00 0.00 175.10 174.51 3dah n SER 36 N 4.32 0.08 -4.00 3.32 2.88 0.14 -4.87 113.62 115.48 3dah n SER 36 Ca 0.00 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 3dah n SER 36 Cb 0.42 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.76 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 1.34 0.42 0.70 -1.46 1.81 -1.26 -1.62 118.95 118.87 3dah s ARG 37 Ca 0.00 -0.52 -0.11 0.00 -1.72 0.00 0.00 55.73 53.38 3dah s ARG 37 Cb 0.00 -0.23 0.01 0.00 -0.45 0.00 0.00 34.95 34.28 3dah s ARG 37 CO 0.00 0.04 1.08 -0.06 -0.68 0.00 0.00 175.30 175.69 3dah s PHE 38 N -0.95 3.33 0.42 -0.53 0.08 0.45 -4.76 117.98 116.03 3dah s PHE 38 Ca -0.07 1.12 0.15 0.00 0.12 0.00 0.00 56.93 58.25 3dah s PHE 38 Cb -0.07 -3.00 1.04 0.00 -0.57 0.00 0.00 43.02 40.42 3dah s PHE 38 CO -0.00 -1.14 1.91 0.66 -0.10 0.00 0.00 175.22 176.55 3dah h SER 39 N -0.63 0.40 0.60 1.36 4.64 -2.02 0.30 113.55 118.20 3dah h SER 39 Ca -0.45 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 3dah h SER 39 Cb 1.24 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3dah h SER 39 CO 0.63 0.21 0.00 -0.90 -0.87 0.00 0.00 176.83 175.89 3dah n ASP 40 N -4.48 0.00 0.00 4.97 5.75 -1.26 -4.92 116.55 116.61 3dah n ASP 40 Ca 0.15 0.06 0.00 0.00 -0.01 0.00 0.00 54.79 54.98 3dah n ASP 40 Cb 0.53 -0.34 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 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 1.03 0.44 3.77 6.12 0.00 0.11 -5.06 105.19 111.60 3dah n GLY 41 Ca 0.11 0.00 -0.36 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 -0.92 3.56 0.29 1.61 2.02 -1.26 -4.71 118.70 119.29 3dah s GLU 42 Ca 0.00 1.65 -0.29 0.00 0.02 0.00 0.00 54.97 56.35 3dah s GLU 42 Cb 0.00 -2.18 -0.10 0.00 0.10 0.00 0.00 34.13 31.95 3dah s GLU 42 CO 0.00 -0.69 1.26 0.42 0.02 0.00 0.00 175.26 176.28 3dah s ILE 43 N -1.70 2.99 -0.19 -1.63 1.01 -1.26 -0.41 121.20 120.02 3dah s ILE 43 Ca 0.68 0.95 -0.01 0.00 0.00 0.00 0.00 60.65 62.27 3dah s ILE 43 Cb -0.25 -3.60 -0.00 0.00 0.01 0.00 0.00 42.46 38.61 3dah s ILE 43 CO 0.29 0.21 -0.11 -1.58 0.00 0.00 0.00 174.94 173.75 3dah s GLN 44 N -1.32 3.26 -0.03 2.79 0.74 -0.64 -4.74 119.66 119.72 3dah s GLN 44 Ca 0.50 -0.70 0.01 0.00 0.05 0.00 0.00 55.36 55.21 3dah s GLN 44 Cb -0.37 -2.79 0.02 0.00 1.10 0.00 0.00 33.01 30.97 3dah s GLN 44 CO 0.47 -0.10 -0.02 0.08 -0.55 0.00 0.00 175.29 175.17 3dah s VAL 45 N 1.16 0.30 -0.04 1.34 1.01 -1.25 0.26 120.40 123.18 3dah s VAL 45 Ca 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 3dah s VAL 45 Cb -0.14 -0.36 0.03 0.00 0.00 0.00 0.00 36.38 35.91 3dah s VAL 45 CO -0.04 0.16 0.03 -0.70 0.00 0.00 0.00 175.10 174.55 3dah s GLU 46 N 0.83 0.16 -0.16 2.72 2.12 -0.78 -5.00 118.70 118.59 3dah s GLU 46 Ca -0.09 0.20 -0.29 0.00 0.36 0.00 0.00 54.97 55.15 3dah s GLU 46 Cb -0.12 -0.52 -0.02 0.00 0.26 0.00 0.00 34.13 33.72 3dah s GLU 46 CO -0.01 -0.23 1.37 0.42 -0.54 0.00 0.00 175.26 176.27 3dah s ILE 47 N 1.55 4.09 -0.44 -3.70 -1.09 -1.26 -1.16 121.20 119.19 3dah s ILE 47 Ca -0.03 1.31 0.04 0.00 -2.23 0.00 0.00 60.65 59.74 3dah s ILE 47 Cb -0.13 -3.89 0.63 0.00 -1.58 0.00 0.00 42.46 37.49 3dah s ILE 47 CO -0.03 -0.17 1.89 0.00 -1.23 0.00 0.00 174.94 175.40 3dah n GLN 48 N 6.86 2.22 -3.49 2.79 6.02 0.41 -4.90 117.38 127.28 3dah n GLN 48 Ca 0.15 -2.89 -0.15 0.00 -0.01 0.00 0.00 57.00 54.10 3dah n GLN 48 Cb 0.45 -2.13 -0.04 0.00 1.02 0.00 0.00 30.24 29.53 3dah n GLN 48 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 3dah s GLU 49 N -3.18 1.13 0.08 -1.09 2.12 -1.24 -4.81 118.70 111.71 3dah s GLU 49 Ca 0.55 -0.07 -0.31 0.00 0.36 0.00 0.00 54.97 55.50 3dah s GLU 49 Cb 0.46 0.53 -0.08 0.00 0.26 0.00 0.00 34.13 35.30 3dah s GLU 49 CO 0.10 -0.42 1.57 1.21 -0.54 0.00 0.00 175.26 177.18 3dah s ASN 50 N -1.85 6.67 0.00 -1.70 3.84 -1.26 -4.92 114.94 115.71 3dah s ASN 50 Ca -0.06 2.43 0.00 0.00 0.21 0.00 0.00 52.86 55.44 3dah s ASN 50 Cb -0.00 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 38.13 3dah s ASN 50 CO 0.00 -0.82 0.79 1.33 -2.79 0.00 0.00 177.10 175.61 3dah n VAL 51 N 4.51 0.61 -1.64 -5.21 0.24 -1.26 -5.03 118.33 110.55 3dah n VAL 51 Ca 0.15 -0.64 -0.44 0.00 -2.04 0.00 0.00 64.34 61.37 3dah n VAL 51 Cb 0.41 0.72 -0.03 0.00 -1.47 0.00 0.00 33.84 33.47 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 -0.30 2.41 -1.03 7.34 0.63 -1.26 -1.31 116.66 123.15 3dah n ARG 52 Ca 0.00 0.82 -0.01 0.00 -0.92 0.00 0.00 57.85 57.74 3dah n ARG 52 Cb 0.31 -3.00 -0.00 0.00 0.45 0.00 0.00 32.46 30.22 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 5.00 0.44 3.87 5.14 0.00 0.36 -4.79 105.19 115.20 3dah n GLY 53 Ca 0.24 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.84 3.82 -0.86 1.61 -0.14 -0.42 -3.98 119.74 118.92 3dah s LYS 54 Ca 0.00 0.36 -0.22 0.00 -1.36 0.00 0.00 55.97 54.76 3dah s LYS 54 Cb 0.00 -2.54 0.09 0.00 -1.68 0.00 0.00 37.83 33.69 3dah s LYS 54 CO 0.00 0.19 1.17 0.34 -0.76 0.00 0.00 175.35 176.29 3dah s ASP 55 N -2.64 6.43 -0.22 2.83 -1.08 0.14 -1.07 116.67 121.07 3dah s ASP 55 Ca 0.49 -1.47 -0.09 0.00 -0.52 0.00 0.00 52.55 50.96 3dah s ASP 55 Cb -0.11 -2.46 -0.04 0.00 -1.46 0.00 0.00 42.92 38.85 3dah s ASP 55 CO 0.24 -1.34 0.11 -0.69 0.52 0.00 0.00 175.17 174.01 3dah s VAL 56 N 3.89 5.05 -0.16 1.11 1.01 0.06 -1.06 120.40 130.30 3dah s VAL 56 Ca 0.33 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.36 3dah s VAL 56 Cb -0.07 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.96 3dah s VAL 56 CO -0.02 0.39 -0.07 -0.36 0.00 0.00 0.00 175.10 175.04 3dah s PHE 57 N 0.83 2.94 -0.24 5.22 2.99 0.24 -0.79 117.98 129.17 3dah s PHE 57 Ca 0.06 -0.53 -0.07 0.00 0.00 0.00 0.00 56.93 56.38 3dah s PHE 57 Cb -0.13 -1.95 -0.03 0.00 0.00 0.00 0.00 43.02 40.91 3dah s PHE 57 CO 0.02 -0.19 0.07 0.08 -0.00 0.00 0.00 175.22 175.21 3dah s VAL 58 N 0.56 4.44 -0.50 -0.44 1.01 0.50 -0.92 120.40 125.05 3dah s VAL 58 Ca -0.05 -0.13 -0.14 0.00 0.00 0.00 0.00 61.98 61.65 3dah s VAL 58 Cb -0.15 -3.06 0.11 0.00 0.00 0.00 0.00 36.38 33.28 3dah s VAL 58 CO 0.03 0.36 0.43 -0.22 0.00 0.00 0.00 175.10 175.70 3dah s LEU 59 N 1.35 5.90 -0.27 3.92 2.96 0.15 0.40 118.68 133.10 3dah s LEU 59 Ca 0.05 -1.66 -0.02 0.00 -0.22 0.00 0.00 54.13 52.28 3dah s LEU 59 Cb -0.15 -2.16 0.15 0.00 0.50 0.00 0.00 46.19 44.54 3dah s LEU 59 CO 0.04 -0.76 0.47 -1.58 -1.32 0.00 0.00 176.35 173.20 3dah s GLN 60 N 1.57 0.44 0.40 1.98 2.00 -0.45 -3.96 119.66 121.62 3dah s GLN 60 Ca 0.04 0.75 -0.26 0.00 -2.00 0.00 0.00 55.36 53.89 3dah s GLN 60 Cb -0.27 -0.03 -0.09 0.00 0.80 0.00 0.00 33.01 33.42 3dah s GLN 60 CO 0.03 -0.62 1.19 -1.12 -0.50 0.00 0.00 175.29 174.28 3dah s SER 61 N 2.68 6.52 -0.87 6.67 0.01 -1.26 -4.26 113.70 123.18 3dah s SER 61 Ca 0.15 2.40 -0.03 0.00 1.31 0.00 0.00 55.95 59.79 3dah s SER 61 Cb -0.15 -2.62 0.24 0.00 0.21 0.00 0.00 66.02 63.70 3dah s SER 61 CO -0.18 -0.68 2.20 0.35 0.41 0.00 0.00 173.24 175.34 3dah n THR 62 N 0.14 4.39 -2.12 1.44 -2.24 -0.76 -4.76 114.28 110.37 3dah n THR 62 Ca 0.04 -4.42 -0.27 0.00 -2.27 0.00 0.00 64.05 57.12 3dah n THR 62 Cb 0.46 -1.51 0.12 0.00 -2.10 0.00 0.00 70.33 67.29 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 -3.27 1.25 -2.21 0.00 0.00 -1.26 -2.83 120.51 112.19 3dah n ALA 64 Ca 0.12 0.39 -0.43 0.00 0.00 0.00 0.00 53.44 53.52 3dah n ALA 64 Cb 0.60 -2.28 -0.02 0.00 0.00 0.00 0.00 19.45 17.75 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 -0.89 3.96 0.05 0.00 0.04 -1.26 -5.03 135.00 131.87 3dah s PRO 65 Ca 0.64 1.67 -0.24 0.00 0.04 0.00 0.00 61.00 63.11 3dah s PRO 65 Cb -0.61 -3.95 -0.16 0.00 0.04 0.00 0.00 34.50 29.82 3dah s PRO 65 CO 0.54 -1.08 1.54 1.15 0.04 0.00 0.00 177.00 179.18 3dah h THR 66 N 5.90 1.18 -0.40 1.26 2.02 -1.80 -1.88 112.91 119.19 3dah h THR 66 Ca -0.32 -0.52 -0.10 0.00 0.77 0.00 0.00 66.41 66.24 3dah h THR 66 Cb 1.14 1.48 -0.02 0.00 -1.74 0.00 0.00 68.15 69.01 3dah h THR 66 CO 0.99 0.14 -0.16 0.78 0.37 0.00 0.00 175.52 177.65 3dah h ASN 67 N -0.17 0.73 -0.33 4.18 -0.26 -1.91 -0.91 115.58 116.91 3dah h ASN 67 Ca 0.01 -0.23 -0.08 0.00 -0.56 0.00 0.00 56.30 55.43 3dah h ASN 67 Cb 0.22 -0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 37.27 3dah h ASN 67 CO -0.00 0.90 -0.13 0.44 -1.06 0.00 0.00 177.43 177.58 3dah h ASP 68 N 0.66 0.68 -0.25 5.81 3.32 -1.90 -1.34 116.42 123.40 3dah h ASP 68 Ca 0.11 -0.39 -0.09 0.00 0.02 0.00 0.00 57.03 56.67 3dah h ASP 68 Cb 0.63 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 3dah h ASP 68 CO 0.04 0.92 -0.16 0.78 -1.72 0.00 0.00 179.24 179.10 3dah h ASN 69 N 0.44 0.67 -0.27 6.45 2.35 -1.27 -1.32 115.58 122.62 3dah h ASN 69 Ca 0.08 -0.21 -0.06 0.00 -0.55 0.00 0.00 56.30 55.56 3dah h ASN 69 Cb 0.64 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 3dah h ASN 69 CO 0.04 0.84 -0.06 0.25 -1.65 0.00 0.00 177.43 176.85 3dah h LEU 70 N 0.61 0.52 -1.16 1.61 5.85 -1.06 -2.72 115.31 118.96 3dah