#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 -0.62 3.70 0.27 0.00 -1.26 -4.80 105.19 102.48 3dah n GLY 6 Ca 0.00 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.08 4.26 -0.00 0.99 2.96 -1.26 -0.29 118.68 124.25 3dah s LEU 7 Ca 0.02 1.17 0.06 0.00 -0.22 0.00 0.00 54.13 55.16 3dah s LEU 7 Cb 0.01 -3.13 -0.02 0.00 0.50 0.00 0.00 46.19 43.56 3dah s LEU 7 CO 0.02 -0.22 -0.19 -0.04 -1.32 0.00 0.00 176.35 174.60 3dah s MET 8 N 1.31 1.51 -0.10 1.98 -1.94 0.11 -4.95 119.30 117.21 3dah s MET 8 Ca 0.37 -0.73 0.02 0.00 -1.71 0.00 0.00 55.69 53.64 3dah s MET 8 Cb -0.17 -1.49 0.02 0.00 2.01 0.00 0.00 34.83 35.20 3dah s MET 8 CO 0.16 0.40 -0.14 0.08 -0.01 0.00 0.00 175.02 175.51 3dah s VAL 9 N -0.52 1.42 0.21 -6.03 1.01 -1.26 -0.41 120.40 114.81 3dah s VAL 9 Ca 0.07 -0.59 0.10 0.00 0.00 0.00 0.00 61.98 61.55 3dah s VAL 9 Cb -0.08 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 3dah s VAL 9 CO -0.00 0.42 -0.10 -0.36 0.00 0.00 0.00 175.10 175.06 3dah s PHE 10 N 1.01 2.58 0.13 5.22 0.08 -0.08 0.30 117.98 127.22 3dah s PHE 10 Ca -0.07 -0.24 0.08 0.00 0.12 0.00 0.00 56.93 56.82 3dah s PHE 10 Cb -0.15 -1.23 -0.04 0.00 -0.57 0.00 0.00 43.02 41.04 3dah s PHE 10 CO -0.02 0.55 -0.19 -0.08 -0.10 0.00 0.00 175.22 175.38 3dah s THR 11 N -1.89 1.73 0.00 0.64 -1.32 -1.26 -0.16 115.64 113.38 3dah s THR 11 Ca 0.26 -1.71 0.00 0.00 -1.21 0.00 0.00 61.69 59.04 3dah s THR 11 Cb -0.08 -1.67 0.00 0.00 -1.51 0.00 0.00 72.50 69.24 3dah s THR 11 CO 0.15 -0.19 0.00 0.61 -2.21 0.00 0.00 174.62 172.99 3dah n GLY 12 N 0.73 1.30 0.68 6.08 0.00 -1.22 -4.95 105.19 107.82 3dah n GLY 12 Ca -0.17 -1.89 0.13 0.00 0.00 0.00 0.00 46.02 44.10 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 2.13 0.08 1.61 5.03 -1.26 -4.10 115.26 118.74 3dah n ASN 13 Ca 0.00 -1.71 -0.04 0.00 0.87 0.00 0.00 54.58 53.69 3dah n ASN 13 Cb 0.00 -0.02 0.15 0.00 -1.02 0.00 0.00 39.78 38.89 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 4.46 0.94 -0.45 5.41 0.00 -1.92 -3.40 119.26 124.30 3dah h ALA 14 Ca 0.00 -0.48 -0.28 0.00 0.00 0.00 0.00 54.91 54.14 3dah h ALA 14 Cb 0.69 -0.09 -0.26 0.00 0.00 0.00 0.00 17.79 18.14 3dah h ALA 14 CO 0.00 0.67 -0.72 0.27 0.00 0.00 0.00 179.25 179.47 3dah n ASN 15 N -3.95 -0.48 -0.09 0.00 0.23 -1.26 -4.56 115.26 105.16 3dah n ASN 15 Ca -0.02 -2.60 -0.07 0.00 -0.53 0.00 0.00 54.58 51.36 3dah n ASN 15 Cb 0.56 0.37 0.00 0.00 -2.08 0.00 0.00 39.78 38.63 3dah n ASN 15 CO 0.00 0.00 0.00 1.55 -0.93 0.00 0.00 177.26 177.88 3dah h PRO 16 N 2.46 0.20 -0.48 -0.53 0.13 -1.78 -2.28 132.00 129.71 3dah h PRO 16 Ca -0.19 -0.01 0.06 0.00 -0.87 0.00 0.00 66.00 64.99 3dah h PRO 16 Cb 1.24 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 3dah h PRO 16 CO 0.18 0.13 0.18 0.00 -0.23 0.00 0.00 178.00 178.26 3dah h ALA 17 N 1.22 0.58 -0.97 -0.56 0.00 -1.95 -1.59 119.26 116.00 3dah h ALA 17 Ca 0.14 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.14 3dah h ALA 17 Cb 0.14 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 3dah h ALA 17 CO -0.17 -0.21 0.64 1.25 0.00 0.00 0.00 179.25 180.76 3dah h LEU 18 N 0.36 1.07 -0.88 0.00 5.85 -1.85 -2.42 115.31 117.44 3dah h LEU 18 Ca 0.23 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.83 3dah h LEU 18 Cb 0.22 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3dah h LEU 18 CO -0.22 0.75 -0.22 0.00 -0.34 0.00 0.00 178.44 178.40 3dah h ALA 19 N 1.38 1.05 -0.52 1.25 0.00 -0.73 -0.65 119.26 121.03 3dah h ALA 19 Ca 0.38 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3dah h ALA 19 Cb -0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3dah h ALA 19 CO -0.11 0.58 -0.04 1.96 0.00 0.00 0.00 179.25 181.64 3dah h GLN 20 N 0.52 0.91 -0.25 0.00 4.20 -1.04 -1.47 115.11 117.97 3dah h GLN 20 Ca 0.08 -0.28 -0.14 0.00 0.06 0.00 0.00 58.65 58.37 3dah h GLN 20 Cb 0.66 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.35 3dah h GLN 20 CO 0.05 0.93 -0.39 1.49 -0.67 0.00 0.00 178.83 180.24 3dah h GLU 21 N 0.84 0.71 -0.23 1.46 4.57 -1.08 -0.47 114.58 120.38 3dah h GLU 21 Ca 0.15 -0.42 0.05 0.00 -1.18 0.00 0.00 59.36 57.96 3dah h GLU 21 Cb 0.54 0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 29.12 3dah h GLU 21 CO 0.03 1.04 -0.11 0.28 -1.18 0.00 0.00 179.01 179.07 3dah h VAL 22 N 0.43 0.65 -0.12 0.32 2.07 -1.07 -2.13 116.25 116.40 3dah h VAL 22 Ca 0.02 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.45 3dah h VAL 22 Cb 0.98 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 3dah h VAL 22 CO 0.09 0.00 -0.34 0.58 0.02 0.00 0.00 177.57 177.92 3dah h VAL 23 N -0.08 1.28 -0.22 2.57 2.07 -1.22 -2.03 116.25 118.61 3dah h VAL 23 Ca 0.12 -1.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 3dah h VAL 23 Cb 0.27 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 3dah h VAL 23 CO -0.28 0.40 0.09 0.50 0.02 0.00 0.00 177.57 178.31 3dah h LYS 24 N 0.21 0.33 -0.86 1.57 3.64 -0.81 -2.45 116.57 118.21 3dah h LYS 24 Ca 0.03 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 59.40 3dah h LYS 24 Cb 0.71 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.42 3dah h LYS 24 CO 0.05 0.38 0.54 0.82 -2.27 0.00 0.00 179.45 178.97 3dah h ILE 25 N 0.21 1.08 0.00 2.00 2.04 -1.01 -2.44 117.51 119.40 3dah h ILE 25 Ca 0.08 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 3dah h ILE 25 Cb 0.16 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.22 3dah h ILE 25 CO -0.01 0.18 -0.11 -0.07 0.00 0.00 0.00 178.15 178.15 3dah h LEU 26 N 1.01 0.00 -0.98 1.44 3.38 -1.26 -3.47 115.31 115.42 3dah h LEU 26 Ca 0.36 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.32 3dah h LEU 26 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3dah h LEU 26 CO -0.15 0.11 -0.02 0.61 0.09 0.00 0.00 178.44 179.07 3dah n GLY 27 N 0.03 0.90 3.07 0.83 0.00 -0.92 -5.08 105.19 104.02 3dah n GLY 27 Ca 0.00 -0.65 -0.09 0.00 0.00 0.00 0.00 46.02 45.28 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 -3.00 0.29 0.57 -0.61 -4.36 -1.04 -5.08 121.20 107.97 3dah s ILE 28 Ca 0.02 -1.50 -0.15 0.00 -0.26 0.00 0.00 60.65 58.76 3dah s ILE 28 Cb -0.01 -1.09 -0.05 0.00 1.25 0.00 0.00 42.46 42.56 3dah s ILE 28 CO 0.02 -0.78 1.03 -2.16 0.24 0.00 0.00 174.94 173.29 3dah s PRO 29 N -2.97 3.57 0.44 0.37 0.04 -1.26 -4.37 135.00 130.82 3dah s PRO 29 Ca -0.01 1.05 -0.24 0.00 0.04 0.00 0.00 61.00 61.84 3dah s PRO 29 Cb 0.01 -2.08 -0.08 0.00 0.04 0.00 0.00 34.50 32.39 3dah s PRO 29 CO -0.06 -0.59 1.21 -1.17 0.04 0.00 0.00 177.00 176.43 3dah s LEU 30 N -4.44 4.08 0.27 -3.56 2.96 -1.26 -4.67 118.68 112.06 3dah s LEU 30 Ca 0.61 2.42 -0.29 0.00 -0.22 0.00 0.00 54.13 56.64 3dah s LEU 30 Cb -0.13 -4.13 -0.10 0.00 0.50 0.00 0.00 46.19 42.33 3dah s LEU 30 CO 0.37 -0.90 1.30 -0.83 -1.32 0.00 0.00 176.35 174.97 3dah s GLY 31 N -1.16 2.76 -0.31 7.98 0.00 0.15 -4.96 107.32 111.78 3dah s GLY 31 Ca 0.61 1.18 -0.29 0.00 0.00 0.00 0.00 44.72 46.22 3dah s GLY 31 CO 0.39 1.96 1.20 0.54 0.00 0.00 0.00 173.10 177.19 3dah s LYS 32 N -1.07 3.99 -0.03 2.90 1.02 -1.26 -4.77 119.74 120.52 3dah s LYS 32 Ca 0.52 1.17 -0.13 0.00 0.02 0.00 0.00 55.97 57.54 3dah s LYS 32 Cb -0.38 -3.81 0.02 0.00 -0.52 0.00 0.00 37.83 33.14 3dah s LYS 32 CO 0.46 -1.02 0.29 0.00 -0.92 0.00 0.00 175.35 174.16 3dah s ALA 33 N 4.02 -0.73 -0.22 5.17 0.00 -1.26 -0.55 121.76 128.20 3dah s ALA 33 Ca 0.51 0.38 -0.16 0.00 0.00 0.00 0.00 51.96 52.69 3dah s ALA 33 Cb -0.15 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 3dah s ALA 33 CO 0.20 -0.23 0.42 1.41 0.00 0.00 0.00 175.76 177.55 3dah s MET 34 N -1.05 4.14 -0.21 0.00 1.75 -0.29 -4.93 119.30 118.72 3dah s MET 34 Ca -0.11 0.21 -0.02 0.00 -1.25 0.00 0.00 55.69 54.53 3dah s MET 34 Cb -0.05 -3.57 0.06 0.00 2.84 0.00 0.00 34.83 34.11 3dah s MET 34 CO 0.03 -0.12 0.01 0.08 -0.65 0.00 0.00 175.02 174.37 3dah s VAL 35 N 1.57 0.83 0.00 10.11 1.01 -1.26 -1.59 120.40 131.07 3dah s VAL 35 Ca 0.19 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.40 3dah s VAL 35 Cb -0.15 -1.27 0.00 0.00 0.00 0.00 0.00 36.38 34.96 3dah s VAL 35 CO 0.09 -0.18 0.00 -0.24 0.00 0.00 0.00 175.10 174.76 3dah n SER 36 N 4.93 0.00 -4.03 3.32 2.88 0.80 -4.87 113.62 116.66 3dah n SER 36 Ca -0.10 -0.06 -0.18 0.00 -1.33 0.00 0.00 58.87 57.20 3dah n SER 36 Cb 0.46 0.00 -0.14 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 0.81 0.71 0.85 -1.46 1.81 -1.26 -0.56 118.95 119.86 3dah s ARG 37 Ca 0.00 -0.36 -0.12 0.00 -1.72 0.00 0.00 55.73 53.53 3dah s ARG 37 Cb 0.00 -0.68 0.10 0.00 -0.45 0.00 0.00 34.95 33.92 3dah s ARG 37 CO 0.00 0.18 1.16 -0.06 -0.68 0.00 0.00 175.30 175.91 3dah s PHE 38 N -0.29 2.76 0.36 -0.53 0.08 0.61 -4.79 117.98 116.18 3dah s PHE 38 Ca 0.03 0.79 0.05 0.00 0.12 0.00 0.00 56.93 57.91 3dah s PHE 38 Cb -0.04 -3.46 0.72 0.00 -0.57 0.00 0.00 43.02 39.67 3dah s PHE 38 CO -0.00 -2.03 1.97 1.03 -0.10 0.00 0.00 175.22 176.09 3dah h SER 39 N -1.25 0.68 0.49 1.36 0.87 -2.02 0.35 113.55 114.04 3dah h SER 39 Ca -0.48 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 3dah h SER 39 Cb 1.33 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 3dah h SER 39 CO 0.64 0.45 0.00 -0.90 -0.53 0.00 0.00 176.83 176.49 3dah n ASP 40 N -4.47 0.00 0.00 6.23 5.75 -1.26 -4.91 116.55 117.89 3dah n ASP 40 Ca 0.10 -0.18 0.00 0.00 -0.01 0.00 0.00 54.79 54.70 3dah n ASP 40 Cb 0.19 -0.26 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 1.09 0.68 3.77 6.12 0.00 0.11 -5.08 105.19 111.88 3dah n GLY 41 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.84 4.08 0.21 1.61 2.02 -1.26 -4.73 118.70 119.79 3dah s GLU 42 Ca 0.00 1.71 -0.31 0.00 0.02 0.00 0.00 54.97 56.39 3dah s GLU 42 Cb 0.00 -2.62 -0.11 0.00 0.10 0.00 0.00 34.13 31.50 3dah s GLU 42 CO 0.00 -0.26 1.57 0.42 0.02 