#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hdf n GLY 33 N 0.00 0.12 3.77 0.27 0.00 -1.26 -4.97 105.19 103.13 3hdf n GLY 33 Ca 0.00 -0.38 -0.38 0.00 0.00 0.00 0.00 46.02 45.26 3hdf n GLY 33 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hdf s LEU 34 N -5.10 4.25 0.12 0.99 1.43 -1.26 -4.97 118.68 114.14 3hdf s LEU 34 Ca 0.76 2.13 -0.32 0.00 -1.03 0.00 0.00 54.13 55.67 3hdf s LEU 34 Cb -0.32 -4.02 -0.11 0.00 0.03 0.00 0.00 46.19 41.76 3hdf s LEU 34 CO 0.48 -0.42 1.80 -1.84 0.23 0.00 0.00 176.35 176.59 3hdf n GLU 35 N 0.27 2.65 -0.77 1.70 -0.00 -1.26 -2.35 120.64 120.88 3hdf n GLU 35 Ca 0.03 0.96 0.00 0.00 -0.00 0.00 0.00 57.16 58.16 3hdf n GLU 35 Cb 0.48 -2.83 0.00 0.00 -0.00 0.00 0.00 31.44 29.09 3hdf n GLU 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3hdf n GLY 36 N 4.12 0.79 3.71 -1.84 0.00 -1.26 -5.03 105.19 105.68 3hdf n GLY 36 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 3hdf n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hdf s VAL 37 N -2.98 5.38 -0.24 1.61 1.01 -0.99 -5.07 120.40 119.12 3hdf s VAL 37 Ca 0.00 0.23 -0.19 0.00 0.00 0.00 0.00 61.98 62.02 3hdf s VAL 37 Cb 0.00 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 3hdf s VAL 37 CO 0.00 0.41 0.55 -0.44 0.00 0.00 0.00 175.10 175.62 3hdf s SER 38 N 0.56 6.52 0.00 3.32 0.01 -1.26 -4.82 113.70 118.03 3hdf s SER 38 Ca 0.09 0.63 0.26 0.00 1.31 0.00 0.00 55.95 58.24 3hdf s SER 38 Cb -0.12 -2.30 0.65 0.00 0.21 0.00 0.00 66.02 64.46 3hdf s SER 38 CO 0.00 -0.27 1.50 -1.22 0.41 0.00 0.00 173.24 173.66 3hdf n TYR 39 N 5.32 0.00 -5.09 2.43 4.01 -1.26 -0.81 117.16 121.76 3hdf n TYR 39 Ca -0.03 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.39 3hdf n TYR 39 Cb 0.50 -0.11 -0.15 0.00 -0.31 0.00 0.00 39.34 39.27 3hdf n TYR 39 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3hdf s ILE 40 N -2.51 2.48 0.54 -0.72 1.01 -1.26 -0.32 121.20 120.42 3hdf s ILE 40 Ca 0.23 -0.91 -0.22 0.00 0.00 0.00 0.00 60.65 59.75 3hdf s ILE 40 Cb 0.19 -1.95 -0.05 0.00 0.01 0.00 0.00 42.46 40.66 3hdf s ILE 40 CO 0.53 0.57 1.35 -2.84 0.00 0.00 0.00 174.94 174.55 3hdf s PRO 41 N -0.23 3.19 0.05 2.79 0.02 -1.26 -4.86 135.00 134.70 3hdf s PRO 41 Ca -0.01 2.21 -0.03 0.00 0.02 0.00 0.00 61.00 63.20 3hdf s PRO 41 Cb -0.13 -2.27 -0.03 0.00 0.02 0.00 0.00 34.50 32.08 3hdf s PRO 41 CO 0.03 -1.15 0.02 1.52 -0.33 0.00 0.00 177.00 177.09 3hdf s TYR 42 N -1.32 0.42 -0.06 6.54 -0.85 -0.30 -4.78 117.35 117.00 3hdf s TYR 42 Ca 0.71 -0.92 -0.22 0.00 -0.52 0.00 0.00 57.07 56.11 3hdf s TYR 42 Cb -0.40 -0.31 -0.04 0.00 0.38 0.00 0.00 41.96 41.60 3hdf s TYR 42 CO 0.47 -0.40 0.66 0.15 -1.52 0.00 0.00 175.55 174.91 3hdf s LYS 43 N -3.71 4.41 0.41 -3.49 1.02 -1.26 -0.42 119.74 116.70 3hdf s LYS 43 Ca 0.05 0.81 -0.06 0.00 0.02 0.00 0.00 55.97 56.78 3hdf s LYS 43 Cb 0.06 -3.43 0.09 0.00 -0.52 0.00 0.00 37.83 34.03 3hdf s LYS 43 CO -0.09 0.13 0.55 -0.40 -0.92 0.00 0.00 175.35 174.62 3hdf n ASP 44 N 3.59 0.09 0.23 2.83 5.68 -0.28 -4.86 116.55 123.84 3hdf n ASP 44 Ca -0.03 -1.23 0.07 0.00 -0.50 0.00 0.00 54.79 53.10 3hdf n ASP 44 Cb 0.51 -0.42 0.59 0.00 -1.14 0.00 0.00 41.12 40.66 3hdf n ASP 44 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3hdf h ILE 45 N -1.26 1.04 -0.61 2.12 6.09 -1.98 -1.09 117.51 121.83 3hdf h ILE 45 Ca -0.18 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.12 3hdf h ILE 45 Cb 0.51 1.07 0.00 0.00 0.47 0.00 0.00 36.82 38.87 3hdf h ILE 45 CO 0.13 0.06 0.00 1.33 -3.07 0.00 0.00 178.15 176.60 3hdf n VAL 46 N -4.47 1.06 -0.51 2.19 0.24 -1.26 -4.93 118.33 110.64 3hdf n VAL 46 Ca -0.03 -0.89 0.00 0.00 -2.04 0.00 0.00 64.34 61.38 3hdf n VAL 46 Cb 0.13 0.31 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 3hdf n VAL 46 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hdf n GLY 47 N 1.36 0.74 3.73 7.63 0.00 -0.41 -5.05 105.19 113.19 3hdf n GLY 47 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 3hdf n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hdf s VAL 48 N -2.09 5.21 0.21 1.61 1.01 -1.26 -4.75 120.40 120.34 3hdf s VAL 48 Ca 0.00 0.85 -0.30 0.00 0.00 0.00 0.00 61.98 62.52 3hdf s VAL 48 Cb 0.00 -3.77 -0.09 0.00 0.00 0.00 0.00 36.38 32.52 3hdf s VAL 48 CO 0.00 0.36 1.42 0.26 0.00 0.00 0.00 175.10 177.14 3hdf s TRP 49 N 0.49 3.11 0.02 5.22 0.52 -1.26 -1.12 118.94 125.92 3hdf s TRP 49 Ca 0.23 1.01 0.00 0.00 0.02 0.00 