#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dze h PHE 1 N 0.00 0.45 -0.59 7.33 3.57 -2.05 -1.80 116.94 123.85 3dze h PHE 1 Ca 0.00 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.42 3dze h PHE 1 Cb 0.00 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 3dze h PHE 1 CO 0.00 0.36 0.09 -1.49 -2.23 0.00 0.00 178.31 175.04 3dze h TRP 2 N 0.41 1.00 -0.40 0.41 4.06 -2.05 0.44 115.95 119.83 3dze h TRP 2 Ca 0.12 -0.13 0.00 0.00 2.06 0.00 0.00 58.89 60.94 3dze h TRP 2 Cb 0.05 -0.28 -0.02 0.00 -1.00 0.00 0.00 29.16 27.91 3dze h TRP 2 CO -0.03 0.86 0.25 1.49 -3.56 0.00 0.00 178.44 177.45 3dze h GLU 3 N 0.90 0.53 -0.55 0.49 4.81 -1.96 -1.52 114.58 117.27 3dze h GLU 3 Ca 0.18 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3dze h GLU 3 Cb 0.40 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 3dze h GLU 3 CO 0.01 0.37 0.35 2.35 -0.73 0.00 0.00 179.01 181.35 3dze h TRP 4 N 0.53 0.71 -0.15 0.92 7.01 -0.84 -1.27 115.95 122.86 3dze h TRP 4 Ca 0.14 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.15 3dze h TRP 4 Cb -0.04 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 26.78 3dze h TRP 4 CO -0.04 0.47 0.09 1.25 -2.79 0.00 0.00 178.44 177.42 3dze h LEU 5 N 0.74 0.17 -0.89 0.65 5.85 -0.72 -0.19 115.31 120.94 3dze h LEU 5 Ca 0.20 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 3dze h LEU 5 Cb -0.05 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 3dze h LEU 5 CO -0.04 0.15 0.55 0.78 -0.34 0.00 0.00 178.44 179.54 3dze h ASN 6 N 0.18 1.05 -0.37 1.25 2.35 -1.11 -1.08 115.58 117.86 3dze h ASN 6 Ca 0.05 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3dze h ASN 6 Cb 0.00 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.09 3dze h ASN 6 CO -0.01 0.80 0.19 0.00 -1.65 0.00 0.00 177.43 176.76 3dze h ALA 7 N 1.30 0.47 0.00 -0.83 0.00 -0.69 -2.40 119.26 117.12 3dze h ALA 7 Ca 0.32 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 3dze h ALA 7 Cb -0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3dze h ALA 7 CO -0.06 0.02 -0.40 -0.39 0.00 0.00 0.00 179.25 178.42 3dze h VAL 8 N 0.46 0.87 -0.59 0.00 -1.51 -0.81 0.11 116.25 114.78 3dze h VAL 8 Ca 0.13 -1.64 -0.01 0.00 -1.23 0.00 0.00 66.70 63.94 3dze h VAL 8 Cb 0.09 2.01 -0.03 0.00 -2.13 0.00 0.00 31.29 31.24 3dze h VAL 8 CO -0.02 0.39 0.31 -0.26 -1.23 0.00 0.00 177.57 176.76 3dze h PHE 9 N 0.00 0.80 0.00 5.19 0.04 -1.02 -3.20 116.94 118.75 3dze h PHE 9 Ca -0.00 -0.01 -0.21 0.00 2.80 0.00 0.00 57.97 60.55 3dze h PHE 9 Cb 0.98 -0.26 -0.03 0.00 2.20 