#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t8d n GLY 2 N 0.00 -1.54 3.77 0.46 0.00 -1.26 -5.13 105.19 101.49 1t8d n GLY 2 Ca 0.00 0.98 -0.39 0.00 0.00 0.00 0.00 46.02 46.61 1t8d n GLY 2 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1t8d s PHE 3 N 0.00 3.71 -0.75 1.61 0.08 -1.26 -4.47 117.98 116.90 1t8d s PHE 3 Ca 0.00 1.24 -0.24 0.00 0.12 0.00 0.00 56.93 58.05 1t8d s PHE 3 Cb 0.00 -2.61 0.06 0.00 -0.57 0.00 0.00 43.02 39.90 1t8d s PHE 3 CO 0.00 0.38 1.15 0.08 -0.10 0.00 0.00 175.22 176.73 1t8d s VAL 4 N -0.33 4.09 0.00 -0.44 1.01 -1.26 -4.86 120.40 118.60 1t8d s VAL 4 Ca 0.31 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.08 1t8d s VAL 4 Cb -0.19 -4.82 0.00 0.00 0.00 0.00 0.00 36.38 31.37 1t8d s VAL 4 CO 0.18 -1.67 0.00 0.00 0.00 0.00 0.00 175.10 173.61 1t8d n ASN 6 N 8.96 -1.13 0.28 0.00 5.15 -1.26 -5.00 115.26 122.26 1t8d n ASN 6 Ca 0.00 -1.69 0.19 0.00 -0.60 0.00 0.00 54.58 52.48 1t8d n ASN 6 Cb 0.00 1.06 0.92 0.00 -0.53 0.00 0.00 39.78 41.23 1t8d n ASN 6 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1t8d h THR 7 N 0.29 0.00 -3.49 -0.44 1.03 -1.84 -3.36 112.91 105.10 1t8d h THR 7 Ca -0.45 -0.17 -0.74 0.00 -0.01 0.00 0.00 66.41 65.03 1t8d h THR 7 Cb 1.23 1.08 -0.29 0.00 -1.07 0.00 0.00 68.15 69.10 1t8d h THR 7 CO -0.11 0.00 -0.23 0.00 -0.01 0.00 0.00 175.52 175.18 1t8d n PRO 9 N 4.32 0.00 -3.55 0.00 -0.04 -1.26 -4.73 135.00 129.73 1t8d n PRO 9 Ca 0.02 0.10 -0.36 0.00 -0.04 0.00 0.00 63.50 63.21 1t8d n PRO 9 Cb 0.42 -0.45 -0.08 0.00 -0.04 0.00 0.00 33.50 33.36 1t8d n PRO 9 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1t8d s GLU 10 N -0.52 4.21 0.00 0.54 2.02 -1.26 -4.68 118.70 119.01 1t8d s GLU 10 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 54.97 55.01 1t8d s GLU 10 Cb 0.00 -3.46 0.00 0.00 0.10 0.00 0.00 34.13 30.77 1t8d s GLU 10 CO 0.00 0.17 0.00 1.63 0.02 0.00 0.00 175.26 177.08 1t8d n LYS 11 N 3.82 0.00 -1.09 1.61 5.02 -1.26 -4.85 118.16 121.41 1t8d n LYS 11 Ca -0.12 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.74 1t8d n LYS 11 Cb 0.52 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.47 1t8d n LYS 11 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1t8d n TRP 12 N 0.00 0.51 -4.34 2.13 8.01 -1.26 -4.56 117.44 117.94 1t8d n TRP 12 Ca 0.00 0.76 -0.25 0.00 -1.31 0.00 0.00 57.50 56.70 1t8d n TRP 12 Cb 0.00 -1.51 -0.17 0.00 -2.01 0.00 0.00 31.31 27.63 1t8d n TRP 12 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.69 177.10 1t8d s ILE 13 N 0.14 1.08 0.11 -0.99 1.01 0.16 -4.15 121.20 118.56 1t8d s ILE 13 Ca 0.66 -0.41 0.03 0.00 0.00 0.00 0.00 60.65 60.94 1t8d s ILE 13 Cb -0.92 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 40.48 1t8d s ILE 13 CO 0.42 0.36 0.14 0.21 0.00 0.00 0.00 174.94 176.06 1t8d s ASN 14 N 1.02 5.73 0.00 3.58 3.84 -1.26 0.88 114.94 128.73 1t8d s ASN 14 Ca -0.08 0.02 0.00 0.00 0.21 0.00 0.00 52.86 53.01 1t8d s ASN 14 Cb -0.15 -1.59 0.00 0.00 -0.55 0.00 0.00 41.25 38.97 1t8d s ASN 14 CO -0.01 0.13 0.00 0.49 -2.79 0.00 0.00 177.10 174.92 1t8d n PHE 15 N 0.10 0.00 -0.22 0.43 3.72 0.13 -4.96 117.46 116.66 1t8d n PHE 15 Ca -0.08 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.35 1t8d n PHE 15 Cb 0.53 0.00 0.13 0.00 -0.94 0.00 0.00 39.48 39.19 1t8d n PHE 15 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1t8d h GLN 16 N 0.00 0.18 0.00 -1.08 3.07 -1.99 -3.41 115.11 111.89 1t8d h GLN 16 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 58.73 1t8d h GLN 16 Cb 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 27.48 27.52 1t8d h GLN 16 CO 0.00 0.12 0.00 2.89 0.09 0.00 0.00 178.83 181.93 1t8d n ARG 17 N -5.21 0.00 -4.29 0.06 1.85 -1.26 -4.07 116.66 103.73 1t8d n ARG 17 Ca 0.11 0.00 -0.25 0.00 -1.00 0.00 0.00 57.85 56.70 1t8d n ARG 17 Cb 0.38 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.71 1t8d n ARG 17 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 1t8d s LYS 18 N 0.00 2.18 0.22 2.89 -2.85 -1.26 -2.78 119.74 118.15 1t8d s LYS 18 Ca 0.00 -1.33 0.05 0.00 -1.00 0.00 0.00 55.97 53.70 1t8d s LYS 18 Cb 0.00 -2.17 -0.05 0.00 -2.06 0.00 0.00 37.83 33.55 1t8d s LYS 18 CO 0.00 0.40 -0.06 0.00 0.10 0.00 0.00 175.35 175.79 1t8d s TYR 20 N -3.20 1.85 -0.22 0.00 1.51 0.25 -1.03 117.35 116.52 1t8d s TYR 20 Ca 0.25 -0.45 -0.01 0.00 -1.01 0.00 0.00 57.07 55.86 1t8d s TYR 20 Cb 0.03 -0.95 0.02 0.00 -0.11 0.00 0.00 41.96 40.96 1t8d s TYR 20 CO 0.08 0.31 -0.10 0.71 -1.11 0.00 0.00 175.55 175.44 1t8d s TYR 21 N -1.78 2.97 -0.45 2.71 2.02 0.63 -0.66 117.35 122.78 1t8d s TYR 21 Ca 0.14 -1.52 0.08 0.00 -0.37 0.00 0.00 57.07 55.40 1t8d s TYR 21 Cb -0.07 -2.02 0.40 0.00 -0.40 0.00 0.00 41.96 39.87 1t8d s TYR 21 CO 0.06 -0.73 1.00 1.19 -1.57 0.00 0.00 175.55 175.50 1t8d n PHE 22 N 4.66 2.87 -2.23 2.71 3.72 -1.26 -1.57 117.46 126.38 1t8d n PHE 22 Ca -0.18 -3.39 -0.21 0.00 -0.05 0.00 0.00 57.45 53.62 1t8d n PHE 22 Cb 0.48 -0.28 0.13 0.00 -0.94 0.00 0.00 39.48 38.87 1t8d n PHE 22 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1t8d n GLY 23 N -0.26 -0.18 3.58 1.37 0.00 -0.56 -4.67 105.19 104.47 1t8d n GLY 23 Ca 0.30 -1.