0.00 56.10 57.37 3hdf s TRP 49 Cb -0.15 -3.77 -0.02 0.00 -1.15 0.00 0.00 33.47 28.39 3hdf s TRP 49 CO 0.09 -2.55 -0.03 0.99 0.02 0.00 0.00 176.95 175.46 3hdf s THR 50 N 0.31 0.16 0.14 2.01 2.01 0.44 -4.33 115.64 116.38 3hdf s THR 50 Ca 0.61 -0.84 -0.17 0.00 0.31 0.00 0.00 61.69 61.60 3hdf s THR 50 Cb -0.40 -0.28 0.04 0.00 0.01 0.00 0.00 72.50 71.87 3hdf s THR 50 CO 0.39 -0.43 0.46 0.54 -0.69 0.00 0.00 174.62 174.88 3hdf s VAL 51 N -1.29 0.05 0.00 3.82 0.11 -0.21 -1.15 120.40 121.73 3hdf s VAL 51 Ca -0.14 -0.51 0.00 0.00 -2.93 0.00 0.00 61.98 58.40 3hdf s VAL 51 Cb -0.09 -1.21 0.00 0.00 -1.53 0.00 0.00 36.38 33.55 3hdf s VAL 51 CO -0.01 -0.22 0.00 0.00 -3.33 0.00 0.00 175.10 171.54 3hdf n HIS 53 N 13.93 2.62 -1.33 0.00 8.25 -1.26 -4.31 115.22 133.12 3hdf n HIS 53 Ca 0.00 -2.88 -0.11 0.00 -0.26 0.00 0.00 57.72 54.47 3hdf n HIS 53 Cb 0.00 -1.99 -0.05 0.00 1.12 0.00 0.00 29.99 29.07 3hdf n HIS 53 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hdf n GLY 54 N 2.25 1.26 3.73 -1.41 0.00 -1.22 -4.48 105.19 105.33 3hdf n GLY 54 Ca 0.63 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3hdf n GLY 54 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3hdf s HIS 55 N -2.41 3.16 0.10 1.61 5.65 -0.24 -4.81 115.29 118.36 3hdf s HIS 55 Ca 0.00 1.05 0.06 0.00 0.25 0.00 0.00 55.06 56.42 3hdf s HIS 55 Cb 0.00 -3.72 -0.03 0.00 -1.18 0.00 0.00 32.58 27.65 3hdf s HIS 55 CO 0.00 -2.38 -0.16 0.95 -0.65 0.00 0.00 174.74 172.50 3hdf s THR 56 N 0.38 1.38 0.00 0.89 -4.23 -1.26 -1.04 115.64 111.76 3hdf s THR 56 Ca 0.60 -1.55 0.00 0.00 -1.18 0.00 0.00 61.69 59.56 3hdf s THR 56 Cb -0.39 -1.40 0.00 0.00 1.34 0.00 0.00 72.50 72.05 3hdf s THR 56 CO 0.37 -0.26 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 3hdf n GLY 57 N 0.90 3.12 0.00 3.99 0.00 -1.26 -4.93 105.19 107.00 3hdf n GLY 57 Ca -0.18 -1.22 0.09 0.00 0.00 0.00 0.00 46.02 44.71 3hdf n GLY 57 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hdf n LYS 58 N -1.38 0.47 0.00 1.61 4.76 -1.26 -2.57 118.16 119.79 3hdf n LYS 58 Ca 0.00 0.04 0.12 0.00 -2.87 0.00 0.00 58.31 55.60 3hdf n LYS 58 Cb 0.00 -1.50 0.33 0.00 -1.84 0.00 0.00 35.03 32.02 3hdf n LYS 58 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3hdf n ASP 59 N -1.09 0.41 -4.74 4.39 5.75 -1.26 -4.90 116.55 115.11 3hdf n ASP 59 Ca 0.12 -0.12 -0.41 0.00 -0.01 0.00 0.00 54.79 54.36 3hdf n ASP 59 Cb 0.09 0.09 -0.03 0.00 -1.03 0.00 0.00 41.12 40.24 3hdf n ASP 59 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3hdf s ILE 60 N -2.98 2.88 -0.42 2.12 1.01 -1.06 -4.98 121.20 117.77 3hdf s ILE 60 Ca 0.12 0.71 -0.16 0.00 0.00 0.00 0.00 60.65 61.32 3hdf s ILE 60 Cb 0.18 -3.45 0.03 0.00 0.01 0.00 0.00 42.46 39.22 3hdf s ILE 60 CO 0.66 0.10 0.36 -0.04 0.00 0.00 0.00 174.94 176.02 3hdf s MET 61 N -0.01 3.01 0.27 2.79 -1.94 -1.26 -5.04 119.30 117.12 3hdf s MET 61 Ca 0.60 -0.96 -0.31 0.00 -1.71 0.00 0.00 55.69 53.31 3hdf s MET 61 Cb -0.40 -3.99 -0.12 0.00 2.01 0.00 0.00 34.83 32.33 3hdf s MET 61 CO 0.39 -0.82 1.64 1.28 -0.01 0.00 0.00 175.02 177.51 3hdf n LEU 62 N 5.33 4.30 0.00 -0.03 4.77 -1.26 -2.09 117.00 128.02 3hdf n LEU 62 Ca -0.10 1.12 0.00 0.00 -0.03 0.00 0.00 56.01 57.00 3hdf n LEU 62 Cb 0.47 -1.59 0.00 0.00 -2.33 0.00 0.00 43.42 39.96 3hdf n LEU 62 CO 0.43 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 3hdf n GLY 63 N 2.67 2.89 3.76 -0.72 0.00 -1.26 -5.02 105.19 107.51 3hdf n GLY 63 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3hdf n GLY 63 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hdf s LYS 64 N -0.40 4.39 -0.43 1.61 2.20 -0.89 -4.93 119.74 121.28 3hdf s LYS 64 Ca 0.00 2.14 -0.20 0.00 -0.36 0.00 0.00 55.97 57.55 3hdf s LYS 64 Cb 0.00 -3.12 0.02 0.00 -1.51 0.00 0.00 37.83 33.22 3hdf s LYS 64 CO 0.00 -0.19 0.59 0.99 -0.36 0.00 0.00 175.35 176.38 3hdf s THR 65 N -0.64 4.89 0.36 3.43 2.01 -1.26 -4.21 115.64 120.22 3hdf s THR 65 Ca 0.52 0.01 -0.25 0.00 0.31 0.00 0.00 61.69 62.28 3hdf s THR 65 Cb -0.38 -4.16 -0.10 0.00 0.01 0.00 0.00 72.50 67.87 3hdf s THR 65 CO 0.46 -0.55 0.99 -0.31 -0.69 0.00 0.00 174.62 174.53 3hdf s TYR 66 N 2.65 3.48 0.53 4.92 1.51 0.57 -5.02 117.35 125.99 3hdf s TYR 66 Ca 0.20 1.71 -0.06 0.00 -1.01 0.00 0.00 57.07 57.91 3hdf s TYR 66 Cb -0.15 -3.01 -0.02 0.00 -0.11 0.00 0.00 41.96 38.67 3hdf s TYR 66 CO 0.18 -0.18 0.85 0.95 -1.11 0.00 0.00 175.55 176.24 3hdf s THR 