#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t8d s GLY 2 N 0.00 1.92 0.22 0.23 0.00 -1.26 -5.04 107.32 103.40 1t8d s GLY 2 Ca 0.00 0.12 -0.28 0.00 0.00 0.00 0.00 44.72 44.55 1t8d s GLY 2 CO 0.00 0.40 0.89 -1.36 0.00 0.00 0.00 173.10 173.03 1t8d s PHE 3 N -2.81 3.94 0.00 1.90 0.08 -1.26 -4.92 117.98 114.91 1t8d s PHE 3 Ca 0.58 1.82 0.00 0.00 0.12 0.00 0.00 56.93 59.46 1t8d s PHE 3 Cb -0.11 -2.91 0.00 0.00 -0.57 0.00 0.00 43.02 39.43 1t8d s PHE 3 CO 0.41 0.46 0.00 1.55 -0.10 0.00 0.00 175.22 177.54 1t8d n VAL 4 N 1.45 0.00 -1.91 -0.44 3.14 -1.26 -4.92 118.33 114.39 1t8d n VAL 4 Ca -0.03 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.93 1t8d n VAL 4 Cb 0.48 -0.11 -0.00 0.00 -1.06 0.00 0.00 33.84 33.15 1t8d n VAL 4 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1t8d n ASN 6 N 4.86 -1.03 0.14 0.00 2.85 -1.26 -4.93 115.26 115.88 1t8d n ASN 6 Ca 0.51 -1.97 0.12 0.00 -0.11 0.00 0.00 54.58 53.13 1t8d n ASN 6 Cb 0.36 0.34 0.51 0.00 1.24 0.00 0.00 39.78 42.23 1t8d n ASN 6 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 1t8d n THR 7 N -0.19 0.87 -3.56 -0.44 5.66 -1.26 -4.23 114.28 111.12 1t8d n THR 7 Ca -0.26 0.32 -0.41 0.00 -3.05 0.00 0.00 64.05 60.66 1t8d n THR 7 Cb 0.71 -1.27 -0.07 0.00 -1.55 0.00 0.00 70.33 68.14 1t8d n THR 7 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1t8d n PRO 9 N 4.18 0.00 -3.54 0.00 -0.04 -1.26 -4.71 135.00 129.62 1t8d n PRO 9 Ca 0.03 0.09 -0.36 0.00 -0.04 0.00 0.00 63.50 63.21 1t8d n PRO 9 Cb 0.41 -0.42 -0.07 0.00 -0.04 0.00 0.00 33.50 33.38 1t8d n PRO 9 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1t8d s GLU 10 N -0.39 4.25 0.00 0.54 2.56 -1.26 -4.67 118.70 119.73 1t8d s GLU 10 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.97 55.05 1t8d s GLU 10 Cb 0.00 -3.42 0.00 0.00 2.00 0.00 0.00 34.13 32.71 1t8d s GLU 10 CO 0.00 0.24 0.00 1.63 -0.56 0.00 0.00 175.26 176.57 1t8d n LYS 11 N 3.57 0.00 -1.10 4.30 5.02 -1.26 -4.86 118.16 123.83 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 0.44 -4.24 2.13 8.01 -1.26 -4.53 117.44 117.99 1t8d n TRP 12 Ca 0.00 0.78 -0.24 0.00 -1.31 0.00 0.00 57.50 56.73 1t8d n TRP 12 Cb 0.00 -1.54 -0.17 0.00 -2.01 0.00 0.00 31.31 27.60 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 -0.03 0.89 0.11 -0.99 1.01 0.13 -4.14 121.20 118.18 1t8d s ILE 13 Ca 0.66 -0.29 0.03 0.00 0.00 0.00 0.00 60.65 61.06 1t8d s ILE 13 Cb -0.93 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.63 1t8d s ILE 13 CO 0.42 0.32 0.12 0.21 0.00 0.00 0.00 174.94 176.01 1t8d s ASN 14 N 1.10 5.66 0.00 3.58 3.84 -1.26 0.88 114.94 128.73 1t8d s ASN 14 Ca -0.07 -0.01 0.00 0.00 0.21 0.00 0.00 52.86 52.99 1t8d s ASN 14 Cb -0.14 -1.54 0.00 0.00 -0.55 0.00 0.00 41.25 39.01 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 0.13 0.00 -0.22 0.43 3.72 0.12 -4.96 117.46 116.69 1t8d n PHE 15 Ca -0.08 0.00 0.03 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 39.20 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 0.20 0.00 -1.08 -0.00 -2.04 -3.40 115.11 108.80 1t8d h GLN 16 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1t8d h GLN 16 Cb 0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 27.48 27.43 1t8d h GLN 16 CO 0.00 0.14 0.00 2.89 -0.00 0.00 0.00 178.83 181.86 1t8d n ARG 17 N -5.20 0.00 -4.29 0.06 1.85 -1.26 -4.96 116.66 102.87 1t8d n ARG 17 Ca 0.11 0.00 -0.25 0.00 -1.00 0.00 0.00 57.85 56.71 1t8d n ARG 17 Cb 0.39 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.72 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 0.23 2.89 -2.85 -1.26 -2.54 119.74 118.39 1t8d s LYS 18 Ca 0.00 -1.33 0.06 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 -0.08 0.00 0.10 0.00 0.00 175.35 175.78 1t8d s TYR 20 N -3.14 1.86 -0.22 0.00 1.51 0.25 -0.90 117.35 116.71 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 40.95 1t8d s TYR 20 CO 0.08 0.32 -0.11 0.71 -1.11 0.00 0.00 175.55 175.44 1t8d s TYR 21 N -1.82 2.97 -0.45 2.71 2.02 0.63 -0.69 117.35 122.73 1t8d s TYR 21 Ca 0.14 -1.54 0.08 0.00 -0.37 0.00 0.00 57.07 55.37 1t8d s TYR 21 Cb -0.07 -2.01 0.40 0.00 -0.40 0.00 0.00 41.96 39.88 1t8d s TYR 21 CO 0.06 -0.74 1.01 1.19 -1.57 0.00 0.00 175.55 175.51 1t8d n PHE 22 N 4.65 2.96 -2.30 2.71 3.72 -1.26 -1.52 117.46 126.43 1t8d n PHE 22 Ca -0.18 -3.35 -0.19 0.00 -0.05 0.00 0.00 57.45 53.68 1t8d n PHE 22 Cb 0.48 -0.26 