0.00 0.00 175.26 177.01 3dah s ILE 43 N -1.50 2.45 -0.23 -1.63 1.09 -1.26 -0.28 121.20 119.83 3dah s ILE 43 Ca 0.58 0.34 -0.02 0.00 -1.10 0.00 0.00 60.65 60.44 3dah s ILE 43 Cb -0.27 -3.22 0.01 0.00 -1.06 0.00 0.00 42.46 37.92 3dah s ILE 43 CO 0.34 0.04 -0.07 -1.58 -0.10 0.00 0.00 174.94 173.57 3dah s GLN 44 N 0.62 3.04 -0.02 2.79 0.74 0.28 -4.77 119.66 122.34 3dah s GLN 44 Ca 0.68 -0.84 0.02 0.00 0.05 0.00 0.00 55.36 55.28 3dah s GLN 44 Cb -0.45 -2.94 0.00 0.00 1.10 0.00 0.00 33.01 30.73 3dah s GLN 44 CO 0.36 -0.30 -0.09 0.08 -0.55 0.00 0.00 175.29 174.79 3dah s VAL 45 N 1.37 0.75 -0.05 1.34 1.01 -1.26 -0.14 120.40 123.43 3dah s VAL 45 Ca 0.03 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.64 3dah s VAL 45 Cb -0.15 -0.67 0.04 0.00 0.00 0.00 0.00 36.38 35.59 3dah s VAL 45 CO -0.05 0.24 0.12 -0.70 0.00 0.00 0.00 175.10 174.70 3dah s GLU 46 N 0.18 0.05 -0.32 2.72 2.12 -0.62 -4.99 118.70 117.84 3dah s GLU 46 Ca -0.03 0.33 -0.25 0.00 0.36 0.00 0.00 54.97 55.38 3dah s GLU 46 Cb -0.08 -0.21 0.01 0.00 0.26 0.00 0.00 34.13 34.11 3dah s GLU 46 CO 0.00 -0.17 0.89 0.42 -0.54 0.00 0.00 175.26 175.86 3dah s ILE 47 N 1.21 4.69 -1.10 -3.70 -1.09 -1.26 -1.14 121.20 118.80 3dah s ILE 47 Ca -0.09 1.34 0.18 0.00 -2.23 0.00 0.00 60.65 59.86 3dah s ILE 47 Cb -0.12 -4.25 0.70 0.00 -1.58 0.00 0.00 42.46 37.21 3dah s ILE 47 CO -0.05 -0.35 1.61 0.00 -1.23 0.00 0.00 174.94 174.92 3dah n GLN 48 N 6.46 3.68 -4.07 2.79 6.02 0.29 -4.85 117.38 127.70 3dah n GLN 48 Ca 0.07 -2.86 -0.10 0.00 -0.01 0.00 0.00 57.00 54.09 3dah n GLN 48 Cb 0.48 -1.87 -0.07 0.00 1.02 0.00 0.00 30.24 29.80 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 -1.84 1.45 0.06 -1.09 -1.05 -1.23 -4.92 118.70 110.08 3dah s GLU 49 Ca 0.50 -1.41 -0.30 0.00 -0.15 0.00 0.00 54.97 53.60 3dah s GLU 49 Cb 0.32 0.40 -0.05 0.00 -0.44 0.00 0.00 34.13 34.36 3dah s GLU 49 CO 0.24 -0.57 1.12 1.21 0.95 0.00 0.00 175.26 178.22 3dah s ASN 50 N -3.08 7.19 0.00 0.83 2.47 -1.26 -4.95 114.94 116.13 3dah s ASN 50 Ca 0.29 1.92 0.00 0.00 0.42 0.00 0.00 52.86 55.49 3dah s ASN 50 Cb 0.02 -2.58 0.00 0.00 -1.45 0.00 0.00 41.25 37.24 3dah s ASN 50 CO 0.11 -0.38 0.71 1.33 -3.72 0.00 0.00 177.10 175.15 3dah n VAL 51 N 3.73 0.46 -2.38 -5.21 0.24 -1.26 -5.03 118.33 108.89 3dah n VAL 51 Ca 0.07 -0.69 -0.41 0.00 -2.04 0.00 0.00 64.34 61.27 3dah n VAL 51 Cb 0.48 0.81 -0.03 0.00 -1.47 0.00 0.00 33.84 33.62 3dah n VAL 51 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dah s ARG 52 N -0.46 4.49 0.00 7.34 1.70 -1.25 -1.72 118.95 129.04 3dah s ARG 52 Ca 0.00 1.87 0.00 0.00 -0.47 0.00 0.00 55.73 57.13 3dah s ARG 52 Cb 0.00 -3.24 0.00 0.00 -0.57 0.00 0.00 34.95 31.14 3dah s ARG 52 CO 0.00 -0.08 0.00 0.41 -1.08 0.00 0.00 175.30 174.55 3dah n GLY 53 N 2.17 2.67 3.86 3.88 0.00 -0.65 -4.81 105.19 112.30 3dah n GLY 53 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 3.50 -0.57 1.61 -0.14 -0.70 -4.07 119.74 119.37 3dah s LYS 54 Ca 0.00 0.82 -0.19 0.00 -1.36 0.00 0.00 55.97 55.24 3dah s LYS 54 Cb 0.00 -2.07 0.09 0.00 -1.68 0.00 0.00 37.83 34.17 3dah s LYS 54 CO 0.00 -0.65 0.69 0.34 -0.76 0.00 0.00 175.35 174.97 3dah s ASP 55 N -3.96 6.19 -0.22 2.83 -1.08 0.60 -0.60 116.67 120.43 3dah s ASP 55 Ca 0.56 -1.28 -0.09 0.00 -0.52 0.00 0.00 52.55 51.22 3dah s ASP 55 Cb -0.12 -2.30 -0.04 0.00 -1.46 0.00 0.00 42.92 39.00 3dah s ASP 55 CO 0.52 -1.07 0.11 -0.69 0.52 0.00 0.00 175.17 174.56 3dah s VAL 56 N 2.72 5.04 -0.12 1.11 1.01 0.08 -0.71 120.40 129.53 3dah s VAL 56 Ca 0.13 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 3dah s VAL 56 Cb -0.23 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 3dah s VAL 56 CO 0.08 0.39 -0.08 -0.36 0.00 0.00 0.00 175.10 175.13 3dah s PHE 57 N 0.82 2.91 -0.22 5.22 2.99 0.45 -0.97 117.98 129.19 3dah s PHE 57 Ca 0.06 -0.35 -0.04 0.00 0.00 0.00 0.00 56.93 56.60 3dah s PHE 57 Cb -0.13 -1.84 -0.01 0.00 0.00 0.00 0.00 43.02 41.04 3dah s PHE 57 CO 0.02 -0.01 -0.04 0.08 -0.00 0.00 0.00 175.22 175.28 3dah s VAL 58 N 0.05 3.44 -0.40 -0.44 1.01 0.22 -0.91 120.40 123.37 3dah s VAL 58 Ca -0.02 -0.47 -0.17 0.00 0.00 0.00 0.00 61.98 61.31 3dah s VAL 58 Cb -0.14 -2.56 0.01 0.00 0.00 0.00 0.00 36.38 33.69 3dah s VAL 58 CO 0.03 0.42 0.44 -0.22 0.00 0.00 0.00 175.10 175.78 3dah s LEU 59 N 1.42 4.71 -0.29 3.92 2.96 0.78 0.03 118.68 132.20 3dah s LEU 59 Ca 0.05 -0.51 0.03 0.00 -0.22 0.00 0.00 54.13 53.49 3dah s LEU 59 Cb -0.14 -2.41 0.18 0.00 0.50 0.00 0.00 46.19 44.31 3dah s LEU 59 CO -0.02 -0.53 0.52 -1.58 -1.32 0.00 0.00 176.35 173.42 3dah s GLN 60 N 2.18 0.50 0.44 1.98 2.00 0.23 -3.37 119.66 123.62 3dah s GLN 60 Ca 0.13 0.48 -0.25 0.00 -2.00 0.00 0.00 55.36 53.71 3dah s GLN 60 Cb -0.17 0.08 -0.08 0.00 0.80 0.00 0.00 33.01 33.63 3dah s GLN 60 CO 0.13 -0.97 1.43 -1.12 -0.50 0.00 0.00 175.29 174.27 3dah s SER 61 N 2.73 5.92 -0.87 6.67 0.01 -1.26 -4.31 113.70 122.59 3dah s SER 61 Ca 0.11 2.93 -0.01 0.00 1.31 0.00 0.00 55.95 60.29 3dah s SER 61 Cb -0.12 -2.65 0.34 0.00 0.21 0.00 0.00 66.02 63.80 3dah s SER 61 CO -0.26 -1.15 1.85 0.35 0.41 0.00 0.00 173.24 174.44 3dah n THR 62 N -0.14 4.33 -2.11 1.44 -2.24 -0.41 -4.76 114.28 110.38 3dah n THR 62 Ca 0.05 -4.97 -0.28 0.00 -2.27 0.00 0.00 64.05 56.59 3dah n THR 62 Cb 0.42 -1.35 0.14 0.00 -2.10 0.00 0.00 70.33 67.43 3dah n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dah s ALA 64 N -3.59 3.53 -0.36 0.00 0.00 -1.26 -2.91 121.76 117.17 3dah s ALA 64 Ca 0.69 1.23 -0.29 0.00 0.00 0.00 0.00 51.96 53.59 3dah s ALA 64 Cb -0.06 -3.49 -0.00 0.00 0.00 0.00 0.00 23.12 19.56 3dah s ALA 64 CO 0.49 -0.62 1.54 -1.25 0.00 0.00 0.00 175.76 175.92 3dah s PRO 65 N -1.03 3.56 0.08 0.00 0.04 -1.26 -5.05 135.00 131.33 3dah s PRO 65 Ca 0.53 1.18 -0.28 0.00 0.04 0.00 0.00 61.00 62.47 3dah s PRO 65 Cb -0.39 -4.06 -0.17 0.00 0.04 0.00 0.00 34.50 29.92 3dah s PRO 65 CO 0.47 -1.58 1.68 1.15 0.04 0.00 0.00 177.00 178.75 3dah h THR 66 N 6.49 0.67 -0.31 1.26 2.02 -1.81 -0.93 112.91 120.30 3dah h THR 66 Ca -0.30 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 66.76 3dah h THR 66 Cb 1.13 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 3dah h THR 66 CO 1.06 0.00 -0.29 0.78 0.37 0.00 0.00 175.52 177.43 3dah h ASN 67 N -0.45 0.67 0.01 4.18 -0.26 -1.91 0.28 115.58 118.09 3dah h ASN 67 Ca -0.04 -0.26 -0.00 0.00 -0.56 0.00 0.00 56.30 55.44 3dah h ASN 67 Cb 0.35 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.42 3dah h ASN 67 CO 0.07 0.93 -0.00 0.44 -1.06 0.00 0.00 177.43 177.80 3dah h ASP 68 N 0.56 -0.01 -0.22 5.81 3.32 -1.93 0.41 116.42 124.36 3dah h ASP 68 Ca 0.07 -0.22 -0.04 0.00 0.02 0.00 0.00 57.03 56.86 3dah h ASP 68 Cb 0.79 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 3dah h ASP 68 CO 0.06 0.22 0.02 0.78 -1.72 0.00 0.00 179.24 178.60 3dah h ASN 69 N -0.23 0.45 -0.13 6.45 2.35 -0.88 0.27 115.58 123.86 3dah h ASN 69 Ca -0.00 -0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 55.64 3dah h ASN 69 Cb 0.22 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 3dah h ASN 69 CO 0.00 0.51 -0.06 0.25 -1.65 0.00 0.00 177.43 176.48 3dah h LEU 70 N 0.47 0.28 -1.04 1.61 5.85 -0.42 -2.88 115.31 119.18 3dah h LEU 70 Ca 0.11 -0.40 -0.09 0.00 0.84 0.00 0.00 57.88 58.34 3dah h LEU 70 Cb 0.28 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3dah h LEU 70 CO 0.01 0.62 -0.25 0.24 -0.34 0.00 0.00 178.44 178.72 3dah h MET 71 N -0.07 0.38 -0.39 1.25 2.86 -0.53 -1.09 114.93 117.35 3dah h MET 71 Ca 0.03 -0.14 0.05 0.00 -2.06 0.00 0.00 59.70 57.59 3dah h MET 71 Cb 0.51 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.10 3dah h MET 71 CO 0.02 0.61 0.11 0.93 1.06 0.00 0.00 176.91 179.63 3dah h GLU 72 N 0.34 0.24 -0.60 1.72 5.08 -0.50 -1.33 114.58 119.52 3dah h GLU 72 Ca 0.05 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 3dah h GLU 72 Cb 0.62 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 3dah h GLU 72 CO 0.04 0.16 0.24 1.25 -1.00 0.00 0.00 179.01 179.70 3dah h LEU 73 N 0.25 0.84 0.03 1.33 5.85 -1.21 -0.28 115.31 122.11 3dah h LEU 73 Ca 0.18 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.75 3dah h LEU 73 Cb 0.19 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 3dah h LEU 73 CO -0.21 0.78 -0.16 0.24 -0.34 0.00 0.00 178.44 178.74 3dah h MET 74 N 0.84 -0.27 -0.33 1.25 2.86 -1.01 -0.80 114.93 117.47 3dah h MET 74 Ca 0.20 0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.83 3dah h MET 74 Cb 0.21 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 3dah h MET 74 CO -0.02 -0.18 0.08 0.82 1.06 0.00 0.00 176.91 178.67 3dah h ILE 75 N -0.28 1.22 -0.52 -1.22 1.08 -1.13 -1.28 117.51 115.38 3dah h ILE 75 Ca 0.04 -0.75 0.04 0.00 -0.39 0.00 0.00 64.86 63.80 3dah h ILE 75 Cb 0.34 1.08 -0.04 0.00 -3.07 0.00 0.00 36.82 35.13 3dah h ILE 75 CO -0.14 0.25 0.28 0.24 -0.69 0.00 0.00 178.15 178.10 3dah h MET 76 N 0.38 0.54 -0.23 2.37 2.86 -1.02 -0.35 114.93 119.47 3dah h MET 76 Ca 0.10 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.72 3dah h MET 76 Cb 0.30 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 3dah h MET 76 CO 0.00 0.36 0.15 0.28 1.06 0.00 0.00 176.91 178.75 3dah h VAL 77 N 0.56 1.04 -0.53 -2.22 2.07 -0.97 -0.44 116.25 115.76 3dah h VAL 77 Ca 0.22 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.66 3dah h VAL 77 Cb 0.09 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 3dah h VAL 77 CO -0.13 0.05 0.32 -0.78 0.02 0.00 0.00 177.57 177.06 3dah h ASP 78 N 0.30 0.54 -0.46 0.57 3.58 -0.90 0.25 116.42 120.29 3dah h ASP 78 Ca 0.09 -0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.52 3dah h ASP 78 Cb -0.02 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 40.89 3dah h ASP 78 CO -0.03 0.38 0.23 0.00 -2.88 0.00 0.00 179.24 176.94 3dah h ALA 79 N 1.22 0.60 -0.42 -0.78 0.00 -0.81 -1.22 119.26 117.85 3dah h ALA 79 Ca 0.21 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3dah h ALA 79 Cb -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3dah h ALA 79 CO -0.08 0.15 0.25 -0.07 0.00 0.00 0.00 179.25 179.50 3dah h LEU 80 N 0.61 0.52 -0.63 0.00 3.38 -0.80 0.30 115.31 118.69 3dah h LEU 80 Ca 0.16 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.07 3dah h LEU 80 Cb 0.10 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3dah h LEU 80 CO -0.02 0.44 0.42 0.50 0.09 0.00 0.00 178.44 179.86 3dah h LYS 81 N 0.55 0.82 0.00 1.13 3.64 -0.78 -1.78 116.57 120.16 3dah h LYS 81 Ca 0.15 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 3dah h LYS 81 Cb 0.02 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 31.65 3dah h LYS 81 CO -0.03 0.55 -0.08 0.00 -2.27 0.00 0.00 179.45 177.62 3dah h ARG 82 N 0.85 0.00 -0.62 1.90 3.08 -0.97 -1.99 114.38 116.63 3dah h ARG 82 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3dah h ARG 82 Cb -0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.95 3dah h ARG 82 CO -0.05 0.08 0.00 0.00 -1.07 0.00 0.00 179.97 178.93 3dah n ALA 83 N -2.13 2.80 -3.56 0.04 0.00 0.07 -4.92 120.51 112.81 3dah n ALA 83 Ca 0.02 -0.62 -0.25 0.00 0.00 0.00 0.00 53.44 52.59 3dah n ALA 83 Cb 0.44 -1.02 0.06 0.00 0.00 0.00 0.00 19.45 18.93 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 0.26 -6.02 -4.62 0.00 7.64 -0.75 -3.93 113.62 106.21 3dah n SER 84 Ca 0.10 -0.54 -0.46 0.00 1.01 0.00 0.00 58.87 58.98 3dah n SER 84 Cb 0.46 -4.76 -0.03 0.00 -1.01 0.00 0.00 64.21 58.86 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 -4.69 0.17 0.03 -0.43 0.00 -0.72 -1.64 120.51 113.23 3dah n ALA 85 Ca -0.00 0.42 -0.02 0.00 0.00 0.00 0.00 53.44 53.83 3dah n ALA 85 Cb 0.56 -2.13 0.23 0.00 0.00 0.00 0.00 19.45 18.12 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 3.20 0.48 -4.46 0.00 0.00 -1.00 -3.43 103.07 97.87 3dah h GLY 86 Ca -0.43 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 46.48 3dah h GLY 86 CO 0.69 0.34 0.19 -1.60 0.00 0.00 0.00 176.54 176.16 3dah s ARG 87 N -4.53 0.93 -0.10 4.80 3.52 -0.98 -4.95 118.95 117.65 3dah s ARG 87 Ca -0.07 0.55 0.03 0.00 -0.13 0.00 0.00 55.73 56.12 3dah s ARG 87 Cb 0.14 0.45 0.01 0.00 -1.56 0.00 0.00 34.95 33.98 3dah s ARG 87 CO 0.78 -0.23 -0.19 0.42 -0.81 0.00 0.00 175.30 175.27 3dah s ILE 88 N -0.53 1.72 -0.11 4.11 1.01 -1.26 -0.74 121.20 125.40 3dah s ILE 88 Ca -0.06 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 59.81 3dah s ILE 88 Cb -0.02 -1.52 0.01 0.00 0.01 0.00 0.00 42.46 40.94 3dah s ILE 88 CO 0.06 0.48 -0.22 -0.89 0.00 0.00 0.00 174.94 174.37 3dah s THR 89 N 0.58 1.97 -0.37 2.92 2.01 -0.14 -1.84 115.64 120.77 3dah s THR 89 Ca -0.15 -0.95 -0.17 0.00 0.31 0.00 0.00 61.69 60.73 3dah s THR 89 Cb -0.17 -1.72 0.00 0.00 0.01 0.00 0.00 72.50 70.62 3dah s THR 89 CO 0.05 0.54 0.45 0.00 -0.69 0.00 0.00 174.62 174.97 3dah s ALA 90 N 0.57 3.46 -0.51 7.40 0.00 -0.57 -0.61 121.76 131.50 3dah s ALA 90 Ca -0.14 -1.22 -0.19 0.00 0.00 0.00 0.00 51.96 50.41 3dah s ALA 90 Cb -0.17 -2.98 0.06 0.00 0.00 0.00 0.00 23.12 20.03 3dah s ALA 90 CO 0.04 -1.30 0.64 0.00 0.00 0.00 0.00 175.76 175.14 3dah s ALA 91 N 2.24 3.38 -0.67 0.00 0.00 0.10 -1.44 121.76 125.37 3dah s ALA 91 Ca 0.15 -1.75 0.04 0.00 0.00 0.00 0.00 51.96 50.40 3dah s ALA 91 Cb -0.16 -3.37 0.16 0.00 0.00 0.00 0.00 23.12 19.75 3dah s ALA 91 CO 0.13 -2.03 0.46 0.42 0.00 0.00 0.00 175.76 174.74 3dah s ILE 92 N 2.66 2.99 0.14 0.00 1.01 0.15 -0.60 121.20 127.55 3dah s ILE 92 Ca 0.15 -3.96 -0.21 0.00 0.00 0.00 0.00 60.65 56.63 3dah s ILE 92 Cb -0.19 -2.97 0.01 0.00 0.01 0.00 0.00 42.46 39.32 3dah s ILE 92 CO 0.12 -0.96 1.66 -0.65 0.00 0.00 0.00 174.94 175.11 3dah h PRO 93 N 5.79 -0.16 -4.89 2.79 0.11 -1.80 -3.36 132.00 130.48 3dah h PRO 93 Ca 0.08 0.01 -0.65 0.00 0.11 0.00 0.00 66.00 65.55 3dah h PRO 93 Cb 0.80 0.04 -0.21 0.00 0.11 0.00 0.00 31.00 31.74 3dah h PRO 93 CO 0.72 -0.11 -0.57 -0.47 -0.21 0.00 0.00 178.00 177.37 3dah s TYR 94 N -6.14 3.15 -0.55 0.65 5.04 -1.26 -1.70 117.35 116.54 3dah s TYR 94 Ca -0.14 -0.27 -0.18 0.00 -2.44 0.00 0.00 57.07 54.04 3dah s TYR 94 Cb 0.11 -2.32 0.10 0.00 0.35 0.00 0.00 41.96 40.21 3dah s TYR 94 CO 0.68 -0.31 0.59 0.12 -1.34 0.00 0.00 175.55 175.29 3dah s PHE 95 N 1.67 3.11 0.76 4.97 5.36 -1.26 -1.29 117.98 131.31 3dah s PHE 95 Ca 0.06 -1.00 -0.14 0.00 -0.96 0.00 0.00 56.93 54.89 3dah s PHE 95 Cb -0.16 -3.79 0.06 0.00 -0.34 0.00 0.00 43.02 38.79 3dah s PHE 95 CO 0.07 -1.12 1.17 0.20 -1.46 0.00 0.00 175.22 174.09 3dah s GLY 96 N 3.38 2.13 0.00 13.12 0.00 -1.18 -3.12 107.32 121.65 3dah s GLY 96 Ca 0.08 0.73 0.00 0.00 0.00 0.00 0.00 44.72 45.54 3dah s GLY 96 CO 0.06 1.13 0.00 -1.72 0.00 0.00 0.00 173.10 172.57 3dah n TYR 97 N -3.07 0.00 0.29 1.90 4.01 -1.26 -4.90 117.16 114.13 3dah n TYR 97 Ca 0.12 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 58.01 3dah n TYR 97 Cb 0.51 -0.70 0.87 0.00 -0.31 0.00 0.00 39.34 39.71 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 1.55 0.00 -0.72 0.00 -1.93 -2.07 119.26 116.09 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 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3dah h ALA 98 CO 0.00 0.01 0.00 0.54 0.00 0.00 0.00 179.25 179.80 3dah n ARG 99 N -3.90 0.01 -3.35 0.00 1.74 -1.26 -4.04 116.66 105.86 3dah n ARG 99 Ca -0.03 0.01 -0.45 0.00 -0.77 0.00 0.00 57.85 56.61 3dah n ARG 99 Cb 0.09 -1.51 -0.01 0.00 -1.02 0.00 0.00 32.46 30.02 3dah n ARG 99 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3dah s GLN 100 N -3.00 4.10 0.00 5.56 -1.52 -0.79 -4.82 119.66 119.19 3dah s GLN 100 Ca 0.14 -3.13 0.04 0.00 -1.95 0.00 0.00 55.36 50.46 3dah s GLN 100 Cb 0.19 -4.52 0.12 0.00 -0.22 0.00 0.00 33.01 28.58 3dah s GLN 100 CO 0.53 -1.25 1.08 -0.40 -0.25 0.00 0.00 175.29 175.00 3dah n ASP 101 N 2.84 2.32 -3.65 5.90 5.75 -1.26 -1.62 116.55 126.83 3dah n ASP 101 Ca 0.22 -1.95 -0.04 0.00 -0.01 0.00 0.00 54.79 53.02 3dah n ASP 101 Cb 0.40 -0.09 -0.01 0.00 -1.03 0.00 0.00 41.12 40.39 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 -0.96 0.86 -0.36 0.11 1.70 -1.26 -5.03 118.95 114.00 3dah s ARG 102 Ca 0.09 -0.43 -0.11 0.00 -0.47 0.00 0.00 55.73 54.81 3dah s ARG 102 Cb 0.05 0.32 0.02 0.00 -0.57 0.00 0.00 34.95 34.76 3dah s ARG 102 CO 0.06 -0.39 0.20 1.03 -1.08 0.00 0.00 175.30 175.13 3dah s ARG 103 N -2.98 2.99 0.86 3.89 0.52 -1.26 -4.74 118.95 118.22 3dah s ARG 103 Ca 0.11 -0.97 -0.14 0.00 -0.52 0.00 0.00 55.73 54.21 3dah s ARG 103 Cb 0.00 -3.72 0.01 0.00 0.52 0.00 0.00 34.95 31.76 3dah s ARG 103 CO -0.02 -0.62 0.47 -2.30 0.02 0.00 0.00 175.30 172.85 3dah n PRO 104 N 5.01 -0.05 -0.17 3.54 -0.02 -1.26 -4.90 135.00 137.15 3dah n PRO 104 Ca -0.12 0.03 -0.04 0.00 -2.02 0.00 0.00 63.50 61.35 3dah n PRO 104 Cb 0.47 -1.87 -0.04 0.00 -0.02 0.00 0.00 33.50 32.04 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 -1.37 -0.18 -2.40 -0.52 0.63 -1.26 -2.25 116.66 109.32 3dah n ARG 105 Ca 0.08 0.67 -0.28 0.00 -0.92 0.00 0.00 57.85 57.40 3dah n ARG 105 Cb 0.52 -0.99 0.01 0.00 0.45 0.00 0.00 32.46 32.44 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 -4.32 4.98 -3.83 6.15 7.64 -1.26 -4.99 113.62 117.99 3dah n SER 106 Ca 0.01 -3.73 -0.25 0.00 1.01 0.00 0.00 58.87 55.91 3dah n SER 106 Cb 0.11 -0.51 -0.17 0.00 -1.01 0.00 0.00 64.21 62.63 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 -3.59 0.99 -1.28 -0.43 0.00 -0.95 -5.06 121.76 111.44 3dah s ALA 107 Ca 0.49 -0.33 -0.15 0.00 0.00 0.00 0.00 51.96 51.97 3dah s ALA 107 Cb 0.40 -0.83 0.12 0.00 0.00 0.00 0.00 23.12 22.81 3dah s ALA 107 CO -0.19 -0.45 1.69 0.54 0.00 0.00 0.00 175.76 177.34 3dah n ARG 108 N 5.05 3.28 -4.48 0.00 1.74 -1.26 -4.61 116.66 116.37 3dah n ARG 108 Ca -0.09 -3.46 -0.27 0.00 -0.77 0.00 0.00 57.85 53.26 3dah n ARG 108 Cb 0.50 -3.23 -0.10 0.00 -1.02 0.00 0.00 32.46 28.61 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 2.61 2.12 0.36 1.55 -7.23 -1.26 -5.14 120.40 113.41 3dah s VAL 109 Ca 0.47 -1.94 -0.14 0.00 -1.81 0.00 0.00 61.98 58.56 3dah s VAL 109 Cb 0.03 -2.96 -0.08 0.00 0.56 0.00 0.00 36.38 33.93 3dah s VAL 109 CO 0.02 -0.03 0.76 0.00 -0.31 0.00 0.00 175.10 175.55 3dah s ALA 110 N -2.67 3.31 -1.12 1.32 0.00 -1.26 -4.89 121.76 116.46 3dah s ALA 110 Ca 0.36 -0.03 -0.11 0.00 0.00 0.00 0.00 51.96 52.18 3dah s ALA 110 Cb 0.07 -2.77 0.24 0.00 0.00 0.00 0.00 23.12 20.66 3dah s ALA 110 CO 0.19 0.18 1.19 0.42 0.00 0.00 0.00 175.76 177.75 3dah s ILE 111 N -2.15 5.64 0.34 0.00 1.01 -1.26 -4.77 121.20 120.01 3dah s ILE 111 Ca 0.54 -3.07 0.01 0.00 0.00 0.00 0.00 60.65 58.13 3dah s ILE 111 Cb -0.10 -4.70 0.26 0.00 0.01 0.00 0.00 42.46 37.93 3dah s ILE 111 CO 0.23 -1.32 2.00 0.28 0.00 0.00 0.00 174.94 176.13 3dah h SER 112 N 6.95 0.77 -0.08 3.58 0.02 -1.80 -0.67 113.55 122.32 3dah h SER 112 Ca 0.22 -0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.17 3dah h SER 112 Cb 0.89 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.23 3dah h SER 112 CO 1.07 0.56 0.07 0.00 -1.14 0.00 0.00 176.83 177.39 3dah h ALA 113 N 1.58 1.86 0.13 3.77 0.00 -1.23 -0.89 119.26 124.48 3dah h ALA 113 Ca 0.24 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.90 3dah h ALA 113 Cb -0.10 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.70 3dah h ALA 113 CO -0.05 -0.11 -1.22 -0.22 0.00 0.00 0.00 179.25 177.65 3dah h LYS 114 N 0.00 0.27 -0.57 0.00 1.63 -1.37 -1.93 116.57 114.61 3dah h LYS 114 Ca 0.04 -0.47 0.12 0.00 -0.85 0.00 0.00 60.65 59.49 3dah h LYS 114 Cb 0.18 0.17 -0.10 0.00 -0.60 0.00 0.00 32.23 31.88 3dah h LYS 114 CO -0.00 1.22 -0.08 0.28 -3.45 0.00 0.00 