67 N -1.68 4.53 0.25 -0.71 -4.23 -1.26 -4.84 115.64 107.69 3hdf s THR 67 Ca 0.54 0.23 -0.03 0.00 -1.18 0.00 0.00 61.69 61.25 3hdf s THR 67 Cb -0.19 -3.75 0.22 0.00 1.34 0.00 0.00 72.50 70.12 3hdf s THR 67 CO 0.25 -0.78 1.77 0.11 -0.54 0.00 0.00 174.62 175.42 3hdf h LYS 68 N 0.04 0.59 -0.97 3.99 1.57 -1.98 -0.56 116.57 119.24 3hdf h LYS 68 Ca -0.46 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.32 3hdf h LYS 68 Cb 1.22 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 33.34 3hdf h LYS 68 CO 0.61 0.39 0.64 0.00 -0.57 0.00 0.00 179.45 180.52 3hdf h ALA 69 N 1.52 1.28 -0.24 3.86 0.00 -1.99 -1.06 119.26 122.62 3hdf h ALA 69 Ca 0.42 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.13 3hdf h ALA 69 Cb 0.55 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3hdf h ALA 69 CO -0.33 0.53 -0.48 0.93 0.00 0.00 0.00 179.25 179.89 3hdf h GLU 70 N 1.24 0.64 -0.71 0.00 5.08 -1.62 -1.14 114.58 118.07 3hdf h GLU 70 Ca 0.38 -0.37 -0.04 0.00 -1.00 0.00 0.00 59.36 58.34 3hdf h GLU 70 Cb -0.01 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 3hdf h GLU 70 CO -0.12 0.98 0.30 0.00 -1.00 0.00 0.00 179.01 179.17 3hdf h LYS 72 N 1.03 0.44 -0.90 0.00 1.57 -0.94 -1.73 116.57 116.04 3hdf h LYS 72 Ca 0.24 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3hdf h LYS 72 Cb 0.18 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.48 3hdf h LYS 72 CO -0.02 0.90 0.57 0.00 -0.57 0.00 0.00 179.45 180.32 3hdf h ALA 73 N 1.04 1.14 -0.45 3.86 0.00 -0.84 0.84 119.26 124.85 3hdf h ALA 73 Ca -0.00 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 3hdf h ALA 73 Cb 1.12 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3hdf h ALA 73 CO 0.10 0.57 -0.17 -0.07 0.00 0.00 0.00 179.25 179.68 3hdf h LEU 74 N 1.22 0.88 -0.55 0.00 3.38 -0.95 -1.90 115.31 117.40 3hdf h LEU 74 Ca 0.32 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 3hdf h LEU 74 Cb -0.10 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 3hdf h LEU 74 CO -0.07 1.04 0.08 0.25 0.09 0.00 0.00 178.44 179.84 3hdf h LEU 75 N 0.77 0.88 -0.81 1.67 5.85 -0.91 -1.11 115.31 121.65 3hdf h LEU 75 Ca 0.11 -0.27 0.04 0.00 0.84 0.00 0.00 57.88 58.61 3hdf h LEU 75 Cb 0.70 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.45 3hdf h LEU 75 CO 0.05 0.93 0.51 -1.13 -0.34 0.00 0.00 178.44 178.46 3hdf h ASN 76 N 0.81 0.84 -0.47 1.25 -0.73 -0.65 0.12 115.58 116.75 3hdf h ASN 76 Ca 0.17 -0.00 -0.04 0.00 1.87 0.00 0.00 56.30 58.29 3hdf h ASN 76 Cb 0.42 -0.18 -0.02 0.00 0.27 0.00 0.00 38.32 38.81 3hdf h ASN 76 CO 0.01 0.57 0.13 0.50 -0.37 0.00 0.00 177.43 178.28 3hdf h LYS 77 N 0.99 0.75 -0.37 6.67 3.64 -1.07 -1.52 116.57 125.66 3hdf h LYS 77 Ca 0.33 -0.17 -0.15 0.00 -1.27 0.00 0.00 60.65 59.39 3hdf h LYS 77 Cb 0.04 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 3hdf h LYS 77 CO -0.12 0.72 -0.37 -0.44 -2.27 0.00 0.00 179.45 176.97 3hdf h ASP 78 N 0.64 0.93 -0.08 4.20 3.32 -0.68 -2.43 116.42 122.32 3hdf h ASP 78 Ca 0.15 -0.42 -0.10 0.00 0.02 0.00 0.00 57.03 56.68 3hdf h ASP 78 Cb 0.30 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3hdf h ASP 78 CO -0.00 1.19 -0.27 -0.07 -1.72 0.00 0.00 179.24 178.37 3hdf h LEU 79 N 0.72 0.53 -1.13 1.55 3.38 -0.71 -1.70 115.31 117.95 3hdf h LEU 79 Ca 0.06 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 3hdf h LEU 79 Cb 0.95 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 3hdf h LEU 79 CO 0.09 0.79 -0.01 0.00 0.09 0.00 0.00 178.44 179.40 3hdf h ALA 80 N 1.25 1.29 -0.29 1.53 0.00 -1.12 0.47 119.26 122.39 3hdf h ALA 80 Ca 0.06 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 3hdf h ALA 80 Cb 0.72 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3hdf h ALA 80 CO 0.06 0.48 -0.10 1.15 0.00 0.00 0.00 179.25 180.83 3hdf h THR 81 N 0.56 1.29 -0.70 0.00 2.02 -1.01 -1.26 112.91 113.80 3hdf h THR 81 Ca 0.12 -1.16 0.04 0.00 0.77 0.00 0.00 66.41 66.17 3hdf h THR 81 Cb 0.38 1.45 -0.05 0.00 -1.74 0.00 0.00 68.15 68.19 3hdf h THR 81 CO 0.01 0.37 0.43 0.58 0.37 0.00 0.00 175.52 177.29 3hdf h VAL 82 N 0.32 1.07 -0.65 3.16 2.07 -0.91 -2.49 116.25 118.84 3hdf h VAL 82 Ca 0.07 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3hdf h VAL 82 Cb 0.60 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 3hdf h VAL 82 CO 0.03 0.15 0.39 0.00 0.02 0.00 0.00 177.57 178.17 3hdf h ALA 83 N 1.31 0.83 -0.62 1.67 0.00 -0.64 -0.82 119.26 120.99 