0.00 0.00 35.95 38.84 3dze h PHE 9 CO 0.00 0.57 -1.30 -0.91 -0.60 0.00 0.00 178.31 176.07 3dze h ASN 10 N 0.82 0.00 -3.46 2.17 4.21 -0.83 -3.46 115.58 115.04 3dze h ASN 10 Ca 0.21 0.00 -0.53 0.00 1.21 0.00 0.00 56.30 57.19 3dze h ASN 10 Cb 0.04 0.00 0.07 0.00 -1.12 0.00 0.00 38.32 37.32 3dze h ASN 10 CO -0.03 0.78 0.81 -0.75 -1.29 0.00 0.00 177.43 176.94 3dze s LYS 11 N -2.79 4.19 0.11 0.81 2.20 0.29 -3.60 119.74 120.96 3dze s LYS 11 Ca -0.02 2.44 -0.30 0.00 -0.36 0.00 0.00 55.97 57.73 3dze s LYS 11 Cb 0.09 -3.05 -0.07 0.00 -1.51 0.00 0.00 37.83 33.28 3dze s LYS 11 CO 0.81 -0.51 1.21 0.08 -0.36 0.00 0.00 175.35 176.58 3dze s VAL 12 N -0.21 3.83 -0.50 4.02 1.01 -1.26 -5.00 120.40 122.29 3dze s VAL 12 Ca 0.59 1.39 -0.15 0.00 0.00 0.00 0.00 61.98 63.81 3dze s VAL 12 Cb -0.45 -3.89 0.10 0.00 0.00 0.00 0.00 36.38 32.14 3dze s VAL 12 CO 0.48 0.15 0.43 -0.62 0.00 0.00 0.00 175.10 175.54 3dze s ASP 13 N 0.72 6.12 0.48 3.32 3.68 -1.26 -4.96 116.67 124.77 3dze s ASP 13 Ca 0.57 -1.56 0.31 0.00 2.13 0.00 0.00 52.55 53.99 3dze s ASP 13 Cb -0.31 -2.18 1.19 0.00 -1.45 0.00 0.00 42.92 40.17 3dze s ASP 13 CO 0.32 -0.74 1.90 0.45 0.13 0.00 0.00 175.17 177.23 3dze h HIS 14 N 8.78 0.00 -0.64 -5.34 3.86 -2.00 -1.65 115.15 118.17 3dze h HIS 14 Ca -0.29 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 58.84 3dze h HIS 14 Cb 1.10 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.55 3dze h HIS 14 CO 0.68 0.00 0.06 -0.44 0.86 0.00 0.00 177.93 179.09 3dze h ASP 15 N 0.00 1.05 -0.40 2.45 3.32 -1.99 -1.76 116.42 119.09 3dze h ASP 15 Ca 0.00 -0.27 -0.08 0.00 0.02 0.00 0.00 57.03 56.70 3dze h ASP 15 Cb 0.54 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 3dze h ASP 15 CO 0.00 1.07 -0.05 -0.09 -1.72 0.00 0.00 179.24 178.45 3dze h ARG 16 N 1.01 0.74 -0.79 3.56 9.65 -1.74 -1.34 114.38 125.46 3dze h ARG 16 Ca 0.19 -0.26 0.09 0.00 -1.10 0.00 0.00 59.98 58.90 3dze h ARG 16 Cb 0.49 -0.05 -0.07 0.00 -1.39 0.00 0.00 29.97 28.95 3dze h ARG 16 CO 0.02 0.85 0.44 0.82 2.80 0.00 0.00 179.97 184.91 3dze h ILE 17 N 0.56 0.91 -0.58 1.20 2.04 -1.27 -0.43 117.51 119.93 3dze h ILE 17 Ca 0.11 -0.26 -0.05 0.00 1.00 0.00 0.00 64.86 65.66 3dze h ILE 17 Cb 0.55 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 3dze h ILE 17 CO 0.03 0.14 0.17 -0.09 0.00 0.00 0.00 178.15 178.39 3dze h ARG 18 N 0.75 0.91 0.04 2.37 2.43 -0.94 0.20 114.38 120.14 3dze h ARG 18 Ca 0.38 -0.21 -0.25 0.00 -0.81 0.00 0.00 59.98 59.09 3dze h ARG 18 Cb 0.34 -0.13 0.02 0.00 -0.42 0.00 0.00 29.97 