h LEU 70 Ca 0.10 -0.36 -0.08 0.00 0.84 0.00 0.00 57.88 58.38 3dah h LEU 70 Cb 0.61 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 3dah h LEU 70 CO 0.04 0.76 -0.31 0.24 -0.34 0.00 0.00 178.44 178.83 3dah h MET 71 N 0.27 0.19 -0.48 1.25 2.86 -1.18 -0.19 114.93 117.65 3dah h MET 71 Ca 0.07 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 3dah h MET 71 Cb 0.53 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 3dah h MET 71 CO 0.03 0.48 0.24 0.93 1.06 0.00 0.00 176.91 179.65 3dah h GLU 72 N 0.17 0.69 -0.47 1.72 5.08 -1.20 -0.19 114.58 120.38 3dah h GLU 72 Ca 0.02 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3dah h GLU 72 Cb 0.63 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 3dah h GLU 72 CO 0.05 0.58 0.27 1.25 -1.00 0.00 0.00 179.01 180.15 3dah h LEU 73 N 0.64 0.57 -0.08 1.33 5.85 -1.08 0.38 115.31 122.91 3dah h LEU 73 Ca 0.17 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.84 3dah h LEU 73 Cb 0.11 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 3dah h LEU 73 CO -0.02 0.47 -0.05 0.24 -0.34 0.00 0.00 178.44 178.74 3dah h MET 74 N 0.62 -0.05 -0.35 1.25 2.86 -0.73 -0.58 114.93 117.94 3dah h MET 74 Ca 0.17 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.65 3dah h MET 74 Cb 0.02 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 3dah h MET 74 CO -0.03 -0.03 -0.42 0.82 1.06 0.00 0.00 176.91 178.31 3dah h ILE 75 N -0.05 1.27 -0.63 -1.22 2.04 -0.93 -1.50 117.51 116.50 3dah h ILE 75 Ca 0.05 -1.60 -0.03 0.00 1.00 0.00 0.00 64.86 64.29 3dah h ILE 75 Cb 0.12 1.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 3dah h ILE 75 CO -0.11 0.53 0.28 0.24 0.00 0.00 0.00 178.15 179.08 3dah h MET 76 N 0.72 0.92 -0.38 2.37 2.86 -0.85 -0.90 114.93 119.67 3dah h MET 76 Ca 0.05 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 3dah h MET 76 Cb 1.01 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 32.49 3dah h MET 76 CO 0.10 0.76 0.22 0.28 1.06 0.00 0.00 176.91 179.33 3dah h VAL 77 N 0.87 1.14 -0.81 -2.22 2.07 -0.94 -0.96 116.25 115.41 3dah h VAL 77 Ca 0.21 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.39 3dah h VAL 77 Cb 0.16 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 3dah h VAL 77 CO -0.02 0.14 0.52 -0.78 0.02 0.00 0.00 177.57 177.45 3dah h ASP 78 N 0.49 0.93 -0.74 0.57 3.58 -1.15 -0.28 116.42 119.83 3dah h ASP 78 Ca 0.14 -0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.54 3dah h ASP 78 Cb 0.03 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 40.82 3dah h ASP 78 CO -0.02 0.69 0.43 0.00 -2.88 0.00 0.00 179.24 177.46 3dah h ALA 79 N 1.29 0.95 -0.22 -0.78 0.00 -0.70 -1.83 119.26 117.97 3dah h ALA 79 Ca 0.29 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 3dah h ALA 79 Cb -0.11 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 3dah h ALA 79 CO -0.06 0.43 -0.12 -0.07 0.00 0.00 0.00 179.25 179.43 3dah h LEU 80 N 1.02 0.48 -0.26 0.00 -0.00 -0.95 -2.32 115.31 113.27 3dah h LEU 80 Ca 0.26 -0.42 0.01 0.00 -0.00 0.00 0.00 57.88 57.74 3dah h LEU 80 Cb -0.01 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.50 3dah h LEU 80 CO -0.05 0.80 0.14 0.50 -0.00 0.00 0.00 178.44 179.83 3dah h LYS 81 N 0.17 0.29 0.00 1.13 3.64 -0.85 -1.89 116.57 119.06 3dah h LYS 81 Ca 0.05 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 3dah h LYS 81 Cb 0.62 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.38 3dah h LYS 81 CO 0.03 0.19 -0.09 0.00 -2.27 0.00 0.00 179.45 177.31 3dah h ARG 82 N 0.30 0.00 -0.25 1.90 3.08 -1.34 -0.92 114.38 117.14 3dah h ARG 82 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 3dah h ARG 82 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 3dah h ARG 82 CO -0.06 0.09 0.00 0.00 -1.07 0.00 0.00 179.97 178.93 3dah n ALA 83 N -2.16 2.48 -3.06 0.04 0.00 -0.88 -4.93 120.51 112.01 3dah n ALA 83 Ca 0.00 -0.51 -0.13 0.00 0.00 0.00 0.00 53.44 52.80 3dah n ALA 83 Cb 0.34 -1.02 0.05 0.00 0.00 0.00 0.00 19.45 18.82 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 0.32 -3.73 -4.77 0.00 7.64 -0.35 -3.99 113.62 108.74 3dah n SER 84 Ca 0.12 -0.34 -0.41 0.00 1.01 0.00 0.00 58.87 59.25 3dah n SER 84 Cb 0.27 -3.26 -0.00 0.00 -1.01 0.00 0.00 64.21 60.21 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 -3.62 2.45 -0.30 -0.43 0.00 -0.76 -0.49 120.51 117.36 3dah n ALA 85 Ca -0.06 0.35 -0.05 0.00 0.00 0.00 0.00 53.44 53.68 3dah n ALA 85 Cb 0.56 -2.43 0.07 0.00 0.00 0.00 0.00 19.45 17.64 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 3.38 1.29 -4.61 0.00 0.00 -1.23 -3.42 103.07 98.49 3dah h GLY 86 Ca -0.50 -0.68 -0.07 0.00 0.00 0.00 0.00 47.33 46.08 3dah h GLY 86 CO 0.68 0.64 0.04 -1.60 0.00 0.00 0.00 176.54 176.30 3dah s ARG 87 N -5.62 0.84 -0.16 4.80 3.52 -0.80 -4.92 118.95 116.62 3dah s ARG 87 Ca -0.12 0.51 0.01 0.00 -0.13 0.00 0.00 55.73 55.99 3dah s ARG 87 Cb 0.16 0.40 0.02 0.00 -1.56 0.00 0.00 34.95 33.97 3dah s ARG 87 CO 0.84 -0.19 -0.16 0.42 -0.81 0.00 0.00 175.30 175.39 3dah s ILE 88 N -0.44 1.75 -0.18 4.11 1.01 -1.26 -0.76 121.20 125.43 3dah s ILE 88 Ca -0.06 -0.75 -0.00 0.00 0.00 0.00 0.00 60.65 59.84 3dah s ILE 88 Cb -0.03 -1.61 0.00 0.00 0.01 0.00 0.00 42.46 40.83 3dah s ILE 88 CO 0.05 0.49 -0.14 -0.89 0.00 0.00 0.00 174.94 174.44 3dah s THR 89 N 1.39 2.62 -0.38 2.92 2.01 0.03 -0.94 115.64 123.29 3dah s THR 89 Ca 0.04 -0.76 -0.22 0.00 0.31 0.00 0.00 61.69 61.06 3dah s THR 89 Cb -0.13 -2.13 0.01 0.00 0.01 0.00 0.00 72.50 70.26 3dah s THR 89 CO -0.11 0.50 0.72 0.00 -0.69 0.00 0.00 174.62 175.04 3dah s ALA 90 N 1.15 3.41 -0.59 7.40 0.00 -0.05 -0.37 121.76 132.71 3dah s ALA 90 Ca 0.01 -0.84 -0.18 0.00 0.00 0.00 0.00 51.96 50.95 3dah s ALA 90 Cb -0.14 -3.31 0.11 0.00 0.00 0.00 0.00 23.12 19.78 3dah s ALA 90 CO -0.06 -1.54 0.69 0.00 0.00 0.00 0.00 175.76 174.85 3dah s ALA 91 N 2.97 3.45 -0.75 0.00 0.00 0.16 -0.92 121.76 126.67 3dah s ALA 91 Ca 0.28 -2.28 -0.00 0.00 0.00 0.00 0.00 51.96 49.95 3dah s ALA 91 Cb -0.14 -3.50 0.19 0.00 0.00 0.00 0.00 23.12 19.67 3dah s ALA 91 CO 0.17 -2.32 0.59 0.42 0.00 0.00 0.00 175.76 174.62 3dah s ILE 92 N 2.53 3.75 0.13 0.00 1.01 0.63 -1.35 121.20 127.91 3dah s ILE 92 Ca 0.11 -3.66 -0.19 0.00 0.00 0.00 0.00 60.65 56.91 3dah s ILE 92 Cb -0.25 -3.40 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 3dah s ILE 92 CO 0.05 -0.99 1.71 -0.65 0.00 0.00 0.00 174.94 175.07 3dah h PRO 93 N 6.21 0.06 -4.75 2.79 0.11 -1.81 -3.34 132.00 131.26 3dah h PRO 93 Ca 0.09 -0.00 -0.67 0.00 0.11 0.00 0.00 66.00 65.52 3dah h PRO 93 Cb 0.85 -0.01 -0.20 0.00 0.11 0.00 0.00 31.00 31.75 3dah h PRO 93 CO 0.77 0.04 -0.51 -0.47 -0.21 0.00 0.00 178.00 177.63 3dah s TYR 94 N -6.19 3.21 -0.61 0.65 5.04 -1.26 -1.85 117.35 116.34 3dah s TYR 94 Ca -0.13 -0.28 -0.21 0.00 -2.44 0.00 0.00 57.07 54.01 3dah s TYR 94 Cb 0.11 -2.43 0.08 0.00 0.35 0.00 0.00 41.96 40.06 3dah s TYR 94 CO 0.69 -0.37 0.83 0.12 -1.34 0.00 0.00 175.55 175.48 3dah s PHE 95 N 1.69 2.84 0.67 4.97 5.36 -1.25 -1.83 117.98 130.42 3dah s PHE 95 Ca 0.06 -0.64 -0.16 0.00 -0.96 0.00 0.00 56.93 55.23 3dah s PHE 95 Cb -0.17 -4.08 0.00 0.00 -0.34 0.00 0.00 43.02 38.43 3dah s PHE 95 CO 0.09 -1.42 1.16 0.20 -1.46 0.00 0.00 175.22 173.79 3dah s GLY 96 N 3.46 2.36 0.00 13.12 0.00 -1.23 -3.17 107.32 121.86 3dah s GLY 96 Ca 0.18 0.77 0.00 0.00 0.00 0.00 0.00 44.72 45.67 3dah s GLY 96 CO 0.10 1.15 0.00 -1.72 0.00 0.00 0.00 173.10 172.63 3dah n TYR 97 N -2.31 0.00 0.32 1.90 4.01 -1.26 -4.91 117.16 114.91 3dah n TYR 97 Ca 0.12 0.00 0.19 0.00 -0.16 0.00 0.00 57.90 58.05 3dah n TYR 97 Cb 0.51 -0.42 1.06 0.00 -0.31 0.00 0.00 39.34 40.18 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 1.25 0.00 -0.72 0.00 -1.94 -1.81 119.26 116.04 3dah h ALA 98 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dah h ALA 98 Cb 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3dah h ALA 98 CO 0.00 0.01 -0.03 0.54 0.00 0.00 0.00 179.25 179.76 3dah n ARG 99 N -3.45 0.16 -3.31 0.00 1.74 -1.26 -4.10 116.66 106.44 3dah n ARG 99 Ca -0.03 0.13 -0.44 0.00 -0.77 0.00 0.00 57.85 56.74 3dah n ARG 99 Cb 0.09 -1.68 -0.00 0.00 -1.02 0.00 0.00 32.46 29.84 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 -1.96 3.61 -0.05 5.56 -0.06 -0.68 -4.76 117.38 119.04 3dah n GLN 100 Ca 0.06 -4.48 0.02 0.00 -2.00 0.00 0.00 57.00 50.60 3dah n GLN 100 Cb 0.40 -2.53 0.05 0.00 -4.06 0.00 0.00 30.24 24.09 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 2.42 2.04 -3.72 1.69 5.75 -1.26 -1.61 116.55 121.87 3dah n ASP 101 Ca 0.24 -1.73 -0.03 0.00 -0.01 0.00 0.00 54.79 53.26 3dah n ASP 101 Cb 0.38 -0.06 -0.01 0.00 -1.03 0.00 0.00 41.12 40.40 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 -0.79 1.21 -0.41 0.11 1.70 -1.26 -5.02 118.95 114.48 3dah s ARG 102 Ca 0.08 -0.68 -0.07 0.00 -0.47 0.00 0.00 55.73 54.59 3dah s ARG 102 Cb 0.05 0.40 0.09 0.00 -0.57 0.00 0.00 34.95 34.92 3dah