3hdf h ALA 83 Ca 0.29 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3hdf h ALA 83 Cb 0.05 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3hdf h ALA 83 CO -0.12 0.31 0.40 0.00 0.00 0.00 0.00 179.25 179.83 3hdf h ARG 84 N 0.88 0.82 -0.24 0.00 3.08 -0.91 -0.05 114.38 117.96 3hdf h ARG 84 Ca 0.23 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.15 3hdf h ARG 84 Cb -0.02 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.84 3hdf h ARG 84 CO -0.04 0.55 -0.17 1.96 -1.07 0.00 0.00 179.97 181.20 3hdf h GLN 85 N 0.84 0.53 0.00 0.04 4.20 -0.85 -3.38 115.11 116.50 3hdf h GLN 85 Ca 0.22 -0.26 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 3hdf h GLN 85 Cb -0.08 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 3hdf h GLN 85 CO -0.05 0.83 -2.04 0.44 -0.67 0.00 0.00 178.83 177.34 3hdf n ILE 86 N -4.44 0.21 -0.19 2.54 -5.35 -0.41 -4.46 119.36 107.26 3hdf n ILE 86 Ca -0.04 -0.54 0.12 0.00 -0.27 0.00 0.00 62.75 62.01 3hdf n ILE 86 Cb 0.39 -0.06 0.43 0.00 -1.74 0.00 0.00 39.64 38.65 3hdf n ILE 86 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 3hdf h ASN 87 N 0.00 0.53 0.01 7.28 -0.26 -1.18 0.14 115.58 122.10 3hdf h ASN 87 Ca -0.08 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.68 3hdf h ASN 87 Cb 1.17 -0.09 0.00 0.00 -1.06 0.00 0.00 38.32 38.34 3hdf h ASN 87 CO 0.00 0.30 0.00 -0.65 -1.06 0.00 0.00 177.43 176.02 3hdf h PRO 88 N 0.58 0.00 -0.02 0.81 0.11 -1.80 -1.51 132.00 130.18 3hdf h PRO 88 Ca 0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.48 3hdf h PRO 88 Cb 0.63 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.74 3hdf h PRO 88 CO -0.14 0.00 -0.19 0.66 -0.21 0.00 0.00 178.00 178.12 3hdf n TYR 89 N -2.84 0.00 -3.44 0.65 4.01 0.46 -4.79 117.16 111.22 3hdf n TYR 89 Ca -0.03 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.30 3hdf n TYR 89 Cb 0.06 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 38.99 3hdf n TYR 89 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3hdf s ILE 90 N -1.95 5.21 -0.70 -0.72 1.01 -0.57 -4.86 121.20 118.61 3hdf s ILE 90 Ca 0.20 -0.23 0.08 0.00 0.00 0.00 0.00 60.65 60.70 3hdf s ILE 90 Cb 0.17 -3.85 0.20 0.00 0.01 0.00 0.00 42.46 38.99 3hdf s ILE 90 CO 0.37 -0.16 1.12 0.29 0.00 0.00 0.00 174.94 176.56 3hdf n LYS 91 N 5.29 2.53 -4.33 2.79 5.02 -1.26 -4.97 118.16 123.23 3hdf n LYS 91 Ca -0.10 -1.77 -0.19 0.00 -2.02 0.00 0.00 58.31 54.23 3hdf n LYS 91 Cb 0.49 -1.19 -0.10 0.00 -0.02 0.00 0.00 35.03 34.21 3hdf n LYS 91 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3hdf s VAL 92 N -0.95 1.71 -0.26 -0.18 -7.23 -1.26 -5.09 120.40 107.13 3hdf s VAL 92 Ca 0.15 -2.09 -0.27 0.00 -1.81 0.00 0.00 61.98 57.96 3hdf s VAL 92 Cb 0.08 -1.94 0.01 0.00 0.56 0.00 0.00 36.38 35.09 3hdf s VAL 92 CO 0.11 -0.52 0.96 -0.62 -0.31 0.00 0.00 175.10 174.73 3hdf s ASP 93 N -3.08 6.95 0.16 4.85 2.15 -1.26 -5.03 116.67 121.42 3hdf s ASP 93 Ca 0.19 1.14 0.11 0.00 0.43 0.00 0.00 52.55 54.42 3hdf s ASP 93 Cb -0.02 -2.50 -0.04 0.00 -0.30 0.00 0.00 42.92 40.06 3hdf s ASP 93 CO 0.06 -0.67 -0.24 0.27 -0.17 0.00 0.00 175.17 174.42 3hdf s ILE 94 N 3.17 2.24 0.42 4.11 -4.36 -1.26 -5.11 121.20 120.42 3hdf s ILE 94 Ca 0.41 -1.90 -0.25 0.00 -0.26 0.00 0.00 60.65 58.65 3hdf s ILE 94 Cb -0.14 -2.03 -0.10 0.00 1.25 0.00 0.00 42.46 41.44 3hdf s ILE 94 CO 0.09 -0.06 1.15 -2.65 0.24 0.00 0.00 174.94 173.71 3hdf n PRO 95 N 0.54 1.65 0.26 0.37 -0.02 -1.26 -4.78 135.00 131.75 3hdf n PRO 95 Ca -0.15 0.59 0.08 0.00 -2.02 0.00 0.00 63.50 62.00 3hdf n PRO 95 Cb 0.55 -2.22 0.64 0.00 -0.02 0.00 0.00 33.50 32.45 3hdf n PRO 95 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3hdf h GLU 96 N 1.82 0.00 -0.26 -0.52 9.09 -1.99 -0.84 114.58 121.87 3hdf h GLU 96 Ca -0.46 0.00 -0.13 0.00 0.05 0.00 0.00 59.36 58.82 3hdf h GLU 96 Cb 1.32 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.40 3hdf h GLU 96 CO 0.58 0.01 -0.37 1.79 0.05 0.00 0.00 179.01 181.08 3hdf h THR 97 N 0.00 1.29 -0.25 -1.06 1.35 -1.97 -2.36 112.91 109.91 3hdf h THR 97 Ca -0.00 -1.51 -0.10 0.00 -0.55 0.00 0.00 66.41 64.25 3hdf h THR 97 Cb 0.03 1.49 -0.00 0.00 -1.73 0.00 0.00 68.15 67.93 3hdf h THR 97 CO 0.00 0.48 -0.23 -0.03 -0.25 0.00 0.00 175.52 175.49 3hdf h MET 98 N 0.49 0.60 -0.32 4.72 1.85 -1.44 -2.65 114.93 118.17 3hdf h MET 98 Ca 0.05 -0.31 0.02 0.00 -0.61 0.00 0.00 59.70 58.85 3hdf h MET 98 Cb 0.86 