29.79 3dze h ARG 18 CO -0.24 0.83 -1.02 -0.44 -1.51 0.00 0.00 179.97 177.58 3dze h ASP 19 N 0.82 0.82 0.00 -3.80 3.32 -0.48 -3.38 116.42 113.72 3dze h ASP 19 Ca 0.18 -0.78 0.00 0.00 0.02 0.00 0.00 57.03 56.46 3dze h ASP 19 Cb 0.31 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3dze h ASP 19 CO -0.00 1.50 0.00 1.33 -1.72 0.00 0.00 179.24 180.35 3dze n VAL 20 N -3.91 0.00 0.00 -1.35 0.24 -0.24 -5.03 118.33 108.03 3dze n VAL 20 Ca -0.12 -0.46 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 3dze n VAL 20 Cb 0.88 1.05 0.00 0.00 -1.47 0.00 0.00 33.84 34.30 3dze n VAL 20 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dze n GLY 21 N 0.30 -0.00 0.28 7.63 0.00 0.06 -4.16 105.19 109.30 3dze n GLY 21 Ca 0.00 -1.64 -0.01 0.00 0.00 0.00 0.00 46.02 44.37 3dze n GLY 21 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3dze h PRO 22 N 0.00 0.76 -0.60 1.61 0.11 -1.88 -1.99 132.00 130.00 3dze h PRO 22 Ca 0.00 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 3dze h PRO 22 Cb 0.00 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 30.91 3dze h PRO 22 CO 0.00 0.50 0.15 -0.44 -0.21 0.00 0.00 178.00 178.00 3dze h ASP 23 N 0.78 0.92 -0.27 -2.05 3.32 -1.86 0.10 116.42 117.35 3dze h ASP 23 Ca 0.32 -0.23 -0.07 0.00 0.02 0.00 0.00 57.03 57.07 3dze h ASP 23 Cb 0.17 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 3dze h ASP 23 CO -0.17 0.91 -0.09 -0.09 -1.72 0.00 0.00 179.24 178.07 3dze h ARG 24 N 0.88 0.54 -0.80 3.56 9.65 -1.73 -0.49 114.38 125.99 3dze h ARG 24 Ca 0.19 -0.22 -0.03 0.00 -1.10 0.00 0.00 59.98 58.82 3dze h ARG 24 Cb 0.35 -0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 28.87 3dze h ARG 24 CO 0.00 0.76 0.37 0.00 2.80 0.00 0.00 179.97 183.90 3dze h ALA 25 N 0.76 1.04 -0.25 2.80 0.00 -1.18 -1.18 119.26 121.24 3dze h ALA 25 Ca 0.06 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 3dze h ALA 25 Cb 0.58 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3dze h ALA 25 CO 0.03 0.62 -0.38 0.00 0.00 0.00 0.00 179.25 179.52 3dze h ALA 26 N 1.19 0.86 -0.77 0.00 0.00 -0.73 -1.89 119.26 117.93 3dze h ALA 26 Ca 0.27 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.76 3dze h ALA 26 Cb 0.15 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 3dze h ALA 26 CO -0.03 0.64 0.51 0.77 0.00 0.00 0.00 179.25 181.14 3dze h SER 27 N 0.48 0.88 -0.35 0.00 0.02 -0.60 -0.00 113.55 113.98 3dze h SER 27 Ca 0.04 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.94 3dze h SER 27 Cb 0.88 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.19 