179.45 177.42 3dah h VAL 115 N -0.31 0.48 -0.59 2.00 2.07 -1.01 0.57 116.25 119.45 3dah h VAL 115 Ca -0.25 -0.02 0.02 0.00 0.82 0.00 0.00 66.70 67.27 3dah h VAL 115 Cb 1.74 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 3dah h VAL 115 CO 0.10 0.01 0.37 0.58 0.02 0.00 0.00 177.57 178.65 3dah h VAL 116 N 0.05 1.10 -0.20 2.57 2.07 -1.24 0.13 116.25 120.74 3dah h VAL 116 Ca 0.28 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.58 3dah h VAL 116 Cb 0.44 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 3dah h VAL 116 CO -0.54 0.14 0.01 0.00 0.02 0.00 0.00 177.57 177.20 3dah h ALA 117 N 1.24 0.18 -0.28 1.67 0.00 -0.48 -1.09 119.26 120.51 3dah h ALA 117 Ca 0.23 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.23 3dah h ALA 117 Cb -0.03 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3dah h ALA 117 CO -0.08 -0.42 0.06 -0.91 0.00 0.00 0.00 179.25 177.90 3dah h ASN 118 N 0.08 0.02 -0.04 0.00 2.35 -0.65 -2.32 115.58 115.02 3dah h ASN 118 Ca 0.09 0.04 0.04 0.00 -0.55 0.00 0.00 56.30 55.92 3dah h ASN 118 Cb 0.11 0.05 -0.05 0.00 0.05 0.00 0.00 38.32 38.48 3dah h ASN 118 CO -0.15 0.05 -0.29 0.24 -1.65 0.00 0.00 177.43 175.63 3dah h MET 119 N 0.17 -0.40 -0.57 0.81 2.86 -0.47 -0.96 114.93 116.37 3dah h MET 119 Ca 0.13 0.03 0.08 0.00 -2.06 0.00 0.00 59.70 57.87 3dah h MET 119 Cb 0.13 0.09 -0.06 0.00 0.06 0.00 0.00 31.60 31.81 3dah h MET 119 CO -0.16 -0.26 0.22 -0.07 1.06 0.00 0.00 176.91 177.69 3dah h LEU 120 N -0.41 0.24 -0.54 1.22 4.07 -1.08 -0.29 115.31 118.52 3dah h LEU 120 Ca 0.07 0.07 -0.07 0.00 0.08 0.00 0.00 57.88 58.02 3dah h LEU 120 Cb 0.52 0.04 -0.02 0.00 1.08 0.00 0.00 40.66 42.27 3dah h LEU 120 CO -0.27 0.16 0.05 -0.33 -1.08 0.00 0.00 178.44 176.97 3dah h GLU 121 N 0.42 0.92 0.00 1.13 5.08 -1.20 -1.79 114.58 119.15 3dah h GLU 121 Ca 0.28 -0.27 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 3dah h GLU 121 Cb 0.31 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3dah h GLU 121 CO -0.27 0.91 -0.29 0.97 -1.00 0.00 0.00 179.01 179.34 3dah h ILE 122 N 0.81 0.87 0.00 3.13 6.09 -0.72 -2.56 117.51 125.13 3dah h ILE 122 Ca 0.16 -1.14 -0.08 0.00 -1.37 0.00 0.00 64.86 62.43 3dah h ILE 122 Cb 0.46 1.69 -0.01 0.00 0.47 0.00 0.00 36.82 39.42 3dah h ILE 122 CO 0.02 0.28 -0.37 0.00 -3.07 0.00 0.00 178.15 175.02 3dah h ALA 123 N 1.71 1.18 0.00 0.18 0.00 -0.69 -3.47 119.26 118.18 3dah h ALA 123 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3dah h ALA 123 Cb 0.66 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3dah h ALA 123 CO 0.04 0.46 0.00 0.41 0.00 0.00 0.00 179.25 180.15 3dah n GLY 124 N -0.17 1.38 3.74 0.00 0.00 -0.96 -4.12 105.19 105.06 3dah n GLY 124 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.91 3.31 -0.04 1.61 1.01 -0.71 -4.71 120.40 118.97 3dah s VAL 125 Ca 0.00 1.12 0.11 0.00 0.00 0.00 0.00 61.98 63.21 3dah s VAL 125 Cb 0.00 -3.71 -0.17 0.00 0.00 0.00 0.00 36.38 32.50 3dah s VAL 125 CO 0.00 0.19 0.21 -0.62 0.00 0.00 0.00 175.10 174.87 3dah n GLU 126 N 2.35 0.76 -3.71 2.72 1.02 -0.76 -4.55 120.64 118.46 3dah n GLU 126 Ca 0.05 -0.08 -0.13 0.00 -0.02 0.00 0.00 57.16 56.97 3dah n GLU 126 Cb 0.43 -1.28 -0.09 0.00 -0.02 0.00 0.00 31.44 30.48 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 -2.69 0.54 -0.10 3.49 0.52 -1.21 -4.18 118.95 115.32 3dah s ARG 127 Ca -0.04 0.63 0.00 0.00 -0.52 0.00 0.00 55.73 55.80 3dah s ARG 127 Cb 0.07 0.27 -0.02 0.00 0.52 0.00 0.00 34.95 35.78 3dah s ARG 127 CO 0.48 -0.07 -0.10 0.42 0.02 0.00 0.00 175.30 176.05 3dah s ILE 128 N 0.22 3.38 -0.13 1.52 -1.09 -0.40 -1.51 121.20 123.20 3dah s ILE 128 Ca -0.00 -0.57 0.02 0.00 -2.23 0.00 0.00 60.65 57.87 3dah s ILE 128 Cb -0.03 -2.40 -0.00 0.00 -1.58 0.00 0.00 42.46 38.44 3dah s ILE 128 CO 0.01 0.55 -0.19 -0.63 -1.23 0.00 0.00 174.94 173.45 3dah s ILE 129 N -0.20 2.38 0.14 2.92 1.01 -0.52 -0.41 121.20 126.52 3dah s ILE 129 Ca 0.02 -0.89 -0.03 0.00 0.00 0.00 0.00 60.65 59.75 3dah s ILE 129 Cb -0.13 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 3dah s ILE 129 CO 0.03 0.54 0.11 0.28 0.00 0.00 0.00 174.94 175.90 3dah s THR 130 N 0.57 0.09 -0.11 2.92 -1.32 -0.04 0.33 115.64 118.08 3dah s THR 130 Ca -0.11 -1.79 0.02 0.00 -1.21 0.00 0.00 61.69 58.59 3dah s THR 130 Cb -0.16 -2.00 0.01 0.00 -1.51 0.00 0.00 72.50 68.84 3dah s THR 130 CO 0.04 -0.42 -0.15 -0.32 -2.21 0.00 0.00 174.62 171.56 3dah s MET 131 N -4.03 2.17 -1.31 7.08 1.75 -0.69 -0.50 119.30 123.77 3dah s MET 131 Ca 0.23 -0.55 -0.14 0.00 -1.25 0.00 0.00 55.69 53.98 3dah s MET 131 Cb 0.06 -1.85 0.01 0.00 2.84 0.00 0.00 34.83 35.89 3dah s MET 131 CO 0.01 -0.06 0.51 -0.25 -0.65 0.00 0.00 175.02 174.59 3dah n ASP 132 N 4.18 -2.36 -4.63 1.11 8.00 -0.16 -4.69 116.55 117.99 3dah n ASP 132 Ca -0.19 -1.13 -0.48 0.00 0.71 0.00 0.00 54.79 53.71 3dah n ASP 132 Cb 0.51 -2.57 -0.04 0.00 -0.02 0.00 0.00 41.12 39.01 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 -4.53 2.45 -0.09 0.64 7.94 -1.26 -4.88 117.00 117.26 3dah n LEU 133 Ca -0.21 1.12 -0.01 0.00 -1.11 0.00 0.00 56.01 55.81 3dah n LEU 133 Cb 0.63 -1.33 0.26 0.00 0.53 0.00 0.00 43.42 43.52 3dah n LEU 133 CO 0.74 -0.72 1.03 -0.74 -1.11 0.00 0.00 177.39 176.59 3dah h HIS 134 N 4.61 0.73 -3.36 1.96 -0.00 -1.90 -3.39 115.15 113.80 3dah h HIS 134 Ca -0.45 -0.04 -0.39 0.00 -0.00 0.00 0.00 60.37 59.48 3dah h HIS 134 Cb 1.30 -0.22 -0.37 0.00 -0.00 0.00 0.00 27.41 28.12 3dah h HIS 134 CO 0.58 0.59 -0.76 0.00 -0.00 0.00 0.00 177.93 178.35 3dah s ALA 135 N -5.28 0.48 0.58 5.26 0.00 -1.26 -5.03 121.76 116.51 3dah s ALA 135 Ca -0.09 0.04 0.28 0.00 0.00 0.00 0.00 51.96 52.19 3dah s ALA 135 Cb 0.16 -0.55 1.69 0.00 0.00 0.00 0.00 23.12 24.42 3dah s ALA 135 CO 0.78 -0.30 2.16 -0.44 0.00 0.00 0.00 175.76 177.96 3dah h ASP 136 N 7.90 0.00 0.52 0.00 3.45 -2.01 -1.79 116.42 124.49 3dah h ASP 136 Ca -0.27 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.19 3dah h ASP 136 Cb 1.13 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.90 3dah h ASP 136 CO 0.33 0.00 -0.00 1.56 -1.57 0.00 0.00 179.24 179.55 3dah h GLN 137 N 0.00 0.00 -0.50 3.56 7.50 -1.96 -2.55 115.11 121.16 3dah h GLN 137 Ca 0.05 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.20 3dah h GLN 137 Cb 0.29 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.80 3dah h GLN 137 CO -0.00 0.00 0.32 0.82 -1.50 0.00 0.00 178.83 178.47 3dah h ILE 138 N 0.00 1.14 -1.07 2.54 2.04 -1.73 -1.44 117.51 118.99 3dah h ILE 138 Ca -0.00 -0.27 0.30 0.00 1.00 0.00 0.00 64.86 65.89 3dah h ILE 138 Cb 0.26 0.41 -0.12 0.00 -0.74 0.00 0.00 36.82 36.63 3dah h ILE 138 CO 0.00 0.13 0.66 1.56 0.00 0.00 0.00 178.15 180.50 3dah h GLN 139 N 0.69 0.37 0.00 2.37 4.20 -1.67 0.20 115.11 121.26 3dah h GLN 139 Ca 0.18 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.87 3dah h GLN 139 Cb -0.06 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.64 3dah h GLN 139 CO -0.04 0.24 0.00 0.41 -0.67 0.00 0.00 178.83 178.77 3dah n GLY 140 N -1.40 -0.89 0.18 3.46 0.00 -0.54 -2.74 105.19 103.26 3dah n GLY 140 Ca 0.29 -0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.26 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 -2.87 1.61 0.04 -0.67 -3.45 116.94 111.59 3dah h PHE 141 Ca 0.00 0.00 -0.63 0.00 2.80 0.00 0.00 57.97 60.14 3dah h PHE 141 Cb 0.03 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.13 3dah h PHE 141 CO 0.00 0.03 -0.48 -0.06 -0.60 0.00 0.00 178.31 177.19 3dah s PHE 142 N -3.25 3.53 -0.91 -0.55 0.08 -1.11 -4.66 117.98 111.12 3dah s PHE 142 Ca 0.04 0.33 0.15 0.00 0.12 0.00 0.00 56.93 57.57 3dah s PHE 142 Cb 0.07 -1.81 0.50 0.00 -0.57 0.00 0.00 43.02 41.20 3dah s PHE 142 CO 0.71 0.61 1.42 -0.25 -0.10 0.00 0.00 175.22 177.61 3dah n ASP 143 N 0.61 3.74 -4.71 1.36 8.00 -1.26 -4.96 116.55 119.33 3dah n ASP 143 Ca -0.08 -2.35 -0.26 0.00 0.71 0.00 0.00 54.79 52.82 3dah n ASP 143 Cb 0.52 -0.42 -0.07 0.00 -0.02 0.00 0.00 41.12 41.13 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 -1.64 3.96 0.37 0.53 -4.36 -1.26 -5.10 121.20 113.71 3dah s ILE 144 Ca 0.37 -1.38 -0.27 0.00 -0.26 0.00 0.00 60.65 59.11 3dah s ILE 144 Cb 0.24 -3.02 -0.11 0.00 1.25 0.00 0.00 42.46 40.81 3dah s ILE 144 CO 0.18 -0.15 1.33 -0.81 0.24 0.00 0.00 174.94 175.73 3dah n PRO 145 N -0.34 2.19 -3.97 0.37 -0.04 -1.26 -4.87 135.00 127.07 3dah n PRO 145 Ca -0.09 0.77 -0.26 0.00 -0.04 0.00 0.00 63.50 63.88 3dah n PRO 145 Cb 0.56 -2.42 -0.17 0.00 -0.04 0.00 0.00 33.50 31.43 3dah n PRO 145 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3dah s VAL 146 N -1.13 0.99 -0.37 0.52 1.01 -1.26 -1.27 120.40 118.89 3dah s VAL 146 Ca 0.56 -0.28 -0.08 0.00 0.00 0.00 0.00 61.98 62.18 3dah s VAL 146 Cb -0.53 -1.00 0.05 0.00 0.00 0.00 0.00 36.38 34.89 3dah s VAL 146 CO 0.61 0.36 0.17 -1.81 0.00 0.00 0.00 175.10 174.44 3dah s ASP 147 N 1.60 5.50 -0.45 3.32 1.01 0.46 -4.99 116.67 123.13 3dah s ASP 147 Ca 0.03 -1.23 -0.19 0.00 0.71 0.00 0.00 52.55 51.86 3dah s ASP 147 Cb -0.13 -1.94 0.03 0.00 1.01 0.00 0.00 42.92 41.89 3dah s ASP 147 CO -0.07 -0.41 0.58 0.21 0.21 0.00 0.00 175.17 175.70 3dah s ASN 148 N 1.64 6.27 0.10 0.27 2.47 -1.26 -0.86 114.94 123.58 3dah s ASN 148 Ca 0.01 -0.54 0.02 0.00 0.42 0.00 0.00 52.86 52.76 3dah s ASN 148 Cb -0.20 -2.29 -0.04 0.00 -1.45 0.00 0.00 41.25 37.27 3dah s ASN 148 CO 0.03 -0.74 0.23 0.27 -3.72 0.00 0.00 177.10 173.17 3dah s ILE 149 N 2.59 5.25 -0.05 -5.21 -4.36 0.34 -4.88 121.20 114.88 3dah s ILE 149 Ca 0.18 -0.58 -0.00 0.00 -0.26 0.00 0.00 60.65 59.99 3dah s ILE 149 Cb -0.16 -3.62 -0.03 0.00 1.25 0.00 0.00 42.46 39.89 3dah s ILE 149 CO 0.16 0.03 0.00 -0.31 0.24 0.00 0.00 174.94 175.06 3dah s TYR 150 N -1.61 3.12 -2.24 1.37 2.02 -1.26 -0.99 117.35 117.76 3dah s