0.11 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 -0.29 0.08 3.14 1.37 0.00 -0.44 -4.67 105.19 104.37 1t8d n GLY 23 Ca 0.31 -1.93 -0.20 0.00 0.00 0.00 0.00 46.02 44.21 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 -4.73 0.92 0.00 1.61 -2.85 -1.26 -0.23 119.74 113.19 1t8d s LYS 24 Ca 0.54 -0.74 0.00 0.00 -1.00 0.00 0.00 55.97 54.77 1t8d s LYS 24 Cb -0.03 -0.92 0.00 0.00 -2.06 0.00 0.00 37.83 34.82 1t8d s LYS 24 CO 0.36 0.23 0.00 0.41 0.10 0.00 0.00 175.35 176.45 1t8d n GLY 25 N 1.93 0.71 0.00 0.59 0.00 -0.57 -4.80 105.19 103.05 1t8d n GLY 25 Ca -0.18 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1t8d n GLY 25 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1t8d n THR 26 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -4.80 114.28 108.59 1t8d n THR 26 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1t8d n THR 26 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1t8d n THR 26 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1t8d n LYS 27 N 0.00 0.00 -0.37 -0.78 4.81 -1.26 -4.93 118.16 115.62 1t8d n LYS 27 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1t8d n LYS 27 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 1t8d n LYS 27 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1t8d n GLN 28 N -2.16 2.28 -0.01 1.64 6.02 -1.26 -4.64 117.38 119.26 1t8d n GLN 28 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 1t8d n GLN 28 Cb 0.00 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.19 1t8d n GLN 28 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 177.06 178.40 1t8d h TRP 29 N 0.19 0.10 -0.58 1.08 7.01 -1.99 -2.64 115.95 119.11 1t8d h TRP 29 Ca 0.00 -0.01 0.14 0.00 2.11 0.00 0.00 58.89 61.13 1t8d h TRP 29 Cb 0.00 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.00 1t8d h TRP 29 CO 0.00 0.27 0.41 -0.39 -2.79 0.00 0.00 178.44 175.94 1t8d h VAL 30 N -0.11 0.77 0.00 2.65 -1.51 -1.98 0.34 116.25 116.42 1t8d h VAL 30 Ca 0.02 -0.05 -0.09 0.00 -1.23 0.00 0.00 66.70 65.34 1t8d h VAL 30 Cb 0.22 0.61 -0.01 0.00 -2.13 0.00 0.00 31.29 29.97 1t8d h VAL 30 CO -0.00 0.03 -0.45 -0.74 -1.23 0.00 0.00 177.57 175.18 1t8d h HIS 31 N 0.15 0.00 -0.03 5.19 2.76 -1.87 -2.40 115.15 118.96 1t8d h HIS 31 Ca 0.28 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.43 1t8d h HIS 31 Cb 0.89 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.85 1t8d h HIS 31 CO -0.00 0.45 -0.04 0.00 -1.30 0.00 0.00 177.93 177.04 1t8d h ALA 32 N 1.55 0.04 -0.97 5.26 0.00 -0.09 -2.11 119.26 122.95 1t8d h ALA 32 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1t8d h ALA 32 Cb 0.90 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 1t8d h ALA 32 CO 0.06 -0.15 0.62 0.07 0.00 0.00 0.00 179.25 179.84 1t8d h ARG 33 N -0.44 1.30 -0.54 0.00 -0.00 -1.45 -0.90 114.38 112.35 1t8d h ARG 33 Ca 0.00 -0.10 -0.02 0.00 -0.00 0.00 0.00 59.98 59.87 1t8d h ARG 33 Cb 0.59 -0.28 -0.03 0.00 -0.00 0.00 0.00 29.97 30.25 1t8d h ARG 33 CO 0.01 0.88 0.26 -0.92 -0.00 0.00 0.00 179.97 180.20 1t8d h TYR 34 N 1.33 0.75 -0.52 4.08 5.03 -1.42 -1.14 116.97 125.07 1t8d h TYR 34 Ca 0.35 -0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.55 1t8d h TYR 34 Cb -0.11 -0.24 -0.02 0.00 1.55 0.00 0.00 36.73 37.91 1t8d h TYR 34 CO 0.00 0.55 -0.02 0.00 -1.32 0.00 0.00 178.16 177.37 1t8d h ALA 35 N 1.52 0.98 -0.18 1.82 0.00 -0.49 -2.63 119.26 120.28 1t8d h ALA 35 Ca 0.19 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1t8d h ALA 35 Cb 0.09 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1t8d h ALA 35 CO -0.02 0.62 0.03 0.00 0.00 0.00 0.00 179.25 179.87 1t8d h ASP 37 N 0.10 0.51 0.63 0.00 5.19 -1.14 0.55 116.42 122.27 1t8d h ASP 37 Ca 0.08 0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.45 1t8d h ASP 37 Cb 0.08 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.49 1t8d h ASP 37 CO -0.11 0.31 -0.25 -0.78 -3.12 0.00 0.00 179.24 175.28 1t8d h ASP 38 N 0.57 0.00 0.01 6.45 1.82 -0.92 -2.39 116.42 121.96 1t8d h ASP 38 Ca 0.32 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.96 1t8d h ASP 38 Cb 0.49 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.50 1t8d h ASP 38 CO -0.11 0.25 -0.70 0.23 -1.61 0.00 0.00 179.24 177.31 1t8d n MET 39 N -3.62 0.66 -3.11 0.28 2.81 0.59 -4.98 117.12 109.74 1t8d n MET 39 Ca -0.01 -0.54 -0.14 0.00 -1.81 0.00 0.00 57.70 55.20 1t8d n MET 39 Cb 0.38 -1.49 0.04 0.00 -0.71 0.00 0.00 33.22 31.45 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 -0.70 -4.53 0.00 0.03 1.02 0.16 -4.93 120.64 111.69 1t8d n GLU 40 Ca 0.07 0.48 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 1t8d n GLU 40 Cb 0.40 -4.45 0.00 0.00 -0.02 0.00 0.00 31.44 27.37 1t8d n GLU 40 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1t8d n GLY 41 N -1.37 2.07 3.41 0.62 0.00 -0.52 -4.74 105.19 104.66 1t8d n GLY 41 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 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 3.66 1.26 -0.37 1.61 2.00 0.25 -4.76 119.66 123.30 1t8d s GLN 42 Ca 0.00 -0.50 -0.29 0.00 -2.00 0.00 0.00 55.36 52.57 1t8d s GLN 42 Cb 0.00 0.58 0.01 0.00 0.80 0.00 0.00 33.01 34.40 1t8d s GLN 42 CO 0.00 -0.55 1.31 -1.17 -0.50 0.00 0.00 175.29 174.38 1t8d s LEU 43 N -2.76 3.74 0.00 3.68 2.96 -1.26 0.27 118.68 125.31 1t8d s LEU 43 Ca 0.01 0.96 0.00 0.00 -0.22 0.00 0.00 54.13 54.88 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 -0.13 -1.22 0.00 1.33 -1.32 0.00 0.00 176.35 175.01 1t8d n VAL 44 N 6.60 0.00 -2.80 1.68 0.24 -1.25 -3.22 118.33 119.58 1t8d n VAL 44 Ca 0.15 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.34 1t8d n VAL 44 Cb 0.47 0.00 0.05 0.00 -1.47 0.00 0.00 33.84 32.90 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 -0.27 -3.60 -4.60 -1.34 2.88 -1.26 -4.63 113.62 100.80 1t8d n SER 45 Ca 0.00 -0.44 -0.46 0.00 -1.33 0.00 0.00 58.87 56.64 1t8d n SER 45 Cb 0.00 -3.61 -0.02 0.00 -0.75 0.00 0.00 64.21 59.83 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 -2.86 1.56 -0.31 2.46 -0.00 -1.26 -4.83 119.36 114.12 1t8d n ILE 46 Ca -0.12 -0.39 0.00 0.00 -0.00 0.00 0.00 62.75 62.24 1t8d n ILE 46 Cb 0.60 -1.04 0.00 0.00 -0.00 0.00 0.00 39.64 39.20 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 0.78 0.00 -4.34 4.28 1.44 -1.26 -4.88 115.22 111.25 1t8d n HIS 47 Ca 0.11 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.49 1t8d n HIS 47 Cb 0.30 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.25 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 -0.18 3.19 0.56 4.39 0.15 -1.26 -4.87 113.70 115.69 1t8d s SER 48 Ca 0.00 -0.61 0.36 0.00 0.70 0.00 0.00 55.95 56.39 1t8d s SER 48 Cb 0.00 -1.48 1.47 0.00 -1.71 0.00 0.00 66.02 64.30 1t8d s SER 48 CO 0.00 0.03 1.72 -0.65 1.20 0.00 0.00 173.24 175.54 1t8d h PRO 49 N 7.69 0.00 -0.06 5.44 0.11 -1.99 0.52 132.00 143.71 1t8d h PRO 49 Ca -0.40 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.63 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 -0.28 1.49 -0.21 0.00 0.00 178.00 179.61 1t8d h GLU 50 N 0.00 0.30 -0.26 1.05 4.81 -1.98 -1.94 114.58 116.56 1t8d h GLU 50 Ca 0.54 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.52 1t8d h GLU 50 Cb 2.37 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 31.78 1t8d h GLU 50 CO -0.01 0.88 0.11 0.93 -0.73 0.00 0.00 179.01 180.19 1t8d h GLU 51 N -0.21 0.38 -0.82 1.92 4.39 -0.44 0.58 114.58 120.37 1t8d h GLU 51 Ca -0.02 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.63 1t8d h GLU 51 Cb 0.92 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.47 1t8d h GLU 51 CO 0.06 0.40 0.54 -0.56 -1.16 0.00 0.00 179.01 178.29 1t8d h GLN 52 N 0.27 1.07 -0.25 2.33 -0.00 -1.20 -0.97 115.11 116.36 1t8d h GLN 52 Ca 0.09 -0.06 -0.11 0.00 -0.00 0.00 0.00 58.65 58.56 1t8d h GLN 52 Cb 0.16 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.48 27.39 1t8d h GLN 52 CO -0.01 0.71 -0.33 0.22 -0.00 0.00 0.00 178.83 179.43 1t8d h ASP 53 N 1.10 0.54 0.15 0.06 3.58 -1.03 0.62 116.42 121.45 1t8d h ASP 53 Ca 0.30 -0.21 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 1t8d h ASP 53 Cb -0.12 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.79 1t8d h ASP 53 CO -0.07 0.83 -0.07 -0.26 -2.88 0.00 0.00 179.24 176.79 1t8d h PHE 54 N 0.45 -0.19 -0.08 0.28 0.04 0.13 0.17 116.94 117.75 1t8d h PHE 54 Ca 0.05 -0.00 -0.21 0.00 2.80 0.00 0.00 57.97 60.61 1t8d h PHE 54 Cb 0.79 0.06 0.00 0.00 2.20 0.00 0.00 35.95 39.00 1t8d h PHE 54 CO 0.03 -0.12 -0.80 1.37 -0.60 0.00 0.00 178.31 178.19 1t8d h LEU 55 N -0.21 0.65 -1.13 1.54 8.10 -1.20 -1.43 115.31 121.64 1t8d h LEU 55 Ca -0.02 -0.45 0.01 0.00 0.11 0.00 0.00 57.88 57.53 1t8d h LEU 55 Cb 0.16 -0.19 -0.04 0.00 -0.44 0.00 0.00 40.66 40.14 1t8d h LEU 55 CO 0.03 1.22 0.59 0.74 -4.11 0.00 0.00 178.44 176.91 