#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 -1.60 3.65 0.23 0.00 -1.26 -5.12 105.19 101.09 1t8d n GLY 2 Ca 0.00 0.57 -0.40 0.00 0.00 0.00 0.00 46.02 46.18 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 3.34 -2.05 1.61 0.08 -1.26 -4.93 117.98 114.76 1t8d s PHE 3 Ca 0.00 0.90 0.15 0.00 0.12 0.00 0.00 56.93 58.10 1t8d s PHE 3 Cb 0.00 -2.83 0.44 0.00 -0.57 0.00 0.00 43.02 40.06 1t8d s PHE 3 CO 0.00 -0.25 1.36 1.33 -0.10 0.00 0.00 175.22 177.56 1t8d n VAL 4 N 4.92 0.55 -2.04 -0.44 0.24 -1.25 -4.92 118.33 115.38 1t8d n VAL 4 Ca -0.01 -0.57 -0.42 0.00 -2.04 0.00 0.00 64.34 61.30 1t8d n VAL 4 Cb 0.49 0.34 -0.03 0.00 -1.47 0.00 0.00 33.84 33.17 1t8d n VAL 4 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1t8d n ASN 6 N 4.24 0.00 0.23 0.00 5.15 -1.26 -4.93 115.26 118.70 1t8d n ASN 6 Ca 0.13 0.00 0.06 0.00 -0.60 0.00 0.00 54.58 54.18 1t8d n ASN 6 Cb 0.40 0.00 0.54 0.00 -0.53 0.00 0.00 39.78 40.20 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 0.00 1.05 -3.31 -0.44 1.03 -1.85 -3.34 112.91 106.06 1t8d h THR 7 Ca 0.00 -0.57 -0.66 0.00 -0.01 0.00 0.00 66.41 65.17 1t8d h THR 7 Cb 0.00 1.31 -0.39 0.00 -1.07 0.00 0.00 68.15 68.00 1t8d h THR 7 CO 0.00 0.16 -0.42 0.00 -0.01 0.00 0.00 175.52 175.25 1t8d n PRO 9 N 2.62 0.00 0.00 0.00 -0.04 -1.26 -4.76 135.00 131.57 1t8d n PRO 9 Ca 0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.60 1t8d n PRO 9 Cb 0.35 -0.45 0.00 0.00 -0.04 0.00 0.00 33.50 33.37 1t8d n PRO 9 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1t8d n GLU 10 N -0.27 0.00 0.00 0.54 2.13 -1.26 -4.81 120.64 116.96 1t8d n GLU 10 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1t8d n GLU 10 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1t8d n GLU 10 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1t8d n LYS 11 N 0.00 0.00 0.00 5.31 4.01 -1.26 -4.73 118.16 121.49 1t8d n LYS 11 Ca 0.00 0.51 0.00 0.00 -0.51 0.00 0.00 58.31 58.31 1t8d n LYS 11 Cb 0.00 -1.16 0.00 0.00 -0.51 0.00 0.00 35.03 33.36 1t8d n LYS 11 CO 0.00 0.00 0.00 0.91 -1.11 0.00 0.00 177.40 177.20 1t8d n TRP 12 N -1.44 0.00 -3.83 2.13 7.02 -1.22 -4.64 117.44 115.46 1t8d n TRP 12 Ca 0.00 0.00 -0.20 0.00 -1.02 0.00 0.00 57.50 56.28 1t8d n TRP 12 Cb 0.00 0.00 -0.17 0.00 -2.42 0.00 0.00 31.31 28.72 1t8d n TRP 12 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 1t8d s ILE 13 N 0.00 0.21 0.09 -0.99 1.01 0.39 -4.39 121.20 117.52 1t8d s ILE 13 Ca 0.00 0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.84 1t8d s ILE 13 Cb 0.00 -0.36 -0.04 0.00 0.01 0.00 0.00 42.46 42.07 1t8d s ILE 13 CO 0.00 0.20 0.13 0.21 0.00 0.00 0.00 174.94 175.48 1t8d s ASN 14 N 1.61 5.77 0.00 3.58 2.47 -1.26 0.94 114.94 128.06 1t8d s ASN 14 Ca -0.01 0.05 0.00 0.00 0.42 0.00 0.00 52.86 53.32 1t8d s ASN 14 Cb -0.13 -1.61 0.00 0.00 -1.45 0.00 0.00 41.25 38.06 1t8d s ASN 14 CO -0.03 0.15 0.00 0.49 -3.72 0.00 0.00 177.10 173.99 1t8d n PHE 15 N 0.25 0.00 -0.28 0.43 3.72 0.13 -4.89 117.46 116.82 1t8d n PHE 15 Ca -0.08 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.41 1t8d n PHE 15 Cb 0.52 0.00 0.23 0.00 -0.94 0.00 0.00 39.48 39.29 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 0.44 0.00 -1.08 3.07 -1.98 -3.39 115.11 112.17 1t8d h GLN 16 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 58.65 58.71 1t8d h GLN 16 Cb 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 27.48 27.46 1t8d h GLN 16 CO 0.00 0.29 0.00 2.89 0.09 0.00 0.00 178.83 182.10 1t8d n ARG 17 N -5.00 0.00 -4.30 0.06 1.85 -1.26 -4.78 116.66 103.21 1t8d n ARG 17 Ca 0.17 0.00 -0.25 0.00 -1.00 0.00 0.00 57.85 56.77 1t8d n ARG 17 Cb 0.50 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.82 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 2.14 0.10 2.89 -2.85 -1.26 -1.31 119.74 119.45 1t8d s LYS 18 Ca 0.00 -1.37 0.05 0.00 -1.00 0.00 0.00 55.97 53.65 1t8d s LYS 18 Cb 0.00 -2.13 -0.03 0.00 -2.06 0.00 0.00 37.83 33.60 1t8d s LYS 18 CO 0.00 0.40 -0.13 0.00 0.10 0.00 0.00 175.35 175.71 1t8d s TYR 20 N -1.85 2.00 -0.35 0.00 1.51 0.27 -1.07 117.35 117.85 1t8d s TYR 20 Ca 0.03 -1.14 -0.10 0.00 -1.01 0.00 0.00 57.07 54.86 1t8d s TYR 20 Cb -0.07 -1.50 0.02 0.00 -0.11 0.00 0.00 41.96 40.31 1t8d s TYR 20 CO 0.02 -0.64 0.17 1.52 -1.11 0.00 0.00 175.55 175.51 1t8d s TYR 21 N 1.54 3.23 -1.24 2.71 1.13 0.04 0.15 117.35 124.91 1t8d s TYR 21 Ca 0.04 -0.98 -0.06 0.00 -1.41 0.00 0.00 57.07 54.66 1t8d s TYR 21 Cb -0.13 -2.39 0.19 0.00 -1.10 0.00 0.00 41.96 38.53 1t8d s TYR 21 CO -0.10 -0.63 2.02 1.19 -2.51 0.00 0.00 175.55 175.53 1t8d n PHE 22 N 4.96 2.67 -1.54 -3.49 3.72 -1.26 -2.35 117.46 120.16 1t8d n PHE 22 Ca -0.12 -2.74 -0.29 0.00 -0.05 0.00 0.00 57.45 54.25 1t8d n PHE 22 Cb 0.46 -1.70 0.11 0.00 -0.94 0.00 0.00 39.48 37.42 1t8d n PHE 22 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1t8d s GLY 23 N -0.02 1.60 -0.07 1.37 0.00 0.25 -4.75 107.32 105.70 1t8d s GLY 23 Ca 0.44 -0.37 0.01 0.00 0.00 0.00 0.00 44.72 44.80 1t8d s GLY 23 CO -0.04 0.13 -0.05 -1.59 0.00 0.00 0.00 173.10 171.54 1t8d s LYS 24 N -5.22 2.78 0.00 2.90 -2.85 -1.26 0.39 119.74 116.48 1t8d s LYS 24 Ca 0.62 -0.53 0.00 0.00 -1.00 0.00 0.00 55.97 55.06 1t8d s LYS 24 Cb -0.15 -2.62 0.00 0.00 -2.06 0.00 0.00 37.83 33.00 1t8d s LYS 24 CO 0.54 0.67 0.00 0.41 0.10 0.00 0.00 175.35 177.06 1t8d n GLY 25 N 2.15 1.76 3.72 0.59 0.00 0.14 -4.61 105.19 108.94 1t8d n GLY 25 Ca -0.18 0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1t8d n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1t8d s THR 26 N 0.00 5.03 0.00 2.61 -4.23 -1.26 -3.13 115.64 114.65 1t8d s THR 26 Ca 0.00 1.51 0.00 0.00 -1.18 0.00 0.00 61.69 62.02 1t8d s THR 26 Cb 0.00 -4.07 0.00 0.00 1.34 0.00 0.00 72.50 69.77 1t8d s THR 26 CO 0.00 0.24 0.00 2.29 -0.54 0.00 0.00 174.62 176.61 1t8d n LYS 27 N 3.78 0.00 -3.96 3.99 2.85 -1.26 -5.04 118.16 118.52 1t8d n LYS 27 Ca -0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1t8d n LYS 27 Cb 0.51 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 34.91 1t8d n LYS 27 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 1t8d s GLN 28 N 0.22 0.79 0.01 -1.58 -0.21 -1.26 -4.72 119.66 112.90 1t8d s GLN 28 Ca 0.00 -0.51 -0.25 0.00 0.02 0.00 0.00 55.36 54.62 1t8d s GLN 28 Cb 0.00 0.22 -0.18 0.00 1.00 0.00 0.00 33.01 34.04 1t8d s GLN 28 CO 0.00 -0.37 1.38 2.35 -2.12 0.00 0.00 175.29 176.53 1t8d h TRP 29 N 2.00 -0.07 -0.58 0.91 7.01 -1.99 -2.47 115.95 120.77 1t8d h TRP 29 Ca -0.24 -0.00 0.14 0.00 2.11 0.00 0.00 58.89 60.89 1t8d h TRP 29 Cb 1.20 0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 28.25 1t8d h TRP 29 CO 1.45 0.27 0.40 -0.39 -2.79 0.00 0.00 178.44 177.38 1t8d h VAL 30 N -0.41 0.79 0.00 2.65 -1.51 -1.99 0.42 116.25 116.19 1t8d h VAL 30 Ca -0.01 -0.06 -0.11 0.00 -1.23 0.00 0.00 66.70 65.30 1t8d h VAL 30 Cb 0.37 0.60 -0.02 0.00 -2.13 0.00 0.00 31.29 30.11 1t8d h VAL 30 CO 0.01 0.03 -0.51 0.45 -1.23 0.00 0.00 177.57 176.33 1t8d h HIS 31 N 0.18 0.00 -0.01 5.19 3.86 -1.90 -2.33 115.15 120.14 1t8d h HIS 31 Ca 0.28 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.48 1t8d h HIS 31 Cb 0.85 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.32 1t8d h HIS 31 CO -0.00 0.51 -0.02 0.00 0.86 0.00 0.00 177.93 179.28 1t8d h ALA 32 N 1.49 0.02 -0.64 2.45 0.00 0.28 -1.76 119.26 121.10 1t8d h ALA 32 Ca -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1t8d h ALA 32 Cb 1.00 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1t8d h ALA 32 CO 0.07 -0.19 0.34 0.07 0.00 0.00 0.00 179.25 179.53 1t8d h ARG 33 N -0.50 0.89 -0.28 0.00 -0.00 -1.42 -1.13 114.38 111.94 1t8d h ARG 33 Ca 0.00 -0.10 -0.07 0.00 -0.00 0.00 0.00 59.98 59.81 1t8d h ARG 33 Cb 0.56 -0.18 -0.02 0.00 -0.00 0.00 0.00 29.97 30.34 1t8d h ARG 33 CO 0.00 0.67 -0.14 1.88 -0.00 0.00 0.00 179.97 182.39 1t8d h TYR 34 N 0.90 0.51 -0.58 4.08 0.05 -1.40 -2.25 116.97 118.28 1t8d h TYR 34 Ca 0.23 -0.08 -0.06 0.00 0.05 0.00 0.00 58.73 58.86 1t8d h TYR 34 Cb 0.04 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.62 1t8d h TYR 34 CO 0.01 0.60 0.11 0.00 -1.05 0.00 0.00 178.16 177.83 1t8d h ALA 35 N 1.42 0.77 -0.02 3.88 0.00 -0.30 -2.17 119.26 122.85 1t8d h ALA 35 Ca 0.08 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1t8d h ALA 35 Cb 0.50 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1t8d h ALA 35 CO 0.03 0.50 -0.13 0.00 0.00 0.00 0.00 179.25 179.65 1t8d h ASP 37 N -0.22 0.00 0.50 0.00 5.19 -1.22 0.34 116.42 121.02 1t8d h ASP 37 Ca 0.05 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.37 1t8d h ASP 37 Cb 0.29 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.78 1t8d h ASP 37 CO -0.15 0.00 -0.44 -0.78 -3.12 0.00 0.00 179.24 174.76 1t8d h ASP 38 N 0.00 0.00 -0.08 6.45 3.58 -0.47 -2.60 116.42 123.30 1t8d h ASP 38 Ca 0.17 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.62 1t8d h ASP 38 Cb 0.70 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.75 