TYR 150 Ca 0.34 0.14 0.19 0.00 -0.37 0.00 0.00 57.07 57.37 3dah s TYR 150 Cb -0.12 -1.74 0.64 0.00 -0.40 0.00 0.00 41.96 40.34 3dah s TYR 150 CO 0.27 0.46 1.48 0.00 -1.57 0.00 0.00 175.55 176.20 3dah n ALA 151 N 1.82 2.49 -0.23 3.71 0.00 -1.26 -4.43 120.51 122.61 3dah n ALA 151 Ca -0.17 -0.59 0.04 0.00 0.00 0.00 0.00 53.44 52.72 3dah n ALA 151 Cb 0.53 -1.05 0.15 0.00 0.00 0.00 0.00 19.45 19.08 3dah n ALA 151 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3dah h THR 152 N 2.41 0.50 -0.79 0.00 1.35 -1.98 -1.55 112.91 112.83 3dah h THR 152 Ca 0.00 -0.07 0.12 0.00 -0.55 0.00 0.00 66.41 65.91 3dah h THR 152 Cb 0.53 0.28 -0.08 0.00 -1.73 0.00 0.00 68.15 67.15 3dah h THR 152 CO 0.00 0.04 0.40 -0.65 -0.25 0.00 0.00 175.52 175.06 3dah h PRO 153 N 0.20 0.61 0.03 4.72 0.11 -1.96 0.46 132.00 136.16 3dah h PRO 153 Ca 0.38 -0.04 -0.22 0.00 0.11 0.00 0.00 66.00 66.23 3dah h PRO 153 Cb 0.63 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.58 3dah h PRO 153 CO -0.52 0.40 -1.00 -0.84 -0.21 0.00 0.00 178.00 175.82 3dah h ILE 154 N 0.62 1.63 0.01 4.15 3.07 -1.71 -0.25 117.51 125.03 3dah h ILE 154 Ca 0.41 -3.15 -0.00 0.00 1.55 0.00 0.00 64.86 63.67 3dah h ILE 154 Cb 0.52 2.77 0.00 0.00 -0.27 0.00 0.00 36.82 39.84 3dah h ILE 154 CO -0.32 0.91 -0.00 -0.07 -1.05 0.00 0.00 178.15 177.61 3dah h LEU 155 N 0.03 -0.01 -1.02 0.16 3.38 -0.93 -2.96 115.31 113.95 3dah h LEU 155 Ca -0.04 -0.55 -0.09 0.00 0.09 0.00 0.00 57.88 57.29 3dah h LEU 155 Cb 1.73 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.46 3dah h LEU 155 CO 0.14 0.55 -0.22 -0.07 0.09 0.00 0.00 178.44 178.94 3dah h LEU 156 N -0.58 0.44 -0.26 1.67 4.07 -0.18 -1.64 115.31 118.83 3dah h LEU 156 Ca -0.00 -0.14 0.06 0.00 0.08 0.00 0.00 57.88 57.89 3dah h LEU 156 Cb 0.57 -0.12 -0.08 0.00 1.08 0.00 0.00 40.66 42.11 3dah h LEU 156 CO 0.00 0.67 -0.29 1.23 -1.08 0.00 0.00 178.44 178.97 3dah h GLY 157 N 0.99 -0.26 1.16 0.83 0.00 -1.10 -1.17 103.07 103.52 3dah h GLY 157 Ca 0.06 0.36 -0.08 0.00 0.00 0.00 0.00 47.33 47.67 3dah h GLY 157 CO 0.04 -0.21 0.05 -1.80 0.00 0.00 0.00 176.54 174.63 3dah h ASP 158 N -0.29 0.98 -0.10 0.19 3.58 -1.32 -1.93 116.42 117.52 3dah h ASP 158 Ca 0.14 -0.25 -0.00 0.00 0.42 0.00 0.00 57.03 57.34 3dah h ASP 158 Cb 0.51 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.29 3dah h ASP 158 CO -0.43 1.00 0.06 0.25 -2.88 0.00 0.00 179.24 177.25 3dah h LEU 159 N 0.94 0.13 -1.32 2.28 6.46 -1.00 -2.57 115.31 120.24 3dah h LEU 159 Ca 0.18 -0.07 -0.06 0.00 -0.12 0.00 0.00 57.88 57.81 3dah h LEU 159 Cb 0.47 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 3dah h LEU 159 CO 0.02 0.16 -0.21 0.03 -0.62 0.00 0.00 178.44 177.82 3dah h ARG 160 N 0.08 0.20 0.00 1.25 3.08 -1.20 -3.00 114.38 114.79 3dah h ARG 160 Ca 0.04 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3dah h ARG 160 Cb 0.06 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.09 3dah h ARG 160 CO -0.01 0.40 0.00 -0.22 -1.07 0.00 0.00 179.97 179.08 3dah h LYS 161 N 0.18 0.00 0.00 0.04 3.64 -0.92 -2.68 116.57 116.83 3dah h LYS 161 Ca 0.03 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3dah h LYS 161 Cb 0.48 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 3dah h LYS 161 CO 0.03 0.00 -0.27 0.00 -2.27 0.00 0.00 179.45 176.94 3dah n GLN 162 N -2.77 1.30 -2.66 1.90 10.64 -1.13 -5.04 117.38 119.62 3dah n GLN 162 Ca -0.02 -2.79 -0.05 0.00 -1.83 0.00 0.00 57.00 52.30 3dah n GLN 162 Cb 0.06 -1.45 0.00 0.00 -0.86 0.00 0.00 30.24 27.99 3dah n GLN 162 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3dah n ASN 163 N -1.17 -0.99 -4.75 2.61 3.02 -1.01 -4.81 115.26 108.16 3dah n ASN 163 Ca 0.16 -0.19 -0.41 0.00 -0.03 0.00 0.00 54.58 54.11 3dah n ASN 163 Cb 0.68 -0.33 -0.04 0.00 -0.61 0.00 0.00 39.78 39.49 3dah n ASN 163 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3dah s TYR 164 N -2.04 3.47 0.14 3.10 2.02 -1.26 -5.01 117.35 117.77 3dah s TYR 164 Ca 0.01 1.53 -0.30 0.00 -0.37 0.00 0.00 57.07 57.94 3dah s TYR 164 Cb -0.00 -3.38 -0.07 0.00 -0.40 0.00 0.00 41.96 38.11 3dah s TYR 164 CO 0.18 -0.95 1.18 -1.25 -1.57 0.00 0.00 175.55 173.14 3dah s PRO 165 N -0.74 4.49 -1.17 -1.71 0.04 -1.26 -4.15 135.00 130.50 3dah s PRO 165 Ca 0.49 1.81 -0.03 0.00 0.04 0.00 0.00 61.00 63.32 3dah s PRO 165 Cb -0.32 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 30.91 3dah s PRO 165 CO 0.39 -0.11 0.92 -0.25 0.04 0.00 0.00 177.00 177.98 3dah n ASP 166 N 2.94 -3.48 -4.76 6.66 8.00 -1.26 -4.03 116.55 120.62 3dah n ASP 166 Ca 0.06 -0.70 -0.41 0.00 0.71 0.00 0.00 54.79 54.44 3dah n ASP 166 Cb 0.45 -4.90 -0.02 0.00 -0.02 0.00 0.00 41.12 36.64 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 -6.12 4.41 -0.08 0.64 2.96 -1.26 -2.50 118.68 116.74 3dah s LEU 167 Ca 0.17 2.62 -0.03 0.00 -0.22 0.00 0.00 54.13 56.67 3dah s LEU 167 Cb -0.03 -3.63 0.04 0.00 0.50 0.00 0.00 46.19 43.07 3dah s LEU 167 CO 0.75 -0.58 0.07 -0.22 -1.32 0.00 0.00 176.35 175.05 3dah s LEU 168 N -1.04 0.23 0.02 -0.68 0.20 0.16 -4.23 118.68 113.34 3dah s LEU 168 Ca 0.53 -0.13 -0.30 0.00 0.69 0.00 0.00 54.13 54.92 3dah s LEU 168 Cb -0.40 -0.19 -0.05 0.00 -0.43 0.00 0.00 46.19 45.12 3dah s LEU 168 CO 0.47 -0.28 1.30 -0.69 -0.29 0.00 0.00 176.35 176.86 3dah s VAL 169 N 2.15 3.86 -0.10 1.68 1.01 -1.10 -1.87 120.40 126.03 3dah s VAL 169 Ca 0.04 1.28 0.03 0.00 0.00 0.00 0.00 61.98 63.32 3dah s VAL 169 Cb -0.13 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 3dah s VAL 169 CO -0.05 0.04 -0.19 -0.69 0.00 0.00 0.00 175.10 174.21 3dah s VAL 170 N 1.82 2.52 -0.32 2.92 1.01 -0.46 -2.43 120.40 125.47 3dah s VAL 170 Ca 0.61 -0.86 -0.18 0.00 0.00 0.00 0.00 61.98 61.55 3dah s VAL 170 Cb -0.30 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 3dah s VAL 170 CO 0.27 0.55 0.52 -0.55 0.00 0.00 0.00 175.10 175.88 3dah s SER 171 N 0.22 6.36 -0.06 3.32 0.15 -0.78 -4.51 113.70 118.40 3dah s SER 171 Ca -0.12 0.19 -0.03 0.00 0.70 0.00 0.00 55.95 56.69 3dah s SER 171 Cb -0.16 -2.27 -0.02 0.00 -1.71 0.00 0.00 66.02 61.86 3dah s SER 171 CO 0.07 -0.41 0.17 1.55 1.20 0.00 0.00 173.24 175.82 3dah h PRO 172 N 8.30 -0.11 -7.15 5.44 0.13 -1.90 -3.40 132.00 133.30 3dah h PRO 172 Ca -0.28 0.01 -0.47 0.00 -0.87 0.00 0.00 66.00 64.39 3dah h PRO 172 Cb 1.13 0.03 0.01 0.00 0.13 0.00 0.00 31.00 32.30 3dah h PRO 172 CO 0.75 -0.07 0.37 0.16 -0.23 0.00 0.00 178.00 178.97 3dah s ASP 173 N -4.62 6.59 0.50 1.44 1.47 -1.26 -4.97 116.67 115.82 3dah s ASP 173 Ca -0.02 1.65 0.28 0.00 1.18 0.00 0.00 52.55 55.64 3dah s ASP 173 Cb 0.00 -2.52 1.26 0.00 -0.34 0.00 0.00 42.92 41.31 3dah s ASP 173 CO 0.05 -0.61 1.97 -0.37 0.68 0.00 0.00 175.17 176.89 3dah h VAL 174 N 1.16 0.45 0.65 2.11 -1.51 -1.98 -3.34 116.25 113.79 3dah h VAL 174 Ca -0.48 -0.77 -0.03 0.00 -1.23 0.00 0.00 66.70 64.20 3dah h VAL 174 Cb 1.19 1.54 0.00 0.00 -2.13 0.00 0.00 31.29 31.89 3dah h VAL 174 CO 0.61 0.14 -0.34 1.23 -1.23 0.00 0.00 177.57 177.98 3dah h GLY 175 N 1.51 -1.00 -3.48 5.19 0.00 -2.00 -3.26 103.07 100.03 3dah h GLY 175 Ca -0.00 0.39 -0.36 0.00 0.00 0.00 0.00 47.33 47.36 3dah h GLY 175 CO 0.02 -0.36 0.46 0.61 0.00 0.00 0.00 176.54 177.27 3dah n GLY 176 N -1.46 4.19 0.17 4.60 0.00 -1.25 -4.36 105.19 107.08 3dah n GLY 176 Ca -0.11 -1.16 -0.01 0.00 0.00 0.00 0.00 46.02 44.74 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 0.93 1.36 0.96 1.61 2.07 -1.72 -2.80 116.25 118.66 3dah h VAL 177 Ca 0.33 -1.74 -0.05 0.00 0.82 0.00 0.00 66.70 66.07 3dah h VAL 177 Cb 1.07 1.90 0.01 0.00 -1.52 0.00 0.00 31.29 32.75 3dah h VAL 177 CO 0.83 0.50 -0.46 0.58 0.02 0.00 0.00 177.57 179.04 3dah h VAL 178 N 0.06 0.05 0.00 2.57 2.07 -1.87 -2.81 116.25 116.32 3dah h VAL 178 Ca -0.00 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3dah h VAL 178 Cb 0.91 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 3dah h VAL 178 CO 0.07 0.00 0.00 0.03 0.02 0.00 0.00 177.57 177.69 3dah h ARG 179 N -1.30 0.00 -0.23 1.57 3.08 -1.91 -2.26 114.38 113.33 3dah h ARG 179 Ca -0.13 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.79 3dah h ARG 179 Cb 0.99 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 3dah h ARG 179 CO 0.22 0.00 -0.40 0.00 -1.07 0.00 0.00 179.97 178.72 3dah h ALA 180 N 2.28 0.87 -0.13 0.04 0.00 -1.40 -1.80 119.26 119.13 3dah h ALA 180 Ca 0.00 -0.43 -0.13 0.00 0.00 0.00 0.00 54.91 54.35 3dah h ALA 180 Cb 0.45 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3dah h ALA 180 CO 0.00 0.64 -0.48 -0.09 0.00 0.00 0.00 179.25 179.32 3dah h ARG 181 N 0.45 0.34 0.00 0.00 2.43 -1.15 -2.18 114.38 114.27 3dah h ARG 181 Ca 0.04 -0.19 -0.09 0.00 -0.81 0.00 0.00 59.98 58.93 3dah h ARG 181 Cb 0.89 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 3dah h ARG 181 CO 0.08 0.75 -0.44 0.00 -1.51 0.00 0.00 179.97 178.85 3dah h ALA 182 N 1.22 1.25 -0.01 2.80 0.00 -1.31 -1.34 119.26 121.88 3dah h ALA 182 Ca 0.01 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 3dah h ALA 182 Cb 0.95 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3dah h ALA 182 CO 0.08 0.55 -0.17 1.25 0.00 0.00 0.00 179.25 180.96 3dah h LEU 183 N 0.00 0.16 -0.62 0.00 6.46 -1.21 -2.91 115.31 117.19 3dah h LEU 183 Ca -0.00 -0.76 0.06 0.00 -0.12 0.00 0.00 57.88 57.06 3dah h LEU 183 Cb 0.79 -0.05 -0.06 0.00 -0.73 0.00 0.00 40.66 40.62 3dah h LEU 183 CO 0.06 0.89 0.32 0.00 -0.62 0.00 0.00 178.44 179.09 3dah h ALA 184 N 0.27 0.83 -0.78 1.25 0.00 -1.36 -1.36 119.26 118.10 3dah h ALA 184 Ca -0.02 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.01 3dah h ALA 184 Cb 0.92 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 3dah h ALA 184 CO 0.03 -0.03 0.44 -0.22 0.00 0.00 0.00 179.25 179.47 3dah h LYS 185 N 0.59 0.74 0.00 0.00 3.64 -1.33 0.10 116.57 120.32 3dah h LYS 185 Ca 0.29 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.57 3dah h LYS 185 Cb 0.22 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 3dah h LYS 185 CO -0.20 0.49 -0.27 0.37 -2.27 0.00 0.00 179.45 177.57 3dah h GLN 186 N 0.76 0.00 -0.36 1.90 4.15 -1.07 -2.59 115.11 117.90 3dah h GLN 186 Ca 0.37 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.79 3dah h GLN 186 Cb 0.