1t8d h THR 56 N 0.35 1.23 -0.04 0.15 2.02 -0.71 0.67 112.91 116.58 1t8d h THR 56 Ca -0.05 -0.41 -0.20 0.00 0.77 0.00 0.00 66.41 66.51 1t8d h THR 56 Cb 1.41 -0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1t8d h THR 56 CO 0.15 0.22 -0.82 0.50 0.37 0.00 0.00 175.52 175.93 1t8d h LYS 57 N 1.20 0.38 0.00 6.66 1.63 -0.60 -3.00 116.57 122.85 1t8d h LYS 57 Ca 0.33 -0.36 -0.06 0.00 -0.85 0.00 0.00 60.65 59.71 1t8d h LYS 57 Cb -0.14 0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 31.57 1t8d h LYS 57 CO -0.07 1.02 -0.28 1.25 -3.45 0.00 0.00 179.45 177.91 1t8d h HIS 58 N 0.24 0.00 -2.99 1.91 2.76 -0.10 -3.44 115.15 113.53 1t8d h HIS 58 Ca -0.05 0.00 -0.52 0.00 -2.20 0.00 0.00 60.37 57.60 1t8d h HIS 58 Cb 1.43 0.00 0.07 0.00 1.55 0.00 0.00 27.41 30.46 1t8d h HIS 58 CO 0.05 0.28 0.94 0.00 -1.30 0.00 0.00 177.93 177.90 1t8d s ALA 59 N -3.67 3.84 0.85 5.26 0.00 0.22 -5.01 121.76 123.26 1t8d s ALA 59 Ca 0.00 1.56 0.00 0.00 0.00 0.00 0.00 51.96 53.52 1t8d s ALA 59 Cb 0.11 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1t8d s ALA 59 CO 0.66 -0.93 0.00 0.45 0.00 0.00 0.00 175.76 175.93 1t8d n SER 60 N 3.15 0.00 0.16 0.00 2.88 -1.26 -4.78 113.62 113.77 1t8d n SER 60 Ca 0.12 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.84 1t8d n SER 60 Cb 0.37 0.00 0.79 0.00 -0.75 0.00 0.00 64.21 64.62 1t8d n SER 60 CO 0.00 0.00 0.00 1.12 -1.23 0.00 0.00 175.04 174.93 1t8d h HIS 61 N 0.00 0.00 -2.86 0.66 2.07 -2.00 -3.41 115.15 109.61 1t8d h HIS 61 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1t8d h HIS 61 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1t8d h HIS 61 CO 0.00 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 175.11 1t8d n THR 62 N -3.79 0.00 -3.03 6.12 -2.24 -1.26 -5.08 114.28 105.00 1t8d n THR 62 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1t8d n THR 62 Cb 0.43 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.44 1t8d n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1t8d n GLY 63 N 5.00 4.93 3.29 3.38 0.00 -1.26 -4.85 105.19 115.69 1t8d n GLY 63 Ca 0.00 -2.09 -0.16 0.00 0.00 0.00 0.00 46.02 43.77 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 -0.18 2.12 -0.13 1.61 1.04 -1.23 -3.67 113.70 113.26 1t8d s SER 64 Ca 0.00 -1.03 -0.04 0.00 0.48 0.00 0.00 55.95 55.36 1t8d s SER 64 Cb 0.00 -0.06 -0.03 0.00 0.10 0.00 0.00 66.02 66.02 1t8d s SER 64 CO 0.00 -0.27 0.02 0.26 0.98 0.00 0.00 173.24 174.22 1t8d s TRP 65 N -3.18 3.18 0.38 5.02 0.51 -1.24 -3.16 118.94 120.45 1t8d s TRP 65 Ca 0.20 0.07 0.08 0.00 -2.12 0.00 0.00 56.10 54.33 1t8d s TRP 65 Cb 0.01 -1.92 -0.06 0.00 -0.81 0.00 0.00 33.47 30.70 1t8d s TRP 65 CO 0.04 0.28 0.08 0.96 -0.51 0.00 0.00 176.95 177.80 1t8d s ILE 66 N -0.25 2.42 -0.35 2.03 -4.36 -1.25 -4.21 121.20 115.23 1t8d s ILE 66 Ca 0.06 -1.86 -0.05 0.00 -0.26 0.00 0.00 60.65 58.54 1t8d s ILE 66 Cb -0.12 -2.91 -0.15 0.00 1.25 0.00 0.00 42.46 40.52 1t8d s ILE 66 CO 0.02 -0.09 2.64 0.61 0.24 0.00 0.00 174.94 178.36 1t8d n GLY 67 N -1.07 2.76 3.07 6.27 0.00 -1.20 -4.67 105.19 110.35 1t8d n GLY 67 Ca -0.03 -0.93 -0.28 0.00 0.00 0.00 0.00 46.02 44.78 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 1.75 -0.04 0.99 1.98 -1.26 -1.74 118.68 120.39 1t8d s LEU 68 Ca 0.49 -0.42 -0.02 0.00 -2.89 0.00 0.00 54.13 51.29 1t8d s LEU 68 Cb 0.20 -1.07 0.03 0.00 0.66 0.00 0.00 46.19 46.00 1t8d s LEU 68 CO -0.01 0.04 0.04 -0.60 -1.89 0.00 0.00 176.35 173.93 1t8d s ARG 69 N 0.85 0.05 0.63 1.98 3.00 0.12 -3.66 118.95 121.92 1t8d s ARG 69 Ca -0.10 0.30 -0.07 0.00 -1.00 0.00 0.00 55.73 54.86 1t8d s ARG 69 Cb -0.15 -0.54 0.01 0.00 0.00 0.00 0.00 34.95 34.27 1t8d s ARG 69 CO 0.01 -0.30 0.96 0.54 0.00 0.00 0.00 175.30 176.51 1t8d s ASN 70 N 1.95 5.48 -0.89 -2.12 4.22 -0.51 -0.95 114.94 122.12 1t8d s ASN 70 Ca 0.02 0.79 -0.08 0.00 -2.14 0.00 0.00 52.86 51.46 1t8d s ASN 70 Cb -0.12 -1.71 -0.14 0.00 1.28 0.00 0.00 41.25 40.56 1t8d s ASN 70 CO -0.03 -1.18 2.97 0.18 -2.04 0.00 0.00 177.10 176.99 1t8d n LEU 71 N -2.72 6.62 -2.90 3.54 4.77 -0.54 -4.66 117.00 121.11 1t8d n LEU 71 Ca 0.05 -3.58 -0.10 0.00 -0.03 0.00 0.00 56.01 52.36 1t8d n LEU 71 Cb 0.58 -1.38 0.01 0.00 -2.33 0.00 0.00 43.42 40.30 1t8d n LEU 71 CO 0.54 1.62 -0.04 0.47 -1.33 0.00 0.00 177.39 178.65 1t8d n ASP 72 N 3.27 -7.75 -3.64 -1.43 8.00 -1.26 -3.16 116.55 110.57 1t8d n ASP 72 Ca 0.58 0.58 -0.27 