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.09 1t8d n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t8d s LYS 24 N -4.92 3.03 0.00 1.61 0.00 -1.26 -0.92 119.74 117.27 1t8d s LYS 24 Ca 0.57 -0.51 0.00 0.00 0.00 0.00 0.00 55.97 56.03 1t8d s LYS 24 Cb -0.02 -2.71 0.00 0.00 0.00 0.00 0.00 37.83 35.09 1t8d s LYS 24 CO 0.39 0.57 0.00 0.41 0.00 0.00 0.00 175.35 176.72 1t8d n GLY 25 N 2.52 0.90 1.14 0.59 0.00 -0.37 -4.68 105.19 105.30 1t8d n GLY 25 Ca -0.18 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.13 1t8d n GLY 25 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1t8d n THR 26 N -1.69 -2.63 -0.25 2.61 -1.04 -1.26 -2.70 114.28 107.31 1t8d n THR 26 Ca 0.00 1.24 0.00 0.00 -2.04 0.00 0.00 64.05 63.25 1t8d n THR 26 Cb 0.00 -1.92 0.00 0.00 -1.82 0.00 0.00 70.33 66.59 1t8d n THR 26 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1t8d n LYS 27 N -1.94 0.59 -4.15 -2.82 4.01 -1.26 -4.39 118.16 108.20 1t8d n LYS 27 Ca 0.00 -0.25 -0.10 0.00 -0.51 0.00 0.00 58.31 57.45 1t8d n LYS 27 Cb 0.26 -0.72 -0.10 0.00 -0.51 0.00 0.00 35.03 33.96 1t8d n LYS 27 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 1t8d s GLN 28 N -0.16 0.81 0.07 1.97 -0.21 -1.26 -4.66 119.66 116.22 1t8d s GLN 28 Ca 0.00 -1.34 -0.24 0.00 0.02 0.00 0.00 55.36 53.80 1t8d s GLN 28 Cb 0.00 0.02 -0.16 0.00 1.00 0.00 0.00 33.01 33.86 1t8d s GLN 28 CO 0.00 -0.11 1.64 2.35 -2.12 0.00 0.00 175.29 177.05 1t8d h TRP 29 N 2.98 -0.02 -0.57 0.91 7.01 -1.98 -2.34 115.95 121.93 1t8d h TRP 29 Ca -0.35 -0.00 0.14 0.00 2.11 0.00 0.00 58.89 60.79 1t8d h TRP 29 Cb 1.17 0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 28.21 1t8d h TRP 29 CO 0.53 0.08 0.40 -0.39 -2.79 0.00 0.00 178.44 176.27 1t8d h VAL 30 N -0.12 0.78 0.00 2.65 -1.51 -1.97 0.38 116.25 116.46 1t8d h VAL 30 Ca -0.00 -0.05 -0.10 0.00 -1.23 0.00 0.00 66.70 65.32 1t8d h VAL 30 Cb 0.11 0.62 -0.01 0.00 -2.13 0.00 0.00 31.29 29.88 1t8d h VAL 30 CO 0.00 0.03 -0.46 0.45 -1.23 0.00 0.00 177.57 176.36 1t8d h HIS 31 N 0.14 0.00 -0.03 5.19 3.86 -1.85 -2.40 115.15 120.07 1t8d h HIS 31 Ca 0.27 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.47 1t8d h HIS 31 Cb 0.88 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.35 1t8d h HIS 31 CO -0.00 0.46 -0.04 0.00 0.86 0.00 0.00 177.93 179.21 1t8d h ALA 32 N 1.54 0.05 -0.94 2.45 0.00 0.15 -1.99 119.26 120.52 1t8d h ALA 32 Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1t8d h ALA 32 Cb 0.93 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 1t8d h ALA 32 CO 0.06 -0.16 0.55 0.07 0.00 0.00 0.00 179.25 179.77 1t8d h ARG 33 N -0.41 1.29 -0.52 0.00 -0.00 -1.45 -1.03 114.38 112.26 1t8d h ARG 33 Ca 0.00 -0.13 -0.01 0.00 -0.00 0.00 0.00 59.98 59.84 1t8d h ARG 33 Cb 0.57 -0.26 -0.03 0.00 -0.00 0.00 0.00 29.97 30.25 1t8d h ARG 33 CO 0.01 0.91 0.26 -0.92 -0.00 0.00 0.00 179.97 180.23 1t8d h TYR 34 N 1.30 0.70 -0.48 4.08 5.03 -1.41 -0.87 116.97 125.31 1t8d h TYR 34 Ca 0.34 -0.01 -0.09 0.00 2.58 0.00 0.00 58.73 61.55 1t8d h TYR 34 Cb -0.03 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 38.00 1t8d h TYR 34 CO 0.01 0.51 -0.06 0.00 -1.32 0.00 0.00 178.16 177.30 1t8d h ALA 35 N 1.57 0.99 -0.16 1.82 0.00 -0.44 -2.62 119.26 120.42 1t8d h ALA 35 Ca 0.18 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1t8d h ALA 35 Cb 0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1t8d h ALA 35 CO -0.03 0.61 0.03 0.00 0.00 0.00 0.00 179.25 179.86 1t8d h ASP 37 N 0.10 0.46 0.77 0.00 1.82 -1.14 0.40 116.42 118.83 1t8d h ASP 37 Ca 0.07 0.01 -0.05 0.00 -0.39 0.00 0.00 57.03 56.68 1t8d h ASP 37 Cb 0.07 -0.08 -0.01 0.00 0.68 0.00 0.00 39.33 39.99 1t8d h ASP 37 CO -0.10 0.27 -0.23 0.44 -1.61 0.00 0.00 179.24 178.01 1t8d h ASP 38 N 0.51 0.00 0.02 2.28 3.32 -0.89 -2.38 116.42 119.27 1t8d h ASP 38 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 1t8d h ASP 38 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1t8d h ASP 38 CO -0.10 0.23 -0.54 0.23 -1.72 0.00 0.00 179.24 177.35 1t8d n MET 39 N -3.49 0.99 -2.98 3.56 2.81 0.75 -4.97 117.12 113.78 1t8d n MET 39 Ca -0.00 -0.80 -0.13 0.00 -1.81 0.00 0.00 57.70 54.96 1t8d n MET 39 Cb 0.40 -1.48 0.04 0.00 -0.71 0.00 0.00 33.22 31.46 1t8d n MET 39 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1t8d n GLU 40 N -0.31 -3.93 0.00 0.03 -0.58 0.11 -4.92 120.64 111.03 1t8d n GLU 40 Ca 0.09 0.47 0.00 0.00 -0.42 0.00 0.00 57.16 57.30 1t8d n GLU 40 Cb 0.44 -4.41 0.00 0.00 -0.57 0.00 0.00 31.44 26.89 1t8d n GLU 40 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1t8d n GLY 41 N -1.29 2.43 3.47 0.62 0.00 -0.45 -4.72 105.19 105.25 1t8d n GLY 41 Ca -0.01 -0.12 -0.11 0.00 0.00 0.00 0.00 46.02 45.78 1t8d n GLY 41 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1t8d s GLN 42 N 3.53 1.19 -0.37 1.61 0.74 0.20 -4.72 119.66 121.85 1t8d s GLN 42 Ca 0.00 -0.46 -0.29 0.00 0.05 0.00 0.00 55.36 54.66 1t8d s GLN 42 Cb 0.00 0.53 0.01 0.00 1.10 0.00 0.00 33.01 34.65 1t8d s GLN 42 CO 0.00 -0.52 1.36 -1.17 -0.55 0.00 0.00 175.29 174.40 1t8d s LEU 43 N -2.70 3.71 0.00 3.68 2.96 -1.26 0.28 118.68 125.35 1t8d s LEU 43 Ca 0.03 0.97 0.00 0.00 -0.22 0.00 0.00 54.13 54.91 1t8d s LEU 43 Cb -0.01 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.14 1t8d s LEU 43 CO -0.11 -1.28 0.00 1.33 -1.32 0.00 0.00 176.35 174.97 1t8d n VAL 44 N 6.70 0.00 -2.90 1.68 0.24 -1.25 -2.94 118.33 119.87 1t8d n VAL 44 Ca 0.16 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.35 1t8d n VAL 44 Cb 0.47 0.00 0.05 0.00 -1.47 0.00 0.00 33.84 32.89 1t8d n VAL 44 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1t8d n SER 45 N -0.19 -2.78 -4.56 -1.34 7.64 -1.26 -4.65 113.62 106.48 1t8d n SER 45 Ca 0.00 -0.33 -0.42 0.00 1.01 0.00 0.00 58.87 59.13 1t8d n SER 45 Cb 0.00 -3.07 0.01 0.00 -1.01 0.00 0.00 64.21 60.14 1t8d n SER 45 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1t8d n ILE 46 N -3.11 2.27 -0.93 0.44 -5.35 -1.26 -4.85 119.36 106.57 1t8d n ILE 46 Ca -0.11 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.87 1t8d n ILE 46 Cb 0.58 -0.95 0.00 0.00 -1.74 0.00 0.00 39.64 37.52 1t8d n ILE 46 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1t8d n HIS 47 N -0.58 0.00 -4.36 4.28 1.44 -1.26 -4.86 115.22 109.88 1t8d n HIS 47 Ca 0.10 -0.01 -0.33 0.00 -2.01 0.00 0.00 57.72 55.48 1t8d n HIS 47 Cb 0.39 -0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.34 1t8d n HIS 47 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1t8d s SER 48 N -0.01 3.20 0.56 4.39 0.15 -1.26 -4.74 113.70 115.99 1t8d s SER 48 Ca 0.00 -0.61 0.37 0.00 0.70 0.00 0.00 55.95 56.41 1t8d s SER 48 Cb 0.00 -1.48 1.51 0.00 -1.71 0.00 0.00 66.02 64.34 1t8d s SER 48 CO 0.00 0.04 1.72 -0.65 1.20 0.00 0.00 173.24 175.55 1t8d h PRO 49 N 7.66 0.00 -0.06 5.44 0.11 -1.98 0.42 132.00 143.58 1t8d h PRO 49 Ca -0.39 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.64 1t8d h PRO 49 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1t8d h PRO 49 CO 0.60 0.00 -0.26 1.49 -0.21 0.00 0.00 178.00 179.62 1t8d h GLU 50 N 0.00 0.28 -0.26 1.05 4.81 -1.97 -1.66 114.58 116.82 1t8d h GLU 50 Ca 0.58 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.58 1t8d h GLU 50 Cb 2.47 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 31.89 1t8d h GLU 50 CO -0.01 0.86 0.11 0.93 -0.73 0.00 0.00 179.01 180.18 1t8d h GLU 51 N -0.24 0.39 -0.75 1.92 5.08 -0.65 0.70 114.58 121.04 1t8d h GLU 51 Ca -0.02 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1t8d h GLU 51 Cb 0.91 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.06 1t8d h GLU 51 CO 0.05 0.42 0.42 -0.56 -1.00 0.00 0.00 179.01 178.34 1t8d h GLN 52 N 0.28 1.03 -0.22 2.33 -0.00 -1.25 -1.49 115.11 115.79 1t8d h GLN 52 Ca 0.09 -0.11 -0.10 0.00 -0.00 0.00 0.00 58.65 58.52 1t8d h GLN 52 Cb 0.17 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.48 27.43 1t8d h GLN 52 CO -0.01 0.76 -0.31 0.22 -0.00 0.00 0.00 178.83 179.49 1t8d h ASP 53 N 1.03 0.46 0.08 0.06 3.58 -1.00 0.99 116.42 121.62 1t8d h ASP 53 Ca 0.26 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.54 1t8d h ASP 53 Cb 0.02 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 1t8d h ASP 53 CO -0.04 0.75 -0.07 -0.26 -2.88 0.00 0.00 179.24 176.73 1t8d h PHE 54 N 0.39 -0.19 -0.08 0.28 0.04 0.14 0.39 116.94 117.92 1t8d h PHE 54 Ca 0.05 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.63 1t8d h PHE 54 Cb 0.74 0.07 -0.00 0.00 2.20 0.00 0.00 35.95 38.96 1t8d h PHE 54 CO 0.02 -0.12 -0.77 1.37 -0.60 0.00 0.00 178.31 178.22 1t8d h LEU 55 N -0.17 0.56 -1.09 1.54 8.10 -1.27 -1.52 115.31 121.46 1t8d h LEU 55 Ca 0.00 -0.38 