s ARG 102 CO 0.06 -0.56 0.24 1.03 -1.08 0.00 0.00 175.30 174.99 3dah s ARG 103 N -3.18 2.42 0.25 3.89 0.52 -1.26 -4.69 118.95 116.90 3dah s ARG 103 Ca 0.13 -1.58 -0.30 0.00 -0.52 0.00 0.00 55.73 53.45 3dah s ARG 103 Cb -0.01 -3.71 -0.14 0.00 0.52 0.00 0.00 34.95 31.61 3dah s ARG 103 CO 0.03 -1.00 1.28 -2.30 0.02 0.00 0.00 175.30 173.33 3dah n PRO 104 N 4.81 1.78 -2.17 3.54 -0.02 -1.26 -0.91 135.00 140.76 3dah n PRO 104 Ca -0.08 0.63 -0.08 0.00 -2.02 0.00 0.00 63.50 61.95 3dah n PRO 104 Cb 0.42 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.69 3dah n PRO 104 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3dah n ARG 105 N 1.50 -0.95 -2.94 -0.52 0.63 -1.26 0.24 116.66 113.36 3dah n ARG 105 Ca 0.11 0.03 -0.22 0.00 -0.92 0.00 0.00 57.85 56.84 3dah n ARG 105 Cb 0.31 -0.91 0.03 0.00 0.45 0.00 0.00 32.46 32.34 3dah n ARG 105 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 3dah n SER 106 N 0.11 -6.15 -4.71 6.15 7.64 -0.09 -4.97 113.62 111.60 3dah n SER 106 Ca 0.02 -0.26 -0.33 0.00 1.01 0.00 0.00 58.87 59.31 3dah n SER 106 Cb 0.09 -4.99 0.12 0.00 -1.01 0.00 0.00 64.21 58.43 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 -3.17 1.90 -1.39 -0.43 0.00 0.14 -4.85 121.76 113.95 3dah s ALA 107 Ca 0.27 0.75 -0.11 0.00 0.00 0.00 0.00 51.96 52.86 3dah s ALA 107 Cb -0.12 -3.45 0.09 0.00 0.00 0.00 0.00 23.12 19.64 3dah s ALA 107 CO 0.33 -2.19 2.15 0.54 0.00 0.00 0.00 175.76 176.60 3dah n ARG 108 N -3.31 3.36 -4.64 0.00 1.74 -1.26 -4.74 116.66 107.81 3dah n ARG 108 Ca 0.13 -3.01 -0.29 0.00 -0.77 0.00 0.00 57.85 53.91 3dah n ARG 108 Cb 0.51 -3.05 -0.10 0.00 -1.02 0.00 0.00 32.46 28.79 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 1.64 1.85 0.26 1.55 -7.23 -1.26 -5.15 120.40 112.06 3dah s VAL 109 Ca 0.46 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.53 3dah s VAL 109 Cb 0.13 -2.85 -0.07 0.00 0.56 0.00 0.00 36.38 34.15 3dah s VAL 109 CO -0.05 0.00 0.59 0.00 -0.31 0.00 0.00 175.10 175.33 3dah s ALA 110 N -2.74 3.52 -1.16 1.32 0.00 -1.26 -4.92 121.76 116.51 3dah s ALA 110 Ca 0.30 -0.23 -0.12 0.00 0.00 0.00 0.00 51.96 51.91 3dah s ALA 110 Cb 0.08 -2.50 0.21 0.00 0.00 0.00 0.00 23.12 20.91 3dah s ALA 110 CO 0.15 0.45 1.31 0.42 0.00 0.00 0.00 175.76 178.09 3dah s ILE 111 N -1.88 5.35 0.41 0.00 1.01 -1.26 -4.78 121.20 120.04 3dah s ILE 111 Ca 0.49 -2.87 0.11 0.00 0.00 0.00 0.00 60.65 58.38 3dah s ILE 111 Cb -0.11 -4.80 0.31 0.00 0.01 0.00 0.00 42.46 37.87 3dah s ILE 111 CO 0.21 -1.47 1.98 0.28 0.00 0.00 0.00 174.94 175.94 3dah h SER 112 N 7.05 0.48 0.46 3.58 0.02 -1.81 -1.60 113.55 121.72 3dah h SER 112 Ca 0.26 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.14 3dah h SER 112 Cb 0.88 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.31 3dah h SER 112 CO 1.16 0.30 -0.39 0.00 -1.14 0.00 0.00 176.83 176.76 3dah h ALA 113 N 1.67 1.28 -0.14 3.77 0.00 -1.34 -1.75 119.26 122.75 3dah h ALA 113 Ca 0.28 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 3dah h ALA 113 Cb 0.39 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.13 3dah h ALA 113 CO -0.08 0.49 -0.52 -0.22 0.00 0.00 0.00 179.25 178.92 3dah h LYS 114 N 0.00 0.61 -0.40 0.00 1.63 -1.53 -1.65 116.57 115.22 3dah h LYS 114 Ca -0.00 -0.46 0.08 0.00 -0.85 0.00 0.00 60.65 59.41 3dah h LYS 114 Cb 0.73 0.08 -0.07 0.00 -0.60 0.00 0.00 32.23 32.37 3dah h LYS 114 CO 0.05 1.08 -0.09 0.28 -3.45 0.00 0.00 179.45 177.32 3dah h VAL 115 N 0.26 0.61 -0.76 2.00 2.07 -1.24 -0.11 116.25 119.07 3dah h VAL 115 Ca -0.02 -0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 3dah h VAL 115 Cb 1.15 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 3dah h VAL 115 CO 0.11 0.00 0.27 0.58 0.02 0.00 0.00 177.57 178.55 3dah h VAL 116 N 0.00 1.26 -0.14 2.57 2.07 -1.32 -0.15 116.25 120.54 3dah h VAL 116 Ca 0.19 -0.87 0.04 0.00 0.82 0.00 0.00 66.70 66.87 3dah h VAL 116 Cb 0.29 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 3dah h VAL 116 CO -0.40 0.35 -0.08 0.00 0.02 0.00 0.00 177.57 177.46 3dah h ALA 117 N 1.14 0.05 -0.73 1.67 0.00 -0.78 -1.28 119.26 119.32 3dah h ALA 117 Ca 0.25 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.26 3dah h ALA 117 Cb 0.27 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 3dah h ALA 117 CO -0.01 -0.52 0.45 -0.91 0.00 0.00 0.00 179.25 178.26 3dah h ASN 118 N -0.07 0.72 -0.30 0.00 2.35 -0.68 -2.11 115.58 115.49 3dah h ASN 118 Ca 0.08 0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.87 3dah h ASN 118 Cb 0.19 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 3dah h ASN 118 CO -0.19 0.49 0.13 0.24 -1.65 0.00 0.00 177.43 176.45 3dah h MET 119 N 0.86 0.27 -0.43 0.81 2.86 -0.76 -0.84 114.93 117.70 3dah h MET 119 Ca 0.31 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.88 3dah h MET 119 Cb 0.08 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 3dah h MET 119 CO -0.14 0.18 0.07 -0.07 1.06 0.00 0.00 176.91 178.01 3dah h LEU 120 N 0.28 0.69 -0.61 1.22 3.38 -1.04 -1.58 115.31 117.64 3dah h LEU 120 Ca 0.13 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3dah h LEU 120 Cb 0.08 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3dah h LEU 120 CO -0.11 0.77 0.36 -0.33 0.09 0.00 0.00 178.44 179.22 3dah h GLU 121 N 0.57 0.84 0.00 1.13 5.08 -1.35 -1.90 114.58 118.95 3dah h GLU 121 Ca 0.13 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 3dah h GLU 121 Cb 0.38 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3dah h GLU 121 CO 0.01 0.61 -0.22 0.97 -1.00 0.00 0.00 179.01 179.38 3dah h ILE 122 N 0.83 0.73 0.00 3.13 6.09 -0.90 -2.63 117.51 124.76 3dah h ILE 122 Ca 0.22 -0.91 -0.01 0.00 -1.37 0.00 0.00 64.86 62.78 3dah h ILE 122 Cb -0.00 1.57 -0.00 0.00 0.47 0.00 0.00 36.82 38.85 3dah h ILE 122 CO -0.04 0.21 -0.07 0.00 -3.07 0.00 0.00 178.15 175.19 3dah h ALA 123 N 1.78 0.97 0.00 0.18 0.00 -1.10 -3.47 119.26 117.62 3dah h ALA 123 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3dah h ALA 123 Cb 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3dah h ALA 123 CO 0.03 0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.77 3dah n GLY 124 N 0.71 1.76 3.71 0.00 0.00 -0.99 -4.17 105.19 106.21 3dah n GLY 124 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 4.00 -0.16 1.61 1.01 -0.73 -4.68 120.40 119.45 3dah s VAL 125 Ca 0.00 1.42 0.18 0.00 0.00 0.00 0.00 61.98 63.58 3dah s VAL 125 Cb 0.00 -3.91 -0.25 0.00 0.00 0.00 0.00 36.38 32.22 3dah s VAL 125 CO 0.00 0.09 0.22 -0.62 0.00 0.00 0.00 175.10 174.79 3dah n GLU 126 N 4.21 0.68 -3.83 2.72 1.02 -0.11 -4.57 120.64 120.75 3dah n GLU 126 Ca 0.10 0.03 -0.12 0.00 -0.02 0.00 0.00 57.16 57.14 3dah n GLU 126 Cb 0.46 -1.57 -0.11 0.00 -0.02 0.00 0.00 31.44 30.20 3dah n GLU 126 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3dah s ARG 127 N -2.61 0.32 -0.10 3.49 0.52 -1.18 -4.03 118.95 115.35 3dah s ARG 127 Ca -0.09 0.00 0.02 0.00 -0.52 0.00 0.00 55.73 55.14 3dah s ARG 127 Cb 0.07 0.14 -0.02 0.00 0.52 0.00 0.00 34.95 35.67 3dah s ARG 127 CO 0.84 -0.06 -0.15 0.42 0.02 0.00 0.00 175.30 176.36 3dah s ILE 128 N -0.48 2.87 -0.13 1.52 -1.09 -0.36 -0.87 121.20 122.66 3dah s ILE 128 Ca -0.06 -0.75 0.01 0.00 -2.23 0.00 0.00 60.65 57.62 3dah s ILE 128 Cb -0.04 -2.16 -0.01 0.00 -1.58 0.00 0.00 42.46 38.67 3dah s ILE 128 CO 0.01 0.55 -0.16 -0.63 -1.23 0.00 0.00 174.94 173.48 3dah s ILE 129 N 0.08 2.78 0.06 2.92 1.01 -0.10 -1.25 121.20 126.69 3dah s ILE 129 Ca -0.07 -0.76 -0.03 0.00 0.00 0.00 0.00 60.65 59.80 3dah s ILE 129 Cb -0.15 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.14 3dah s ILE 129 CO 0.05 0.53 0.03 0.28 0.00 0.00 0.00 174.94 175.83 3dah s THR 130 N 0.43 0.19 -0.13 2.92 -1.32 0.01 -0.27 115.64 117.47 3dah s THR 130 Ca -0.12 -1.57 0.02 0.00 -1.21 0.00 0.00 61.69 58.81 3dah s THR 130 Cb -0.16 -1.37 -0.00 0.00 -1.51 0.00 0.00 72.50 69.45 3dah s THR 130 CO 0.05 -0.87 -0.19 -0.32 -2.21 0.00 0.00 174.62 171.09 3dah s MET 131 N -3.69 3.17 -1.33 7.08 1.75 -0.77 0.52 119.30 126.02 3dah s MET 131 Ca 0.05 -0.80 -0.15 0.00 -1.25 0.00 0.00 55.69 53.54 3dah s MET 131 Cb 0.06 -2.49 0.01 0.00 2.84 0.00 0.00 34.83 35.25 3dah s MET 131 CO -0.09 0.11 0.47 -0.25 -0.65 0.00 0.00 175.02 174.60 3dah n ASP 132 N 3.77 -2.12 -4.60 1.11 8.00 0.25 -4.68 116.55 118.27 3dah n ASP 132 Ca -0.19 -1.17 -0.54 0.00 0.71 0.00 0.00 54.79 53.60 3dah n ASP 132 Cb 0.52 -2.33 -0.06 0.00 -0.02 0.00 0.00 41.12 39.23 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 -4.61 1.58 -0.19 0.64 7.94 -1.26 -4.84 117.00 116.26 3dah n LEU 133 Ca -0.21 1.12 0.08 0.00 -1.11 0.00 0.00 56.01 55.89 3dah n LEU 133 Cb 0.63 -1.15 0.38 0.00 0.53 0.00 0.00 43.42 43.82 3dah n LEU 133 CO 0.76 -1.03 1.21 -0.74 -1.11 0.00 0.00 177.39 176.48 3dah h HIS 134 N 4.84 0.72 -3.37 1.96 -0.00 -1.88 -3.39 115.15 114.04 3dah h HIS 134 Ca -0.48 0.02 -0.45 0.00 -0.00 0.00 0.00 60.37 59.46 3dah h