0.00 0.71 0.00 0.00 54.79 56.39 1t8d n ASP 72 Cb 0.44 -5.04 -0.05 0.00 -0.02 0.00 0.00 41.12 36.46 1t8d n ASP 72 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1t8d n LEU 73 N -0.16 -0.51 0.08 0.64 -0.00 -0.68 -4.76 117.00 111.60 1t8d n LEU 73 Ca 0.09 -0.64 0.11 0.00 -0.00 0.00 0.00 56.01 55.58 1t8d n LEU 73 Cb 0.43 -1.27 0.01 0.00 -0.00 0.00 0.00 43.42 42.59 1t8d n LEU 73 CO 0.48 0.06 0.01 0.29 -0.00 0.00 0.00 177.39 178.23 1t8d n LYS 74 N -3.25 0.53 0.00 1.47 5.02 -1.19 -4.85 118.16 115.89 1t8d n LYS 74 Ca 0.07 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 1t8d n LYS 74 Cb 0.42 -1.76 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 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 1.23 2.13 3.57 0.72 0.00 -1.26 -5.02 105.19 106.55 1t8d n GLY 75 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.63 3.88 -0.22 1.61 2.02 -1.26 -5.03 118.70 119.06 1t8d s GLU 76 Ca 0.00 -0.38 -0.12 0.00 0.02 0.00 0.00 54.97 54.50 1t8d s GLU 76 Cb 0.00 -3.35 -0.05 0.00 0.10 0.00 0.00 34.13 30.83 1t8d s GLU 76 CO 0.00 0.03 0.20 -0.06 0.02 0.00 0.00 175.26 175.45 1t8d s PHE 77 N 1.06 3.35 -0.00 1.61 0.08 -1.26 -1.47 117.98 121.34 1t8d s PHE 77 Ca 0.05 0.34 0.07 0.00 0.12 0.00 0.00 56.93 57.51 1t8d s PHE 77 Cb -0.14 -2.29 -0.02 0.00 -0.57 0.00 0.00 43.02 40.00 1t8d s PHE 77 CO 0.04 0.11 -0.23 0.42 -0.10 0.00 0.00 175.22 175.45 1t8d s ILE 78 N 0.91 1.84 0.47 0.64 1.01 -0.13 -2.97 121.20 122.98 1t8d s ILE 78 Ca 0.10 -1.05 -0.21 0.00 0.00 0.00 0.00 60.65 59.48 1t8d s ILE 78 Cb -0.13 -1.54 -0.08 0.00 0.01 0.00 0.00 42.46 40.71 1t8d s ILE 78 CO 0.04 0.47 1.05 0.26 0.00 0.00 0.00 174.94 176.76 1t8d s TRP 79 N -0.60 3.04 0.60 3.97 0.52 -0.74 0.14 118.94 125.88 1t8d s TRP 79 Ca 0.09 1.59 0.31 0.00 0.02 0.00 0.00 56.10 58.11 1t8d s TRP 79 Cb -0.09 -3.11 1.87 0.00 -1.15 0.00 0.00 33.47 30.98 1t8d s TRP 79 CO -0.00 -0.86 2.24 -0.24 0.02 0.00 0.00 176.95 178.12 1t8d h VAL 80 N 1.72 0.46 0.00 4.03 3.04 -1.66 0.26 116.25 124.10 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 0.97 0.00 0.00 -2.01 0.00 0.00 31.29 31.48 1t8d h VAL 80 CO 0.60 0.00 0.00 -0.67 -1.01 0.00 0.00 177.57 176.49 1t8d n ASP 81 N -3.75 0.00 -0.18 3.17 2.03 -1.26 -4.86 116.55 111.70 1t8d n ASP 81 Ca -0.02 -0.89 0.00 0.00 0.52 0.00 0.00 54.79 54.40 1t8d n ASP 81 Cb 0.12 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.52 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 0.76 0.65 2.76 0.27 0.00 0.90 -5.06 105.19 105.47 1t8d n GLY 82 Ca 0.21 -0.77 -0.25 0.00 0.00 0.00 0.00 46.02 45.21 1t8d n GLY 82 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1t8d s SER 83 N -2.95 2.23 0.49 1.61 0.15 -1.21 -4.92 113.70 109.10 1t8d s SER 83 Ca 0.00 -0.44 -0.21 0.00 0.70 0.00 0.00 55.95 56.01 1t8d s SER 83 Cb 0.00 -0.53 -0.10 0.00 -1.71 0.00 0.00 66.02 63.68 1t8d s SER 83 CO 0.00 -0.24 0.60 0.00 1.20 0.00 0.00 173.24 174.79 1t8d n HIS 84 N 5.09 -0.37 -1.21 3.44 1.44 -1.26 -1.78 115.22 120.57 1t8d n HIS 84 Ca -0.08 0.52 -0.36 0.00 -2.01 0.00 0.00 57.72 55.79 1t8d n HIS 84 Cb 0.49 -2.00 0.08 0.00 0.12 0.00 0.00 29.99 28.67 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 -1.20 1.69 0.06 0.61 0.31 -1.16 -4.76 118.33 113.88 1t8d n VAL 85 Ca 0.11 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1t8d n VAL 85 Cb 0.43 -0.78 0.00 0.00 -0.91 0.00 0.00 33.84 32.58 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 -0.67 0.65 -0.10 4.52 9.92 -1.26 -4.94 116.55 124.66 1t8d n ASP 86 Ca 0.10 0.19 -0.20 0.00 -0.53 0.00 0.00 54.79 54.36 1t8d n ASP 86 Cb 0.50 -0.12 -0.10 0.00 -0.64 0.00 0.00 41.12 40.76 1t8d n ASP 86 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1t8d n TYR 87 N -3.39 0.93 -1.51 1.24 4.02 -1.26 -5.10 117.16 112.09 1t8d n TYR 87 Ca 0.00 0.40 0.02 0.00 -0.01 0.00 0.00 57.90 58.31 1t8d n TYR 87 Cb 0.07 -1.04 -0.01 0.00 -0.02 0.00 0.00 39.34 38.33 1t8d n TYR 87 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1t8d n SER 88 N -4.45 -8.13 0.00 7.72 7.64 -1.26 -4.98 113.62 110.16 1t8d n SER 88 Ca -0.30 1.78 0.00 0.00 1.01 0.00 0.00 58.87 61.36 1t8d n SER 88 Cb 0.63 -4.88 0.00 0.00 -1.01 0.00 0.00 64.21 58.96 1t8d n SER 88 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1t8d n ASN 89 N -2.74 0.41 -4.24 6.43 3.02 -1.26 -5.06 115.26 111.81 1t8d n ASN 89 Ca -0.01 -0.09 -0.57 0.00 -0.03 0.00 0.00 54.58 53.88 