1t8d h ASP 38 CO -0.00 0.44 0.00 0.23 -2.88 0.00 0.00 179.24 177.03 1t8d n MET 39 N -3.92 1.99 -2.46 0.28 2.81 0.49 -4.96 117.12 111.35 1t8d n MET 39 Ca -0.01 -1.82 -0.13 0.00 -1.81 0.00 0.00 57.70 53.93 1t8d n MET 39 Cb 0.48 -1.41 0.01 0.00 -0.71 0.00 0.00 33.22 31.58 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 1.20 -1.90 0.00 0.03 4.71 0.89 -4.96 120.64 120.62 1t8d n GLU 40 Ca 0.13 0.56 0.00 0.00 -0.01 0.00 0.00 57.16 57.84 1t8d n GLU 40 Cb 0.53 -4.68 0.00 0.00 -1.01 0.00 0.00 31.44 26.28 1t8d n GLU 40 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1t8d n GLY 41 N -1.10 1.20 3.45 0.62 0.00 0.05 -4.76 105.19 104.64 1t8d n GLY 41 Ca -0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.80 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 3.79 1.11 -0.38 1.61 0.74 0.29 -4.66 119.66 122.16 1t8d s GLN 42 Ca 0.00 -0.36 -0.29 0.00 0.05 0.00 0.00 55.36 54.76 1t8d s GLN 42 Cb 0.00 0.51 0.01 0.00 1.10 0.00 0.00 33.01 34.63 1t8d s GLN 42 CO 0.00 -0.48 1.31 -1.17 -0.55 0.00 0.00 175.29 174.40 1t8d s LEU 43 N -2.54 3.72 0.00 3.68 2.96 -1.26 0.03 118.68 125.28 1t8d s LEU 43 Ca 0.01 0.92 0.00 0.00 -0.22 0.00 0.00 54.13 54.85 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 -0.10 -1.24 0.00 1.33 -1.32 0.00 0.00 176.35 175.02 1t8d n VAL 44 N 6.65 0.00 -3.00 1.68 0.24 -1.24 -2.89 118.33 119.77 1t8d n VAL 44 Ca 0.15 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.33 1t8d n VAL 44 Cb 0.48 0.00 0.06 0.00 -1.47 0.00 0.00 33.84 32.91 1t8d n VAL 44 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1t8d n SER 45 N -0.22 -2.25 -4.57 -1.34 2.88 -1.26 -4.62 113.62 102.23 1t8d n SER 45 Ca 0.00 -0.42 -0.47 0.00 -1.33 0.00 0.00 58.87 56.65 1t8d n SER 45 Cb 0.00 -3.66 -0.03 0.00 -0.75 0.00 0.00 64.21 59.77 1t8d n SER 45 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1t8d n ILE 46 N -3.22 1.47 -0.57 2.46 -0.00 -1.26 -4.84 119.36 113.40 1t8d n ILE 46 Ca -0.18 -0.37 0.00 0.00 -0.00 0.00 0.00 62.75 62.20 1t8d n ILE 46 Cb 0.61 -0.86 0.00 0.00 -0.00 0.00 0.00 39.64 39.40 1t8d n ILE 46 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1t8d n HIS 47 N 0.82 0.00 -4.41 4.28 1.44 -1.26 -4.86 115.22 111.22 1t8d n HIS 47 Ca 0.13 -0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.50 1t8d n HIS 47 Cb 0.28 -0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.23 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 3.14 0.55 4.39 0.15 -1.26 -4.77 113.70 115.90 1t8d s SER 48 Ca 0.00 -0.62 0.38 0.00 0.70 0.00 0.00 55.95 56.41 1t8d s SER 48 Cb 0.00 -1.47 1.55 0.00 -1.71 0.00 0.00 66.02 64.39 1t8d s SER 48 CO 0.00 0.04 1.74 -0.65 1.20 0.00 0.00 173.24 175.57 1t8d h PRO 49 N 7.61 0.00 -0.06 5.44 0.11 -1.98 0.47 132.00 143.59 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 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1t8d h PRO 49 CO 0.59 0.00 -0.29 1.49 -0.21 0.00 0.00 178.00 179.59 1t8d h GLU 50 N 0.00 0.31 -0.26 1.05 4.81 -1.97 -1.99 114.58 116.52 1t8d h GLU 50 Ca 0.61 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.58 1t8d h GLU 50 Cb 2.52 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 31.93 1t8d h GLU 50 CO -0.01 0.89 0.11 0.93 -0.73 0.00 0.00 179.01 180.20 1t8d h GLU 51 N -0.20 0.39 -0.95 1.92 4.39 -0.53 0.79 114.58 120.38 1t8d h GLU 51 Ca -0.02 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.61 1t8d h GLU 51 Cb 0.93 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.47 1t8d h GLU 51 CO 0.06 0.41 0.59 -0.56 -1.16 0.00 0.00 179.01 178.35 1t8d h GLN 52 N 0.28 1.29 -0.18 2.33 -0.00 -1.22 -0.88 115.11 116.72 1t8d h GLN 52 Ca 0.09 -0.11 -0.13 0.00 -0.00 0.00 0.00 58.65 58.51 1t8d h GLN 52 Cb 0.17 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.48 27.36 1t8d h GLN 52 CO -0.01 0.89 -0.43 0.22 -0.00 0.00 0.00 178.83 179.50 1t8d h ASP 53 N 1.31 0.44 0.09 0.06 3.58 -0.98 0.12 116.42 121.04 1t8d h ASP 53 Ca 0.34 -0.20 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 1t8d h ASP 53 Cb -0.08 -0.12 -0.00 0.00 1.72 0.00 0.00 39.33 40.84 1t8d h ASP 53 CO -0.07 0.82 -0.07 -0.26 -2.88 0.00 0.00 179.24 176.78 1t8d h PHE 54 N 0.34 -0.18 -0.06 0.28 -1.00 0.19 0.38 116.94 116.90 1t8d h PHE 54 Ca 0.03 -0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.62 1t8d h PHE 54 Cb 0.89 0.07 -0.01 0.00 3.61 0.00 0.00 35.95 40.51 1t8d h PHE 54 CO 0.03 -0.11 -0.75 1.37 -1.61 0.00 0.00 178.31 177.24 1t8d h LEU 55 N -0.17 0.42 -0.90 1.54 8.10 -1.24 -1.50 115.31 121.56 1t8d h LEU 55 Ca -0.00 -0.28 0.01 0.00 0.11 0.00 0.00 57.88 57.71 1t8d h LEU 55 Cb 0.15 -0.12 -0.04 0.00 -0.44 0.00 0.00 40.66 40.20 1t8d h LEU 55 CO -0.00 1.02 0.59 0.74 -4.11 0.00 0.00 178.44 176.67 1t8d h THR 56 N 0.23 1.24 -0.05 0.15 2.02 -0.41 0.42 112.91 116.51 1t8d h THR 56 Ca -0.03 -0.45 -0.19 0.00 0.77 0.00 0.00 66.41 66.51 1t8d h THR 56 Cb 1.32 -0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1t8d h THR 56 CO 0.12 0.23 -0.80 0.50 0.37 0.00 0.00 175.52 175.95 1t8d h LYS 57 N 1.23 0.37 -0.02 6.66 1.63 -0.18 -3.00 116.57 123.26 1t8d h LYS 57 Ca 0.33 -0.34 -0.07 0.00 -0.85 0.00 0.00 60.65 59.72 1t8d h LYS 57 Cb -0.12 0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.58 1t8d h LYS 57 CO -0.07 1.00 -0.30 1.25 -3.45 0.00 0.00 179.45 177.87 1t8d h HIS 58 N 0.24 0.04 -2.75 1.91 2.76 -0.23 -3.41 115.15 113.72 1t8d h HIS 58 Ca -0.04 -0.01 -0.56 0.00 -2.20 0.00 0.00 60.37 57.56 1t8d h HIS 58 Cb 1.39 -0.01 -0.04 0.00 1.55 0.00 0.00 27.41 30.30 1t8d h HIS 58 CO 0.05 0.34 1.22 0.00 -1.30 0.00 0.00 177.93 178.24 1t8d s ALA 59 N -4.35 2.82 0.00 5.26 0.00 0.14 -4.94 121.76 120.69 1t8d s ALA 59 Ca -0.03 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 51.90 1t8d s ALA 59 Cb 0.15 -4.04 0.00 0.00 0.00 0.00 0.00 23.12 19.23 1t8d s ALA 59 CO 0.72 -2.75 0.28 0.45 0.00 0.00 0.00 175.76 174.46 1t8d n SER 60 N 10.17 0.00 -0.03 0.00 2.88 -1.26 -4.69 113.62 120.69 1t8d n SER 60 Ca 0.20 0.28 -0.02 0.00 -1.33 0.00 0.00 58.87 58.00 1t8d n SER 60 Cb 0.48 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.88 1t8d n SER 60 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 1t8d n HIS 61 N -0.32 0.00 -3.51 0.66 -0.00 -1.26 -4.97 115.22 105.82 1t8d n HIS 61 Ca 0.00 0.00 -0.38 0.00 0.46 0.00 0.00 57.72 57.80 1t8d n HIS 61 Cb 0.00 -0.31 -0.06 0.00 -0.12 0.00 0.00 29.99 29.50 1t8d n HIS 61 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 1t8d s THR 62 N -2.21 5.05 0.00 3.57 -4.23 -1.26 -4.90 115.64 111.66 1t8d s THR 62 Ca -0.03 0.82 0.00 0.00 -1.18 0.00 0.00 61.69 61.29 1t8d s THR 62 Cb 0.02 -3.70 0.00 0.00 1.34 0.00 0.00 72.50 70.16 1t8d s THR 62 CO 0.28 0.58 0.00 0.61 -0.54 0.00 0.00 174.62 175.55 1t8d n GLY 63 N 1.85 -2.69 3.22 3.99 0.00 -1.26 -4.70 105.19 105.60 1t8d n GLY 63 Ca -0.14 -1.36 -0.12 0.00 0.00 0.00 0.00 46.02 44.40 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 -1.66 1.34 -0.15 1.61 1.04 -1.16 -3.74 113.70 110.99 1t8d s SER 64 Ca 0.00 -1.07 -0.05 0.00 0.48 0.00 0.00 55.95 55.31 1t8d s SER 64 Cb 0.00 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.16 1t8d s SER 64 CO 0.00 -0.47 0.02 0.26 0.98 0.00 0.00 173.24 174.03 1t8d s TRP 65 N -3.56 3.17 0.36 5.02 0.51 -1.23 -2.68 118.94 120.53 1t8d s TRP 65 Ca 0.17 -0.01 0.08 0.00 -2.12 0.00 0.00 56.10 54.22 1t8d s TRP 65 Cb 0.05 -1.97 -0.05 0.00 -0.81 0.00 0.00 33.47 30.68 1t8d s TRP 65 CO -0.00 0.18 0.09 0.96 -0.51 0.00 0.00 176.95 177.66 1t8d s ILE 66 N 0.06 2.68 -0.37 2.03 -4.36 -1.26 -4.19 121.20 115.80 1t8d s ILE 66 Ca 0.03 -1.82 -0.06 0.00 -0.26 0.00 0.00 60.65 58.54 1t8d s ILE 66 Cb -0.13 -2.91 -0.18 0.00 1.25 0.00 0.00 42.46 40.50 1t8d s ILE 66 CO 0.02 -0.15 2.95 0.61 0.24 0.00 0.00 174.94 178.61 1t8d n GLY 67 N -1.08 2.96 3.06 6.27 0.00 -1.14 -4.67 105.19 110.59 1t8d n GLY 67 Ca -0.03 -1.06 -0.28 0.00 0.00 0.00 0.00 46.02 44.65 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 1.73 -0.04 0.99 0.20 -1.26 -1.69 118.68 118.64 1t8d s LEU 68 Ca 0.56 -0.40 -0.01 0.00 0.69 0.00 0.00 54.13 54.96 1t8d s LEU 68 Cb 0.23 -1.05 0.03 0.00 -0.43 0.00 0.00 46.19 44.97 1t8d s LEU 68 CO -0.01 0.03 0.04 -0.60 -0.29 0.00 0.00 176.35 175.52 1t8d s ARG 69 N 0.85 0.12 0.45 1.98 3.52 0.12 -3.44 118.95 122.55 1t8d s ARG 69 Ca -0.10 0.26 -0.20 0.00 -0.13 0.00 0.00 55.73 55.56 1t8d s ARG 69 Cb -0.15 -0.58 -0.10 0.00 -1.56 0.00 0.00 34.95 32.55 1t8d s ARG 69 CO 0.01 -0.28 0.97 1.21 -0.81 0.00 0.00 175.30 176.39 1t8d s ASN 70 N 1.87 6.82 0.00 -2.12 3.84 0.14 -0.41 114.94 125.08 1t8d s ASN 70 Ca 0.02 1.71 0.00 0.00 0.21 0.00 0.00 52.86 54.79 1t8d s ASN 70 Cb -0.12 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.04 1t8d s ASN 70 CO -0.03 -0.45 0.21 0.18 -2.79 0.00 0.00 177.10 174.22 1t8d n LEU 71 N -0.81 0.07 -3.46 3.21 4.77 -0.99 -4.71 117.00 115.09 1t8d n LEU 71 Ca 0.07 0.21 -0.28 0.00 -0.03 0.00 0.00 56.01 55.99 1t8d n LEU 71 Cb 0.54 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.52 1t8d