HIS 134 Cb 1.34 -0.24 -0.35 0.00 -0.00 0.00 0.00 27.41 28.17 3dah h HIS 134 CO 0.63 0.35 -0.78 0.00 -0.00 0.00 0.00 177.93 178.13 3dah s ALA 135 N -5.63 0.86 0.48 5.26 0.00 -1.26 -5.04 121.76 116.43 3dah s ALA 135 Ca -0.09 -0.19 0.24 0.00 0.00 0.00 0.00 51.96 51.91 3dah s ALA 135 Cb 0.20 -0.58 1.44 0.00 0.00 0.00 0.00 23.12 24.18 3dah s ALA 135 CO 0.77 -0.15 2.11 -0.44 0.00 0.00 0.00 175.76 178.06 3dah h ASP 136 N 7.53 0.00 0.69 0.00 3.32 -2.00 -2.14 116.42 123.81 3dah h ASP 136 Ca -0.32 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.72 3dah h ASP 136 Cb 1.15 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 3dah h ASP 136 CO 0.42 0.09 -0.07 1.56 -1.72 0.00 0.00 179.24 179.52 3dah h GLN 137 N 0.00 0.00 -0.31 3.56 7.50 -1.96 -2.75 115.11 121.14 3dah h GLN 137 Ca -0.00 0.00 0.09 0.00 0.50 0.00 0.00 58.65 59.24 3dah h GLN 137 Cb 0.22 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.73 3dah h GLN 137 CO 0.01 0.07 0.23 0.82 -1.50 0.00 0.00 178.83 178.47 3dah h ILE 138 N 0.00 0.79 -0.73 2.54 2.04 -1.78 0.21 117.51 120.57 3dah h ILE 138 Ca -0.00 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.02 3dah h ILE 138 Cb 0.44 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.31 3dah h ILE 138 CO 0.01 0.00 0.50 1.56 0.00 0.00 0.00 178.15 180.22 3dah h GLN 139 N 0.00 0.30 0.00 2.37 4.20 -1.69 -0.32 115.11 119.97 3dah h GLN 139 Ca 0.15 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.84 3dah h GLN 139 Cb 0.61 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.33 3dah h GLN 139 CO -0.00 0.20 0.00 0.41 -0.67 0.00 0.00 178.83 178.77 3dah n GLY 140 N -1.56 -1.30 0.10 3.46 0.00 0.06 -2.84 105.19 103.11 3dah n GLY 140 Ca 0.14 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.17 3dah n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3dah n PHE 141 N -1.38 0.74 -4.07 1.61 3.72 -0.13 -4.81 117.46 113.14 3dah n PHE 141 Ca 0.10 0.25 -0.30 0.00 -0.05 0.00 0.00 57.45 57.45 3dah n PHE 141 Cb 0.26 -0.91 -0.07 0.00 -0.94 0.00 0.00 39.48 37.83 3dah n PHE 141 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3dah s PHE 142 N -3.18 3.14 -0.70 1.38 0.08 -1.13 -4.65 117.98 112.92 3dah s PHE 142 Ca 0.08 0.05 0.11 0.00 0.12 0.00 0.00 56.93 57.29 3dah s PHE 142 Cb 0.11 -1.60 0.31 0.00 -0.57 0.00 0.00 43.02 41.27 3dah s PHE 142 CO 0.48 0.51 1.25 -0.25 -0.10 0.00 0.00 175.22 177.11 3dah n ASP 143 N 0.47 2.96 -4.61 1.36 8.00 -1.26 -4.99 116.55 118.48 3dah n ASP 143 Ca -0.09 -2.17 -0.23 0.00 0.71 0.00 0.00 54.79 53.01 3dah n ASP 143 Cb 0.52 -0.26 -0.08 0.00 -0.02 0.00 0.00 41.12 41.28 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 -1.30 3.18 0.24 0.53 -4.36 -1.26 -5.10 121.20 113.13 3dah s ILE 144 Ca 0.24 -2.01 -0.31 0.00 -0.26 0.00 0.00 60.65 58.30 3dah s ILE 144 Cb 0.14 -2.74 -0.12 0.00 1.25 0.00 0.00 42.46 40.99 3dah s ILE 144 CO 0.13 -0.36 1.59 -2.65 0.24 0.00 0.00 174.94 173.88 3dah n PRO 145 N -0.85 2.50 -4.02 0.37 -0.02 -1.26 -4.87 135.00 126.85 3dah n PRO 145 Ca -0.06 0.90 -0.31 0.00 -2.02 0.00 0.00 63.50 62.01 3dah n PRO 145 Cb 0.59 -2.67 -0.16 0.00 -0.02 0.00 0.00 33.50 31.25 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 0.39 1.67 -0.38 -1.45 1.01 -1.26 -1.22 120.40 119.16 3dah s VAL 146 Ca 0.70 -0.84 -0.13 0.00 0.00 0.00 0.00 61.98 61.70 3dah s VAL 146 Cb -0.56 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.20 3dah s VAL 146 CO 0.43 0.34 0.25 -1.81 0.00 0.00 0.00 175.10 174.32 3dah s ASP 147 N 1.42 5.94 -0.40 3.32 1.01 -0.38 -5.01 116.67 122.56 3dah s ASP 147 Ca 0.02 -0.84 -0.15 0.00 0.71 0.00 0.00 52.55 52.29 3dah s ASP 147 Cb -0.14 -2.10 0.01 0.00 1.01 0.00 0.00 42.92 41.70 3dah s ASP 147 CO -0.10 -0.38 0.32 0.21 0.21 0.00 0.00 175.17 175.43 3dah s ASN 148 N 1.64 6.12 0.30 0.27 2.47 -1.26 -0.81 114.94 123.68 3dah s ASN 148 Ca 0.04 -0.75 0.06 0.00 0.42 0.00 0.00 52.86 52.63 3dah s ASN 148 Cb -0.19 -2.17 -0.02 0.00 -1.45 0.00 0.00 41.25 37.43 3dah s ASN 148 CO 0.09 -0.44 0.44 0.27 -3.72 0.00 0.00 177.10 173.74 3dah s ILE 149 N 1.79 4.53 -0.05 -5.21 -4.36 0.18 -4.89 121.20 113.20 3dah s ILE 149 Ca 0.07 -0.96 0.06 0.00 -0.26 0.00 0.00 60.65 59.55 3dah s ILE 149 Cb -0.18 -3.59 -0.02 0.00 1.25 0.00 0.00 42.46 39.92 3dah s ILE 149 CO 0.11 -0.24 -0.22 -0.31 0.24 0.00 0.00 174.94 174.52 3dah s TYR 150 N -2.12 2.49 -1.89 1.37 2.02 -1.26 -0.58 117.35 117.38 3dah s TYR 150 Ca 0.41 -0.52 0.31 0.00 -0.37 0.00 0.00 57.07 56.89 3dah s TYR 150 Cb -0.09 -1.59 1.65 0.00 -0.40 0.00 0.00 41.96 41.52 3dah s TYR 150 CO 0.31 -0.09 2.09 0.00 -1.57 0.00 0.00 175.55 176.29 3dah n ALA 151 N 2.72 2.65 -0.23 3.71 0.00 -1.26 -4.37 120.51 123.73 3dah n ALA 151 Ca -0.17 -0.22 -0.00 0.00 0.00 0.00 0.00 53.44 53.04 3dah n ALA 151 Cb 0.52 -1.45 0.07 0.00 0.00 0.00 0.00 19.45 18.58 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 0.33 0.31 -0.79 0.00 2.02 -1.98 0.25 112.91 113.05 3dah h THR 152 Ca 0.00 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.30 3dah h THR 152 Cb 0.16 0.31 -0.06 0.00 -1.74 0.00 0.00 68.15 66.83 3dah h THR 152 CO 0.00 0.00 0.52 -0.65 0.37 0.00 0.00 175.52 175.76 3dah h PRO 153 N -0.01 0.59 0.26 6.66 0.11 -1.89 0.23 132.00 137.95 3dah h PRO 153 Ca 0.32 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.38 3dah h PRO 153 Cb 0.50 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.48 3dah h PRO 153 CO -0.69 0.39 -0.12 0.82 -0.21 0.00 0.00 178.00 178.18 3dah h ILE 154 N 0.61 0.68 -0.15 4.15 2.04 -1.34 -2.09 117.51 121.41 3dah h ILE 154 Ca 0.38 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 3dah h ILE 154 Cb 0.62 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 3dah h ILE 154 CO -0.15 0.15 0.04 -0.07 0.00 0.00 0.00 178.15 178.12 3dah h LEU 155 N -0.86 0.22 -0.74 1.44 3.38 -0.78 -1.51 115.31 116.47 3dah h LEU 155 Ca -0.04 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.59 3dah h LEU 155 Cb 0.51 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3dah h LEU 155 CO 0.06 0.39 -0.30 -0.07 0.09 0.00 0.00 178.44 178.61 3dah h LEU 156 N 0.05 0.64 -0.21 1.67 3.38 -0.72 -0.47 115.31 119.66 3dah h LEU 156 Ca 0.05 -0.25 0.05 0.00 0.09 0.00 0.00 57.88 57.82 3dah h LEU 156 Cb 0.25 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 3dah h LEU 156 CO 0.00 0.91 -0.14 1.23 0.09 0.00 0.00 178.44 180.53 3dah h GLY 157 N 1.01 0.02 1.13 0.83 0.00 -1.23 0.28 103.07 105.11 3dah h GLY 157 Ca 0.07 0.17 -0.14 0.00 0.00 0.00 0.00 47.33 47.43 3dah h GLY 157 CO 0.06 -0.15 -0.27 -1.80 0.00 0.00 0.00 176.54 174.39 3dah h ASP 158 N -0.13 1.02 -0.77 0.19 1.82 -1.12 -1.99 116.42 115.44 3dah h ASP 158 Ca 0.12 -0.41 -0.02 0.00 -0.39 0.00 0.00 57.03 56.33 3dah h ASP 158 Cb 0.31 -0.28 -0.04 0.00 0.68 0.00 0.00 39.33 40.00 3dah h ASP 158 CO -0.29 1.21 0.40 0.25 -1.61 0.00 0.00 179.24 179.21 3dah h LEU 159 N 0.83 0.98 -0.47 2.28 5.85 -0.82 -2.19 115.31 121.77 3dah h LEU 159 Ca 0.10 -0.11 -0.13 0.00 0.84 0.00 0.00 57.88 58.58 3dah h LEU 159 Cb 0.85 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 3dah h LEU 159 CO 0.08 0.81 -0.20 0.03 -0.34 0.00 0.00 178.44 178.81 3dah h ARG 160 N 1.07 0.96 -0.89 1.25 3.08 -0.87 -2.82 114.38 116.17 3dah h ARG 160 Ca 0.27 -0.41 0.13 0.00 0.07 0.00 0.00 59.98 60.04 3dah h ARG 160 Cb 0.07 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.01 3dah h ARG 160 CO -0.04 1.08 0.57 -0.22 -1.07 0.00 0.00 179.97 180.29 3dah h LYS 161 N 0.81 0.71 -0.07 0.04 3.64 -1.07 -2.29 116.57 118.33 3dah h LYS 161 Ca 0.11 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.37 3dah h LYS 161 Cb 0.78 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 3dah h LYS 161 CO 0.06 0.47 -0.30 1.96 -2.27 0.00 0.00 179.45 179.37 3dah h GLN 162 N 0.73 0.14 -4.99 1.90 1.08 -1.13 -3.47 115.11 109.36 3dah h GLN 162 Ca 0.44 -0.05 -0.28 0.00 -1.45 0.00 0.00 58.65 57.31 3dah h GLN 162 Cb 0.66 -0.01 0.13 0.00 -0.05 0.00 0.00 27.48 28.22 3dah h GLN 162 CO -0.20 0.43 -0.62 -1.71 -0.95 0.00 0.00 178.83 175.78 3dah n ASN 163 N -4.14 -2.85 -4.75 1.46 5.15 -0.86 -4.94 115.26 104.31 3dah n ASN 163 Ca -0.01 -0.49 -0.41 0.00 -0.60 0.00 0.00 54.58 53.06 3dah n ASN 163 Cb 0.38 -4.28 -0.03 0.00 -0.53 0.00 0.00 39.78 35.31 3dah n ASN 163 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 3dah s TYR 164 N -3.29 3.31 0.39 1.20 2.02 -1.26 -5.01 117.35 114.70 3dah s TYR 164 Ca 0.11 1.45 -0.24 0.00 -0.37 0.00 0.00 57.07 58.02 3dah s TYR 164 Cb -0.05 -3.51 -0.09 0.00 -0.40 0.00 0.00 41.96 37.91 3dah s TYR 164 CO 0.60 -1.40 1.03 -1.25 -1.57 0.00 0.00 175.55 172.96 3dah s PRO 165 N -1.04 4.23 -1.34 -1.71 0.04 -1.26 -4.17 135.00 129.75 3dah s PRO 165 Ca 0.50 1.48 -0.06 0.00 0.04 0.00 0.00 61.00 62.96 3dah s PRO 165 Cb -0.36 -2.57 0.02 0.00 0.04 0.00 0.00 34.50 31.63 3dah s PRO 165 CO 0.43 -0.08 1.04 -0.25 0.04 0.00 0.00 177.00 178.19 3dah n ASP 166 N 0.00 -4.31 -4.70 6.66 8.00 -1.26 -3.73 