1t8d n ASN 89 Cb 0.49 0.25 -0.12 0.00 -0.61 0.00 0.00 39.78 39.79 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 -0.29 1.07 -1.72 3.10 4.27 -1.25 -3.76 117.44 118.85 1t8d n TRP 90 Ca 0.00 0.71 -0.67 0.00 -3.89 0.00 0.00 57.50 53.65 1t8d n TRP 90 Cb 0.00 -2.28 -0.10 0.00 -1.36 0.00 0.00 31.31 27.57 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 7.81 -1.47 -1.74 -1.67 0.00 0.34 -4.86 120.51 118.92 1t8d n ALA 91 Ca 0.56 0.50 -0.37 0.00 0.00 0.00 0.00 53.44 54.13 1t8d n ALA 91 Cb -0.03 -1.90 0.06 0.00 0.00 0.00 0.00 19.45 17.58 1t8d n ALA 91 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1t8d s PRO 92 N 2.81 2.65 0.00 0.00 0.02 -1.26 -2.83 135.00 136.40 1t8d s PRO 92 Ca 1.03 2.03 0.00 0.00 0.02 0.00 0.00 61.00 64.09 1t8d s PRO 92 Cb -1.48 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 31.17 1t8d s PRO 92 CO 0.80 -1.51 0.00 0.41 -0.33 0.00 0.00 177.00 176.37 1t8d n GLY 93 N 0.83 2.88 2.77 0.52 0.00 -1.26 -4.67 105.19 106.26 1t8d n GLY 93 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.17 1t8d n GLY 93 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1t8d n GLU 94 N -0.64 -3.22 0.00 1.61 1.02 -1.13 -4.83 120.64 113.45 1t8d n GLU 94 Ca 0.00 2.62 0.07 0.00 -0.02 0.00 0.00 57.16 59.83 1t8d n GLU 94 Cb 0.00 -4.88 0.39 0.00 -0.02 0.00 0.00 31.44 26.93 1t8d n GLU 94 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1t8d n PRO 95 N 0.84 0.26 -1.90 3.49 -0.04 -1.26 -4.81 135.00 131.58 1t8d n PRO 95 Ca -0.02 0.12 -0.38 0.00 -0.04 0.00 0.00 63.50 63.18 1t8d n PRO 95 Cb 0.09 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.08 1t8d n PRO 95 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1t8d s THR 96 N -2.47 2.33 0.32 0.52 2.01 -1.26 -4.90 115.64 112.19 1t8d s THR 96 Ca 0.16 0.24 0.23 0.00 0.31 0.00 0.00 61.69 62.63 1t8d s THR 96 Cb 0.10 -3.12 0.23 0.00 0.01 0.00 0.00 72.50 69.72 1t8d s THR 96 CO 0.22 -0.01 1.94 -1.28 -0.69 0.00 0.00 174.62 174.80 1t8d h SER 97 N 1.51 0.00 -3.64 3.53 0.87 -2.01 -3.39 113.55 110.42 1t8d h SER 97 Ca -0.51 0.00 -0.62 0.00 -1.23 0.00 0.00 61.79 59.43 1t8d h SER 97 Cb 1.29 0.00 -0.38 0.00 -0.44 0.00 0.00 62.40 62.87 1t8d h SER 97 CO 0.58 0.21 -0.78 -0.13 -0.53 0.00 0.00 176.83 176.18 1t8d s ARG 98 N -4.03 1.62 -1.13 2.24 0.52 -1.26 -5.05 118.95 111.86 1t8d s ARG 98 Ca -0.02 -1.15 -0.12 0.00 -0.52 0.00 0.00 55.73 53.92 1t8d s ARG 98 Cb 0.13 -2.66 0.23 0.00 0.52 0.00 0.00 34.95 33.16 1t8d s ARG 98 CO 0.63 -0.67 1.22 -1.12 0.02 0.00 0.00 175.30 175.39 1t8d s SER 99 N 1.31 7.16 0.09 0.23 0.01 -1.26 -4.35 113.70 116.89 1t8d s SER 99 Ca -0.03 -3.24 0.00 0.00 1.31 0.00 0.00 55.95 53.99 1t8d s SER 99 Cb -0.19 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.75 1t8d s SER 99 CO -0.08 -0.52 0.00 1.67 0.41 0.00 0.00 173.24 174.72 1t8d n GLN 100 N 4.13 0.00 -2.33 12.44 7.27 -1.26 -5.11 117.38 132.52 1t8d n GLN 100 Ca 0.28 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.93 1t8d n GLN 100 Cb 0.41 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.04 1t8d n GLN 100 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 1t8d s GLY 101 N -2.00 1.89 -0.30 1.69 0.00 -1.26 -4.91 107.32 102.44 1t8d s GLY 101 Ca 0.00 0.71 -0.09 0.00 0.00 0.00 0.00 44.72 45.35 1t8d s GLY 101 CO 0.00 2.43 0.79 -1.83 0.00 0.00 0.00 173.10 174.49 1t8d s GLU 102 N 2.61 0.43 0.00 2.90 -1.05 -1.26 -1.24 118.70 121.09 1t8d s GLU 102 Ca 0.60 0.91 0.00 0.00 -0.15 0.00 0.00 54.97 56.33 1t8d s GLU 102 Cb -0.27 0.53 0.00 0.00 -0.44 0.00 0.00 34.13 33.94 1t8d s GLU 102 CO 0.23 -0.32 0.00 -3.47 0.95 0.00 0.00 175.26 172.64 1t8d n ASP 103 N 5.34 0.03 -3.73 0.83 2.03 -1.23 -1.69 116.55 118.13 1t8d n ASP 103 Ca -0.06 -0.18 -0.10 0.00 0.52 0.00 0.00 54.79 54.97 1t8d n ASP 103 Cb 0.51 0.36 -0.03 0.00 -0.72 0.00 0.00 41.12 41.24 1t8d n ASP 103 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1t8d s VAL 105 N -3.87 2.38 0.34 0.00 1.01 -1.24 -2.28 120.40 116.74 1t8d s VAL 105 Ca 0.09 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.23 1t8d s VAL 105 Cb -0.01 -1.94 -0.07 0.00 0.00 0.00 0.00 36.38 34.36 1t8d s VAL 105 CO -0.03 0.55 -0.00 0.00 0.00 0.00 0.00 175.10 175.62 1t8d s MET 106 N 0.36 1.75 -0.09 2.72 0.23 -0.87 -3.82 119.30 119.58 1t8d s MET 106 Ca -0.16 -1.95 0.03 0.00 -1.03 0.00 0.00 55.69 52.58 1t8d s MET 106 Cb -0.17 -1.28 0.00 0.00 -1.53 0.00 0.00 34.83 