3dze h SER 27 CO 0.08 0.64 0.11 -0.33 -1.14 0.00 0.00 176.83 176.19 3dze h GLU 28 N 1.04 0.54 -0.04 3.45 5.08 -1.00 -0.56 114.58 123.09 3dze h GLU 28 Ca 0.28 -0.12 0.02 0.00 -1.00 0.00 0.00 59.36 58.55 3dze h GLU 28 Cb -0.12 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.02 3dze h GLU 28 CO -0.06 0.57 -0.11 2.35 -1.00 0.00 0.00 179.01 180.76 3dze h TRP 29 N 0.42 -0.27 -0.12 4.33 7.01 -1.10 -0.30 115.95 125.91 3dze h TRP 29 Ca 0.11 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.12 3dze h TRP 29 Cb 0.25 0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.43 3dze h TRP 29 CO 0.01 -0.16 0.06 -0.07 -2.79 0.00 0.00 178.44 175.48 3dze h LEU 30 N -0.16 0.16 -0.66 0.65 3.38 -0.87 -2.09 115.31 115.72 3dze h LEU 30 Ca 0.05 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 3dze h LEU 30 Cb 0.24 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3dze h LEU 30 CO -0.14 0.24 -0.25 -0.07 0.09 0.00 0.00 178.44 178.31 3dze h LEU 31 N 0.07 0.79 -1.75 1.67 4.07 -1.04 0.81 115.31 119.93 3dze h LEU 31 Ca 0.04 -0.30 -0.03 0.00 0.08 0.00 0.00 57.88 57.67 3dze h LEU 31 Cb 0.12 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.64 3dze h LEU 31 CO -0.01 1.01 -0.17 0.08 -1.08 0.00 0.00 178.44 178.27 3dze h ARG 32 N 0.66 0.00 -0.43 1.13 0.11 -0.94 -1.73 114.38 113.19 3dze h ARG 32 Ca 0.09 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.17 3dze h ARG 32 Cb 0.77 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.85 3dze h ARG 32 CO 0.06 0.17 0.00 0.00 0.10 0.00 0.00 179.97 180.30 3dze n GLY 34 N 1.07 0.55 3.96 0.00 0.00 -0.65 -1.37 105.19 108.76 3dze n GLY 34 Ca 0.13 -0.57 -0.21 0.00 0.00 0.00 0.00 46.02 45.37 3dze n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dze s ALA 35 N -2.00 4.46 0.12 4.61 0.00 0.23 -4.33 121.76 124.85 3dze s ALA 35 Ca 0.00 -1.78 0.06 0.00 0.00 0.00 0.00 51.96 50.24 3dze s ALA 35 Cb 0.00 -1.18 -0.04 0.00 0.00 0.00 0.00 23.12 21.90 3dze s ALA 35 CO 0.00 -0.52 -0.14 -1.64 0.00 0.00 0.00 175.76 173.47 3dze s MET 36 N -4.39 1.01 0.11 0.00 1.00 0.01 -3.84 119.30 113.20 3dze s MET 36 Ca 0.50 -1.24 0.03 0.00 0.00 0.00 0.00 55.69 54.98 3dze s MET 36 Cb -0.05 -0.86 -0.04 0.00 0.00 0.00 0.00 34.83 33.88 3dze s MET 36 CO 0.31 0.16 -0.08 0.14 0.00 0.00 0.00 175.02 175.54 3dze s VAL 37 N -2.22 0.86 -0.04 -6.03 -7.23 -1.04 -1.02 120.40 103.68 3dze s VAL 37 Ca 0.09 -1.82 0.02 0.00 -1.81 0.00 0.00 61.98 58.45 3dze s VAL 37 Cb -0.04 -1.56 0.02 0.00 0.56 0.00 0.00 36.38 35.36 3dze s