116.55 117.21 3dah n ASP 166 Ca 0.05 -0.64 -0.42 0.00 0.71 0.00 0.00 54.79 54.49 3dah n ASP 166 Cb 0.50 -4.74 -0.03 0.00 -0.02 0.00 0.00 41.12 36.83 3dah n ASP 166 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3dah s LEU 167 N -6.98 4.35 -0.05 0.64 2.96 -1.26 -2.06 118.68 116.29 3dah s LEU 167 Ca 0.37 2.38 0.03 0.00 -0.22 0.00 0.00 54.13 56.69 3dah s LEU 167 Cb -0.17 -3.57 0.01 0.00 0.50 0.00 0.00 46.19 42.95 3dah s LEU 167 CO 0.76 -0.79 -0.14 -0.22 -1.32 0.00 0.00 176.35 174.64 3dah s LEU 168 N 2.08 1.77 -0.04 -0.68 2.96 0.11 -4.05 118.68 120.83 3dah s LEU 168 Ca 0.69 -0.31 -0.17 0.00 -0.22 0.00 0.00 54.13 54.12 3dah s LEU 168 Cb -0.38 -0.86 -0.05 0.00 0.50 0.00 0.00 46.19 45.40 3dah s LEU 168 CO 0.30 0.08 0.46 -0.69 -1.32 0.00 0.00 176.35 175.18 3dah s VAL 169 N 0.40 5.05 -0.09 1.68 1.01 -0.80 -0.52 120.40 127.13 3dah s VAL 169 Ca -0.10 0.94 0.03 0.00 0.00 0.00 0.00 61.98 62.85 3dah s VAL 169 Cb -0.14 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.47 3dah s VAL 169 CO 0.03 0.47 -0.20 -0.69 0.00 0.00 0.00 175.10 174.71 3dah s VAL 170 N -0.37 1.72 -0.27 2.92 1.01 -0.47 -0.29 120.40 124.65 3dah s VAL 170 Ca 0.25 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 61.19 3dah s VAL 170 Cb -0.16 -1.51 -0.01 0.00 0.00 0.00 0.00 36.38 34.70 3dah s VAL 170 CO 0.13 0.49 0.69 -0.94 0.00 0.00 0.00 175.10 175.46 3dah s SER 171 N 0.45 6.62 0.28 3.32 1.04 -0.56 -4.44 113.70 120.40 3dah s SER 171 Ca -0.17 0.71 0.07 0.00 0.48 0.00 0.00 55.95 57.03 3dah s SER 171 Cb -0.17 -2.36 0.39 0.00 0.10 0.00 0.00 66.02 63.97 3dah s SER 171 CO 0.07 -0.46 1.65 1.55 0.98 0.00 0.00 173.24 177.03 3dah h PRO 172 N 7.95 0.18 0.00 4.02 0.13 -1.93 -3.40 132.00 138.94 3dah h PRO 172 Ca -0.26 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 3dah h PRO 172 Cb 1.11 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3dah h PRO 172 CO 0.81 0.65 0.00 -0.25 -0.23 0.00 0.00 178.00 178.98 3dah n ASP 173 N -3.94 0.00 0.00 1.44 8.00 -1.26 -5.00 116.55 115.79 3dah n ASP 173 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 3dah n ASP 173 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 3dah n ASP 173 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3dah n VAL 174 N 0.00 0.00 -0.49 2.53 0.24 -1.26 -4.85 118.33 114.50 3dah n VAL 174 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 3dah n VAL 174 Cb 0.00 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.35 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 1.09 2.29 0.00 7.63 0.00 -1.26 -3.08 105.19 111.86 3dah n GLY 175 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 1.71 0.21 0.23 -0.02 0.00 -1.26 -4.92 105.19 101.14 3dah n GLY 176 Ca 0.05 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.17 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 1.81 0.65 0.49 1.61 2.07 -1.91 -1.60 116.25 119.38 3dah h VAL 177 Ca 0.00 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 3dah h VAL 177 Cb 0.70 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 3dah h VAL 177 CO 0.00 0.22 -0.24 0.58 0.02 0.00 0.00 177.57 178.15 3dah h VAL 178 N 0.00 0.42 -0.81 2.57 2.07 -1.91 -1.18 116.25 117.42 3dah h VAL 178 Ca -0.00 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 3dah h VAL 178 Cb 0.61 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 3dah h VAL 178 CO 0.03 0.05 0.40 -0.09 0.02 0.00 0.00 177.57 177.99 3dah h ARG 179 N -0.92 1.15 -0.56 1.57 2.43 -1.93 -2.42 114.38 113.71 3dah h ARG 179 Ca -0.07 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 58.92 3dah h ARG 179 Cb 0.60 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 3dah h ARG 179 CO 0.11 0.87 0.25 0.00 -1.51 0.00 0.00 179.97 179.70 3dah h ALA 180 N 1.21 0.72 -0.16 2.80 0.00 -1.31 -0.59 119.26 121.93 3dah h ALA 180 Ca 0.28 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 3dah h ALA 180 Cb 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3dah h ALA 180 CO -0.04 0.30 -0.49 -0.09 0.00 0.00 0.00 179.25 178.93 3dah h ARG 181 N 0.75 0.42 -0.89 0.00 2.43 -1.16 0.11 114.38 116.04 3dah h ARG 181 Ca 0.19 -0.24 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3dah h ARG 181 Cb 0.15 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.67 3dah h ARG 181 CO -0.02 0.82 0.55 0.00 -1.51 0.00 0.00 179.97 179.81 3dah h ALA 182 N 1.14 1.29 -0.21 2.80 0.00 -1.22 0.13 119.26 123.19 3dah h ALA 182 Ca 0.02 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 3dah h ALA 182 Cb 0.98 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 3dah h ALA 182 CO 0.09 0.62 -0.56 1.25 0.00 0.00 0.00 179.25 180.64 3dah h LEU 183 N 1.22 0.73 -0.57 0.00 5.85 -0.75 -2.73 115.31 119.06 3dah h LEU 183 Ca 0.32 -0.39 -0.08 0.00 0.84 0.00 0.00 57.88 58.57 3dah h LEU 183 Cb -0.08 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 3dah h LEU 183 CO -0.06 1.13 0.06 0.00 -0.34 0.00 0.00 178.44 179.23 3dah h ALA 184 N 0.88 0.76 0.00 1.25 0.00 -0.42 -1.90 119.26 119.83 3dah h ALA 184 Ca 0.01 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 3dah h ALA 184 Cb 1.13 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 3dah h ALA 184 CO 0.11 0.54 -0.20 -0.22 0.00 0.00 0.00 179.25 179.48 3dah h LYS 185 N 0.86 0.00 0.00 0.00 3.64 -0.73 1.91 116.57 122.25 3dah h LYS 185 Ca 0.17 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.37 3dah h LYS 185 Cb 0.46 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 3dah h LYS 185 CO 0.02 0.20 -1.13 0.37 -2.27 0.00 0.00 179.45 176.64 3dah h GLN 186 N 0.00 0.00 0.00 1.90 4.15 -1.25 -3.24 115.11 116.67 3dah h GLN 186 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3dah h GLN 186 Cb 0.40 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.09 3dah h GLN 186 CO 0.03 0.53 -0.99 1.28 -1.93 0.00 0.00 178.83 177.75 3dah n LEU 187 N -3.11 0.87 -3.24 -2.39 4.77 -0.73 -5.02 117.00 108.15 3dah n LEU 187 Ca -0.06 -0.47 -0.06 0.00 -0.03 0.00 0.00 56.01 55.39 3dah n LEU 187 Cb 0.87 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.96 3dah n LEU 187 CO 0.43 0.22 0.20 -3.20 -1.33 0.00 0.00 177.39 173.71 3dah n ASN 188 N -1.51 -7.06 -3.43 -1.43 5.15 0.65 -4.98 115.26 102.65 3dah n ASN 188 Ca 0.03 -0.30 -0.12 0.00 -0.60 0.00 0.00 54.58 53.59 3dah n ASN 188 Cb 0.32 -4.44 -0.04 0.00 -0.53 0.00 0.00 39.78 35.09 3dah n ASN 188 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3dah s ASP 190 N -3.15 4.71 -0.06 0.00 1.01 -1.26 -4.69 116.67 113.24 3dah s ASP 190 Ca 0.26 0.71 0.05 0.00 0.71 0.00 0.00 52.55 54.29 3dah s ASP 190 Cb -0.01 -1.29 -0.01 0.00 1.01 0.00 0.00 42.92 42.62 3dah s ASP 190 CO 0.16 -1.74 -0.22 -0.22 0.21 0.00 0.00 175.17 173.36 3dah s LEU 191 N -5.44 2.00 0.17 1.23 1.98 -1.26 -1.90 118.68 115.46 3dah s LEU 191 Ca 0.61 -0.45 0.09 0.00 -2.89 0.00 0.00 54.13 51.49 3dah s LEU 191 Cb -0.11 -1.21 -0.04 0.00 0.66 0.00 0.00 46.19 45.49 3dah s LEU 191 CO 0.48 0.20 -0.20 0.00 -1.89 0.00 0.00 176.35 174.94 3dah s ALA 192 N -0.02 2.14 0.00 5.97 0.00 0.60 -4.74 121.76 125.70 3dah s ALA 192 Ca -0.05 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.38 3dah s ALA 192 Cb -0.13 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.77 3dah s ALA 192 CO 0.04 0.28 0.00 -0.89 0.00 0.00 0.00 175.76 175.18 3dah n ILE 193 N 0.27 0.00 0.00 0.00 5.41 -1.26 -1.50 119.36 122.27 3dah n ILE 193 Ca -0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.62 3dah n ILE 193 Cb 0.57 -0.38 0.00 0.00 -0.71 0.00 0.00 39.64 39.12 3dah n ILE 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3dah n GLY 211 N 2.48 -1.35 3.47 7.39 0.00 -1.26 -4.95 105.19 110.96 3dah n GLY 211 Ca 0.00 -2.06 -0.33 0.00 0.00 0.00 0.00 46.02 43.63 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 0.00 2.66 0.00 1.61 8.01 -1.26 -5.05 118.70 124.67 3dah s GLU 212 Ca 0.00 -0.68 0.00 0.00 0.01 0.00 0.00 54.97 54.30 3dah s GLU 212 Cb 0.00 -2.43 0.00 0.00 -4.31 0.00 0.00 34.13 27.39 3dah s GLU 212 CO 0.00 0.56 0.00 0.28 0.01 0.00 0.00 175.26 176.11 3dah n VAL 213 N 2.49 0.00 -1.93 2.63 0.31 -1.26 -4.90 118.33 115.66 3dah n VAL 213 Ca -0.17 -0.05 -0.41 0.00 -0.01 0.00 0.00 64.34 63.69 3dah n VAL 213 Cb 0.52 0.49 -0.02 0.00 -0.91 0.00 0.00 33.84 33.93 3dah n VAL 213 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 3dah s GLU 214 N -0.42 4.22 0.00 5.55 2.12 -1.25 -3.02 118.70 125.89 3dah s GLU 214 Ca 0.00 2.41 0.00 0.00 0.36 0.00 0.00 54.97 57.74 3dah s GLU 214 Cb 0.00 -3.05 0.00 0.00 0.26 0.00 0.00 34.13 31.34 3dah s GLU 214 CO 0.00 -0.45 0.00 0.41 -0.54 0.00 0.00 175.26 174.68 3dah n GLY 215 N 1.59 1.43 3.62 -1.50 0.00 -0.75 -4.91 105.19 104.67 3dah n GLY 215 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.27 2.45 -0.40 1.61 0.52 -1.17 -4.46 118.95 117.22 3dah s ARG 216 Ca 0.00 -0.83 -0.27 0.00 -0.52 0.00 0.00 55.73 54.11 3dah s ARG 216 Cb 0.00 -2.46 0.02 0.00 0.52 0.00 0.00 34.95 33.03 3dah s ARG 216 