0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.87 3hdf h MET 98 CO 0.07 0.90 0.15 -0.09 -0.40 0.00 0.00 176.91 177.55 3hdf h ARG 99 N 0.31 0.31 -0.87 0.39 2.43 -1.29 -0.34 114.38 115.32 3hdf h ARG 99 Ca 0.04 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.27 3hdf h ARG 99 Cb 0.79 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 30.20 3hdf h ARG 99 CO 0.06 0.21 0.53 0.78 -1.51 0.00 0.00 179.97 180.04 3hdf h GLY 100 N 0.32 1.32 1.07 2.80 0.00 -1.45 -0.81 103.07 106.33 3hdf h GLY 100 Ca 0.14 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 47.04 3hdf h GLY 100 CO -0.10 0.23 0.27 0.00 0.00 0.00 0.00 176.54 176.94 3hdf h ALA 101 N 1.43 1.03 -0.74 3.60 0.00 -1.03 -2.18 119.26 121.37 3hdf h ALA 101 Ca 0.39 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3hdf h ALA 101 Cb 0.23 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3hdf h ALA 101 CO -0.19 0.67 0.24 -0.07 0.00 0.00 0.00 179.25 179.89 3hdf h LEU 102 N 1.13 1.07 -0.59 0.00 3.38 -0.12 0.07 115.31 120.25 3hdf h LEU 102 Ca 0.25 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3hdf h LEU 102 Cb 0.26 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3hdf h LEU 102 CO -0.01 0.99 0.34 1.88 0.09 0.00 0.00 178.44 181.72 3hdf h TYR 103 N 1.10 0.79 -0.52 1.13 0.05 -0.81 -0.53 116.97 118.19 3hdf h TYR 103 Ca 0.24 -0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.96 3hdf h TYR 103 Cb 0.30 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 3hdf h TYR 103 CO 0.02 0.56 0.14 0.77 -1.05 0.00 0.00 178.16 178.60 3hdf h SER 104 N 0.79 0.78 0.12 3.88 0.02 -1.09 -0.35 113.55 117.70 3hdf h SER 104 Ca 0.21 -0.23 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 3hdf h SER 104 Cb 0.02 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 3hdf h SER 104 CO -0.04 0.80 -0.19 0.15 -1.14 0.00 0.00 176.83 176.41 3hdf h PHE 105 N 0.72 -0.50 -0.14 3.45 3.57 -0.68 -2.52 116.94 120.83 3hdf h PHE 105 Ca 0.16 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.57 3hdf h PHE 105 Cb 0.32 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 3hdf h PHE 105 CO 0.02 -0.28 -0.35 0.28 -2.23 0.00 0.00 178.31 175.74 3hdf h VAL 106 N -0.38 1.29 -0.81 1.41 2.07 -0.98 0.91 116.25 119.76 3hdf h VAL 106 Ca 0.02 -1.40 0.11 0.00 0.82 0.00 0.00 66.70 66.25 3hdf h VAL 106 Cb 0.39 1.57 -0.06 0.00 -1.52 0.00 0.00 31.29 31.68 3hdf h VAL 106 CO -0.09 0.42 0.53 0.22 0.02 0.00 0.00 177.57 178.67 3hdf h TYR 107 N 0.25 0.78 0.06 1.57 3.20 -0.85 0.54 116.97 122.52 3hdf h TYR 107 Ca 0.03 0.02 -0.33 0.00 3.14 0.00 0.00 58.73 61.59 3hdf h TYR 107 Cb 0.75 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.73 3hdf h TYR 107 CO 0.02 0.35 -1.87 0.09 -1.64 0.00 0.00 178.16 175.10 3hdf n ASN 108 N -4.52 1.50 -0.03 -2.11 3.02 -0.74 -4.49 115.26 107.90 3hdf n ASN 108 Ca 0.14 0.30 -0.03 0.00 -0.03 0.00 0.00 54.58 54.97 3hdf n ASN 108 Cb 0.36 -0.45 -0.13 0.00 -0.61 0.00 0.00 39.78 38.95 3hdf n ASN 108 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3hdf n VAL 109 N -3.26 1.11 0.00 2.41 0.31 0.24 -5.05 118.33 114.09 3hdf n VAL 109 Ca -0.25 -0.73 0.00 0.00 -0.01 0.00 0.00 64.34 63.35 3hdf n VAL 109 Cb 1.05 -0.56 0.00 0.00 -0.91 0.00 0.00 33.84 33.42 3hdf n VAL 109 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hdf n GLY 110 N 1.51 2.07 0.25 2.92 0.00 0.17 -4.59 105.19 107.52 3hdf n GLY 110 Ca -0.18 -1.46 0.09 0.00 0.00 0.00 0.00 46.02 44.48 3hdf n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hdf h ALA 111 N 0.00 1.47 -0.01 4.61 0.00 -1.96 -2.62 119.26 120.75 3hdf h ALA 111 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3hdf h ALA 111 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3hdf h ALA 111 CO 0.00 0.18 -0.10 0.41 0.00 0.00 0.00 179.25 179.75 3hdf n GLY 112 N -0.85 -0.23 3.74 0.00 0.00 -1.26 -4.71 105.19 101.88 3hdf n GLY 112 Ca -0.02 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 3hdf n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hdf s ASN 113 N -2.19 7.24 0.58 1.61 3.84 -0.99 -4.91 114.94 120.12 3hdf s ASN 113 Ca 0.33 2.10 0.28 0.00 0.21 0.00 0.00 52.86 55.77 3hdf s ASN 113 Cb 0.20 -2.60 1.69 0.00 -0.55 0.00 0.00 41.25 39.99 3hdf s ASN 113 CO 0.41 -0.24 2.18 2.19 -2.79 0.00 0.00 177.10 178.85 3hdf h PHE 114 N 5.17 0.00 -0.41 0.43 -5.15 -1.90 0.31 116.94 115.40 3hdf h PHE 114 Ca -0.44 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.31 