VAL 37 CO 0.03 -0.72 -0.07 -0.60 -0.31 0.00 0.00 175.10 173.42 3dze s ARG 38 N -3.36 1.05 0.30 4.82 3.52 -0.18 -0.05 118.95 125.04 3dze s ARG 38 Ca 0.10 -0.22 -0.16 0.00 -0.13 0.00 0.00 55.73 55.32 3dze s ARG 38 Cb 0.01 -0.96 -0.09 0.00 -1.56 0.00 0.00 34.95 32.35 3dze s ARG 38 CO -0.02 -0.01 0.73 0.71 -0.81 0.00 0.00 175.30 175.90 3dze s TYR 39 N 0.68 3.43 0.20 5.12 2.02 -1.26 -0.73 117.35 126.81 3dze s TYR 39 Ca -0.11 1.24 -0.32 0.00 -0.37 0.00 0.00 57.07 57.52 3dze s TYR 39 Cb -0.13 -2.55 -0.15 0.00 -0.40 0.00 0.00 41.96 38.73 3dze s TYR 39 CO 0.01 0.14 1.21 0.72 -1.57 0.00 0.00 175.55 176.07 3dze n HIS 40 N -0.15 1.52 -0.48 2.71 8.25 0.29 -1.70 115.22 125.65 3dze n HIS 40 Ca 0.02 0.62 0.00 0.00 -0.26 0.00 0.00 57.72 58.10 3dze n HIS 40 Cb 0.53 -2.32 0.00 0.00 1.12 0.00 0.00 29.99 29.31 3dze n HIS 40 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dze n GLY 41 N 1.99 1.29 3.43 -1.41 0.00 -1.26 -4.76 105.19 104.47 3dze n GLY 41 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 3dze n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dze s GLN 42 N -0.28 2.80 0.06 1.61 -1.52 -0.69 -5.02 119.66 116.62 3dze s GLN 42 Ca 0.00 -0.71 -0.08 0.00 -1.95 0.00 0.00 55.36 52.63 3dze s GLN 42 Cb 0.00 -2.45 -0.31 0.00 -0.22 0.00 0.00 33.01 30.04 3dze s GLN 42 CO 0.00 0.47 1.08 0.37 -0.25 0.00 0.00 175.29 176.96 3dze h GLN 43 N 5.84 0.35 -6.57 2.91 4.15 -1.96 -3.43 115.11 116.41 3dze h GLN 43 Ca -0.39 -0.60 -0.52 0.00 0.77 0.00 0.00 58.65 57.91 3dze h GLN 43 Cb 1.17 0.22 -0.03 0.00 0.21 0.00 0.00 27.48 29.06 3dze h GLN 43 CO 0.52 1.28 -0.01 1.03 -1.93 0.00 0.00 178.83 179.73 3dze s ARG 44 N -2.64 3.92 0.22 1.69 0.52 -1.26 -5.07 118.95 116.34 3dze s ARG 44 Ca -0.06 0.49 -0.15 0.00 -0.52 0.00 0.00 55.73 55.50 3dze s ARG 44 Cb 0.06 -2.57 -0.08 0.00 0.52 0.00 0.00 34.95 32.89 3dze s ARG 44 CO 0.90 0.25 0.63 -1.58 0.02 0.00 0.00 175.30 175.52 3dze s TRP 45 N -1.87 3.52 -0.31 -0.53 0.52 -1.26 -4.61 118.94 114.39 3dze s TRP 45 Ca 0.50 1.13 -0.26 0.00 0.02 0.00 0.00 56.10 57.49 3dze s TRP 45 Cb -0.11 -2.44 0.01 0.00 -1.15 0.00 0.00 33.47 29.78 3dze s TRP 45 CO 0.19 0.29 0.92 -0.65 0.02 0.00 0.00 176.95 177.72 3dze s GLN 46 N -2.40 4.00 0.00 4.98 -1.52 0.93 -4.89 119.66 120.76 3dze s GLN 46 Ca 0.45 0.80 0.00 0.00 -1.95 0.00 0.00 55.36 54.66 3dze s GLN 46 Cb -0.13 -3.73 0.00 0.00 -0.22 0.00 0.00 33.01 28.92 3dze s GLN 46 CO 0.20 -0.78 0.00 0.36 -0.25 0.00 0.00 175.29 174.81 3dze n LYS 47 N 6.50 3.54 -4.06 2.91 2.85 -1.26 -2.49 118.16 126.15 