n LEU 71 CO 0.39 0.00 -0.29 1.51 -1.33 0.00 0.00 177.39 177.66 1t8d s ASP 72 N -1.95 2.06 0.00 -1.43 -4.77 -1.26 -4.95 116.67 104.37 1t8d s ASP 72 Ca 0.00 -2.95 0.00 0.00 -3.30 0.00 0.00 52.55 46.30 1t8d s ASP 72 Cb 0.00 -0.55 0.00 0.00 -1.09 0.00 0.00 42.92 41.28 1t8d s ASP 72 CO 0.00 -0.19 0.00 -0.11 0.70 0.00 0.00 175.17 175.57 1t8d n LEU 73 N 3.02 0.00 0.00 2.11 0.00 -1.23 -2.37 117.00 118.52 1t8d n LEU 73 Ca 0.25 0.00 0.03 0.00 0.00 0.00 0.00 56.01 56.29 1t8d n LEU 73 Cb 0.44 0.00 0.18 0.00 0.00 0.00 0.00 43.42 44.04 1t8d n LEU 73 CO 0.11 0.00 0.52 2.29 0.00 0.00 0.00 177.39 180.31 1t8d n LYS 74 N 0.00 0.78 0.00 1.96 2.85 -1.26 -4.77 118.16 117.72 1t8d n LYS 74 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1t8d n LYS 74 Cb 0.00 -1.12 0.00 0.00 -0.65 0.00 0.00 35.03 33.26 1t8d n LYS 74 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1t8d n GLY 75 N 0.34 -1.05 3.83 2.58 0.00 -1.00 -5.06 105.19 104.83 1t8d n GLY 75 Ca 0.05 -1.66 -0.36 0.00 0.00 0.00 0.00 46.02 44.05 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 -2.28 3.30 -0.12 1.61 2.02 -1.26 -4.76 118.70 117.22 1t8d s GLU 76 Ca 0.00 -0.24 -0.29 0.00 0.02 0.00 0.00 54.97 54.45 1t8d s GLU 76 Cb 0.00 -3.06 -0.03 0.00 0.10 0.00 0.00 34.13 31.14 1t8d s GLU 76 CO 0.00 0.74 1.45 -0.06 0.02 0.00 0.00 175.26 177.41 1t8d s PHE 77 N -1.03 2.44 -0.04 1.61 0.08 -1.26 -2.35 117.98 117.42 1t8d s PHE 77 Ca 0.16 0.63 0.04 0.00 0.12 0.00 0.00 56.93 57.88 1t8d s PHE 77 Cb -0.12 -3.70 -0.03 0.00 -0.57 0.00 0.00 43.02 38.60 1t8d s PHE 77 CO 0.06 -2.70 -0.15 0.42 -0.10 0.00 0.00 175.22 172.74 1t8d s ILE 78 N 3.77 2.98 0.50 0.64 1.01 0.45 -2.64 121.20 127.91 1t8d s ILE 78 Ca 0.63 -0.78 -0.20 0.00 0.00 0.00 0.00 60.65 60.31 1t8d s ILE 78 Cb -0.27 -2.16 -0.08 0.00 0.01 0.00 0.00 42.46 39.96 1t8d s ILE 78 CO 0.22 0.57 1.04 0.26 0.00 0.00 0.00 174.94 177.03 1t8d s TRP 79 N -0.74 3.01 0.60 3.97 0.51 -0.08 0.14 118.94 126.35 1t8d s TRP 79 Ca 0.12 1.57 0.31 0.00 -2.12 0.00 0.00 56.10 55.97 1t8d s TRP 79 Cb -0.11 -3.05 1.85 0.00 -0.81 0.00 0.00 33.47 31.36 1t8d s TRP 79 CO 0.01 -0.85 2.22 -0.24 -0.51 0.00 0.00 176.95 177.58 1t8d h VAL 80 N 1.39 0.44 0.00 4.03 3.04 -1.63 0.26 116.25 123.77 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 1.22 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 31.45 1t8d h VAL 80 CO 0.59 0.00 0.00 -0.67 -1.01 0.00 0.00 177.57 176.48 1t8d n ASP 81 N -3.72 0.00 -0.43 3.17 2.03 -1.26 -4.85 116.55 111.49 1t8d n ASP 81 Ca -0.02 -1.08 -0.02 0.00 0.52 0.00 0.00 54.79 54.19 1t8d n ASP 81 Cb 0.15 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.55 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 0.68 0.51 2.85 0.27 0.00 0.90 -5.06 105.19 105.34 1t8d n GLY 82 Ca 0.16 -0.73 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 1t8d n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t8d s SER 83 N -2.96 1.41 0.62 1.61 0.01 -1.21 -4.92 113.70 108.26 1t8d s SER 83 Ca 0.02 -0.14 -0.18 0.00 1.31 0.00 0.00 55.95 56.96 1t8d s SER 83 Cb -0.01 -0.52 -0.04 0.00 0.21 0.00 0.00 66.02 65.66 1t8d s SER 83 CO 0.03 -0.12 0.92 0.00 0.41 0.00 0.00 173.24 174.48 1t8d n HIS 84 N 4.61 0.65 -1.38 2.43 1.44 -1.26 -0.90 115.22 120.80 1t8d n HIS 84 Ca -0.16 0.43 -0.36 0.00 -2.01 0.00 0.00 57.72 55.62 1t8d n HIS 84 Cb 0.50 -2.11 0.07 0.00 0.12 0.00 0.00 29.99 28.57 1t8d n HIS 84 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 1t8d n VAL 85 N -1.86 2.62 -0.04 0.61 0.31 -1.08 -4.76 118.33 114.12 1t8d n VAL 85 Ca 0.14 -0.41 -0.08 0.00 -0.01 0.00 0.00 64.34 63.97 1t8d n VAL 85 Cb 0.48 -0.96 -0.03 0.00 -0.91 0.00 0.00 33.84 32.42 1t8d n VAL 85 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1t8d n ASP 86 N -0.94 1.48 -0.04 4.52 8.00 -1.26 -4.91 116.55 123.40 1t8d n ASP 86 Ca 0.12 0.24 -0.05 0.00 0.71 0.00 0.00 54.79 55.80 1t8d n ASP 86 Cb 0.49 -0.55 -0.05 0.00 -0.02 0.00 0.00 41.12 40.99 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 -3.97 0.00 -1.46 1.24 4.01 -1.26 -5.14 117.16 110.58 1t8d n TYR 87 Ca -0.14 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.70 1t8d n TYR 87 Cb 0.41 -0.36 -0.06 0.00 -0.31 0.00 0.00 39.34 39.02 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 -2.59 -7.90 0.00 7.72 3.41 -1.26 -4.97 113.62 108.03 1t8d n SER 88 Ca -0.15 1.60 0.00 0.00 -0.26 0.00 0.00 58.87 60.06 1t8d n SER 88 Cb 0.70 -4.90 0.00 0.00 -0.26 0.00 0.00 64.21 59.75 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 -3.63 0.48 -4.50 4.04 3.02 -1.26 -5.04 115.26 108.37 1t8d n ASN 89 Ca -0.06 -0.07 -0.32 0.00 -0.03 0.00 0.00 54.58 54.11 1t8d n ASN 89 Cb 0.60 0.23 -0.18 0.00 -0.61 0.00 0.00 39.78 39.81 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 -0.28 0.32 -1.54 3.10 4.27 -1.25 -3.61 117.44 118.46 1t8d n TRP 90 Ca 0.00 0.20 0.09 0.00 -3.89 0.00 0.00 57.50 53.89 1t8d n TRP 90 Cb 0.00 -1.52 -0.05 0.00 -1.36 0.00 0.00 31.31 28.38 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 8.36 -2.91 0.24 -1.67 0.00 0.79 -4.58 120.51 120.74 1t8d n ALA 91 Ca 0.66 0.73 0.12 0.00 0.00 0.00 0.00 53.44 54.95 1t8d n ALA 91 Cb 0.09 -1.55 0.56 0.00 0.00 0.00 0.00 19.45 18.55 1t8d n ALA 91 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1t8d h PRO 92 N -0.63 0.00 0.00 0.00 0.13 -1.90 -3.43 132.00 126.17 1t8d h PRO 92 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1t8d h PRO 92 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1t8d h PRO 92 CO 0.04 0.16 0.00 0.41 -0.23 0.00 0.00 178.00 178.38 1t8d n GLY 93 N -0.00 0.00 2.95 1.56 0.00 -1.26 -5.09 105.19 103.34 1t8d n GLY 93 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1t8d n GLY 93 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1t8d s GLU 94 N 0.00 0.91 0.66 1.61 2.56 -1.26 -5.00 118.70 118.17 1t8d s GLU 94 Ca 0.00 -0.74 0.41 0.00 0.00 0.00 0.00 54.97 54.65 1t8d s GLU 94 Cb 0.00 -0.12 2.28 0.00 2.00 0.00 0.00 34.13 38.29 1t8d s GLU 94 CO 0.00 -1.26 2.32 -1.35 -0.56 0.00 0.00 175.26 174.41 1t8d h PRO 95 N 6.14 0.00 -4.42 4.30 0.11 -1.91 -3.46 132.00 132.75 1t8d h PRO 95 Ca 0.07 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.79 1t8d h PRO 95 Cb 1.13 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.25 1t8d h PRO 95 CO 0.09 0.00 -0.56 2.41 -0.21 0.00 0.00 178.00 179.73 1t8d n THR 96 N -3.19 -1.51 -2.99 -1.15 -1.04 -1.26 -4.95 114.28 98.19 1t8d n THR 96 Ca -0.03 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.64 1t8d n THR 96 Cb 0.10 -2.89 -0.06 0.00 -1.82 0.00 0.00 70.33 65.66 1t8d n THR 96 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1t8d s SER 97 N -2.55 6.97 -0.01 8.00 1.04 -1.26 -4.98 113.70 120.91 1t8d s SER 97 Ca 0.25 1.51 0.02 0.00 0.48 0.00 0.00 55.95 58.21 1t8d s SER 97 Cb -0.12 -2.46 0.02 0.00 0.10 0.00 0.00 66.02 63.57 1t8d s SER 97 CO 0.31 -0.17 0.87 0.54 0.98 0.00 0.00 173.24 175.77 1t8d n ARG 98 N -0.06 1.88 -0.00 4.02 1.74 -1.26 -4.66 116.66 118.31 1t8d n ARG 98 Ca 0.03 -1.29 0.08 0.00 -0.77 0.00 0.00 57.85 55.90 1t8d n ARG 98 Cb 0.52 -0.88 -0.11 0.00 -1.02 0.00 0.00 32.46 30.97 1t8d n ARG 98 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1t8d n SER 99 N -0.42 1.04 -2.10 0.55 3.41 -1.26 -4.98 113.62 109.86 1t8d n SER 99 Ca 0.01 -0.39 -0.18 0.00 -0.26 0.00 0.00 58.87 58.05 1t8d n SER 99 Cb 0.37 1.41 -0.03 0.00 -0.26 0.00 0.00 64.21 65.70 1t8d n SER 99 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1t8d n GLN 100 N -1.75 -1.71 -2.62 4.33 -0.06 -1.26 -4.94 117.38 109.38 1t8d n GLN 100 Ca -0.00 0.93 -0.36 0.00 -2.00 0.00 0.00 57.00 55.57 1t8d n GLN 100 Cb 0.34 -5.47 -0.05 0.00 -4.06 0.00 0.00 30.24 21.01 1t8d n GLN 100 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 1t8d s GLY 101 N -2.21 2.65 -0.30 1.69 0.00 -1.26 -4.90 107.32 102.99 1t8d s GLY 101 Ca 0.00 0.61 -0.10 0.00 0.00 0.00 0.00 44.72 45.23 1t8d s GLY 101 CO 0.00 1.00 0.71 -0.54 0.00 0.00 0.00 173.10 174.28 1t8d s GLU 102 N -2.67 0.52 0.00 2.90 2.02 -1.26 -2.97 118.70 117.24 1t8d s GLU 102 Ca 0.59 1.28 0.00 0.00 0.02 0.00 0.00 54.97 56.86 1t8d s GLU 102 Cb -0.19 0.77 0.00 0.00 0.10 0.00 0.00 34.13 34.81 1t8d s GLU 102 CO 0.23 -0.22 0.00 -3.47 0.02 0.00 0.00 175.26 171.83 1t8d n ASP 103 N 5.36 0.00 -3.88 -0.19 -0.08 -1.21 -3.58 116.55 112.98 1t8d n ASP 103 Ca -0.11 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.08 1t8d n ASP 103 Cb 0.50 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.87 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 -2.60 3.47 0.39 0.00 1.01 -1.22 -2.65 120.40 118.79 1t8d s VAL 105 Ca -0.05 -0.56 0.08 0.00 0.00 0.00 0.00 61.98 61.45 1t8d s VAL 105 Cb -0.01 -2.41 -0.07 0.00 0.00 0.00 0.00 36.38 33.89 1t8d s VAL 105 CO -0.04 0.58 0.03 0.00 0.00 0.00 0.00 175.10 175.66 1t8d s MET 106 N -0.56 2.01 -0.08 2.72 0.23 -0.66 -4.01 119.30 118.95 1t8d s MET 106 Ca 0.08 -1.96 0.03 0.00 -1.03 0.00 0.00 55.69 52.82 1t8d s MET 106 Cb -0.12 -1.78 0.01 0.00 -1.53 0.00 