3hdf h PHE 114 Cb 1.21 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.36 3hdf h PHE 114 CO 0.63 0.00 0.18 0.00 -2.00 0.00 0.00 178.31 177.12 3hdf h ARG 115 N 0.00 0.57 -0.15 6.09 3.08 -1.92 0.02 114.38 122.06 3hdf h ARG 115 Ca 0.04 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 3hdf h ARG 115 Cb 0.20 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 3hdf h ARG 115 CO -0.00 0.45 -0.20 1.15 -1.07 0.00 0.00 179.97 180.30 3hdf h THR 116 N 0.57 1.35 -0.58 2.04 2.02 -1.19 -2.47 112.91 114.65 3hdf h THR 116 Ca 0.14 -1.41 0.03 0.00 0.77 0.00 0.00 66.41 65.95 3hdf h THR 116 Cb 0.08 1.91 -0.04 0.00 -1.74 0.00 0.00 68.15 68.36 3hdf h THR 116 CO -0.02 0.42 0.35 0.28 0.37 0.00 0.00 175.52 176.92 3hdf h SER 117 N 0.04 0.56 -0.47 4.18 0.02 -1.15 -1.34 113.55 115.40 3hdf h SER 117 Ca 0.02 0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 60.84 3hdf h SER 117 Cb 0.76 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 3hdf h SER 117 CO 0.05 0.39 -0.23 0.71 -1.14 0.00 0.00 176.83 176.61 3hdf h THR 118 N 0.69 1.27 -0.34 -2.27 1.35 -1.07 -1.95 112.91 110.58 3hdf h THR 118 Ca 0.24 -1.39 -0.02 0.00 -0.55 0.00 0.00 66.41 64.69 3hdf h THR 118 Cb 0.04 1.16 -0.02 0.00 -1.73 0.00 0.00 68.15 67.60 3hdf h THR 118 CO -0.11 0.48 0.15 0.25 -0.25 0.00 0.00 175.52 176.04 3hdf h LEU 119 N 0.83 0.46 -0.63 3.87 5.85 -1.20 -1.91 115.31 122.59 3hdf h LEU 119 Ca 0.10 -0.15 -0.12 0.00 0.84 0.00 0.00 57.88 58.56 3hdf h LEU 119 Cb 0.81 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3hdf h LEU 119 CO 0.07 0.49 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.41 3hdf h LEU 120 N 0.41 0.91 -0.75 2.25 3.38 -1.20 -1.93 115.31 118.38 3hdf h LEU 120 Ca 0.12 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3hdf h LEU 120 Cb 0.16 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 3hdf h LEU 120 CO -0.01 1.06 0.48 0.03 0.09 0.00 0.00 178.44 180.09 3hdf h ARG 121 N 0.79 1.00 -0.58 1.13 3.08 -1.21 -0.70 114.38 117.89 3hdf h ARG 121 Ca 0.12 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.03 3hdf h ARG 121 Cb 0.71 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 3hdf h ARG 121 CO 0.05 0.68 0.13 0.87 -1.07 0.00 0.00 179.97 180.63 3hdf h LYS 122 N 1.02 0.94 -0.67 0.04 1.57 -1.07 -1.96 116.57 116.44 3hdf h LYS 122 Ca 0.27 -0.24 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 3hdf h LYS 122 Cb -0.09 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.07 3hdf h LYS 122 CO -0.06 0.88 0.20 0.82 -0.57 0.00 0.00 179.45 180.73 3hdf h ILE 123 N 0.85 1.25 -0.01 1.86 2.04 -1.11 0.20 117.51 122.59 3hdf h ILE 123 Ca 0.18 -0.88 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 3hdf h ILE 123 Cb 0.37 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 3hdf h ILE 123 CO 0.01 0.34 -0.13 0.78 0.00 0.00 0.00 178.15 179.15 3hdf h ASN 124 N 0.98 0.01 0.54 1.72 2.35 -0.91 -0.96 115.58 119.31 3hdf h ASN 124 Ca 0.22 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 3hdf h ASN 124 Cb 0.31 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 3hdf h ASN 124 CO -0.01 0.14 -0.17 0.00 -1.65 0.00 0.00 177.43 175.75 3hdf n GLN 125 N -4.38 0.39 -1.07 0.81 1.13 -0.76 -4.86 117.38 108.64 3hdf n GLN 125 Ca -0.02 -0.13 -0.02 0.00 -1.94 0.00 0.00 57.00 54.88 3hdf n GLN 125 Cb 0.20 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 29.04 3hdf n GLN 125 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hdf n GLY 126 N 1.38 0.57 3.26 1.08 0.00 -0.37 -4.95 105.19 106.17 3hdf n GLY 126 Ca 0.11 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 45.10 3hdf n GLY 126 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hdf n ASP 127 N 0.87 4.92 0.09 1.61 2.03 0.61 -4.74 116.55 121.95 3hdf n ASP 127 Ca -0.02 -2.97 -0.06 0.00 0.52 0.00 0.00 54.79 52.26 3hdf n ASP 127 Cb 0.11 -1.61 0.06 0.00 -0.72 0.00 0.00 41.12 38.96 3hdf n ASP 127 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 3hdf h ILE 128 N 4.61 1.47 -0.22 5.18 1.08 -1.92 -1.97 117.51 125.75 3hdf h ILE 128 Ca 0.41 -2.37 0.01 0.00 -0.39 0.00 0.00 64.86 62.52 3hdf h ILE 128 Cb 0.79 2.28 -0.02 0.00 -3.07 0.00 0.00 36.82 36.80 3hdf h ILE 128 CO 1.48 0.69 0.11 0.50 -0.69 0.00 0.00 178.15 180.24 3hdf h LYS 129 N 0.09 0.22 -0.59 2.37 3.11 -1.88 0.32 116.57 120.22 3hdf h LYS 129 Ca -0.02 -0.01 -0.10 0.00 -2.81 0.00 0.00 60.65 57.71 3hdf h LYS 129 Cb 1.31 -0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 32.47 3hdf h LYS 129 CO 0.11 0.15 -0.02 0.78 -2.81 0.00 0.00 179.45 177.66 3hdf h GLY 130 N 0.23 1.12 0.95 5.01 0.00 -1.93 0.09 103.07 108.54 3hdf h GLY 130 Ca 0.09 -0.83 -0.04 0.00 0.00 0.00 0.00 47.33 46.55 3hdf h GLY 130 CO -0.06 0.76 0.12 0.00 0.00 0.00 0.00 176.54 177.37 3hdf h ALA 131 N 1.02 0.57 -0.29 3.60 0.00 -1.11 -1.61 119.26 121.45 3hdf h ALA 131 Ca 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hdf h ALA 131 Cb 0.57 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3hdf h ALA 131 CO 0.03 0.23 0.18 0.00 0.00 0.00 0.00 179.25 179.70 3hdf h ASP 133 N 0.38 0.60 0.18 0.00 3.32 -0.79 0.10 116.42 120.20 3hdf h ASP 133 Ca 0.10 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 3hdf h ASP 133 Cb -0.02 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.46 3hdf h ASP 133 CO -0.02 0.36 -0.09 -0.61 -1.72 0.00 0.00 179.24 177.16 3hdf h GLN 134 N 0.72 -0.23 -0.98 3.56 4.15 -1.00 -2.67 115.11 118.66 3hdf h GLN 134 Ca 0.35 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.79 3hdf h GLN 134 Cb 0.30 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 27.99 3hdf h GLN 134 CO -0.23 -0.15 0.61 -0.07 -1.93 0.00 0.00 178.83 177.06 3hdf h LEU 135 N -0.24 1.15 -0.81 -2.39 3.38 -0.92 -2.80 115.31 112.68 3hdf h LEU 135 Ca -0.02 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3hdf h LEU 135 Cb 0.19 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 3hdf h LEU 135 CO 0.04 0.86 0.32 0.03 0.09 0.00 0.00 178.44 179.77 3hdf h ARG 136 N 1.34 1.19 -0.83 1.13 3.08 -0.83 -0.80 114.38 118.66 3hdf h ARG 136 Ca 0.35 -0.22 0.07 0.00 0.07 0.00 0.00 59.98 60.26 3hdf h ARG 136 Cb -0.10 -0.19 -0.06 0.00 0.08 0.00 0.00 29.97 29.69 3hdf h ARG 136 CO -0.07 0.97 0.50 0.00 -1.07 0.00 0.00 179.97 180.30 3hdf h ARG 137 N 1.16 0.87 0.00 0.04 3.08 -1.21 -2.23 114.38 116.09 3hdf h ARG 137 Ca 0.27 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 60.13 3hdf h ARG 137 Cb 0.22 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 3hdf h ARG 137 CO -0.02 0.57 -0.70 -1.49 -1.07 0.00 0.00 179.97 177.26 3hdf h TRP 138 N 0.89 0.00 -0.66 3.04 4.06 -1.31 -2.81 115.95 119.17 3hdf h TRP 138 Ca 0.38 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.29 3hdf h TRP 138 Cb 0.24 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.37 3hdf h TRP 138 CO -0.04 0.64 0.25 1.15 -3.56 0.00 0.00 178.44 176.88 3hdf h THR 139 N 0.00 1.24 -0.30 1.49 2.02 -0.94 -2.81 112.91 113.61 3hdf h THR 139 Ca -0.02 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 66.37 3hdf h THR 139 Cb 1.50 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.40 3hdf h THR 139 CO 0.08 0.31 0.13 0.22 0.37 0.00 0.00 175.52 176.63 3hdf h TYR 140 N 0.95 0.40 0.00 3.16 3.20 -1.28 -1.43 116.97 121.97 3hdf h TYR 140 Ca 0.22 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.08 3hdf h TYR 140 Cb 0.23 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.36 3hdf h TYR 140 CO 0.02 0.31 0.00 0.00 -1.64 0.00 0.00 178.16 176.85 3hdf h ALA 141 N 1.73 1.00 -0.84 1.82 0.00 -1.23 -3.48 119.26 118.26 3hdf h ALA 141 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hdf h ALA 141 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3hdf h ALA 141 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 3hdf n GLY 142 N -0.58 2.13 0.00 0.00 0.00 -0.54 -5.03 105.19 101.17 3hdf n GLY 142 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3hdf n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hdf n GLY 143 N 0.00 2.75 0.20 -0.02 0.00 -1.26 -4.93 105.19 101.93 3hdf n GLY 143 Ca 0.00 -1.54 0.13 0.00 0.00 0.00 0.00 46.02 44.61 3hdf n GLY 143 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hdf n LYS 144 N 1.14 0.67 -3.41 1.61 5.02 -1.26 -4.82 118.16 117.11 3hdf n LYS 144 Ca 0.00 -0.39 -0.42 0.00 -2.02 0.00 0.00 58.31 55.48 3hdf n LYS 144 Cb 0.00 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.42 3hdf n LYS 144 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 3hdf s GLN 145 N -2.60 3.31 -0.30 1.97 0.74 -1.26 -5.01 119.66 116.52 3hdf s GLN 145 Ca 0.22 -0.65 -0.12 0.00 0.05 0.00 0.00 55.36 54.85 3hdf s GLN 145 Cb 0.19 -3.88 0.15 0.00 1.10 0.00 0.00 33.01 30.56 3hdf s GLN 145 CO 0.56 -0.65 0.80 -0.46 -0.55 0.00 0.00 175.29 174.99 3hdf s TRP 146 N 1.95 -1.06 0.09 1.67 -0.11 -1.26 -5.13 118.94 115.09 3hdf s TRP 146 Ca 0.10 1.79 