0.00 0.00 0.11 0.00 0.00 57.88 57.61 1t8d h LEU 55 Cb 0.16 -0.17 -0.04 0.00 -0.44 0.00 0.00 40.66 40.17 1t8d h LEU 55 CO -0.02 1.14 0.54 0.74 -4.11 0.00 0.00 178.44 176.73 1t8d h THR 56 N 0.31 1.23 -0.00 0.15 2.02 -0.52 0.67 112.91 116.77 1t8d h THR 56 Ca -0.04 -0.47 -0.21 0.00 0.77 0.00 0.00 66.41 66.45 1t8d h THR 56 Cb 1.36 -0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1t8d h THR 56 CO 0.14 0.24 -0.91 0.50 0.37 0.00 0.00 175.52 175.85 1t8d h LYS 57 N 1.18 0.35 0.00 6.66 1.63 -0.15 -3.06 116.57 123.17 1t8d h LYS 57 Ca 0.31 -0.37 -0.06 0.00 -0.85 0.00 0.00 60.65 59.68 1t8d h LYS 57 Cb -0.08 0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.64 1t8d h LYS 57 CO -0.06 1.05 -0.31 1.25 -3.45 0.00 0.00 179.45 177.93 1t8d h HIS 58 N 0.20 0.00 -1.01 1.91 2.76 -0.30 -3.40 115.15 115.31 1t8d h HIS 58 Ca -0.07 0.00 -0.44 0.00 -2.20 0.00 0.00 60.37 57.67 1t8d h HIS 58 Cb 1.54 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 30.43 1t8d h HIS 58 CO 0.05 0.31 1.09 0.00 -1.30 0.00 0.00 177.93 178.08 1t8d s ALA 59 N -3.64 2.15 -0.26 5.26 0.00 0.22 -4.69 121.76 120.81 1t8d s ALA 59 Ca 0.00 -1.76 -0.00 0.00 0.00 0.00 0.00 51.96 50.20 1t8d s ALA 59 Cb 0.11 -4.52 -0.16 0.00 0.00 0.00 0.00 23.12 18.55 1t8d s ALA 59 CO 0.67 -4.22 -0.25 0.43 0.00 0.00 0.00 175.76 172.38 1t8d n SER 60 N 11.68 1.99 0.00 0.00 7.64 -1.26 -4.61 113.62 129.06 1t8d n SER 60 Ca 0.35 -0.07 -0.13 0.00 1.01 0.00 0.00 58.87 60.03 1t8d n SER 60 Cb 0.49 -0.47 -0.10 0.00 -1.01 0.00 0.00 64.21 63.12 1t8d n SER 60 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 1t8d h HIS 61 N -0.15 -0.06 -3.46 1.43 3.86 -1.98 -3.48 115.15 111.31 1t8d h HIS 61 Ca -0.59 -0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 58.51 1t8d h HIS 61 Cb 1.85 0.02 -0.04 0.00 1.06 0.00 0.00 27.41 30.30 1t8d h HIS 61 CO 0.01 0.47 0.07 0.95 0.86 0.00 0.00 177.93 180.29 1t8d s THR 62 N -3.91 0.00 0.00 2.45 -4.23 -1.26 -4.99 115.64 103.70 1t8d s THR 62 Ca -0.16 -1.25 0.00 0.00 -1.18 0.00 0.00 61.69 59.10 1t8d s THR 62 Cb 0.01 -2.67 0.00 0.00 1.34 0.00 0.00 72.50 71.18 1t8d s THR 62 CO 0.64 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.33 1t8d n GLY 63 N -0.52 -2.97 3.21 3.99 0.00 -1.26 -4.65 105.19 102.99 1t8d n GLY 63 Ca -0.04 -1.35 -0.12 0.00 0.00 0.00 0.00 46.02 44.51 1t8d n GLY 63 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1t8d s SER 64 N -1.72 1.27 -0.12 1.61 1.04 -0.25 -3.62 113.70 111.92 1t8d s SER 64 Ca 0.00 -1.07 -0.01 0.00 0.48 0.00 0.00 55.95 55.35 1t8d s SER 64 Cb 0.00 0.09 -0.02 0.00 0.10 0.00 0.00 66.02 66.18 1t8d s SER 64 CO 0.00 -0.48 -0.09 0.26 0.98 0.00 0.00 173.24 173.91 1t8d s TRP 65 N -3.59 2.90 0.36 5.02 0.51 -1.24 -0.99 118.94 121.91 1t8d s TRP 65 Ca 0.17 -0.37 0.08 0.00 -2.12 0.00 0.00 56.10 53.86 1t8d s TRP 65 Cb 0.05 -1.84 -0.05 0.00 -0.81 0.00 0.00 33.47 30.82 1t8d s TRP 65 CO -0.01 -0.02 0.14 0.96 -0.51 0.00 0.00 176.95 177.51 1t8d s ILE 66 N 0.06 2.73 -0.38 2.03 -4.36 -1.24 -4.15 121.20 115.89 1t8d s ILE 66 Ca -0.03 -1.74 -0.06 0.00 -0.26 0.00 0.00 60.65 58.57 1t8d s ILE 66 Cb -0.14 -2.95 -0.18 0.00 1.25 0.00 0.00 42.46 40.44 1t8d s ILE 66 CO 0.04 -0.13 2.92 0.61 0.24 0.00 0.00 174.94 178.61 1t8d n GLY 67 N -1.15 2.95 3.07 6.27 0.00 -1.15 -4.70 105.19 110.48 1t8d n GLY 67 Ca -0.02 -1.05 -0.28 0.00 0.00 0.00 0.00 46.02 44.67 1t8d n GLY 67 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1t8d s LEU 68 N 0.04 1.74 -0.04 0.99 0.20 -1.26 -1.72 118.68 118.62 1t8d s LEU 68 Ca 0.55 -0.41 -0.01 0.00 0.69 0.00 0.00 54.13 54.95 1t8d s LEU 68 Cb 0.23 -1.07 0.03 0.00 -0.43 0.00 0.00 46.19 44.95 1t8d s LEU 68 CO -0.01 0.04 0.03 -0.60 -0.29 0.00 0.00 176.35 175.52 1t8d s ARG 69 N 0.84 0.16 0.08 1.98 3.00 0.15 -3.13 118.95 122.02 1t8d s ARG 69 Ca -0.10 0.25 -0.03 0.00 -1.00 0.00 0.00 55.73 54.86 1t8d s ARG 69 Cb -0.15 -0.60 -0.05 0.00 0.00 0.00 0.00 34.95 34.14 1t8d s ARG 69 CO 0.01 -0.28 0.27 1.21 0.00 0.00 0.00 175.30 176.51 1t8d s ASN 70 N 1.87 6.42 0.27 -2.12 3.84 0.12 -0.34 114.94 124.99 1t8d s ASN 70 Ca 0.02 0.42 -0.14 0.00 0.21 0.00 0.00 52.86 53.37 1t8d s ASN 70 Cb -0.12 -2.02 -0.08 0.00 -0.55 0.00 0.00 41.25 38.47 1t8d s ASN 70 CO -0.03 0.15 0.66 -0.76 -2.79 0.00 0.00 177.10 174.32 1t8d s LEU 71 N -2.43 4.16 0.00 3.21 1.43 -1.05 -4.72 118.68 119.27 1t8d s LEU 71 Ca 0.36 1.17 0.00 0.00 -1.03 0.00 0.00 54.13 54.63 1t8d s LEU 71 Cb -0.13 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.27 1t8d s LEU 71 CO 0.25 -0.11 0.00 -0.67 0.23 0.00 0.00 176.35 176.05 1t8d n ASP 72 N -0.05 0.00 0.10 2.29 2.03 -1.26 -3.46 116.55 116.20 1t8d n ASP 72 Ca 0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.32 1t8d n ASP 72 Cb 0.53 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1t8d n ASP 72 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1t8d n LEU 73 N 0.00 -1.77 -1.21 -2.67 0.00 -1.26 -4.91 117.00 105.19 1t8d n LEU 73 Ca 0.00 0.57 0.11 0.00 0.00 0.00 0.00 56.01 56.70 1t8d n LEU 73 Cb 0.00 1.88 0.26 0.00 0.00 0.00 0.00 43.42 45.56 1t8d n LEU 73 CO 0.00 0.08 0.73 0.29 0.00 0.00 0.00 177.39 178.49 1t8d n LYS 74 N -3.04 2.61 0.00 1.96 5.02 -1.26 -4.50 118.16 118.95 1t8d n LYS 74 Ca 0.00 -2.45 0.00 0.00 -2.02 0.00 0.00 58.31 53.84 1t8d n LYS 74 Cb 0.00 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.49 1t8d n LYS 74 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1t8d n GLY 75 N 1.49 -1.37 3.57 0.72 0.00 -1.22 -5.03 105.19 103.35 1t8d n GLY 75 Ca 0.21 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 1t8d n GLY 75 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1t8d s GLU 76 N 0.00 2.22 -0.25 1.61 2.02 -1.26 -4.94 118.70 118.10 1t8d s GLU 76 Ca 0.00 -0.95 -0.20 0.00 0.02 0.00 0.00 54.97 53.85 1t8d s GLU 76 Cb 0.00 -2.34 -0.02 0.00 0.10 0.00 0.00 34.13 31.87 1t8d s GLU 76 CO 0.00 0.53 0.59 -0.06 0.02 0.00 0.00 175.26 176.34 1t8d s PHE 77 N -1.13 3.29 -0.02 1.61 0.08 -1.26 -2.52 117.98 118.03 1t8d s PHE 77 Ca 0.20 0.77 0.04 0.00 0.12 0.00 0.00 56.93 58.06 1t8d s PHE 77 Cb -0.11 -2.79 -0.03 0.00 -0.57 0.00 0.00 43.02 39.52 1t8d s PHE 77 CO 0.11 -0.28 -0.14 0.42 -0.10 0.00 0.00 175.22 175.23 1t8d s ILE 78 N 2.32 3.07 0.54 0.64 -1.09 0.54 -2.78 121.20 124.44 1t8d s ILE 78 Ca 0.25 -0.84 -0.18 0.00 -2.23 0.00 0.00 60.65 57.65 1t8d s ILE 78 Cb -0.16 -2.24 -0.06 0.00 -1.58 0.00 0.00 42.46 38.42 1t8d s ILE 78 CO 0.09 0.51 1.06 0.26 -1.23 0.00 0.00 174.94 175.63 1t8d s TRP 79 N -0.81 2.92 0.54 3.97 0.52 -1.26 0.31 118.94 125.13 1t8d s TRP 79 Ca 0.13 1.55 0.21 0.00 0.02 0.00 0.00 56.10 58.01 1t8d s TRP 79 Cb -0.11 -3.09 1.41 0.00 -1.15 0.00 0.00 33.47 30.53 1t8d s TRP 79 CO 0.03 -1.09 2.12 -0.24 0.02 0.00 0.00 176.95 177.79 1t8d h VAL 80 N 1.08 0.82 -0.20 4.03 3.04 -1.67 0.34 116.25 123.69 1t8d h VAL 80 Ca -0.49 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 1t8d h VAL 80 Cb 1.23 0.92 0.00 0.00 -2.01 0.00 0.00 31.29 31.43 1t8d h VAL 80 CO 0.58 0.00 0.00 -0.67 -1.01 0.00 0.00 177.57 176.47 1t8d n ASP 81 N -4.33 1.15 -3.34 3.17 2.03 -1.26 -4.88 116.55 109.09 1t8d n ASP 81 Ca 0.01 -2.02 -0.20 0.00 0.52 0.00 0.00 54.79 53.10 1t8d n ASP 81 Cb 0.24 -0.16 0.08 0.00 -0.72 0.00 0.00 41.12 40.56 1t8d n ASP 81 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1t8d n GLY 82 N 0.77 -0.39 0.06 0.27 0.00 0.12 -4.91 105.19 101.10 1t8d n GLY 82 Ca 0.07 0.15 0.02 0.00 0.00 0.00 0.00 46.02 46.25 1t8d n GLY 82 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1t8d n SER 83 N -2.80 0.58 -1.33 1.61 2.88 -1.25 -4.92 113.62 108.39 1t8d n SER 83 Ca -0.09 -0.79 0.17 0.00 -1.33 0.00 0.00 58.87 56.82 1t8d n SER 83 Cb 0.59 0.65 -0.08 0.00 -0.75 0.00 0.00 64.21 64.62 1t8d n SER 83 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 1t8d n HIS 84 N -0.62 -3.54 -1.75 0.66 -0.00 -1.26 -4.78 115.22 103.94 1t8d n HIS 84 Ca 0.01 1.92 -0.33 0.00 0.46 0.00 0.00 57.72 59.78 1t8d n HIS 84 Cb 0.07 -3.22 0.05 0.00 -0.12 0.00 0.00 29.99 26.78 1t8d n HIS 84 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1t8d s VAL 85 N -3.80 3.07 0.00 3.57 1.01 -1.12 -4.37 120.40 118.77 1t8d s VAL 85 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 61.98 62.50 1t8d s VAL 85 Cb 0.00 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.33 1t8d s VAL 85 CO 0.00 -0.29 0.00 0.47 0.00 0.00 0.00 175.10 175.28 1t8d n ASP 86 N -2.37 4.68 0.00 3.32 8.00 -1.26 -4.93 116.55 123.99 1t8d n ASP 86 Ca 0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.61 1t8d n ASP 86 Cb 0.52 0.43 0.00 0.00 -0.02 0.00 0.00 41.12 42.04 1t8d n ASP 86 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1t8d n TYR 87 N -1.99 0.00 -1.53 1.24 4.01 -1.26 -5.15 117.16 112.48 1t8d n TYR 87 Ca 0.00 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.78 1t8d n TYR 87 Cb 0.48 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.48 1t8d n TYR 87 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1t8d n SER 88 N -1.07 -8.27 0.00 7.72 3.41 -1.26 -4.97 113.62 109.18 1t8d n SER 88 Ca 0.00 1.77 0.00 0.00 -0.26 0.00 0.00 58.87 60.38 1t8d n SER 88 Cb 0.02 -5.02 0.00 0.00 -0.26 0.00 0.00 64.21 58.95 1t8d n SER 88 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1t8d