3dze n LYS 47 Ca 0.07 0.00 -0.33 0.00 -1.05 0.00 0.00 58.31 57.00 3dze n LYS 47 Cb 0.48 -0.36 -0.15 0.00 -0.65 0.00 0.00 35.03 34.34 3dze n LYS 47 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 3dze s ASP 48 N -0.63 3.58 0.30 -5.58 -1.08 -1.26 -4.95 116.67 107.05 3dze s ASP 48 Ca 0.00 -0.69 0.05 0.00 -0.52 0.00 0.00 52.55 51.39 3dze s ASP 48 Cb 0.00 -1.55 0.78 0.00 -1.46 0.00 0.00 42.92 40.69 3dze s ASP 48 CO 0.00 -0.03 1.66 0.22 0.52 0.00 0.00 175.17 177.54 3dze h TYR 49 N 7.96 0.54 0.00 -5.34 3.20 -1.95 -0.63 116.97 120.76 3dze h TYR 49 Ca -0.41 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.50 3dze h TYR 49 Cb 1.13 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 39.31 3dze h TYR 49 CO 0.52 -0.15 0.00 0.09 -1.64 0.00 0.00 178.16 176.97 3dze n ASN 50 N -5.14 0.00 -0.88 -2.11 3.02 -1.26 -2.72 115.26 106.17 3dze n ASN 50 Ca 0.23 0.42 0.08 0.00 -0.03 0.00 0.00 54.58 55.28 3dze n ASN 50 Cb 0.73 -0.46 0.19 0.00 -0.61 0.00 0.00 39.78 39.62 3dze n ASN 50 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3dze n HIS 51 N -1.46 0.53 -1.83 3.10 8.25 -0.25 -4.99 115.22 118.57 3dze n HIS 51 Ca 0.05 -0.39 -0.39 0.00 -0.26 0.00 0.00 57.72 56.73 3dze n HIS 51 Cb 0.20 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 31.32 3dze n HIS 51 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3dze s LEU 52 N -1.08 4.02 0.70 2.41 1.43 -1.10 -4.90 118.68 120.15 3dze s LEU 52 Ca 0.31 2.81 -0.15 0.00 -1.03 0.00 0.00 54.13 56.06 3dze s LEU 52 Cb 0.17 -4.08 0.02 0.00 0.03 0.00 0.00 46.19 42.33 3dze s LEU 52 CO 0.23 -1.29 1.18 -2.16 0.23 0.00 0.00 176.35 174.54 3dze s PRO 53 N -2.62 2.40 0.00 1.29 0.04 -1.26 -4.92 135.00 129.93 3dze s PRO 53 Ca 0.65 1.69 0.09 0.00 0.04 0.00 0.00 61.00 63.47 3dze s PRO 53 Cb -0.41 -1.87 0.09 0.00 0.04 0.00 0.00 34.50 32.35 3dze s PRO 53 CO 0.51 -1.62 0.84 0.25 0.04 0.00 0.00 177.00 177.02 3dze n THR 54 N -2.50 0.08 -2.94 1.26 -2.24 -1.26 -5.01 114.28 101.67 3dze n THR 54 Ca 0.13 -0.54 -0.40 0.00 -2.27 0.00 0.00 64.05 60.97 3dze n THR 54 Cb 0.51 1.14 -0.06 0.00 -2.10 0.00 0.00 70.33 69.82 3dze n THR 54 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3dze s GLY 55 N -0.81 2.93 0.00 3.38 0.00 -1.26 -4.85 107.32 106.71 3dze s GLY 55 Ca 0.12 0.39 0.00 0.00 0.00 0.00 0.00 44.72 45.23 3dze s GLY 55 CO 0.12 0.97 0.00 -1.05 0.00 0.00 0.00 173.10 173.14 3dze n PRO 56 N 1.83 0.00 -1.67 2.90 -0.02 -1.26 -4.69 135.00 132.09 3dze n PRO 56 Ca -0.04 0.00 -0.48 0.00 -2.02 0.00 0.00 63.50 60.96 3dze n PRO 