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.00 3dah h GLN 186 CO -0.23 0.27 0.00 1.28 -1.93 0.00 0.00 178.83 178.22 3dah n LEU 187 N -3.41 3.23 -3.22 -2.39 4.77 -0.68 -5.00 117.00 110.30 3dah n LEU 187 Ca 0.00 -1.55 -0.15 0.00 -0.03 0.00 0.00 56.01 54.29 3dah n LEU 187 Cb 0.46 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 3dah n LEU 187 CO 0.34 0.71 -0.15 -3.20 -1.33 0.00 0.00 177.39 173.76 3dah n ASN 188 N 1.25 -2.79 -3.45 -1.43 4.05 0.22 -5.00 115.26 108.10 3dah n ASN 188 Ca 0.17 -0.55 -0.18 0.00 0.45 0.00 0.00 54.58 54.47 3dah n ASN 188 Cb 0.54 -0.92 -0.08 0.00 1.23 0.00 0.00 39.78 40.55 3dah n ASN 188 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3dah s ASP 190 N -3.32 2.29 0.04 0.00 1.01 -1.26 -4.48 116.67 110.94 3dah s ASP 190 Ca 0.39 0.43 0.03 0.00 0.71 0.00 0.00 52.55 54.11 3dah s ASP 190 Cb 0.02 -0.56 -0.02 0.00 1.01 0.00 0.00 42.92 43.37 3dah s ASP 190 CO 0.24 -3.26 -0.10 -0.22 0.21 0.00 0.00 175.17 172.04 3dah s LEU 191 N -6.30 2.19 0.06 1.23 0.20 -1.26 -2.69 118.68 112.11 3dah s LEU 191 Ca 0.72 -0.45 -0.00 0.00 0.69 0.00 0.00 54.13 55.09 3dah s LEU 191 Cb -0.06 -0.38 -0.04 0.00 -0.43 0.00 0.00 46.19 45.28 3dah s LEU 191 CO 0.54 -0.06 -0.04 0.00 -0.29 0.00 0.00 176.35 176.51 3dah s ALA 192 N -0.96 0.57 -0.27 5.97 0.00 -1.02 -5.00 121.76 121.05 3dah s ALA 192 Ca -0.03 -1.19 0.03 0.00 0.00 0.00 0.00 51.96 50.77 3dah s ALA 192 Cb -0.08 0.24 -0.00 0.00 0.00 0.00 0.00 23.12 23.28 3dah s ALA 192 CO 0.01 -0.33 0.35 0.44 0.00 0.00 0.00 175.76 176.23 3dah n ILE 193 N 0.19 0.00 0.00 0.00 -5.35 -1.26 -1.87 119.36 111.07 3dah n ILE 193 Ca -0.14 -0.46 0.00 0.00 -0.27 0.00 0.00 62.75 61.87 3dah n ILE 193 Cb 0.61 1.03 0.00 0.00 -1.74 0.00 0.00 39.64 39.54 3dah n ILE 193 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 3dah n GLU 214 N -0.48 0.00 -0.08 6.28 2.13 -1.26 -4.90 120.64 122.34 3dah n GLU 214 Ca 0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.83 3dah n GLU 214 Cb 0.06 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.77 3dah n GLU 214 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3dah n GLY 215 N 5.00 0.78 3.99 8.31 0.00 -1.26 -3.24 105.19 118.77 3dah n GLY 215 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 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 1.38 2.52 -0.34 1.61 1.81 -1.26 -4.29 118.95 120.39 3dah s ARG 216 Ca 0.00 -1.52 -0.17 0.00 -1.72 0.00 0.00 55.73 52.32 3dah s ARG 216 Cb 0.00 -2.59 -0.01 0.00 -0.45 0.00 0.00 34.95 31.90 3dah s ARG 216 CO 0.00 -0.53 0.47 0.99 -0.68 0.00 0.00 175.30 175.56 3dah s THR 217 N -2.53 5.06 -0.23 0.02 2.01 -1.04 -0.38 115.64 118.54 3dah s THR 217 Ca 0.55 0.34 -0.10 0.00 0.31 0.00 0.00 61.69 62.78 3dah s THR 217 Cb -0.07 -3.91 -0.05 0.00 0.01 0.00 0.00 72.50 68.49 3dah s THR 217 CO 0.33 -0.14 0.15 0.00 -0.69 0.00 0.00 174.62 174.27 3dah s VAL 219 N 0.94 3.93 -0.12 0.00 0.11 -0.78 -0.01 120.40 124.47 3dah s VAL 219 Ca 0.07 -0.36 -0.01 0.00 -2.93 0.00 0.00 61.98 58.75 3dah s VAL 219 Cb -0.13 -2.68 -0.02 0.00 -1.53 0.00 0.00 36.38 32.01 3dah s VAL 219 CO 0.03 0.54 -0.09 -0.63 -3.33 0.00 0.00 175.10 171.62 3dah s ILE 220 N -0.12 3.44 -0.03 7.04 1.01 -0.08 -1.36 121.20 131.09 3dah s ILE 220 Ca 0.03 -0.54 0.07 0.00 0.00 0.00 0.00 60.65 60.21 3dah s ILE 220 Cb -0.13 -2.45 -0.02 0.00 0.01 0.00 0.00 42.46 39.87 3dah s ILE 220 CO 0.02 0.53 -0.25 -0.32 0.00 0.00 0.00 174.94 174.93 3dah s MET 221 N 0.09 2.28 0.09 2.79 1.75 -1.26 0.22 119.30 125.27 3dah s MET 221 Ca -0.03 -0.90 -0.04 0.00 -1.25 0.00 0.00 55.69 53.46 3dah s MET 221 Cb -0.14 -2.11 -0.02 0.00 2.84 0.00 0.00 34.83 35.40 3dah s MET 221 CO 0.04 0.51 0.09 0.34 -0.65 0.00 0.00 175.02 175.35 3dah s ASP 222 N -0.47 0.29 0.08 1.11 -1.08 0.57 -4.97 116.67 112.19 3dah s ASP 222 Ca 0.06 -0.90 -0.16 0.00 -0.52 0.00 0.00 52.55 51.03 3dah s ASP 222 Cb -0.11 0.29 -0.12 0.00 -1.46 0.00 0.00 42.92 41.52 3dah s ASP 222 CO 0.01 -0.69 1.36 0.44 0.52 0.00 0.00 175.17 176.80 3dah h ASP 223 N 2.91 0.71 -5.14 -0.34 3.45 -1.93 -3.00 116.42 113.07 3dah h ASP 223 Ca -0.34 -0.52 -0.05 0.00 0.43 0.00 0.00 57.03 56.54 3dah h ASP 223 Cb 1.18 -0.20 -0.12 0.00 -0.56 0.00 0.00 39.33 39.63 3dah h ASP 223 CO 0.60 1.09 -0.11 0.00 -1.57 0.00 0.00 179.24 179.25 3dah s MET 224 N -4.15 1.22 -0.10 3.56 0.23 -1.26 -1.46 119.30 117.33 3dah s MET 224 Ca -0.12 -0.92 0.00 0.00 -1.03 0.00 0.00 55.69 53.62 3dah s MET 224 Cb 0.08 0.46 0.02 0.00 -1.53 0.00 0.00 34.83 33.86 3dah s MET 224 CO 0.83 -0.48 -0.09 0.08 -2.03 0.00 0.00 175.02 173.32 3dah s VAL 225 N -3.88 1.10 0.00 5.16 1.01 -0.32 -4.90 120.40 118.57 3dah s VAL 225 Ca 0.10 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.71 3dah s VAL 225 Cb 0.01 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.31 3dah s VAL 225 CO -0.05 0.37 0.00 -0.67 0.00 0.00 0.00 175.10 174.76 3dah n ASP 226 N 4.60 0.00 0.24 3.32 2.03 -1.26 -1.09 116.55 124.39 3dah n ASP 226 Ca -0.16 0.00 0.15 0.00 0.52 0.00 0.00 54.79 55.30 3dah n ASP 226 Cb 0.50 0.00 0.48 0.00 -0.72 0.00 0.00 41.12 41.38 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 -0.04 5.18 1.35 -1.94 -2.87 112.91 114.59 3dah h THR 227 Ca 0.00 -0.67 -0.02 0.00 -0.55 0.00 0.00 66.41 65.17 3dah h THR 227 Cb 0.00 1.65 -0.01 0.00 -1.73 0.00 0.00 68.15 68.07 3dah h THR 227 CO 0.00 0.00 -0.01 0.00 -0.25 0.00 0.00 175.52 175.26 3dah n ALA 228 N -2.06 -0.01 0.16 6.62 0.00 -1.26 -4.23 120.51 119.72 3dah n ALA 228 Ca 0.02 0.01 -0.14 0.00 0.00 0.00 0.00 53.44 53.34 3dah n ALA 228 Cb 0.39 -0.95 -0.07 0.00 0.00 0.00 0.00 19.45 18.82 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 -0.39 1.11 0.00 0.00 -1.96 -1.32 103.07 100.50 3dah h GLY 229 Ca -0.02 0.18 -0.16 0.00 0.00 0.00 0.00 47.33 47.33 3dah h GLY 229 CO 0.02 -0.16 -0.38 -0.91 0.00 0.00 0.00 176.54 175.11 3dah h THR 230 N -0.39 1.27 -0.66 4.70 1.35 -1.99 -1.24 112.91 115.95 3dah h THR 230 Ca -0.02 -1.56 0.13 0.00 -0.55 0.00 0.00 66.41 64.41 3dah h THR 230 Cb 0.34 1.42 -0.09 0.00 -1.73 0.00 0.00 68.15 68.08 3dah h THR 230 CO 0.01 0.52 0.18 -0.07 -0.25 0.00 0.00 175.52 175.91 3dah h LEU 231 N 0.73 0.09 -0.13 3.87 3.38 -1.96 -0.40 115.31 120.89 3dah h LEU 231 Ca 0.06 0.11 -0.24 0.00 0.09 0.00 0.00 57.88 57.90 3dah h LEU 231 Cb 0.98 0.14 0.01 0.00 0.09 0.00 0.00 40.66 41.88 3dah h LEU 231 CO 0.09 0.03 -0.94 0.00 0.09 0.00 0.00 178.44 177.71 3dah h LYS 233 N 0.33 -0.18 -0.53 0.00 1.57 -1.13 -1.79 116.57 114.84 3dah h LYS 233 Ca -0.09 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.78 3dah h LYS 233 Cb 1.58 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 33.87 3dah h LYS 233 CO 0.18 -0.12 0.20 0.00 -0.57 0.00 0.00 179.45 179.13 3dah h ALA 234 N 0.74 0.66 -0.89 3.86 0.00 -0.93 -0.60 119.26 122.11 3dah h ALA 234 Ca 0.02 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3dah h ALA 234 Cb 0.21 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 3dah h ALA 234 CO -0.06 -0.20 0.59 0.00 0.00 0.00 0.00 179.25 179.58 3dah h ALA 235 N 1.36 1.38 0.49 0.00 0.00 -0.81 -1.60 119.26 120.07 3dah h ALA 235 Ca 0.26 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 3dah h ALA 235 Cb 0.28 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3dah h ALA 235 CO -0.26 0.56 -0.23 0.37 0.00 0.00 0.00 179.25 179.69 3dah h GLN 236 N 1.19 -0.63 0.00 0.00 5.75 -0.45 -2.39 115.11 118.58 3dah h GLN 236 Ca 0.33 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.88 3dah h GLN 236 Cb -0.10 0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.59 3dah h GLN 236 CO -0.08 -0.34 0.00 1.33 -2.65 0.00 0.00 178.83 177.09 3dah n VAL 237 N -5.24 1.28 0.08 2.39 0.24 -0.31 0.08 118.33 116.86 3dah n VAL 237 Ca -0.10 0.43 -0.19 0.00 -2.04 0.00 0.00 64.34 62.44 3dah n VAL 237 Cb 0.30 -1.34 -0.15 0.00 -1.47 0.00 0.00 33.84 31.18 3dah n VAL 237 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3dah h LEU 238 N 0.00 0.51 0.03 1.34 3.38 -1.25 -3.32 115.31 115.99 3dah h LEU 238 Ca 0.00 -0.65 -0.22 0.00 0.09 0.00 0.00 57.88 57.10 3dah h LEU 238 Cb 0.14 -0.16 0.02 0.00 0.09 0.00 0.00 40.66 40.75 3dah h LEU 238 CO 0.00 1.53 -0.89 0.50 0.09 0.00 0.00 178.44 179.68 3dah h LYS 239 N 0.09 0.55 -0.49 1.13 1.63 -0.27 -2.11 116.57 117.10 3dah h LYS 239 Ca -0.25 -0.63 0.09 0.00 -0.85 0.00 0.00 60.65 59.01 3dah h LYS 239 Cb 2.05 0.19 -0.08 0.00 -0.60 0.00 0.00 32.23 33.79 3dah h LYS 239 CO 0.19 1.24 0.03 0.93 -3.45 0.00 0.00 179.45 178.39 3dah h GLU 240 N 0.12 0.14 -0.98 1.90 5.08 -0.53 -2.52 114.58 117.79 3dah h GLU 240 Ca -0.12 -0.01 -0.27 0.00 -1.00 0.00 0.00 59.36 57.96 3dah h GLU 240 Cb 1.58 -0.03 -0.16 0.00 0.50 0.00 0.00 28.75 30.64 3dah h GLU 240 CO 0.17 0.09 0.35 0.54 -1.00 0.00 0.00 179.01 179.16 3dah n ARG 241 N -5.20 1.83 0.00 2.33 1.74 -1.15 -4.90 116.66 111.31 3dah n ARG 241 Ca 0.05 -1.73 0.00 0.00 -0.77 0.00 0.00 57.85 55.40 3dah n ARG 241 Cb 0.26 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 30.00 3dah n ARG 241 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dah n GLY 242 N -0.38 3.31 3.57 -0.13 0.00 -0.95 -4.77 105.19 105.84 3dah n GLY 242 Ca 0.33 -1.06 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 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 0.00 -0.48 -1.00 4.61 0.00 -0.81 -4.25 120.51 118.58 3dah n ALA 243 