n ASN 89 N -3.02 0.06 -3.71 4.04 3.02 -1.26 -5.08 115.26 109.31 1t8d n ASN 89 Ca -0.02 -0.46 -0.53 0.00 -0.03 0.00 0.00 54.58 53.54 1t8d n ASN 89 Cb 0.53 0.08 -0.10 0.00 -0.61 0.00 0.00 39.78 39.68 1t8d n ASN 89 CO 0.00 0.00 0.00 -2.67 -2.62 0.00 0.00 177.26 171.97 1t8d n TRP 90 N -0.08 1.09 -0.86 3.10 4.27 -1.26 -3.70 117.44 120.00 1t8d n TRP 90 Ca 0.00 0.72 -0.34 0.00 -3.89 0.00 0.00 57.50 53.99 1t8d n TRP 90 Cb 0.09 -1.95 -0.05 0.00 -1.36 0.00 0.00 31.31 28.05 1t8d n TRP 90 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1t8d n ALA 91 N 5.84 -1.94 -0.03 -1.67 0.00 0.13 -4.89 120.51 117.96 1t8d n ALA 91 Ca 0.43 0.32 0.00 0.00 0.00 0.00 0.00 53.44 54.19 1t8d n ALA 91 Cb -0.04 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1t8d n ALA 91 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1t8d n PRO 92 N 1.13 0.00 -3.38 0.00 -0.02 -1.26 -4.18 135.00 127.29 1t8d n PRO 92 Ca 0.12 0.54 -0.45 0.00 -2.02 0.00 0.00 63.50 61.69 1t8d n PRO 92 Cb 0.03 -1.49 -0.02 0.00 -0.02 0.00 0.00 33.50 32.00 1t8d n PRO 92 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1t8d s GLY 93 N -0.97 2.91 -0.70 -1.23 0.00 -1.26 -4.94 107.32 101.12 1t8d s GLY 93 Ca 0.00 -3.56 0.05 0.00 0.00 0.00 0.00 44.72 41.21 1t8d s GLY 93 CO 0.00 1.27 0.49 1.85 0.00 0.00 0.00 173.10 176.72 1t8d s GLU 94 N -0.52 2.44 -0.27 2.90 -6.30 -1.26 -5.07 118.70 110.62 1t8d s GLU 94 Ca 0.24 -3.33 -0.32 0.00 -2.50 0.00 0.00 54.97 49.06 1t8d s GLU 94 Cb -0.10 -3.38 -0.08 0.00 0.00 0.00 0.00 34.13 30.57 1t8d s GLU 94 CO -0.08 -1.29 2.19 -2.30 0.02 0.00 0.00 175.26 173.79 1t8d n PRO 95 N 1.97 1.59 -2.03 4.30 -0.02 -1.26 -4.92 135.00 134.63 1t8d n PRO 95 Ca 0.20 0.44 -0.37 0.00 -2.02 0.00 0.00 63.50 61.76 1t8d n PRO 95 Cb 0.35 -2.86 0.02 0.00 -0.02 0.00 0.00 33.50 31.00 1t8d n PRO 95 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1t8d s THR 96 N 7.62 2.63 0.03 3.45 -4.23 -1.26 -4.97 115.64 118.92 1t8d s THR 96 Ca 1.04 0.43 -0.30 0.00 -1.18 0.00 0.00 61.69 61.68 1t8d s THR 96 Cb -0.59 -3.19 -0.17 0.00 1.34 0.00 0.00 72.50 69.89 1t8d s THR 96 CO 0.42 -0.05 1.32 0.28 -0.54 0.00 0.00 174.62 176.05 1t8d h SER 97 N 1.31 -0.78 0.00 3.99 0.02 -2.05 -3.44 113.55 112.59 1t8d h SER 97 Ca -0.50 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1t8d h SER 97 Cb 1.29 0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.03 1t8d h SER 97 CO 0.57 -0.45 0.00 -1.14 -1.14 0.00 0.00 176.83 174.67 1t8d n ARG 98 N -5.42 0.00 -3.86 3.45 0.63 -1.26 -5.11 116.66 105.09 1t8d n ARG 98 Ca -0.13 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.44 1t8d n ARG 98 Cb 0.38 0.00 -0.12 0.00 0.45 0.00 0.00 32.46 33.17 1t8d n ARG 98 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1t8d s SER 99 N 0.00 5.08 -0.29 6.15 0.15 -1.26 -4.97 113.70 118.56 1t8d s SER 99 Ca 0.00 -0.18 0.07 0.00 0.70 0.00 0.00 55.95 56.54 1t8d s SER 99 Cb 0.00 -1.90 0.61 0.00 -1.71 0.00 0.00 66.02 63.03 1t8d s SER 99 CO 0.00 0.01 1.65 0.00 1.20 0.00 0.00 173.24 176.10 1t8d n GLN 100 N 4.62 3.07 -2.05 5.44 1.13 -1.26 -4.86 117.38 123.47 1t8d n GLN 100 Ca -0.16 -2.54 -0.41 0.00 -1.94 0.00 0.00 57.00 51.94 1t8d n GLN 100 Cb 0.52 -2.05 -0.02 0.00 0.11 0.00 0.00 30.24 28.80 1t8d n GLN 100 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1t8d s GLY 101 N -0.78 2.99 -0.27 1.08 0.00 -1.26 -4.93 107.32 104.16 1t8d s GLY 101 Ca 0.46 1.33 -0.06 0.00 0.00 0.00 0.00 44.72 46.45 1t8d s GLY 101 CO 0.11 1.98 0.53 -0.54 0.00 0.00 0.00 173.10 175.19 1t8d s GLU 102 N -1.88 0.48 0.00 2.90 2.02 -1.26 -2.63 118.70 118.33 1t8d s GLU 102 Ca 0.50 1.08 0.00 0.00 0.02 0.00 0.00 54.97 56.57 1t8d s GLU 102 Cb -0.41 0.43 0.00 0.00 0.10 0.00 0.00 34.13 34.25 1t8d s GLU 102 CO 0.55 -0.40 0.00 -3.47 0.02 0.00 0.00 175.26 171.96 1t8d n ASP 103 N 5.42 0.00 -4.86 -0.19 -0.08 -1.01 -4.17 116.55 111.65 1t8d n ASP 103 Ca -0.07 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.86 1t8d n ASP 103 Cb 0.50 0.28 -0.06 0.00 2.34 0.00 0.00 41.12 44.18 1t8d n ASP 103 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1t8d s VAL 105 N -1.17 5.15 0.39 0.00 1.01 -1.18 -2.53 120.40 122.07 1t8d s VAL 105 Ca 0.21 0.93 0.08 0.00 0.00 0.00 0.00 61.98 63.20 1t8d s VAL 105 Cb -0.12 -3.80 -0.07 0.00 0.00 0.00 0.00 36.38 32.39 1t8d s VAL 105 CO 0.12 0.37 0.01 0.00 0.00 0.00 0.00 175.10 175.59 1t8d s MET 106 N 0.32 1.97 -0.06 2.72 0.23 -0.31 -3.72 119.30 120.44 1t8d s MET 106 Ca 0.25 -2.00 0.04 0.00 -1.03 0.00 0.00 55.69 52.95 1t8d s MET 106 Cb -0.15 -1.73 -0.00 0.00 -1.53 0.00 0.00 34.83 31.42 1t8d s MET 106 CO 0.11 