CO 0.00 0.56 1.00 0.99 0.02 0.00 0.00 175.30 177.88 3dah s THR 217 N -1.14 4.46 -0.12 0.02 2.01 -0.87 -1.41 115.64 118.59 3dah s THR 217 Ca 0.21 1.23 -0.12 0.00 0.31 0.00 0.00 61.69 63.31 3dah s THR 217 Cb -0.11 -4.43 -0.05 0.00 0.01 0.00 0.00 72.50 67.92 3dah s THR 217 CO 0.12 -0.69 0.28 0.00 -0.69 0.00 0.00 174.62 173.64 3dah s VAL 219 N -0.18 1.58 -0.15 0.00 0.11 0.32 -0.31 120.40 121.78 3dah s VAL 219 Ca 0.17 -0.72 -0.04 0.00 -2.93 0.00 0.00 61.98 58.46 3dah s VAL 219 Cb -0.13 -1.41 -0.03 0.00 -1.53 0.00 0.00 36.38 33.28 3dah s VAL 219 CO 0.06 0.45 -0.03 -0.63 -3.33 0.00 0.00 175.10 171.62 3dah s ILE 220 N 0.66 3.98 -0.13 7.04 1.01 0.06 -1.37 121.20 132.45 3dah s ILE 220 Ca -0.13 -0.33 0.02 0.00 0.00 0.00 0.00 60.65 60.20 3dah s ILE 220 Cb -0.16 -2.74 0.01 0.00 0.01 0.00 0.00 42.46 39.59 3dah s ILE 220 CO 0.04 0.51 -0.18 -0.32 0.00 0.00 0.00 174.94 174.98 3dah s MET 221 N 0.20 2.61 0.25 2.79 1.75 -1.26 0.42 119.30 126.06 3dah s MET 221 Ca -0.01 -0.70 0.09 0.00 -1.25 0.00 0.00 55.69 53.82 3dah s MET 221 Cb -0.14 -2.20 -0.05 0.00 2.84 0.00 0.00 34.83 35.28 3dah s MET 221 CO 0.03 -0.09 -0.13 -0.51 -0.65 0.00 0.00 175.02 173.66 3dah s ASP 222 N 1.04 2.98 0.38 1.11 1.11 -0.12 -4.96 116.67 118.22 3dah s ASP 222 Ca -0.03 -1.08 0.20 0.00 0.18 0.00 0.00 52.55 51.81 3dah s ASP 222 Cb -0.15 -0.20 0.26 0.00 1.07 0.00 0.00 42.92 43.90 3dah s ASP 222 CO -0.05 -0.16 1.55 -2.24 1.18 0.00 0.00 175.17 175.45 3dah h ASP 223 N 2.37 0.00 -4.44 0.27 2.03 -1.94 -3.18 116.42 111.53 3dah h ASP 223 Ca -0.39 0.00 -0.16 0.00 -0.73 0.00 0.00 57.03 55.75 3dah h ASP 223 Cb 1.24 0.00 -0.23 0.00 -0.83 0.00 0.00 39.33 39.51 3dah h ASP 223 CO 0.64 0.21 -0.47 -0.32 -1.03 0.00 0.00 179.24 178.27 3dah s MET 224 N -3.13 0.38 -0.16 4.15 0.00 -1.26 -1.00 119.30 118.29 3dah s MET 224 Ca 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 55.69 55.66 3dah s MET 224 Cb 0.06 0.17 0.04 0.00 0.00 0.00 0.00 34.83 35.10 3dah s MET 224 CO 0.70 -0.08 -0.03 0.54 0.00 0.00 0.00 175.02 176.15 3dah s VAL 225 N -0.69 0.92 0.00 10.11 0.11 0.19 -4.90 120.40 126.12 3dah s VAL 225 Ca -0.08 -0.51 0.00 0.00 -2.93 0.00 0.00 61.98 58.46 3dah s VAL 225 Cb -0.05 -1.14 0.00 0.00 -1.53 0.00 0.00 36.38 33.67 3dah s VAL 225 CO 0.01 0.10 0.00 -0.67 -3.33 0.00 0.00 175.10 171.21 3dah n ASP 226 N 4.94 0.00 0.05 3.54 2.03 -1.26 -0.83 116.55 125.02 3dah n ASP 226 Ca -0.11 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.17 3dah n ASP 226 Cb 0.48 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.80 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 0.97 0.00 5.18 1.35 -1.93 -0.90 112.91 117.58 3dah h THR 227 Ca 0.00 -2.57 0.00 0.00 -0.55 0.00 0.00 66.41 63.29 3dah h THR 227 Cb 0.00 2.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.84 3dah h THR 227 CO 0.00 0.55 0.00 0.00 -0.25 0.00 0.00 175.52 175.82 3dah n ALA 228 N -2.38 0.00 -0.05 6.62 0.00 -1.26 -4.35 120.51 119.09 3dah n ALA 228 Ca -0.06 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.44 3dah n ALA 228 Cb 0.89 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.76 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 0.64 0.56 0.00 0.00 -1.96 0.26 103.07 102.57 3dah h GLY 229 Ca 0.00 -0.22 -0.14 0.00 0.00 0.00 0.00 47.33 46.96 3dah h GLY 229 CO 0.00 0.20 -0.61 -0.84 0.00 0.00 0.00 176.54 175.29 3dah h THR 230 N 0.57 1.56 -0.20 4.70 2.02 -1.99 -2.99 112.91 116.57 3dah h THR 230 Ca 0.20 -2.41 0.05 0.00 0.77 0.00 0.00 66.41 65.02 3dah h THR 230 Cb 0.09 3.14 -0.05 0.00 -1.74 0.00 0.00 68.15 69.59 3dah h THR 230 CO -0.05 0.67 -0.14 0.25 0.37 0.00 0.00 175.52 176.62 3dah h LEU 231 N -0.46 -0.45 -0.64 2.58 7.12 -1.78 -2.07 115.31 119.61 3dah h LEU 231 Ca -0.10 0.10 -0.13 0.00 0.13 0.00 0.00 57.88 57.88 3dah h LEU 231 Cb 1.45 0.23 -0.02 0.00 -0.53 0.00 0.00 40.66 41.79 3dah h LEU 231 CO 0.11 -0.18 -0.61 0.00 -0.13 0.00 0.00 178.44 177.64 3dah h LYS 233 N 0.00 0.62 -0.27 0.00 1.57 -1.35 -2.37 116.57 114.77 3dah h LYS 233 Ca -0.01 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.65 3dah h LYS 233 Cb 1.17 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 3dah h LYS 233 CO 0.08 0.62 0.15 0.00 -0.57 0.00 0.00 179.45 179.73 3dah h ALA 234 N 0.97 0.33 -0.61 3.86 0.00 -1.19 -1.41 119.26 121.20 3dah h ALA 234 Ca 0.13 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.12 3dah h ALA 234 Cb 0.26 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 3dah h ALA 234 CO -0.00 -0.24 0.26 0.00 0.00 0.00 0.00 179.25 179.27 3dah h ALA 235 N 1.12 0.81 0.37 0.00 0.00 -1.35 0.44 119.26 120.66 3dah h ALA 235 Ca 0.11 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3dah h ALA 235 Cb 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3dah h ALA 235 CO -0.06 -0.14 -0.23 0.37 0.00 0.00 0.00 179.25 179.20 3dah h GLN 236 N 0.47 -0.55 -0.15 0.00 4.15 -1.07 -2.13 115.11 115.83 3dah h GLN 236 Ca 0.30 0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.79 3dah h GLN 236 Cb 0.33 0.13 -0.03 0.00 0.21 0.00 0.00 27.48 28.12 3dah h GLN 236 CO -0.27 -0.37 -0.02 0.28 -1.93 0.00 0.00 178.83 176.52 3dah h VAL 237 N -0.57 0.87 -0.75 2.39 2.07 -0.94 -2.46 116.25 116.86 3dah h VAL 237 Ca -0.04 -0.01 0.11 0.00 0.82 0.00 0.00 66.70 67.58 3dah h VAL 237 Cb 0.47 0.84 -0.08 0.00 -1.52 0.00 0.00 31.29 31.00 3dah h VAL 237 CO 0.05 0.00 0.36 -0.07 0.02 0.00 0.00 177.57 177.93 3dah h LEU 238 N 0.03 0.43 -1.45 2.57 3.38 -0.88 -0.68 115.31 118.70 3dah h LEU 238 Ca 0.07 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3dah h LEU 238 Cb 0.10 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3dah h LEU 238 CO -0.14 0.22 0.00 0.11 0.09 0.00 0.00 178.44 178.72 3dah h LYS 239 N 0.57 0.00 0.08 1.13 1.57 -1.03 -1.41 116.57 117.48 3dah h LYS 239 Ca 0.39 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.91 3dah h LYS 239 Cb 0.48 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 3dah h LYS 239 CO -0.32 0.00 -1.24 0.93 -0.57 0.00 0.00 179.45 178.26 3dah h GLU 240 N 0.00 0.16 -0.28 3.15 5.08 -0.68 -2.38 114.58 119.62 3dah h GLU 240 Ca 0.00 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 3dah h GLU 240 Cb 0.49 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3dah h GLU 240 CO 0.00 1.08 0.00 0.54 -1.00 0.00 0.00 179.01 179.63 3dah n ARG 241 N -3.43 1.69 -0.42 2.33 5.12 -0.99 -4.92 116.66 116.04 3dah n ARG 241 Ca -0.07 -1.07 0.00 0.00 -1.93 0.00 0.00 57.85 54.77 3dah n ARG 241 Cb 1.00 -1.26 0.00 0.00 -1.16 0.00 0.00 32.46 31.04 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 1.00 0.76 3.62 -0.13 0.00 -0.90 -3.88 105.19 105.66 3dah n GLY 242 Ca 0.11 -0.30 -0.47 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.73 0.13 0.25 4.61 0.00 -0.56 -1.80 120.51 122.41 3dah n ALA 243 Ca 0.00 0.43 -0.15 0.00 0.00 0.00 0.00 53.44 53.72 3dah n ALA 243 Cb 0.00 -2.14 -0.08 0.00 0.00 0.00 0.00 19.45 17.23 3dah n ALA 243 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3dah h LYS 244 N 3.64 -0.59 -4.04 0.00 3.64 -1.46 -3.44 116.57 114.33 3dah h LYS 244 Ca -0.44 0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 58.87 3dah h LYS 244 Cb 1.31 0.13 -0.14 0.00 -0.41 0.00 0.00 32.23 33.12 3dah h LYS 244 CO 0.72 -0.34 -0.50 -0.65 -2.27 0.00 0.00 179.45 176.42 3dah s GLN 245 N -5.64 0.83 -0.09 1.90 -0.21 -1.25 -4.99 119.66 110.21 3dah s GLN 245 Ca -0.16 -1.14 0.00 0.00 0.02 0.00 0.00 55.36 54.09 3dah s GLN 245 Cb 0.03 0.29 0.02 0.00 1.00 0.00 0.00 33.01 34.36 3dah s GLN 245 CO 0.60 -0.24 -0.07 0.08 -2.12 0.00 0.00 175.29 173.54 3dah s VAL 246 N -3.92 0.90 0.06 1.09 1.01 -1.26 -0.94 120.40 117.34 3dah s VAL 246 Ca 0.10 -0.26 0.09 0.00 0.00 0.00 0.00 61.98 61.92 3dah s VAL 246 Cb 0.06 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 3dah s VAL 246 CO -0.07 0.33 -0.26 -0.36 0.00 0.00 0.00 175.10 174.74 3dah s PHE 247 N 1.37 2.33 -0.05 5.22 0.08 0.58 -0.83 117.98 126.67 3dah s PHE 247 Ca -0.02 -0.40 0.04 0.00 0.12 0.00 0.00 56.93 56.67 3dah s PHE 247 Cb -0.14 -1.37 -0.00 0.00 -0.57 0.00 0.00 43.02 40.94 3dah s PHE 247 CO -0.04 0.17 -0.18 0.00 -0.10 0.00 0.00 175.22 175.07 3dah s ALA 248 N -0.85 1.65 -0.12 5.36 0.00 -0.48 -0.76 121.76 126.56 3dah s ALA 248 Ca 0.12 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.37 3dah s ALA 248 Cb -0.10 -0.57 0.01 0.00 0.00 0.00 0.00 23.12 22.46 3dah s ALA 248 CO 0.03 0.27 -0.18 0.71 0.00 0.00 0.00 175.76 176.59 3dah s TYR 249 N 0.14 2.24 -0.04 0.00 2.02 0.17 -0.18 117.35 121.70 3dah s TYR 249 Ca -0.07 -1.09 -0.07 0.00 -0.37 0.00 0.00 57.07 55.47 3dah s TYR 249 Cb -0.13 -1.57 0.01 0.00 -0.40 0.00 0.00 41.96 39.87 3dah s TYR 249 CO 0.03 -0.53 0.17 0.00 -1.57 0.00 0.00 175.55 173.66 3dah s ALA 250 N 0.91 -0.42 -0.05 3.71 0.00 -0.11 -0.94 121.76 124.86 3dah s ALA 250 Ca -0.07 0.24 -0.22 0.00 0.00 0.00 0.00 51.96 51.91 3dah s ALA 250 Cb -0.15 -0.11 -0.17 0.00 0.00 0.00 0.00 