31.85 1t8d s MET 106 CO 0.08 -0.05 -0.20 0.00 -2.03 0.00 0.00 175.02 172.81 1t8d s MET 107 N -3.76 2.56 0.00 3.16 0.23 -1.19 0.68 119.30 120.98 1t8d s MET 107 Ca 0.34 -0.72 0.00 0.00 -1.03 0.00 0.00 55.69 54.28 1t8d s MET 107 Cb 0.07 -1.98 0.00 0.00 -1.53 0.00 0.00 34.83 31.39 1t8d s MET 107 CO 0.16 0.13 0.00 -2.13 -2.03 0.00 0.00 175.02 171.15 1t8d n ARG 108 N 3.61 0.00 0.00 3.16 0.63 -1.13 -3.53 116.66 119.41 1t8d n ARG 108 Ca -0.20 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.73 1t8d n ARG 108 Cb 0.53 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.44 1t8d n ARG 108 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1t8d n GLY 109 N -0.15 1.96 0.01 5.14 0.00 -1.26 -4.68 105.19 106.21 1t8d n GLY 109 Ca 0.00 -0.68 0.07 0.00 0.00 0.00 0.00 46.02 45.41 1t8d n GLY 109 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1t8d n SER 110 N 0.00 1.65 0.00 1.61 7.64 -1.26 -4.98 113.62 118.28 1t8d n SER 110 Ca 0.00 -0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.87 1t8d n SER 110 Cb 0.00 1.66 0.00 0.00 -1.01 0.00 0.00 64.21 64.86 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 1.67 0.75 0.00 0.23 0.00 -1.26 -5.12 105.19 101.46 1t8d n GLY 111 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 3.82 -4.07 1.61 -4.01 -1.26 -4.65 116.66 108.09 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 1.68 2.94 -0.05 2.89 0.52 -1.25 -2.82 118.94 122.86 1t8d s TRP 113 Ca 0.00 -0.20 -0.02 0.00 0.02 0.00 0.00 56.10 55.89 1t8d s TRP 113 Cb 0.00 -1.48 0.03 0.00 -1.15 0.00 0.00 33.47 30.87 1t8d s TRP 113 CO 0.00 0.44 0.06 -0.80 0.02 0.00 0.00 176.95 176.67 1t8d s ASN 114 N -3.85 1.22 -0.46 2.95 0.01 0.21 -0.51 114.94 114.52 1t8d s ASN 114 Ca 0.35 0.04 -0.22 0.00 -0.71 0.00 0.00 52.86 52.32 1t8d s ASN 114 Cb -0.07 -0.15 0.03 0.00 0.41 0.00 0.00 41.25 41.47 1t8d s ASN 114 CO 0.24 -0.26 0.74 -0.62 -1.51 0.00 0.00 177.10 175.69 1t8d s ASP 115 N 2.17 6.36 0.16 -1.22 2.15 -1.26 -2.06 116.67 122.96 1t8d s ASP 115 Ca 0.05 -0.26 -0.20 0.00 0.43 0.00 0.00 52.55 52.57 1t8d s ASP 115 Cb -0.12 -2.36 0.05 0.00 -0.30 0.00 0.00 42.92 40.19 1t8d s ASP 115 CO -0.03 -0.89 0.52 0.00 -0.17 0.00 0.00 175.17 174.60 1t8d s ALA 116 N 3.13 -1.27 0.88 3.66 0.00 -0.97 -4.85 121.76 122.35 1t8d s ALA 116 Ca 0.26 0.18 -0.14 0.00 0.00 0.00 0.00 51.96 52.27 1t8d s ALA 116 Cb -0.13 0.82 0.01 0.00 0.00 0.00 0.00 23.12 23.81 1t8d s ALA 116 CO 0.20 -0.74 0.41 0.34 0.00 0.00 0.00 175.76 175.97 1t8d n PHE 117 N -0.32 -1.37 -1.66 0.00 7.35 -0.37 -3.06 117.46 118.02 1t8d n PHE 117 Ca -0.15 0.26 -0.42 0.00 -0.76 0.00 0.00 57.45 56.38 1t8d n PHE 117 Cb 0.64 -1.81 -0.01 0.00 0.35 0.00 0.00 39.48 38.65 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 6.06 2.28 -2.53 0.00 8.00 -1.26 -4.93 116.55 124.16 1t8d n ASP 119 Ca 0.53 -2.24 -0.04 0.00 0.71 0.00 0.00 54.79 53.75 1t8d n ASP 119 Cb 0.38 -0.49 -0.04 0.00 -0.02 0.00 0.00 41.12 40.95 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 0.19 -4.85 -0.05 -1.24 0.00 -1.26 -5.01 116.66 104.44 1t8d n ARG 120 Ca 0.09 3.60 0.00 0.00 -0.00 0.00 0.00 57.85 61.54 1t8d n ARG 120 Cb 0.49 -5.02 0.00 0.00 0.00 0.00 0.00 32.46 27.93 1t8d n ARG 120 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1t8d n LYS 121 N 1.77 0.00 -4.68 -0.14 5.02 -1.26 -5.12 118.16 113.75 1t8d n LYS 121 Ca -0.31 -0.33 -0.31 0.00 -2.02 0.00 0.00 58.31 55.35 1t8d n LYS 121 Cb 0.48 -0.30 -0.08 0.00 -0.02 0.00 0.00 35.03 35.11 1t8d n LYS 121 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1t8d s LEU 122 N 0.00 2.18 0.00 -0.35 1.02 -1.26 -4.49 118.68 115.77 1t8d s LEU 122 Ca 0.00 -1.67 0.00 0.00 0.02 0.00 0.00 54.13 52.48 1t8d s LEU 122 Cb 0.00 -0.50 0.00 0.00 0.02 0.00 0.00 46.19 45.71 1t8d s LEU 122 CO 0.00 -0.89 0.03 0.61 0.02 0.00 0.00 176.35 176.12 1t8d n GLY 123 N -1.15 0.76 3.10 -3.19 0.00 -1.26 -4.89 105.19 98.55 1t8d n GLY 123 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 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 1.63 -0.14 4.61 0.00 -1.24 -1.52 121.76 125.10 1t8d s ALA 124 Ca 0.00 -0.64 -0.09 0.00 0.00 0.00 0.00 51.96 51.23 1t8d s ALA 124 Cb 0.00 -0.67 -0.04 0.00 0.00 0.00 0.00 23.12 22.40 1t8d s ALA 124 CO 0.00 0.18 0.16 1.67 0.00 0.00 0.00 175.76 177.77 1t8d s TRP 125 N 0.55 3.54 -0.05 0.00 1.48 0.68 -3.71 118.94 121.42 1t8d s TRP 125 Ca -0.16 0.50 0.01 0.00 -1.06 