0.00 -0.19 1.41 -2.03 0.00 0.00 175.02 174.32 1t8d s MET 107 N -3.71 2.17 0.00 3.16 1.75 -0.16 0.77 119.30 123.27 1t8d s MET 107 Ca 0.35 -0.67 0.00 0.00 -1.25 0.00 0.00 55.69 54.12 1t8d s MET 107 Cb 0.06 -1.78 0.00 0.00 2.84 0.00 0.00 34.83 35.95 1t8d s MET 107 CO 0.18 0.20 0.00 -2.13 -0.65 0.00 0.00 175.02 172.63 1t8d n ARG 108 N 3.35 0.00 -0.66 4.11 0.63 -1.01 -1.09 116.66 121.98 1t8d n ARG 108 Ca -0.19 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.44 1t8d n ARG 108 Cb 0.53 0.00 0.19 0.00 0.45 0.00 0.00 32.46 33.63 1t8d n ARG 108 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1t8d s GLY 109 N 0.00 1.65 0.00 5.14 0.00 -1.26 -2.76 107.32 110.08 1t8d s GLY 109 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.09 1t8d s GLY 109 CO 0.00 0.88 0.00 1.44 0.00 0.00 0.00 173.10 175.42 1t8d n SER 110 N -4.43 -4.13 -1.92 1.64 7.64 -1.26 -2.63 113.62 108.53 1t8d n SER 110 Ca 0.09 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.77 1t8d n SER 110 Cb 0.53 -2.81 -0.06 0.00 -1.01 0.00 0.00 64.21 60.86 1t8d n SER 110 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t8d n GLY 111 N -0.22 0.98 0.00 0.23 0.00 -1.11 -4.88 105.19 100.19 1t8d n GLY 111 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1t8d n GLY 111 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1t8d n ARG 112 N -2.62 0.12 -4.03 1.61 1.85 -1.08 -4.74 116.66 107.77 1t8d n ARG 112 Ca -0.22 0.00 -0.22 0.00 -1.00 0.00 0.00 57.85 56.41 1t8d n ARG 112 Cb 0.68 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 32.04 1t8d n ARG 112 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1t8d s TRP 113 N 2.32 2.93 -0.07 2.89 0.52 -1.24 -2.41 118.94 123.86 1t8d s TRP 113 Ca 0.00 -0.23 -0.03 0.00 0.02 0.00 0.00 56.10 55.86 1t8d s TRP 113 Cb 0.00 -1.55 0.04 0.00 -1.15 0.00 0.00 33.47 30.81 1t8d s TRP 113 CO 0.00 0.39 0.13 -0.80 0.02 0.00 0.00 176.95 176.68 1t8d s ASN 114 N -3.88 0.93 -0.40 2.95 0.01 0.23 0.20 114.94 114.99 1t8d s ASN 114 Ca 0.36 0.21 -0.23 0.00 -0.71 0.00 0.00 52.86 52.49 1t8d s ASN 114 Cb -0.06 0.12 0.02 0.00 0.41 0.00 0.00 41.25 41.74 1t8d s ASN 114 CO 0.25 -0.25 0.79 -0.62 -1.51 0.00 0.00 177.10 175.76 1t8d s ASP 115 N 2.25 6.50 0.17 -1.22 2.15 -1.26 -1.17 116.67 124.09 1t8d s ASP 115 Ca 0.04 0.19 -0.20 0.00 0.43 0.00 0.00 52.55 53.01 1t8d s ASP 115 Cb -0.12 -2.40 0.05 0.00 -0.30 0.00 0.00 42.92 40.15 1t8d s ASP 115 CO -0.05 -0.81 0.55 0.00 -0.17 0.00 0.00 175.17 174.69 1t8d s ALA 116 N 3.20 -1.27 0.40 3.66 0.00 -1.05 -4.71 121.76 121.99 1t8d s ALA 116 Ca 0.31 0.15 -0.22 0.00 0.00 0.00 0.00 51.96 52.20 1t8d s ALA 116 Cb -0.13 0.83 -0.14 0.00 0.00 0.00 0.00 23.12 23.69 1t8d s ALA 116 CO 0.19 -0.77 0.34 0.34 0.00 0.00 0.00 175.76 175.86 1t8d n PHE 117 N -0.34 -1.22 -1.41 0.00 7.35 -1.08 -1.65 117.46 119.10 1t8d n PHE 117 Ca -0.14 0.63 -0.42 0.00 -0.76 0.00 0.00 57.45 56.76 1t8d n PHE 117 Cb 0.64 -1.89 -0.04 0.00 0.35 0.00 0.00 39.48 38.53 1t8d n PHE 117 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1t8d n ASP 119 N 7.72 -0.67 0.00 0.00 -0.08 -1.26 -4.58 116.55 117.67 1t8d n ASP 119 Ca 0.50 -1.55 0.00 0.00 -1.51 0.00 0.00 54.79 52.23 1t8d n ASP 119 Cb 0.41 0.32 0.00 0.00 2.34 0.00 0.00 41.12 44.19 1t8d n ASP 119 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1t8d n ARG 120 N -0.69 0.00 -2.66 -0.67 5.12 -1.25 -5.04 116.66 111.47 1t8d n ARG 120 Ca -0.08 0.00 -0.04 0.00 -1.93 0.00 0.00 57.85 55.80 1t8d n ARG 120 Cb 0.67 0.00 0.02 0.00 -1.16 0.00 0.00 32.46 31.99 1t8d n ARG 120 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1t8d n LYS 121 N 0.00 0.22 -0.12 5.56 3.00 -1.26 -5.10 118.16 120.46 1t8d n LYS 121 Ca 0.00 -0.76 0.00 0.00 -0.00 0.00 0.00 58.31 57.55 1t8d n LYS 121 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 35.03 34.98 1t8d n LYS 121 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1t8d n LEU 122 N -0.29 0.00 -0.08 3.14 4.32 -1.26 -4.95 117.00 117.89 1t8d n LEU 122 Ca -0.21 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.78 1t8d n LEU 122 Cb 0.68 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.48 1t8d n LEU 122 CO -0.11 -0.22 0.04 0.61 -1.22 0.00 0.00 177.39 176.49 1t8d n GLY 123 N 5.00 0.94 2.88 -0.72 0.00 -1.26 -4.85 105.19 107.18 1t8d n GLY 123 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1t8d n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t8d s ALA 124 N 0.00 0.62 -0.16 4.61 0.00 -1.23 -1.23 121.76 124.37 1t8d s ALA 124 Ca 0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 51.96 51.86 1t8d s ALA 124 Cb 0.00 