0.00 34.83 31.41 1t8d s MET 106 CO 0.02 0.01 -0.18 1.41 -2.03 0.00 0.00 175.02 174.25 1t8d s MET 107 N -3.73 2.26 0.31 3.16 -2.45 -1.09 0.15 119.30 117.91 1t8d s MET 107 Ca 0.36 -0.63 0.07 0.00 -1.25 0.00 0.00 55.69 54.24 1t8d s MET 107 Cb 0.05 -1.79 -0.03 0.00 1.25 0.00 0.00 34.83 34.31 1t8d s MET 107 CO 0.19 0.12 0.24 0.50 1.05 0.00 0.00 175.02 177.12 1t8d s ARG 108 N 0.45 2.74 0.01 4.11 3.52 -0.60 -2.96 118.95 126.22 1t8d s ARG 108 Ca -0.15 -1.24 0.09 0.00 -0.13 0.00 0.00 55.73 54.29 1t8d s ARG 108 Cb -0.16 -2.47 0.37 0.00 -1.56 0.00 0.00 34.95 31.13 1t8d s ARG 108 CO 0.06 0.20 1.28 0.41 -0.81 0.00 0.00 175.30 176.44 1t8d n GLY 109 N -1.28 -0.80 0.32 8.12 0.00 -1.26 -2.56 105.19 107.73 1t8d n GLY 109 Ca -0.04 -0.03 0.10 0.00 0.00 0.00 0.00 46.02 46.06 1t8d n GLY 109 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1t8d h SER 110 N 0.00 0.25 0.00 1.61 0.02 -1.94 -3.46 113.55 110.04 1t8d h SER 110 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1t8d h SER 110 Cb 0.15 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1t8d h SER 110 CO 0.00 0.17 0.00 0.61 -1.14 0.00 0.00 176.83 176.47 1t8d n GLY 111 N -1.53 1.85 0.00 -3.77 0.00 -1.06 -5.12 105.19 95.56 1t8d n GLY 111 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 0.00 -4.06 1.61 -4.01 -1.25 -4.78 116.66 104.18 1t8d n ARG 112 Ca 0.00 0.00 -0.22 0.00 -1.04 0.00 0.00 57.85 56.59 1t8d n ARG 112 Cb 0.00 0.00 -0.05 0.00 -3.04 0.00 0.00 32.46 29.37 1t8d n ARG 112 CO 0.00 0.00 0.00 -1.58 -3.04 0.00 0.00 177.63 173.01 1t8d s TRP 113 N -5.09 2.93 -0.09 2.89 0.51 -1.24 -1.56 118.94 117.29 1t8d s TRP 113 Ca 0.00 -0.22 -0.01 0.00 -2.12 0.00 0.00 56.10 53.75 1t8d s TRP 113 Cb 0.00 -1.51 0.03 0.00 -0.81 0.00 0.00 33.47 31.18 1t8d s TRP 113 CO 0.00 0.42 -0.03 -0.80 -0.51 0.00 0.00 176.95 176.03 1t8d s ASN 114 N -3.86 1.87 -0.25 2.95 0.02 0.12 -0.15 114.94 115.65 1t8d s ASN 114 Ca 0.36 -0.20 -0.22 0.00 -1.02 0.00 0.00 52.86 51.77 1t8d s ASN 114 Cb -0.06 -0.60 -0.01 0.00 0.02 0.00 0.00 41.25 40.60 1t8d s ASN 114 CO 0.24 -0.17 0.72 -0.62 0.02 0.00 0.00 177.10 177.29 1t8d s ASP 115 N 1.87 6.70 0.16 -1.22 2.15 -1.26 -1.65 116.67 123.41 1t8d s ASP 115 Ca 0.05 0.86 -0.20 0.00 0.43 0.00 0.00 52.55 53.69 1t8d s ASP 115 Cb -0.13 -2.38 0.05 0.00 -0.30 0.00 0.00 42.92 40.16 1t8d s ASP 115 CO -0.06 -0.44 0.53 0.00 -0.17 0.00 0.00 175.17 175.03 1t8d s ALA 116 N 2.66 -1.26 0.03 3.66 0.00 -1.08 -4.90 121.76 120.87 1t8d s ALA 116 Ca 0.30 0.16 -0.06 0.00 0.00 0.00 0.00 51.96 52.36 1t8d s ALA 116 Cb -0.15 0.82 -0.01 0.00 0.00 0.00 0.00 23.12 23.78 1t8d s ALA 116 CO 0.08 -0.75 0.90 0.34 0.00 0.00 0.00 175.76 176.33 1t8d n PHE 117 N -0.33 -0.08 0.00 0.00 7.35 -1.16 -2.77 117.46 120.47 1t8d n PHE 117 Ca -0.15 0.23 0.00 0.00 -0.76 0.00 0.00 57.45 56.78 1t8d n PHE 117 Cb 0.64 -0.44 0.00 0.00 0.35 0.00 0.00 39.48 40.03 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 0.00 -6.80 -4.35 0.00 8.00 -1.26 -4.56 116.55 107.58 1t8d n ASP 119 Ca 0.00 0.74 -0.54 0.00 0.71 0.00 0.00 54.79 55.70 1t8d n ASP 119 Cb 0.00 -2.61 -0.11 0.00 -0.02 0.00 0.00 41.12 38.38 1t8d n ASP 119 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1t8d n ARG 120 N 1.29 0.31 -0.12 -1.24 0.00 -1.26 -4.65 116.66 110.98 1t8d n ARG 120 Ca -0.02 0.07 0.00 0.00 -0.00 0.00 0.00 57.85 57.91 1t8d n ARG 120 Cb 0.34 -1.81 0.00 0.00 0.00 0.00 0.00 32.46 30.99 1t8d n ARG 120 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1t8d n LYS 121 N 7.89 0.00 -0.52 -0.14 4.81 -1.26 -5.08 118.16 123.86 1t8d n LYS 121 Ca 0.53 -0.28 0.00 0.00 -0.87 0.00 0.00 58.31 57.69 1t8d n LYS 121 Cb 0.06 -0.22 0.00 0.00 0.02 0.00 0.00 35.03 34.88 1t8d n LYS 121 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1t8d n LEU 122 N 0.00 0.00 -0.29 3.14 4.32 -1.26 -4.81 117.00 118.09 1t8d n LEU 122 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1t8d n LEU 122 Cb 0.52 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.32 1t8d n LEU 122 CO 0.00 -0.30 0.15 0.61 -1.22 0.00 0.00 177.39 176.63 1t8d n GLY 123 N 5.00 0.64 3.22 -0.72 0.00 -1.26 -4.65 105.19 107.41 1t8d n GLY 123 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.92 -0.17 4.61 0.00 -1.19 -0.68 121.76 123.41 1t8d s ALA 124 Ca 0.00 1.38 -0.06 0.00 0.00 0.00 0.00 51.96 53.28 1t8d s ALA 124 Cb 0.00 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.24 1t8d s ALA 124 CO 0.00 -0.24 0.04 1.67 0.00 0.00 0.00 175.76 177.22 1t8d s TRP 125 