0.04 0.00 1.22 0.00 0.00 56.10 59.25 3hdf s TRP 146 Cb -0.17 0.62 -0.04 0.00 -1.50 0.00 0.00 33.47 32.38 3hdf s TRP 146 CO 0.12 -0.53 0.03 0.15 -4.62 0.00 0.00 176.95 172.10 3hdf s LYS 147 N 2.71 2.67 0.00 5.86 -0.14 -1.26 -5.03 119.74 124.55 3hdf s LYS 147 Ca -0.03 -0.79 0.00 0.00 -1.36 0.00 0.00 55.97 53.78 3hdf s LYS 147 Cb -0.10 -2.60 0.00 0.00 -1.68 0.00 0.00 37.83 33.45 3hdf s LYS 147 CO -0.18 0.55 0.00 0.41 -0.76 0.00 0.00 175.35 175.36 3hdf n GLY 148 N 0.49 -0.42 0.10 -3.33 0.00 -1.26 -4.77 105.19 96.00 3hdf n GLY 148 Ca -0.10 -2.22 0.10 0.00 0.00 0.00 0.00 46.02 43.80 3hdf n GLY 148 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hdf n LEU 149 N 0.00 1.20 -4.85 0.99 4.77 -1.26 -4.87 117.00 112.98 3hdf n LEU 149 Ca 0.00 -0.54 -0.37 0.00 -0.03 0.00 0.00 56.01 55.07 3hdf n LEU 149 Cb 0.00 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 3hdf n LEU 149 CO 0.00 0.27 -0.16 -0.04 -1.33 0.00 0.00 177.39 176.13 3hdf s MET 150 N -2.89 3.58 0.66 3.23 -1.94 -1.26 -5.11 119.30 115.58 3hdf s MET 150 Ca 0.10 -0.13 -0.10 0.00 -1.71 0.00 0.00 55.69 53.85 3hdf s MET 150 Cb 0.16 -3.23 0.01 0.00 2.01 0.00 0.00 34.83 33.78 3hdf s MET 150 CO 0.80 0.69 1.04 0.95 -0.01 0.00 0.00 175.02 178.49 3hdf s THR 151 N -0.79 3.71 0.23 2.05 -4.23 -1.26 -4.86 115.64 110.48 3hdf s THR 151 Ca 0.14 0.41 -0.07 0.00 -1.18 0.00 0.00 61.69 60.99 3hdf s THR 151 Cb -0.12 -3.53 0.18 0.00 1.34 0.00 0.00 72.50 70.37 3hdf s THR 151 CO 0.03 -0.66 1.73 -0.09 -0.54 0.00 0.00 174.62 175.09 3hdf h ARG 152 N -0.48 0.40 -0.09 3.99 1.12 -1.98 -1.83 114.38 115.50 3hdf h ARG 152 Ca -0.45 -0.02 -0.13 0.00 -1.11 0.00 0.00 59.98 58.27 3hdf h ARG 152 Cb 1.25 -0.09 -0.01 0.00 -0.01 0.00 0.00 29.97 31.10 3hdf h ARG 152 CO 0.63 0.26 -0.51 0.00 -3.11 0.00 0.00 179.97 177.24 3hdf h ARG 153 N 0.41 0.26 -0.58 0.20 3.08 -1.98 -1.47 114.38 114.29 3hdf h ARG 153 Ca 0.36 -0.15 -0.09 0.00 0.07 0.00 0.00 59.98 60.17 3hdf h ARG 153 Cb 0.50 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 3hdf h ARG 153 CO -0.36 0.71 0.01 0.93 -1.07 0.00 0.00 179.97 180.19 3hdf h GLU 154 N 0.20 1.00 -0.36 0.04 5.08 -1.79 0.11 114.58 118.86 3hdf h GLU 154 Ca 0.01 -0.30 -0.05 0.00 -1.00 0.00 0.00 59.36 58.01 3hdf h GLU 154 Cb 0.98 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 3hdf h GLU 154 CO 0.08 0.97 0.01 0.82 -1.00 0.00 0.00 179.01 179.90 3hdf h ILE 155 N 0.92 1.25 -0.71 3.13 2.04 -1.20 -2.45 117.51 120.50 3hdf h ILE 155 Ca 0.17 -0.95 0.04 0.00 1.00 0.00 0.00 64.86 65.12 3hdf h ILE 155 Cb 0.52 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 3hdf h ILE 155 CO 0.03 0.32 0.43 -0.08 0.00 0.00 0.00 178.15 178.84 3hdf h GLU 156 N 0.44 0.80 -0.98 2.37 4.81 -1.04 -2.39 114.58 118.59 3hdf h GLU 156 Ca 0.10 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3hdf h GLU 156 Cb 0.44 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.59 3hdf h GLU 156 CO 0.02 0.53 0.63 -0.09 -0.73 0.00 0.00 179.01 179.37 3hdf h ARG 157 N 0.82 1.31 0.00 1.92 2.43 -0.80 0.12 114.38 120.17 3hdf h ARG 157 Ca 0.29 -0.09 -0.04 0.00 -0.81 0.00 0.00 59.98 59.34 3hdf h ARG 157 Cb 0.08 -0.29 -0.01 0.00 -0.42 0.00 0.00 29.97 29.34 3hdf h ARG 157 CO -0.13 0.88 -0.17 0.93 -1.51 0.00 0.00 179.97 179.97 3hdf h GLU 158 N 1.34 0.00 0.03 0.20 4.39 -0.94 -0.13 114.58 119.47 3hdf h GLU 158 Ca 0.36 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.79 3hdf h GLU 158 Cb -0.12 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.50 3hdf h GLU 158 CO -0.07 0.17 -1.43 0.82 -1.16 0.00 0.00 179.01 177.34 3hdf h ILE 159 N 0.00 0.85 -0.40 3.13 5.03 -1.35 -3.40 117.51 121.37 3hdf h ILE 159 Ca -0.00 -2.21 -0.06 0.00 -0.12 0.00 0.00 64.86 62.46 3hdf h ILE 159 Cb 0.51 2.27 -0.02 0.00 -3.03 0.00 0.00 36.82 36.56 3hdf h ILE 159 CO 0.02 0.44 -0.01 0.00 -0.68 0.00 0.00 178.15 177.92 3hdf h LEU 161 N 0.61 0.00 -0.90 0.00 3.38 -1.23 -0.56 115.31 116.60 3hdf h LEU 161 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3hdf h LEU 161 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3hdf h LEU 161 CO 0.02 0.00 0.00 0.79 0.09 0.00 0.00 178.44 179.34 3hdf n TRP 162 N -2.89 0.33 1.17 1.13 7.02 -0.99 -5.12 117.44 118.08 3hdf n TRP 162 Ca 0.00 -0.16 0.13 0.00 -1.02 0.00 0.00 57.50 56.45 3hdf n TRP 162 Cb 0.25 -0.00 0.24 0.00 -2.42 0.00 0.00 31.31 29.38 3hdf n TRP 162 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08