23.12 22.69 3dah s ALA 250 CO -0.02 -0.15 0.92 1.15 0.00 0.00 0.00 175.76 177.66 3dah h THR 251 N 4.57 0.93 -3.62 0.00 2.02 -1.47 -3.18 112.91 112.15 3dah h THR 251 Ca -0.28 -1.16 -0.67 0.00 0.77 0.00 0.00 66.41 65.06 3dah h THR 251 Cb 1.19 1.56 -0.24 0.00 -1.74 0.00 0.00 68.15 68.92 3dah h THR 251 CO 0.40 0.24 -0.59 -1.00 0.37 0.00 0.00 175.52 174.93 3dah s HIS 252 N -3.48 3.16 -1.25 3.16 3.76 -0.17 -2.41 115.29 118.05 3dah s HIS 252 Ca -0.13 -0.78 -0.14 0.00 -0.15 0.00 0.00 55.06 53.86 3dah s HIS 252 Cb 0.00 -2.30 0.15 0.00 1.11 0.00 0.00 32.58 31.54 3dah s HIS 252 CO 0.50 -0.52 1.58 -0.35 -0.85 0.00 0.00 174.74 175.11 3dah n PRO 253 N 4.92 3.35 0.29 8.40 -0.04 -1.26 -0.64 135.00 150.01 3dah n PRO 253 Ca -0.14 -3.65 -0.15 0.00 -0.04 0.00 0.00 63.50 59.51 3dah n PRO 253 Cb 0.49 -3.12 -0.08 0.00 -0.04 0.00 0.00 33.50 30.74 3dah n PRO 253 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3dah h VAL 254 N 4.68 0.39 -5.70 0.52 2.07 -1.40 -3.45 116.25 113.36 3dah h VAL 254 Ca 0.36 -0.29 -0.30 0.00 0.82 0.00 0.00 66.70 67.29 3dah h VAL 254 Cb 0.83 0.50 0.16 0.00 -1.52 0.00 0.00 31.29 31.26 3dah h VAL 254 CO 1.36 0.04 -0.87 0.18 0.02 0.00 0.00 177.57 178.31 3dah n LEU 255 N -5.33 -4.77 -4.63 2.57 4.77 -0.01 -4.96 117.00 104.64 3dah n LEU 255 Ca -0.12 -0.79 -0.26 0.00 -0.03 0.00 0.00 56.01 54.81 3dah n LEU 255 Cb 0.33 -2.95 -0.09 0.00 -2.33 0.00 0.00 43.42 38.37 3dah n LEU 255 CO 0.33 0.19 -0.29 -0.94 -1.33 0.00 0.00 177.39 175.34 3dah s SER 256 N -3.40 4.05 -0.20 -1.43 1.04 -0.36 -4.63 113.70 108.77 3dah s SER 256 Ca 0.45 -1.13 -0.07 0.00 0.48 0.00 0.00 55.95 55.68 3dah s SER 256 Cb -0.09 -0.45 -0.20 0.00 0.10 0.00 0.00 66.02 65.37 3dah s SER 256 CO 0.78 -0.33 0.04 0.61 0.98 0.00 0.00 173.24 175.32 3dah n GLY 257 N -0.97 -0.52 2.18 7.32 0.00 -1.26 -3.15 105.19 108.78 3dah n GLY 257 Ca -0.04 -0.16 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 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 1.89 5.20 0.06 -0.02 0.00 -1.26 -4.73 105.19 106.33 3dah n GLY 258 Ca -0.40 -1.69 -0.13 0.00 0.00 0.00 0.00 46.02 43.81 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 1.47 -0.02 -0.62 4.61 0.00 -1.75 -2.01 119.26 120.93 3dah h ALA 259 Ca 0.58 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.35 3dah h ALA 259 Cb 1.85 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.61 3dah h ALA 259 CO 1.24 -0.35 0.39 0.00 0.00 0.00 0.00 179.25 180.53 3dah h ALA 260 N 0.62 0.80 -0.41 0.00 0.00 -1.84 -0.15 119.26 118.28 3dah h ALA 260 Ca -0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3dah h ALA 260 Cb 0.34 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3dah h ALA 260 CO 0.00 0.15 0.21 -0.44 0.00 0.00 0.00 179.25 179.17 3dah h ASP 261 N 0.77 0.52 1.02 0.00 3.32 -1.86 -2.19 116.42 118.01 3dah h ASP 261 Ca 0.25 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.13 3dah h ASP 261 Cb -0.00 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3dah h ASP 261 CO -0.09 0.47 -0.31 0.08 -1.72 0.00 0.00 179.24 177.67 3dah h ARG 262 N 0.52 0.00 -0.24 3.56 0.11 -0.90 -2.23 114.38 115.21 3dah h ARG 262 Ca 0.14 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.14 3dah h ARG 262 Cb 0.08 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.15 3dah h ARG 262 CO -0.02 0.31 -0.16 0.82 0.10 0.00 0.00 179.97 181.02 3dah h ILE 263 N 0.00 1.31 -0.33 0.08 2.04 -0.97 -3.05 117.51 116.59 3dah h ILE 263 Ca -0.00 -1.28 0.06 0.00 1.00 0.00 0.00 64.86 64.63 3dah h ILE 263 Cb 0.91 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 38.55 3dah h ILE 263 CO 0.04 0.40 -0.01 0.00 0.00 0.00 0.00 178.15 178.58 3dah h ALA 264 N 0.70 0.29 -0.02 1.87 0.00 -1.11 -2.69 119.26 118.30 3dah h ALA 264 Ca 0.05 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3dah h ALA 264 Cb 0.69 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3dah h ALA 264 CO 0.04 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 178.88 3dah n ALA 265 N -2.50 2.50 -2.35 0.00 0.00 -0.86 -4.92 120.51 112.38 3dah n ALA 265 Ca 0.01 -0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.20 3dah n ALA 265 Cb 0.18 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.03 5.42 0.00 0.00 1.04 -1.02 -4.99 113.70 113.13 3dah s SER 266 Ca 0.03 -0.49 0.13 0.00 0.48 0.00 0.00 55.95 56.10 3dah s SER 266 Cb 0.01 -0.88 0.74 0.00 0.10 0.00 0.00 66.02 66.00 3dah s SER 266 CO 0.02 -0.50 1.26 0.00 0.98 0.00 0.00 173.24 175.00 3dah n ALA 267 N -1.54 1.91 -2.51 5.32 0.00 -1.26 -4.77 120.51 117.65 3dah n ALA 267 Ca 0.01 -0.08 -0.42 0.00 0.00 0.00 0.00 53.44 52.96 3dah n ALA 267 Cb 0.60 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.80 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 -2.21 4.34 -0.07 0.00 2.96 -1.26 -4.62 118.68 117.81 3dah s LEU 268 Ca 0.17 1.85 -0.26 0.00 -0.22 0.00 0.00 54.13 55.67 3dah s LEU 268 Cb 0.09 -3.57 -0.24 0.00 0.50 0.00 0.00 46.19 42.97 3dah s LEU 268 CO 0.17 -0.45 0.97 0.44 -1.32 0.00 0.00 176.35 176.15 3dah h ASP 269 N 7.01 0.16 -5.07 3.68 3.32 -1.29 -3.48 116.42 120.75 3dah h ASP 269 Ca -0.39 -0.83 -0.06 0.00 0.02 0.00 0.00 57.03 55.78 3dah h ASP 269 Cb 1.20 -0.05 -0.14 0.00 0.22 0.00 0.00 39.33 40.56 3dah h ASP 269 CO 0.82 0.96 -0.09 -1.83 -1.72 0.00 0.00 179.24 177.38 3dah s GLU 270 N -2.92 1.03 -0.19 3.56 -1.05 -1.24 -4.84 118.70 113.05 3dah s GLU 270 Ca -0.17 -0.66 0.01 0.00 -0.15 0.00 0.00 54.97 54.01 3dah s GLU 270 Cb -0.00 0.45 0.03 0.00 -0.44 0.00 0.00 34.13 34.17 3dah s GLU 270 CO 0.73 -0.39 -0.16 -1.17 0.95 0.00 0.00 175.26 175.22 3dah s LEU 271 N -2.66 2.33 -0.20 1.83 2.96 0.39 -1.38 118.68 121.96 3dah s LEU 271 Ca 0.02 -0.81 -0.09 0.00 -0.22 0.00 0.00 54.13 53.03 3dah s LEU 271 Cb 0.02 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.26 3dah s LEU 271 CO -0.10 -0.07 0.10 -0.69 -1.32 0.00 0.00 176.35 174.26 3dah s VAL 272 N 1.30 5.01 0.35 1.68 1.01 0.75 -1.39 120.40 129.11 3dah s VAL 272 Ca 0.01 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.08 3dah s VAL 272 Cb -0.15 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 3dah s VAL 272 CO -0.10 0.43 0.08 0.68 0.00 0.00 0.00 175.10 176.19 3dah s VAL 273 N 0.56 0.95 0.49 2.92 -7.23 0.11 -0.94 120.40 117.26 3dah s VAL 273 Ca 0.05 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.30 3dah s VAL 273 Cb -0.12 -2.64 0.04 0.00 0.56 0.00 0.00 36.38 34.22 3dah s VAL 273 CO 0.01 0.00 0.67 0.42 -0.31 0.00 0.00 175.10 175.89 3dah s THR 274 N -3.31 2.68 -0.45 5.32 -4.23 -1.01 0.13 115.64 114.76 3dah s THR 274 Ca 0.32 -0.95 0.01 0.00 -1.18 0.00 0.00 61.69 59.89 3dah s THR 274 Cb 0.07 -2.72 0.44 0.00 1.34 0.00 0.00 72.50 71.63 3dah s THR 274 CO 0.15 0.00 1.89 -0.90 -0.54 0.00 0.00 174.62 175.21 3dah n ASP 275 N -2.06 5.47 0.16 3.99 5.75 -0.52 -4.47 116.55 124.87 3dah n ASP 275 Ca 0.11 -3.40 0.02 0.00 -0.01 0.00 0.00 54.79 51.50 3dah n ASP 275 Cb 0.60 -0.89 0.28 0.00 -1.03 0.00 0.00 41.12 40.07 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 0.90 1.26 -3.44 2.12 1.35 -1.88 -3.40 112.91 109.83 3dah h THR 276 Ca 0.50 -1.70 -0.67 0.00 -0.55 0.00 0.00 66.41 63.99 3dah h THR 276 Cb 1.65 1.94 -0.33 0.00 -1.73 0.00 0.00 68.15 69.68 3dah h THR 276 CO 1.09 0.47 -0.88 -0.63 -0.25 0.00 0.00 175.52 175.32 3dah s ILE 277 N -3.81 2.02 0.31 6.82 1.01 -1.26 -4.54 121.20 121.75 3dah s ILE 277 Ca -0.02 -1.01 -0.29 0.00 0.00 0.00 0.00 60.65 59.34 3dah s ILE 277 Cb 0.13 -1.75 -0.10 0.00 0.01 0.00 0.00 42.46 40.75 3dah s ILE 277 CO 0.73 0.55 1.31 -2.84 0.00 0.00 0.00 174.94 174.69 3dah s PRO 278 N 0.28 4.37 0.37 2.79 0.02 -1.26 -4.76 135.00 136.81 3dah s PRO 278 Ca -0.17 2.18 -0.26 0.00 0.02 0.00 0.00 61.00 62.78 3dah s PRO 278 Cb -0.17 -3.10 -0.09 0.00 0.02 0.00 0.00 34.50 31.16 3dah s PRO 278 CO 0.08 -0.19 1.07 -0.51 -0.33 0.00 0.00 177.00 177.12 3dah s LEU 279 N -1.46 4.26 0.00 -5.54 1.43 -1.26 -5.06 118.68 111.05 3dah s LEU 279 Ca 0.50 2.13 -0.13 0.00 -1.03 0.00 0.00 54.13 55.60 3dah s LEU 279 Cb -0.39 -4.01 0.19 0.00 0.03 0.00 0.00 46.19 42.01 3dah s LEU 279 CO 0.50 -0.41 0.77 -1.54 0.23 0.00 0.00 176.35 175.90 3dah n SER 280 N 0.30 -1.30 0.15 2.29 3.41 -1.26 -4.76 113.62 112.45 3dah n SER 280 Ca 0.03 -1.04 -0.13 0.00 -0.26 0.00 0.00 58.87 57.47 3dah n SER 280 Cb 0.48 -0.68 -0.08 0.00 -0.26 0.00 0.00 64.21 63.67 3dah n SER 280 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dah h ALA 281 N -2.34 -0.38 0.00 7.33 0.00 -1.98 -1.33 119.26 120.55 3dah h ALA 281 Ca -0.28 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3dah h ALA 281 Cb 0.83 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 3dah h ALA 281 CO 0.19 -0.55 -0.05 1.05 0.00 0.00 0.00 179.25 179.89 3dah h GLU 282 N -0.72 0.00 0.08 0.00 4.11 -1.98 0.52 114.58 116.58 3dah h GLU 282 Ca -0.04 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.14 3dah h GLU 282 Cb 0.49 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 