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.67 1t8d s ALA 124 CO 0.00 -0.03 0.10 1.67 0.00 0.00 0.00 175.76 177.51 1t8d s TRP 125 N 0.93 3.40 -0.06 0.00 -2.14 -0.10 -3.65 118.94 117.33 1t8d s TRP 125 Ca -0.11 0.31 0.01 0.00 2.66 0.00 0.00 56.10 58.97 1t8d s TRP 125 Cb -0.14 -2.04 0.02 0.00 -3.10 0.00 0.00 33.47 28.21 1t8d s TRP 125 CO -0.00 0.40 -0.08 0.54 -2.66 0.00 0.00 176.95 175.16 1t8d s VAL 126 N -0.16 0.80 0.11 -0.66 0.11 -1.24 -1.50 120.40 117.85 1t8d s VAL 126 Ca 0.09 -0.27 -0.02 0.00 -2.93 0.00 0.00 61.98 58.85 1t8d s VAL 126 Cb -0.12 -0.78 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1t8d s VAL 126 CO 0.01 0.28 0.07 0.00 -3.33 0.00 0.00 175.10 172.13 1t8d s ASP 128 N -3.00 2.49 0.04 0.00 1.47 0.14 0.23 116.67 118.03 1t8d s ASP 128 Ca 0.19 -0.46 -0.21 0.00 1.18 0.00 0.00 52.55 53.24 1t8d s ASP 128 Cb 0.07 -0.24 0.05 0.00 -0.34 0.00 0.00 42.92 42.46 1t8d s ASP 128 CO -0.02 0.21 0.49 -0.60 0.68 0.00 0.00 175.17 175.93 1t8d s ARG 129 N -0.87 0.98 0.19 2.11 3.52 -0.20 0.61 118.95 125.30 1t8d s ARG 129 Ca 0.08 -0.23 -0.31 0.00 -0.13 0.00 0.00 55.73 55.14 1t8d s ARG 129 Cb -0.08 0.45 -0.09 0.00 -1.56 0.00 0.00 34.95 33.66 1t8d s ARG 129 CO 0.01 -0.34 1.45 -0.51 -0.81 0.00 0.00 175.30 175.09 1t8d s LEU 130 N -1.89 4.38 -0.28 -0.88 1.43 -1.26 0.35 118.68 120.53 1t8d s LEU 130 Ca -0.06 2.56 -0.28 0.00 -1.03 0.00 0.00 54.13 55.31 1t8d s LEU 130 Cb -0.01 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 1t8d s LEU 130 CO -0.01 -0.71 1.87 0.00 0.23 0.00 0.00 176.35 177.74 1t8d s ALA 131 N 0.55 2.92 -0.04 4.21 0.00 -1.12 -4.73 121.76 123.56 1t8d s ALA 131 Ca 0.63 0.44 0.02 0.00 0.00 0.00 0.00 51.96 53.05 1t8d s ALA 131 Cb -0.41 -4.00 0.01 0.00 0.00 0.00 0.00 23.12 18.72 1t8d s ALA 131 CO 0.37 -2.53 -0.09 0.95 0.00 0.00 0.00 175.76 174.45 1t8d s THR 132 N 6.88 0.84 -0.14 0.00 -4.23 -1.26 -4.59 115.64 113.14 1t8d s THR 132 Ca 0.84 -0.36 -0.09 0.00 -1.18 0.00 0.00 61.69 60.90 1t8d s THR 132 Cb -0.26 -0.76 -0.06 0.00 1.34 0.00 0.00 72.50 72.76 1t8d s THR 132 CO 0.34 0.27 -0.21 0.00 -0.54 0.00 0.00 174.62 174.48 1t8d s THR 134 N -2.36 -0.46 -0.26 0.00 2.01 -1.26 -5.10 115.64 108.21 1t8d s THR 134 Ca -0.21 -0.41 -0.34 0.00 0.31 0.00 0.00 61.69 61.03 1t8d s THR 134 Cb 0.07 -0.97 -0.11 0.00 0.01 0.00 0.00 72.50 71.50 1t8d s THR 134 CO 0.27 -0.40 2.09 -2.65 -0.69 0.00 0.00 174.62 173.24 1t8d n PRO 135 N 5.32 1.47 -1.52 4.92 -0.02 -1.26 -4.82 135.00 139.09 1t8d n PRO 135 Ca -0.02 0.45 -0.43 0.00 -2.02 0.00 0.00 63.50 61.48 1t8d n PRO 135 Cb 0.47 -2.59 -0.06 0.00 -0.02 0.00 0.00 33.50 31.30 1t8d n PRO 135 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1t8d n PRO 136 N 7.70 1.11 -2.22 0.52 -0.02 -1.26 -4.88 135.00 135.96 1t8d n PRO 136 Ca 0.34 0.21 -0.43 0.00 -2.02 0.00 0.00 63.50 61.61 1t8d n PRO 136 Cb 0.27 -2.82 -0.02 0.00 -0.02 0.00 0.00 33.50 30.91 1t8d n PRO 136 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1t8d s ALA 137 N 9.30 2.90 0.67 3.55 0.00 -1.26 -4.99 121.76 131.93 1t8d s ALA 137 Ca 1.07 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.93 1t8d s ALA 137 Cb -0.58 -4.01 0.12 0.00 0.00 0.00 0.00 23.12 18.65 1t8d s ALA 137 CO 0.39 -2.63 0.84 0.43 0.00 0.00 0.00 175.76 174.78 1t8d n SER 138 N 9.65 1.18 -0.07 0.00 7.64 -1.26 -5.06 113.62 125.70 1t8d n SER 138 Ca 0.18 -1.98 -0.10 0.00 1.01 0.00 0.00 58.87 57.98 1t8d n SER 138 Cb 0.48 -0.54 -0.07 0.00 -1.01 0.00 0.00 64.21 63.07 1t8d n SER 138 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1t8d n GLU 139 N -2.54 0.65 -2.17 1.43 1.02 -1.26 -4.98 120.64 112.79 1t8d n GLU 139 Ca 0.14 0.07 -0.42 0.00 -0.02 0.00 0.00 57.16 56.93 1t8d n GLU 139 Cb 0.50 -1.31 -0.03 0.00 -0.02 0.00 0.00 31.44 30.58 1t8d n GLU 139 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1t8d s GLY 140 N -5.32 2.08 0.72 0.62 0.00 -1.26 -5.02 107.32 99.13 1t8d s GLY 140 Ca -0.18 1.13 -0.08 0.00 0.00 0.00 0.00 44.72 45.59 1t8d s GLY 140 CO 0.38 2.29 0.98 -1.26 0.00 0.00 0.00 173.10 175.48 1t8d n SER 141 N 3.61 0.54 -3.55 1.64 2.88 -1.26 -4.97 113.62 112.51 1t8d n SER 141 Ca 0.10 -1.64 -0.40 0.00 -1.33 0.00 0.00 58.87 55.60 1t8d n SER 141 Cb 0.42 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 63.18 1t8d n SER 141 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1t8d n ALA 142 N -3.36 6.52 -1.86 -1.46 0.00 -1.26 -5.24 120.51 113.85 1t8d n ALA 142 Ca -0.16 -4.22 0.00 0.00 0.00 0.00 0.00 53.44 49.06 1t8d n ALA 142 Cb 0.48 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.27 1t8d n ALA 142 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59