0.00 0.00 56.10 55.39 1t8d s TRP 125 Cb -0.17 -2.06 0.02 0.00 -1.16 0.00 0.00 33.47 30.10 1t8d s TRP 125 CO 0.06 0.55 -0.07 0.54 -4.06 0.00 0.00 176.95 173.97 1t8d s VAL 126 N -0.48 0.73 0.12 -0.66 0.11 -1.24 -1.33 120.40 117.64 1t8d s VAL 126 Ca 0.13 -0.22 -0.02 0.00 -2.93 0.00 0.00 61.98 58.94 1t8d s VAL 126 Cb -0.12 -0.72 -0.04 0.00 -1.53 0.00 0.00 36.38 33.97 1t8d s VAL 126 CO 0.03 0.27 0.07 0.00 -3.33 0.00 0.00 175.10 172.13 1t8d s ASP 128 N -3.01 2.50 0.02 0.00 -4.77 0.14 0.23 116.67 111.78 1t8d s ASP 128 Ca 0.19 -0.46 -0.22 0.00 -3.30 0.00 0.00 52.55 48.76 1t8d s ASP 128 Cb 0.07 -0.24 0.05 0.00 -1.09 0.00 0.00 42.92 41.71 1t8d s ASP 128 CO -0.01 0.21 0.49 -0.60 0.70 0.00 0.00 175.17 175.96 1t8d s ARG 129 N -0.88 0.95 0.31 2.11 3.52 -0.08 0.84 118.95 125.72 1t8d s ARG 129 Ca 0.08 -0.16 -0.29 0.00 -0.13 0.00 0.00 55.73 55.23 1t8d s ARG 129 Cb -0.09 0.43 -0.10 0.00 -1.56 0.00 0.00 34.95 33.64 1t8d s ARG 129 CO 0.01 -0.32 1.34 -0.51 -0.81 0.00 0.00 175.30 175.01 1t8d s LEU 130 N -1.71 4.41 0.00 -0.88 1.43 -1.26 0.28 118.68 120.95 1t8d s LEU 130 Ca -0.08 2.68 0.00 0.00 -1.03 0.00 0.00 54.13 55.70 1t8d s LEU 130 Cb -0.01 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.56 1t8d s LEU 130 CO 0.02 -0.58 0.00 0.00 0.23 0.00 0.00 176.35 176.01 1t8d n ALA 131 N 1.23 0.00 0.65 4.21 0.00 -1.05 -4.72 120.51 120.83 1t8d n ALA 131 Ca 0.02 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.57 1t8d n ALA 131 Cb 0.41 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.89 1t8d n ALA 131 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1t8d n THR 132 N -2.81 0.13 -3.16 0.00 -1.04 -1.26 -4.91 114.28 101.23 1t8d n THR 132 Ca 0.00 -0.20 -0.36 0.00 -2.04 0.00 0.00 64.05 61.45 1t8d n THR 132 Cb 0.00 0.29 -0.06 0.00 -1.82 0.00 0.00 70.33 68.74 1t8d n THR 132 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1t8d s THR 134 N -1.52 0.48 0.48 0.00 2.01 -1.26 -4.98 115.64 110.85 1t8d s THR 134 Ca 0.42 -1.34 -0.23 0.00 0.31 0.00 0.00 61.69 60.85 1t8d s THR 134 Cb -0.16 -1.37 -0.08 0.00 0.01 0.00 0.00 72.50 70.89 1t8d s THR 134 CO 0.20 -0.77 1.12 -2.65 -0.69 0.00 0.00 174.62 171.84 1t8d n PRO 135 N 4.73 1.47 -2.06 4.92 -0.02 -1.26 -4.87 135.00 137.91 1t8d n PRO 135 Ca -0.00 0.53 -0.39 0.00 -2.02 0.00 0.00 63.50 61.62 1t8d n PRO 135 Cb 0.40 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.61 1t8d n PRO 135 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1t8d s PRO 136 N -2.34 2.71 -0.43 0.52 0.04 -1.26 -4.94 135.00 129.30 1t8d s PRO 136 Ca 0.66 0.63 -0.28 0.00 0.04 0.00 0.00 61.00 62.05 1t8d s PRO 136 Cb -0.49 -4.36 -0.00 0.00 0.04 0.00 0.00 34.50 29.69 1t8d s PRO 136 CO 0.54 -2.63 1.56 0.00 0.04 0.00 0.00 177.00 176.51 1t8d s ALA 137 N 8.74 2.88 0.00 8.56 0.00 -1.26 -4.58 121.76 136.10 1t8d s ALA 137 Ca 0.67 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1t8d s ALA 137 Cb -0.13 -4.02 0.00 0.00 0.00 0.00 0.00 23.12 18.97 1t8d s ALA 137 CO 0.22 -2.67 0.00 -1.13 0.00 0.00 0.00 175.76 172.17 1t8d n SER 138 N 9.69 0.00 -3.42 0.00 3.41 -1.26 -5.02 113.62 117.01 1t8d n SER 138 Ca 0.18 -0.50 -0.25 0.00 -0.26 0.00 0.00 58.87 58.04 1t8d n SER 138 Cb 0.48 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.46 1t8d n SER 138 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1t8d n GLU 139 N 0.00 -5.25 -2.49 4.33 4.71 -1.26 -4.93 120.64 115.76 1t8d n GLU 139 Ca 0.00 0.72 -0.41 0.00 -0.01 0.00 0.00 57.16 57.46 1t8d n GLU 139 Cb 0.12 -5.59 -0.04 0.00 -1.01 0.00 0.00 31.44 24.92 1t8d n GLU 139 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1t8d s GLY 140 N -2.96 2.87 0.23 0.62 0.00 -1.26 -5.00 107.32 101.82 1t8d s GLY 140 Ca 0.47 0.85 -0.30 0.00 0.00 0.00 0.00 44.72 45.74 1t8d s GLY 140 CO 0.57 1.64 1.18 -0.56 0.00 0.00 0.00 173.10 175.93 1t8d s SER 141 N -0.26 7.12 0.04 1.64 0.01 -1.26 -4.95 113.70 116.04 1t8d s SER 141 Ca 0.49 2.29 -0.02 0.00 1.31 0.00 0.00 55.95 60.02 1t8d s SER 141 Cb -0.30 -2.62 -0.01 0.00 0.21 0.00 0.00 66.02 63.30 1t8d s SER 141 CO 0.36 -0.31 -0.03 0.00 0.41 0.00 0.00 173.24 173.67 1t8d n ALA 142 N 1.92 2.80 1.67 1.44 0.00 -1.26 -5.28 120.51 121.81 1t8d n ALA 142 Ca 0.02 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.51 1t8d n ALA 142 Cb 0.44 0.30 0.79 0.00 0.00 0.00 0.00 19.45 20.99 1t8d n ALA 142 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59