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 3dah n ALA 243 Cb 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 17.47 3dah n ALA 243 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3dah n LYS 244 N 0.69 0.00 -4.38 0.00 4.76 0.49 -4.75 118.16 114.95 3dah n LYS 244 Ca 0.10 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.26 3dah n LYS 244 Cb 0.32 -0.80 -0.12 0.00 -1.84 0.00 0.00 35.03 32.60 3dah n LYS 244 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3dah s GLN 245 N -0.63 1.56 -0.12 1.97 -0.21 -1.23 -5.02 119.66 115.97 3dah s GLN 245 Ca 0.00 -1.39 0.03 0.00 0.02 0.00 0.00 55.36 54.01 3dah s GLN 245 Cb 0.00 -1.93 0.01 0.00 1.00 0.00 0.00 33.01 32.09 3dah s GLN 245 CO 0.00 0.43 -0.22 0.08 -2.12 0.00 0.00 175.29 173.47 3dah s VAL 246 N -1.38 1.98 0.01 1.09 1.01 -1.26 -0.47 120.40 121.38 3dah s VAL 246 Ca 0.18 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.28 3dah s VAL 246 Cb -0.09 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.53 3dah s VAL 246 CO 0.09 0.54 -0.18 -0.36 0.00 0.00 0.00 175.10 175.18 3dah s PHE 247 N 0.69 1.60 -0.00 5.22 0.08 0.99 -0.02 117.98 126.54 3dah s PHE 247 Ca -0.11 -0.33 0.06 0.00 0.12 0.00 0.00 56.93 56.68 3dah s PHE 247 Cb -0.16 -0.99 -0.02 0.00 -0.57 0.00 0.00 43.02 41.28 3dah s PHE 247 CO 0.01 0.02 -0.20 0.00 -0.10 0.00 0.00 175.22 174.95 3dah s ALA 248 N -0.61 1.70 -0.06 5.36 0.00 -0.73 -0.91 121.76 126.52 3dah s ALA 248 Ca 0.06 -0.91 0.04 0.00 0.00 0.00 0.00 51.96 51.16 3dah s ALA 248 Cb -0.08 -0.41 -0.00 0.00 0.00 0.00 0.00 23.12 22.63 3dah s ALA 248 CO 0.00 0.41 -0.19 0.71 0.00 0.00 0.00 175.76 176.70 3dah s TYR 249 N -0.54 1.94 -0.10 0.00 2.02 0.13 -0.66 117.35 120.15 3dah s TYR 249 Ca 0.08 -0.66 -0.09 0.00 -0.37 0.00 0.00 57.07 56.03 3dah s TYR 249 Cb -0.08 -1.32 0.03 0.00 -0.40 0.00 0.00 41.96 40.19 3dah s TYR 249 CO -0.00 -0.25 0.27 0.00 -1.57 0.00 0.00 175.55 173.99 3dah s ALA 250 N 0.21 -0.66 0.05 3.71 0.00 -0.61 -0.32 121.76 124.14 3dah s ALA 250 Ca -0.09 0.79 -0.27 0.00 0.00 0.00 0.00 51.96 52.38 3dah s ALA 250 Cb -0.14 -0.46 -0.17 0.00 0.00 0.00 0.00 23.12 22.35 3dah s ALA 250 CO 0.04 -0.13 1.51 1.15 0.00 0.00 0.00 175.76 178.33 3dah h THR 251 N 4.82 0.70 -3.61 0.00 2.02 -1.35 -3.26 112.91 112.23 3dah h THR 251 Ca -0.27 -0.25 -0.70 0.00 0.77 0.00 0.00 66.41 65.95 3dah h THR 251 Cb 1.19 0.84 -0.26 0.00 -1.74 0.00 0.00 68.15 68.17 3dah h THR 251 CO 0.34 0.05 -0.54 -1.00 0.37 0.00 0.00 175.52 174.74 3dah s HIS 252 N -5.55 3.26 -1.24 3.16 3.76 -0.54 -2.06 115.29 116.07 3dah s HIS 252 Ca -0.15 -1.17 -0.15 0.00 -0.15 0.00 0.00 55.06 53.44 3dah s HIS 252 Cb 0.04 -2.42 0.14 0.00 1.11 0.00 0.00 32.58 31.45 3dah s HIS 252 CO 0.61 -0.69 1.53 -0.35 -0.85 0.00 0.00 174.74 174.98 3dah n PRO 253 N 4.93 3.32 0.17 8.40 -0.04 -1.26 -1.17 135.00 149.34 3dah n PRO 253 Ca -0.12 -3.69 -0.13 0.00 -0.04 0.00 0.00 63.50 59.53 3dah n PRO 253 Cb 0.45 -3.16 -0.08 0.00 -0.04 0.00 0.00 33.50 30.67 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 4.88 0.59 -5.96 0.52 2.07 -1.49 -3.45 116.25 113.40 3dah h VAL 254 Ca 0.36 -0.64 -0.38 0.00 0.82 0.00 0.00 66.70 66.86 3dah h VAL 254 Cb 0.87 0.88 0.11 0.00 -1.52 0.00 0.00 31.29 31.63 3dah h VAL 254 CO 1.31 0.11 -0.89 0.18 0.02 0.00 0.00 177.57 178.30 3dah n LEU 255 N -5.13 -3.74 -4.98 2.57 4.77 -0.25 -4.95 117.00 105.28 3dah n LEU 255 Ca -0.09 -0.88 -0.20 0.00 -0.03 0.00 0.00 56.01 54.81 3dah n LEU 255 Cb 0.27 -2.70 0.00 0.00 -2.33 0.00 0.00 43.42 38.66 3dah n LEU 255 CO 0.29 0.35 0.13 -0.94 -1.33 0.00 0.00 177.39 175.89 3dah s SER 256 N -3.67 5.87 -1.02 -1.43 1.04 -1.09 -4.62 113.70 108.79 3dah s SER 256 Ca 0.35 -0.10 -0.17 0.00 0.48 0.00 0.00 55.95 56.52 3dah s SER 256 Cb -0.10 -1.21 0.02 0.00 0.10 0.00 0.00 66.02 64.83 3dah s SER 256 CO 0.81 -0.57 0.67 0.61 0.98 0.00 0.00 173.24 175.75 3dah n GLY 257 N -1.80 -1.08 1.65 7.32 0.00 -1.26 -2.67 105.19 107.36 3dah n GLY 257 Ca 0.02 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.51 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 -1.84 0.77 0.22 -0.02 0.00 -1.26 -4.96 105.19 98.10 3dah n GLY 258 Ca -0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 0.08 -0.62 4.61 0.00 -1.68 -1.29 119.26 120.36 3dah h ALA 259 Ca 0.00 0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.10 3dah h ALA 259 Cb 0.00 0.41 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 3dah h ALA 259 CO 0.00 -0.55 0.30 0.00 0.00 0.00 0.00 179.25 179.00 3dah h ALA 260 N 1.12 0.83 -0.52 0.00 0.00 -1.88 -0.82 119.26 117.99 3dah h ALA 260 Ca 0.17 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3dah h ALA 260 Cb 0.38 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3dah h ALA 260 CO -0.41 -0.07 0.16 -0.44 0.00 0.00 0.00 179.25 178.48 3dah h ASP 261 N 0.55 0.76 -0.52 0.00 3.32 -1.83 -1.39 116.42 117.31 3dah h ASP 261 Ca 0.30 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 3dah h ASP 261 Cb 0.27 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 3dah h ASP 261 CO -0.23 0.77 0.29 -0.09 -1.72 0.00 0.00 179.24 178.25 3dah h ARG 262 N 0.71 0.75 -0.00 3.56 2.43 -0.83 -2.22 114.38 118.77 3dah h ARG 262 Ca 0.17 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 3dah h ARG 262 Cb 0.29 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3dah h ARG 262 CO -0.00 0.57 -0.07 0.82 -1.51 0.00 0.00 179.97 179.77 3dah h ILE 263 N 0.76 1.58 -0.69 1.20 2.04 -0.98 -2.53 117.51 118.90 3dah h ILE 263 Ca 0.19 -1.80 0.13 0.00 1.00 0.00 0.00 64.86 64.39 3dah h ILE 263 Cb 0.04 2.77 -0.09 0.00 -0.74 0.00 0.00 36.82 38.80 3dah h ILE 263 CO -0.03 0.48 0.20 0.00 0.00 0.00 0.00 178.15 178.80 3dah h ALA 264 N 0.26 0.89 0.00 1.87 0.00 -1.21 -1.57 119.26 119.50 3dah h ALA 264 Ca -0.01 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3dah h ALA 264 Cb 0.82 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3dah h ALA 264 CO 0.01 -0.28 0.00 0.00 0.00 0.00 0.00 179.25 178.99 3dah n ALA 265 N -2.58 2.20 -1.97 0.00 0.00 -0.84 -4.92 120.51 112.40 3dah n ALA 265 Ca 0.12 -0.08 -0.26 0.00 0.00 0.00 0.00 53.44 53.22 3dah n ALA 265 Cb 0.39 -1.43 0.13 0.00 0.00 0.00 0.00 19.45 18.54 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 -3.14 4.04 0.00 0.00 1.04 -0.59 -4.98 113.70 110.07 3dah s SER 266 Ca 0.12 -0.07 0.26 0.00 0.48 0.00 0.00 55.95 56.75 3dah s SER 266 Cb 0.17 -0.25 1.19 0.00 0.10 0.00 0.00 66.02 67.23 3dah s SER 266 CO 0.49 -2.08 1.86 0.00 0.98 0.00 0.00 173.24 174.48 3dah n ALA 267 N -3.12 2.24 -1.76 5.32 0.00 -1.26 -4.84 120.51 117.09 3dah n ALA 267 Ca 0.14 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 53.07 3dah n ALA 267 Cb 0.60 -1.43 0.01 0.00 0.00 0.00 0.00 19.45 18.63 3dah n ALA 267 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dah n LEU 268 N -1.43 4.68 -0.02 0.00 4.77 -1.26 -4.50 117.00 119.24 3dah n LEU 268 Ca 0.08 1.18 -0.02 0.00 -0.03 0.00 0.00 56.01 57.22 3dah n LEU 268 Cb 0.28 -1.59 -0.12 0.00 -2.33 0.00 0.00 43.42 39.65 3dah n LEU 268 CO 0.23 -0.08 -0.62 0.47 -1.33 0.00 0.00 177.39 176.06 3dah n ASP 269 N 0.27 0.51 -3.60 -1.43 9.92 0.97 -4.97 116.55 118.23 3dah n ASP 269 Ca 0.03 0.23 -0.12 0.00 -0.53 0.00 0.00 54.79 54.40 3dah n ASP 269 Cb 0.39 0.60 -0.06 0.00 -0.64 0.00 0.00 41.12 41.41 3dah n ASP 269 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 3dah s GLU 270 N -2.84 0.72 -0.20 -1.24 2.12 -1.24 -4.85 118.70 111.16 3dah s GLU 270 Ca -0.06 0.54 -0.04 0.00 0.36 0.00 0.00 54.97 55.77 3dah s GLU 270 Cb 0.09 0.35 -0.02 0.00 0.26 0.00 0.00 34.13 34.80 3dah s GLU 270 CO 0.83 -0.15 -0.03 -1.17 -0.54 0.00 0.00 175.26 174.21 3dah s LEU 271 N -0.29 3.07 -0.16 2.70 2.96 0.87 -1.77 118.68 126.07 3dah s LEU 271 Ca -0.01 -0.29 -0.03 0.00 -0.22 0.00 0.00 54.13 53.57 3dah s LEU 271 Cb -0.03 -1.77 -0.02 0.00 0.50 0.00 0.00 46.19 44.86 3dah s LEU 271 CO 0.00 0.04 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.33 3dah s VAL 272 N 1.16 3.69 0.22 1.68 1.01 0.16 -0.68 120.40 127.64 3dah s VAL 272 Ca 0.02 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.58 3dah s VAL 272 Cb -0.15 -2.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 3dah s VAL 272 CO 0.00 0.49 0.10 0.68 0.00 0.00 0.00 175.10 176.37 3dah s VAL 273 N 0.48 0.32 0.65 2.92 -7.23 0.43 -1.57 120.40 116.40 3dah s VAL 273 Ca -0.04 -1.99 0.03 0.00 -1.81 0.00 0.00 61.98 58.16 3dah s VAL 273 Cb -0.15 -2.48 0.10 0.00 0.56 0.00 0.00 36.38 34.41 3dah s VAL 273 CO 0.03 -0.09 0.89 0.42 -0.31 0.00 0.00 175.10 176.04 3dah s THR 274 N -3.92 2.23 -0.41 5.32 -4.23 -0.88 0.79 115.64 114.54 3dah s THR 274 Ca 0.36 -0.74 0.05 0.00 -1.18 0.00 0.00 61.69 60.18 3dah s THR 274 Cb 0.07 -2.50 0.63 0.00 1.34 0.00 0.00 72.50 72.04 3dah s THR 274 CO 0.11 0.00 1.80 -0.90 -0.54 0.00 0.00 174.62 175.09 3dah n ASP 275 N -2.57 3.41 0.11 3.99 5.75 -0.59 -4.51 116.55 122.14 3dah n ASP 275 Ca 0.14 -3.66 -0.02 0.00 -0.01 0.00 0.00 54.79 51.24 3dah n ASP 275 Cb 0.61 -0.79 0.22 0.00 -1.03 0.00 0.00 41.12 40.13 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 1.00 1.34 -3.35 2.12 1.35 -1.88 -3.39 112.91 110.10 3dah h THR 276 Ca 0.53 -1.65 -0.67 0.00 -0.55 0.00 0.00 66.41 64.07 3dah h THR 276 Cb 2.56 1.81 -0.33 0.00 -1.73 0.00 0.00 68.15 70.46 3dah h THR 276 CO 0.92 0.49 -0.79 -0.63 -0.25 0.00 0.00 175.52 175.26 3dah s ILE 277 N -4.00 2.55 0.43 6.82 1.01 -1.26 -4.78 121.20 121.97 3dah s ILE 277 Ca -0.04 -0.97 -0.25 0.00 0.00 0.00 0.00 60.65 59.39 3dah s ILE 277 Cb 0.13 -2.21 -0.08 0.00 0.01 0.00 0.00 42.46 40.31 3dah s ILE 277 CO 0.77 0.35 1.38 -2.84 0.00 0.00 0.00 174.94 174.59 3dah s PRO 278 N 1.31 3.79 0.18 2.79 0.02 -1.26 -4.75 135.00 137.08 3dah s PRO 278 Ca 0.02 2.31 -0.31 0.00 0.02 0.00 0.00 61.00 63.05 3dah s PRO 278 Cb -0.15 -2.69 -0.09 0.00 0.02 0.00 0.00 34.50 31.59 3dah s PRO 278 CO -0.08 -0.70 1.43 -0.51 -0.33 0.00 0.00 177.00 176.82 3dah s LEU 279 N -2.62 4.38 1.18 -5.54 1.02 -1.26 -5.03 118.68 110.81 3dah s LEU 279 Ca 0.60 2.51 -0.16 0.00 0.02 0.00 0.00 54.13 57.09 3dah s LEU 279 Cb -0.41 -3.60 0.27 0.00 0.02 0.00 0.00 46.19 42.47 3dah s LEU 279 CO 0.53 -0.68 1.05 -0.94 0.02 0.00 0.00 176.35 176.33 3dah s SER 280 N 0.76 1.04 0.20 2.29 1.04 -1.26 -4.76 113.70 113.02 3dah s SER 280 Ca 0.63 1.03 -0.11 0.00 0.48 0.00 0.00 55.95 57.98 3dah s SER 280 Cb -0.40 -1.56 0.14 0.00 0.10 0.00 0.00 66.02 64.30 3dah s SER 280 CO 0.36 -4.09 1.87 0.00 0.98 0.00 0.00 173.24 172.35 3dah h ALA 281 N -2.55 0.91 -0.64 5.32 0.00 -1.99 -1.30 119.26 119.00 3dah h ALA 281 Ca -0.52 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.29 3dah h ALA 281 Cb 1.33 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 3dah h ALA 281 CO 0.45 0.34 0.24 0.93 0.00 0.00 0.00 179.25 181.21 3dah h GLU 282 N 0.97 0.97 -0.43 0.00 5.08 -1.99 -1.66 114.58 117.52 3dah h GLU 282 Ca 0.26 -0.19 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 3dah h GLU 282 Cb -0.09 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 3dah h GLU 282 CO -0.05 0.83 -0.26 0.77 -1.00 0.00 0.00 179.01 179.30 3dah h SER 283 N 0.91 0.95 -0.67 1.42 0.02 -1.87 -2.22 113.55 112.08 3dah h SER 283 Ca 0.21 -0.37 0.05 0.00 -0.84 0.00 0.00 61.79 60.84 3dah h SER 283 Cb 0.23 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.46 3dah h SER 283 CO -0.01 1.14 0.38 -0.07 -1.14 0.00 0.00 176.83 177.13 3dah h LEU 284 N 0.78 0.59 -1.03 5.07 3.38 -1.13 -2.98 115.31 120.00 3dah h LEU 284 Ca 0.10 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3dah h LEU 284 Cb 0.82 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 3dah h LEU 284 CO 0.07 0.39 0.03 0.00 0.09 0.00 0.00 178.44 179.03 3dah h ALA 285 N 1.33 1.21 -1.99 1.53 0.00 -1.02 -3.42 119.26 116.88 3dah h ALA 285 Ca 0.29 -0.23 -0.57 0.00 0.00 0.00 0.00 54.91 54.40 3dah h ALA 285 Cb 0.13 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3dah h ALA 285 CO -0.16 0.53 1.09 0.00 0.00 0.00 0.00 179.25 180.71 3dah n PRO 287 N 7.62 0.11 0.12 0.00 -0.04 -1.26 -2.51 135.00 139.04 3dah n PRO 287 Ca 0.18 0.33 0.13 0.00 -0.04 0.00 0.00 63.50 64.10 3dah n PRO 287 Cb 0.46 -1.70 0.39 0.00 -0.04 0.00 0.00 33.50 32.60 3dah n PRO 287 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3dah h LYS 288 N 0.00 0.00 -4.81 0.54 1.57 -1.91 -3.44 116.57 108.53 3dah h LYS 288 Ca 0.00 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.11 3dah h LYS 288 Cb 0.33 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.46 3dah h LYS 288 CO 0.00 0.00 -0.43 0.42 -0.57 0.00 0.00 179.45 178.87 3dah s ILE 289 N -3.12 5.26 -0.08 1.86 1.01 -1.04 -0.09 121.20 125.00 3dah s ILE 289 Ca 0.10 -0.08 0.04 0.00 0.00 0.00 0.00 60.65 60.71 3dah s ILE 289 Cb 0.12 -3.72 -0.01 0.00 0.01 0.00 0.00 42.46 38.86 3dah s ILE 289 CO 0.60 0.01 -0.21 -0.60 0.00 0.00 0.00 174.94 174.74 3dah s ARG 290 N 1.81 2.82 -0.12 2.79 3.52 0.14 -4.96 118.95 124.95 3dah s ARG 290 Ca 0.08 -0.82 -0.01 0.00 -0.13 0.00 0.00 55.73 54.85 3dah s ARG 290 Cb -0.17 -2.32 -0.02 0.00 -1.56 0.00 0.00 34.95 30.87 3dah s ARG 290 CO 0.11 0.34 -0.08 0.00 -0.81 0.00 0.00 175.30 174.87 3dah s ALA 291 N -0.04 2.88 0.14 6.12 0.00 -1.26 -0.43 121.76 129.17 3dah s ALA 291 Ca -0.06 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 51.08 3dah s ALA 291 Cb -0.15 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.60 3dah s ALA 291 CO 0.05 0.35 0.15 -0.51 0.00 0.00 0.00 175.76 175.80 3dah s LEU 292 N -0.07 3.93 0.13 0.00 1.43 0.24 -4.93 118.68 119.40 3dah s LEU 292 Ca 0.00 -0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 3dah s LEU 292 Cb -0.13 -2.54 -0.06 0.00 0.03 0.00 0.00 46.19 43.48 3dah s LEU 292 CO 0.03 0.09 1.02 -0.55 0.23 0.00 0.00 176.35 177.17 3dah s SER 293 N -2.94 7.40 0.00 2.29 0.15 -1.26 -1.55 113.70 117.80 3dah s SER 293 Ca 0.31 1.90 0.15 0.00 0.70 0.00 0.00 55.95 59.02 3dah s SER 293 Cb -0.11 -2.59 0.21 0.00 -1.71 0.00 0.00 66.02 61.82 3dah s SER 293 CO 0.24 -0.13 1.10 -1.54 1.20 0.00 0.00 173.24 174.11 3dah n SER 294 N 2.70 2.59 -0.24 5.45 3.41 -1.26 -4.70 113.62 121.57 3dah n SER 294 Ca 0.03 -1.75 -0.06 0.00 -0.26 0.00 0.00 58.87 56.82 3dah n SER 294 Cb 0.48 -0.10 0.05 0.00 -0.26 0.00 0.00 64.21 64.38 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 2.97 0.87 -0.65 7.33 0.00 -1.92 -1.81 119.26 126.06 3dah h ALA 295 Ca 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 3dah h ALA 295 Cb 0.70 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3dah h ALA 295 CO 0.00 0.41 0.22 0.78 0.00 0.00 0.00 179.25 180.66 3dah h GLY 296 N 0.93 1.05 1.11 0.00 0.00 -1.92 0.13 103.07 104.37 3dah h GLY 296 Ca 0.24 -0.58 -0.16 0.00 0.00 0.00 0.00 47.33 46.83 3dah h GLY 296 CO -0.03 0.54 -0.40 -2.00 0.00 0.00 0.00 176.54 174.65 3dah h LEU 297 N 0.95 0.96 -0.28 3.11 5.85 -1.82 -1.17 115.31 122.91 3dah h LEU 297 Ca 0.21 -0.48 -0.04 0.00 0.84 0.00 0.00 57.88 58.41 3dah h LEU 297 Cb 0.25 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3dah h LEU 297 CO -0.01 1.25 0.01 -0.07 -0.34 0.00 0.00 178.44 179.28 3dah h LEU 298 N 0.70 0.47 -0.95 2.25 -0.00 -1.25 -2.02 115.31 114.51 3dah h LEU 298 Ca 0.05 -0.29 -0.06 0.00 -0.00 0.00 0.00 57.88 57.58 3dah h LEU 298 Cb 1.00 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 41.51 3dah h LEU 298 CO 0.10 0.64 0.11 0.00 -0.00 0.00 0.00 178.44 179.29 3dah h ALA 299 N 0.84 1.14 -0.46 1.53 0.00 -0.96 -0.95 119.26 120.40 3dah h ALA 299 Ca 0.08 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 3dah h ALA 299 Cb 0.40 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3dah h ALA 299 CO 0.01 0.57 -0.11 1.49 0.00 0.00 0.00 179.25 181.21 3dah h GLU 300 N 0.83 0.84 -0.42 0.00 4.57 -1.23 -2.29 114.58 116.88 3dah h GLU 300 Ca 0.18 -0.29 -0.07 0.00 -1.18 0.00 0.00 59.36 58.00 3dah h GLU 300 Cb 0.35 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 3dah h GLU 300 CO 0.00 0.91 -0.01 1.15 -1.18 0.00 0.00 179.01 179.89 3dah h THR 301 N 0.76 1.26 -0.12 0.32 2.02 -0.94 -1.09 112.91 115.12 3dah h THR 301 Ca 0.12 -1.05 0.00 0.00 0.77 0.00 0.00 66.41 66.25 3dah h THR 301 Cb 0.62 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 3dah h THR 301 CO 0.04 0.36 0.08 -0.26 0.37 0.00 0.00 175.52 176.11 3dah h PHE 302 N 0.59 0.15 -0.09 3.16 -1.00 -1.14 -1.49 116.94 117.12 3dah h PHE 302 Ca 0.12 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.90 3dah h PHE 302 Cb 0.51 -0.05 -0.00 0.00 3.61 0.00 0.00 35.95 40.01 3dah h PHE 302 CO 0.04 0.10 0.05 0.77 -1.61 0.00 0.00 178.31 177.67 3dah h SER 303 N 0.15 0.11 -0.78 2.17 0.02 -1.35 -0.82 113.55 113.05 3dah h SER 303 Ca 0.04 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 60.99 3dah h SER 303 Cb -0.01 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.45 3dah h SER 303 CO -0.01 0.12 0.49 0.03 -1.14 0.00 0.00 176.83 176.32 3dah h ARG 304 N 0.08 0.90 -0.25 3.45 3.08 -1.17 0.24 114.38 120.71 3dah h ARG 304 Ca 0.03 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 3dah h ARG 304 Cb 0.03 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 3dah h ARG 304 CO -0.01 0.60 0.04 0.82 -1.07 0.00 0.00 179.97 180.35 3dah h ILE 305 N 0.93 1.23 -0.76 2.04 2.04 -1.12 0.47 117.51 122.34 3dah h ILE 305 Ca 0.32 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 3dah h ILE 305 Cb 0.07 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 3dah h ILE 305 CO -0.14 0.24 0.41 -0.09 0.00 0.00 0.00 178.15 178.58 3dah h ARG 306 N 0.23 1.06 0.00 2.37 9.65 -0.82 -2.53 114.38 124.34 3dah h ARG 306 Ca 0.08 -0.13 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 3dah h ARG 306 Cb 0.32 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 28.70 3dah h ARG 306 CO 0.00 0.79 0.00 0.00 2.80 0.00 0.00 179.97 183.57 3dah h ARG 307 N 1.05 0.00 0.00 0.20 3.08 -0.48 -3.47 114.38 114.76 3dah h ARG 307 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 3dah h ARG 307 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 3dah h ARG 307 CO -0.04 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.27 3dah n GLY 308 N 0.93 0.55 3.83 0.04 0.00 -0.43 -5.06 105.19 105.06 3dah n GLY 308 Ca 0.04 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.27 4.56 0.02 1.61 -0.00 0.15 -4.98 116.67 115.75 3dah s ASP 309 Ca 0.00 1.15 -0.30 0.00 -0.00 0.00 0.00 52.55 53.41 3dah s ASP 309 Cb 0.00 -1.85 -0.04 0.00 -0.00 0.00 0.00 42.92 41.03 3dah s ASP 309 CO 0.00 -1.91 0.96 -0.94 -0.00 0.00 0.00 175.17 173.28 3dah s SER 310 N -4.10 7.37 -0.03 0.27 1.04 -1.26 -4.43 113.70 112.56 3dah s SER 310 Ca 0.61 1.66 -0.18 0.00 0.48 0.00 0.00 55.95 58.52 3dah s SER 310 Cb -0.13 -2.57 -0.32 0.00 0.10 0.00 0.00 66.02 63.10 3dah s SER 310 CO 0.53 -0.22 0.87 0.58 0.98 0.00 0.00 173.24 175.98 3dah h VAL 311 N 4.66 1.32 0.00 5.02 2.07 -1.95 -3.34 116.25 124.04 3dah h VAL 311 Ca -0.41 -2.58 0.00 0.00 0.82 0.00 0.00 66.70 64.53 3dah h VAL 311 Cb 1.22 3.05 0.00 0.00 -1.52 0.00 0.00 31.29 34.04 3dah h VAL 311 CO 0.74 0.76 0.00 0.23 0.02 0.00 0.00 177.57 179.32 3dah n MET 312 N -3.91 0.01 0.14 1.57 2.81 -1.26 -1.83 117.12 114.65 3dah n MET 312 Ca -0.17 0.31 0.12 0.00 -1.81 0.00 0.00 57.70 56.14 3dah n MET 312 Cb 0.96 -1.53 0.51 0.00 -0.71 0.00 0.00 33.22 32.45 3dah n MET 312 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3dah n SER 313 N -1.56 0.63 0.00 7.83 2.88 -1.25 -5.16 113.62 116.99 3dah n SER 313 Ca 0.03 0.69 0.08 0.00 -1.33 0.00 0.00 58.87 58.34 3dah n SER 313 Cb 0.14 -0.81 0.46 0.00 -0.75 0.00 0.00 64.21 63.25 3dah n SER 313 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99