3dah h GLU 282 CO 0.06 0.05 -1.16 0.77 0.07 0.00 0.00 179.01 178.81 3dah h SER 283 N 0.00 0.25 1.04 3.06 0.02 -1.90 -2.75 113.55 113.26 3dah h SER 283 Ca -0.00 -0.27 -0.06 0.00 -0.84 0.00 0.00 61.79 60.62 3dah h SER 283 Cb 0.17 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 3dah h SER 283 CO 0.01 1.22 -0.27 -0.07 -1.14 0.00 0.00 176.83 176.57 3dah h LEU 284 N 0.04 0.00 -0.07 5.07 3.38 -0.20 -3.17 115.31 120.37 3dah h LEU 284 Ca -0.09 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.63 3dah h LEU 284 Cb 1.89 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.66 3dah h LEU 284 CO 0.17 0.27 -0.99 0.00 0.09 0.00 0.00 178.44 177.99 3dah h ALA 285 N 1.73 0.21 -2.14 1.53 0.00 -0.95 -3.44 119.26 116.21 3dah h ALA 285 Ca -0.00 -0.69 -0.56 0.00 0.00 0.00 0.00 54.91 53.66 3dah h ALA 285 Cb 0.86 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3dah h ALA 285 CO 0.04 0.72 1.31 0.00 0.00 0.00 0.00 179.25 181.31 3dah n PRO 287 N 8.04 0.03 0.01 0.00 -0.04 -1.26 -3.03 135.00 138.76 3dah n PRO 287 Ca 0.23 0.16 0.12 0.00 -0.04 0.00 0.00 63.50 63.98 3dah n PRO 287 Cb 0.44 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.69 3dah n PRO 287 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3dah n LYS 288 N -1.48 0.05 -3.64 0.54 5.02 -1.26 -4.81 118.16 112.58 3dah n LYS 288 Ca 0.05 0.01 -0.39 0.00 -2.02 0.00 0.00 58.31 55.97 3dah n LYS 288 Cb 0.22 -1.53 -0.11 0.00 -0.02 0.00 0.00 35.03 33.58 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 -3.03 4.64 -0.12 -0.18 1.01 -1.17 -0.46 121.20 121.91 3dah s ILE 289 Ca 0.11 -0.48 0.02 0.00 0.00 0.00 0.00 60.65 60.30 3dah s ILE 289 Cb 0.17 -3.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.23 3dah s ILE 289 CO 0.68 0.01 -0.19 -0.60 0.00 0.00 0.00 174.94 174.84 3dah s ARG 290 N 1.61 3.21 -0.11 2.79 3.52 -0.49 -4.98 118.95 124.50 3dah s ARG 290 Ca 0.04 -0.79 0.00 0.00 -0.13 0.00 0.00 55.73 54.86 3dah s ARG 290 Cb -0.17 -2.46 -0.02 0.00 -1.56 0.00 0.00 34.95 30.73 3dah s ARG 290 CO 0.07 0.19 -0.11 0.00 -0.81 0.00 0.00 175.30 174.64 3dah s ALA 291 N 0.36 2.76 -0.01 6.12 0.00 -1.26 -0.71 121.76 129.02 3dah s ALA 291 Ca -0.15 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 50.93 3dah s ALA 291 Cb -0.17 -1.23 -0.03 0.00 0.00 0.00 0.00 23.12 21.69 3dah s ALA 291 CO 0.07 0.36 -0.03 -0.51 0.00 0.00 0.00 175.76 175.65 3dah s LEU 292 N -0.06 3.38 0.06 0.00 1.43 0.12 -4.91 118.68 118.70 3dah s LEU 292 Ca -0.01 -0.04 -0.31 0.00 -1.03 0.00 0.00 54.13 52.74 3dah s LEU 292 Cb -0.14 -1.91 -0.06 0.00 0.03 0.00 0.00 46.19 44.11 3dah s LEU 292 CO 0.03 0.30 1.28 -0.55 0.23 0.00 0.00 176.35 177.64 3dah s SER 293 N -1.40 6.98 0.00 2.29 0.15 -1.26 -1.44 113.70 119.02 3dah s SER 293 Ca 0.18 2.09 0.21 0.00 0.70 0.00 0.00 55.95 59.14 3dah s SER 293 Cb -0.11 -2.58 0.60 0.00 -1.71 0.00 0.00 66.02 62.22 3dah s SER 293 CO 0.08 -0.56 1.48 -1.54 1.20 0.00 0.00 173.24 173.89 3dah n SER 294 N 4.25 2.37 -0.23 5.45 3.41 -1.26 -4.53 113.62 123.07 3dah n SER 294 Ca 0.10 -1.83 -0.07 0.00 -0.26 0.00 0.00 58.87 56.82 3dah n SER 294 Cb 0.45 -0.16 0.04 0.00 -0.26 0.00 0.00 64.21 64.28 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 4.22 0.82 -0.70 7.33 0.00 -1.90 -1.80 119.26 127.23 3dah h ALA 295 Ca 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3dah h ALA 295 Cb 0.68 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3dah h ALA 295 CO 0.00 0.37 0.29 0.78 0.00 0.00 0.00 179.25 180.69 3dah h GLY 296 N 0.88 1.11 1.03 0.00 0.00 -1.92 -1.34 103.07 102.84 3dah h GLY 296 Ca 0.22 -0.59 -0.06 0.00 0.00 0.00 0.00 47.33 46.90 3dah h GLY 296 CO -0.03 0.56 0.16 -2.00 0.00 0.00 0.00 176.54 175.23 3dah h LEU 297 N 0.99 0.95 -0.25 3.11 5.85 -1.80 -1.87 115.31 122.29 3dah h LEU 297 Ca 0.23 -0.23 -0.09 0.00 0.84 0.00 0.00 57.88 58.64 3dah h LEU 297 Cb 0.19 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 3dah h LEU 297 CO -0.02 0.93 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.75 3dah h LEU 298 N 0.93 0.60 -0.51 2.25 3.38 -1.17 -2.65 115.31 118.14 3dah h LEU 298 Ca 0.20 -0.44 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 3dah h LEU 298 Cb 0.34 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3dah h LEU 298 CO 0.00 0.92 0.03 0.00 0.09 0.00 0.00 178.44 179.48 3dah h ALA 299 N 0.70 0.69 -0.71 1.53 0.00 -1.16 -0.25 119.26 120.06 3dah h ALA 299 Ca 0.05 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 3dah h ALA 299 Cb 0.72 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 3dah h ALA 299 CO 0.05 0.47 0.21 1.49 0.00 0.00 0.00 179.25 181.47 3dah h GLU 300 N 0.76 1.12 0.32 0.00 4.57 -1.43 -1.36 114.58 118.57 3dah h GLU 300 Ca 0.15 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 3dah h GLU 300 Cb 0.47 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 3dah h GLU 300 CO 0.02 0.96 -0.23 1.15 -1.18 0.00 0.00 179.01 179.74 3dah h THR 301 N 1.06 0.52 -0.56 0.32 2.02 -1.08 0.12 112.91 115.30 3dah h THR 301 Ca 0.23 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.52 3dah h THR 301 Cb 0.32 0.52 -0.09 0.00 -1.74 0.00 0.00 68.15 67.16 3dah h THR 301 CO -0.01 0.00 0.08 -0.26 0.37 0.00 0.00 175.52 175.70 3dah h PHE 302 N -0.55 0.11 -0.26 3.16 -1.00 -0.95 -0.27 116.94 117.18 3dah h PHE 302 Ca -0.03 0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 3dah h PHE 302 Cb 0.47 0.04 -0.01 0.00 3.61 0.00 0.00 35.95 40.06 3dah h PHE 302 CO -0.11 -0.07 0.07 1.03 -1.61 0.00 0.00 178.31 177.62 3dah h SER 303 N 0.20 0.39 -0.85 2.17 0.87 -0.97 -0.74 113.55 114.61 3dah h SER 303 Ca 0.29 -0.22 -0.03 0.00 -1.23 0.00 0.00 61.79 60.60 3dah h SER 303 Cb 0.44 -0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 62.26 3dah h SER 303 CO -0.41 0.50 0.41 0.03 -0.53 0.00 0.00 176.83 176.82 3dah h ARG 304 N 0.25 1.23 -0.81 2.24 3.08 -0.45 -2.37 114.38 117.55 3dah h ARG 304 Ca 0.08 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 3dah h ARG 304 Cb 0.26 -0.22 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 3dah h ARG 304 CO -0.00 0.95 0.50 0.82 -1.07 0.00 0.00 179.97 181.17 3dah h ILE 305 N 1.22 1.22 -0.54 2.04 2.04 -0.72 0.13 117.51 122.90 3dah h ILE 305 Ca 0.29 -0.47 -0.05 0.00 1.00 0.00 0.00 64.86 65.63 3dah h ILE 305 Cb 0.12 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.25 3dah h ILE 305 CO -0.04 0.23 0.13 0.03 0.00 0.00 0.00 178.15 178.50 3dah h ARG 306 N 1.11 0.83 0.00 2.37 2.47 -0.84 -3.00 114.38 117.32 3dah h ARG 306 Ca 0.29 -0.17 0.00 0.00 -1.26 0.00 0.00 59.98 58.84 3dah h ARG 306 Cb -0.07 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.13 3dah h ARG 306 CO -0.06 0.75 -0.66 0.54 0.56 0.00 0.00 179.97 181.10 3dah n ARG 307 N -4.27 0.12 -0.95 0.04 1.74 -0.92 -4.95 116.66 107.47 3dah n ARG 307 Ca 0.04 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 3dah n ARG 307 Cb 0.23 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 3dah n ARG 307 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dah n GLY 308 N 1.44 0.44 3.83 -0.13 0.00 -0.33 -5.06 105.19 105.38 3dah n GLY 308 Ca 0.04 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.99 3dah n GLY 308 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3dah s ASP 309 N -2.69 5.42 0.03 1.61 1.01 -0.12 -5.00 116.67 116.93 3dah s ASP 309 Ca 0.00 1.51 -0.30 0.00 0.71 0.00 0.00 52.55 54.46 3dah s ASP 309 Cb 0.00 -2.39 -0.06 0.00 1.01 0.00 0.00 42.92 41.48 3dah s ASP 309 CO 0.00 -1.40 1.39 -0.55 0.21 0.00 0.00 175.17 174.82 3dah s SER 310 N -3.92 6.85 -0.11 0.27 0.15 -1.26 -4.49 113.70 111.20 3dah s SER 310 Ca 0.58 2.16 -0.16 0.00 0.70 0.00 0.00 55.95 59.23 3dah s SER 310 Cb -0.13 -2.57 -0.27 0.00 -1.71 0.00 0.00 66.02 61.34 3dah s SER 310 CO 0.55 -0.69 0.55 0.58 1.20 0.00 0.00 173.24 175.42 3dah h VAL 311 N 4.76 1.03 -0.96 4.45 2.07 -1.94 -3.37 116.25 122.28 3dah h VAL 311 Ca -0.39 -2.39 0.24 0.00 0.82 0.00 0.00 66.70 64.98 3dah h VAL 311 Cb 1.19 2.70 -0.18 0.00 -1.52 0.00 0.00 31.29 33.48 3dah h VAL 311 CO 0.89 0.70 -0.06 0.80 0.02 0.00 0.00 177.57 179.92 3dah n MET 312 N -3.93 -0.08 -0.25 1.57 0.00 -1.26 -1.67 117.12 111.50 3dah n MET 312 Ca -0.25 1.46 0.07 0.00 -0.00 0.00 0.00 57.70 58.98 3dah n MET 312 Cb 0.90 -2.28 0.14 0.00 0.00 0.00 0.00 33.22 31.98 3dah n MET 312 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 3dah n SER 313 N -5.47 -0.18 0.32 6.12 7.64 -1.26 -0.15 113.62 120.64 3dah n SER 313 Ca 0.20 1.20 0.20 0.00 1.01 0.00 0.00 58.87 61.49 3dah n SER 313 Cb 0.66 -0.40 1.08 0.00 -1.01 0.00 0.00 64.21 64.55 3dah n SER 313 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3dah h LEU 314 N 0.00 0.00 -0.31 -3.43 3.38 -1.58 -3.54 115.31 109.83 3dah h LEU 314 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 3dah h LEU 314 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3dah h LEU 314 CO -0.70 0.00 0.00 0.49 0.09 0.00 0.00 178.44 178.32