N 1.32 3.20 -0.05 0.00 1.48 0.16 -3.52 118.94 121.52 1t8d s TRP 125 Ca -0.09 -0.01 0.02 0.00 -1.06 0.00 0.00 56.10 54.96 1t8d s TRP 125 Cb -0.09 -2.04 0.02 0.00 -1.16 0.00 0.00 33.47 30.21 1t8d s TRP 125 CO -0.11 0.13 -0.08 0.54 -4.06 0.00 0.00 176.95 173.37 1t8d s VAL 126 N 0.30 0.81 0.10 -0.66 0.11 -1.26 -0.59 120.40 119.22 1t8d s VAL 126 Ca 0.02 -0.28 -0.02 0.00 -2.93 0.00 0.00 61.98 58.77 1t8d s VAL 126 Cb -0.13 -0.78 -0.04 0.00 -1.53 0.00 0.00 36.38 33.90 1t8d s VAL 126 CO 0.01 0.28 0.04 0.00 -3.33 0.00 0.00 175.10 172.10 1t8d s ASP 128 N -2.99 2.18 -0.02 0.00 1.47 0.10 -0.78 116.67 116.62 1t8d s ASP 128 Ca 0.17 -0.49 -0.11 0.00 1.18 0.00 0.00 52.55 53.30 1t8d s ASP 128 Cb 0.07 -0.17 0.02 0.00 -0.34 0.00 0.00 42.92 42.50 1t8d s ASP 128 CO -0.03 0.12 0.25 0.00 0.68 0.00 0.00 175.17 176.19 1t8d s ARG 129 N -1.13 0.55 0.10 2.11 1.70 -0.23 0.10 118.95 122.15 1t8d s ARG 129 Ca 0.05 -0.17 -0.30 0.00 -0.47 0.00 0.00 55.73 54.84 1t8d s ARG 129 Cb -0.08 0.24 -0.06 0.00 -0.57 0.00 0.00 34.95 34.48 1t8d s ARG 129 CO 0.02 -0.14 1.08 -0.51 -1.08 0.00 0.00 175.30 174.67 1t8d s LEU 130 N -1.11 4.43 0.00 -1.89 1.43 -1.26 -0.48 118.68 119.80 1t8d s LEU 130 Ca -0.12 1.93 0.00 0.00 -1.03 0.00 0.00 54.13 54.92 1t8d s LEU 130 Cb -0.05 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.58 1t8d s LEU 130 CO 0.03 -0.28 0.00 0.00 0.23 0.00 0.00 176.35 176.33 1t8d n ALA 131 N 3.22 0.00 -2.32 4.21 0.00 -0.42 -4.89 120.51 120.31 1t8d n ALA 131 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.19 1t8d n ALA 131 Cb 0.48 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.77 1t8d n ALA 131 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1t8d s THR 132 N -2.54 2.03 0.32 0.00 -4.23 -1.26 -4.36 115.64 105.60 1t8d s THR 132 Ca 0.00 -1.12 0.00 0.00 -1.18 0.00 0.00 61.69 59.39 1t8d s THR 132 Cb 0.00 -1.69 0.00 0.00 1.34 0.00 0.00 72.50 72.15 1t8d s THR 132 CO 0.00 0.55 0.00 0.00 -0.54 0.00 0.00 174.62 174.63 1t8d s THR 134 N -2.00 4.34 -0.10 0.00 2.01 -1.26 -3.12 115.64 115.50 1t8d s THR 134 Ca 0.00 -0.99 -0.29 0.00 0.31 0.00 0.00 61.69 60.71 1t8d s THR 134 Cb 0.00 -3.46 -0.05 0.00 0.01 0.00 0.00 72.50 69.00 1t8d s THR 134 CO 0.00 -0.26 1.63 -2.16 -0.69 0.00 0.00 174.62 173.15 1t8d s PRO 135 N 1.50 4.07 0.00 4.92 0.04 -1.26 -4.84 135.00 139.43 1t8d s PRO 135 Ca 0.01 2.03 0.17 0.00 0.04 0.00 0.00 61.00 63.25 1t8d s PRO 135 Cb -0.20 -3.99 1.02 0.00 0.04 0.00 0.00 34.50 31.37 1t8d s PRO 135 CO 0.05 -0.97 1.47 -0.35 0.04 0.00 0.00 177.00 177.24 1t8d n PRO 136 N 7.26 0.70 -1.60 0.56 -0.04 -1.26 -4.79 135.00 135.83 1t8d n PRO 136 Ca 0.18 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.23 1t8d n PRO 136 Cb 0.44 -1.38 -0.03 0.00 -0.04 0.00 0.00 33.50 32.49 1t8d n PRO 136 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1t8d s ALA 137 N -2.00 2.30 0.00 0.55 0.00 -1.26 -4.59 121.76 116.76 1t8d s ALA 137 Ca 0.26 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.68 1t8d s ALA 137 Cb 0.12 -4.18 0.00 0.00 0.00 0.00 0.00 23.12 19.06 1t8d s ALA 137 CO 0.20 -3.45 0.00 -1.13 0.00 0.00 0.00 175.76 171.38 1t8d n SER 138 N 13.30 0.03 -4.67 0.00 3.41 -1.26 -5.07 113.62 119.37 1t8d n SER 138 Ca 0.32 -0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.51 1t8d n SER 138 Cb 0.49 0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 1t8d n SER 138 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1t8d s GLU 139 N -0.01 4.23 0.08 4.33 2.02 -1.26 -4.96 118.70 123.12 1t8d s GLU 139 Ca 0.00 1.92 -0.31 0.00 0.02 0.00 0.00 54.97 56.60 1t8d s GLU 139 Cb 0.00 -3.79 -0.08 0.00 0.10 0.00 0.00 34.13 30.36 1t8d s GLU 139 CO 0.00 -0.72 1.56 0.20 0.02 0.00 0.00 175.26 176.32 1t8d s GLY 140 N 2.42 1.67 0.53 -1.39 0.00 -1.26 -4.98 107.32 104.31 1t8d s GLY 140 Ca 0.63 1.16 -0.20 0.00 0.00 0.00 0.00 44.72 46.31 1t8d s GLY 140 CO 0.23 2.70 1.13 -0.56 0.00 0.00 0.00 173.10 176.60 1t8d s SER 141 N 1.93 5.81 -1.00 1.64 0.01 -1.26 -4.97 113.70 115.85 1t8d s SER 141 Ca 0.70 2.19 -0.02 0.00 1.31 0.00 0.00 55.95 60.13 1t8d s SER 141 Cb -0.38 -2.58 0.31 0.00 0.21 0.00 0.00 66.02 63.57 1t8d s SER 141 CO 0.31 -1.16 1.45 0.00 0.41 0.00 0.00 173.24 174.25 1t8d n ALA 142 N -1.16 5.23 1.54 1.44 0.00 -1.26 -5.30 120.51 120.99 1t8d n ALA 142 Ca 0.11 -4.76 0.14 0.00 0.00 0.00 0.00 53.44 48.93 1t8d n ALA 142 Cb 0.50 -2.09 0.56 0.00 0.00 0.00 0.00 19.45 18.42 1t8d n ALA 142 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89