56 Cb 0.49 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.92 3dze n PRO 56 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3dze n LEU 57 N 0.00 3.47 -1.92 2.45 4.77 -1.26 -2.56 117.00 121.95 3dze n LEU 57 Ca 0.00 0.93 -0.18 0.00 -0.03 0.00 0.00 56.01 56.72 3dze n LEU 57 Cb 0.00 -1.38 -0.03 0.00 -2.33 0.00 0.00 43.42 39.68 3dze n LEU 57 CO 0.00 -0.07 -0.22 -0.67 -1.33 0.00 0.00 177.39 175.10 3dze n ASP 58 N 6.99 -5.31 -0.02 -1.43 2.03 -1.26 -4.90 116.55 112.65 3dze n ASP 58 Ca 0.23 0.10 -0.15 0.00 0.52 0.00 0.00 54.79 55.49 3dze n ASP 58 Cb 0.31 -4.39 -0.11 0.00 -0.72 0.00 0.00 41.12 36.21 3dze n ASP 58 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 3dze h LYS 59 N 0.00 0.24 -6.28 -0.67 3.64 -1.77 -3.45 116.57 108.28 3dze h LYS 59 Ca -0.42 -0.24 -0.55 0.00 -1.27 0.00 0.00 60.65 58.17 3dze h LYS 59 Cb 1.29 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 33.14 3dze h LYS 59 CO 0.53 0.94 0.26 0.71 -2.27 0.00 0.00 179.45 179.62 3dze s TYR 60 N -3.26 3.64 -0.12 1.91 2.02 -1.26 -5.04 117.35 115.25 3dze s TYR 60 Ca -0.15 1.54 0.03 0.00 -0.37 0.00 0.00 57.07 58.12 3dze s TYR 60 Cb 0.02 -2.99 0.01 0.00 -0.40 0.00 0.00 41.96 38.59 3dze s TYR 60 CO 0.76 0.05 -0.22 0.15 -1.57 0.00 0.00 175.55 174.72 3dze s LYS 61 N 0.82 2.93 0.10 -0.62 -0.14 -1.26 -4.67 119.74 116.90 3dze s LYS 61 Ca 0.46 -0.83 -0.31 0.00 -1.36 0.00 0.00 55.97 53.93 3dze s LYS 61 Cb -0.20 -2.30 -0.09 0.00 -1.68 0.00 0.00 37.83 33.56 3dze s LYS 61 CO 0.24 0.07 1.62 0.42 -0.76 0.00 0.00 175.35 176.94 3dze s ILE 62 N 0.61 2.91 -0.24 2.17 1.01 -1.26 -0.55 121.20 125.85 3dze s ILE 62 Ca -0.13 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.02 3dze s ILE 62 Cb -0.17 -3.31 -0.15 0.00 0.01 0.00 0.00 42.46 38.84 3dze s ILE 62 CO 0.03 0.01 -0.23 1.67 0.00 0.00 0.00 174.94 176.43 3dze n GLN 63 N 5.01 0.60 -4.11 2.79 7.27 0.09 -3.26 117.38 125.78 3dze n GLN 63 Ca 0.15 0.15 -0.14 0.00 0.07 0.00 0.00 57.00 57.23 3dze n GLN 63 Cb 0.40 -1.48 -0.13 0.00 2.41 0.00 0.00 30.24 31.44 3dze n GLN 63 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3dze s ALA 64 N -2.49 0.48 -0.05 1.69 0.00 -0.85 -0.72 121.76 119.82 3dze s ALA 64 Ca -0.33 -0.47 0.05 0.00 0.00 0.00 0.00 51.96 51.20 3dze s ALA 64 Cb 0.09 -0.03 -0.00 0.00 0.00 0.00 0.00 23.12 23.17 3dze s ALA 64 CO 0.55 0.04 -0.20 0.42 0.00 0.00 0.00 175.76 176.58 3dze s ILE 65 N -0.72 1.65 -0.34 0.00 1.01 -0.24 -1.01 121.20 121.55 3dze s ILE 65 Ca -0.04 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.79 3dze s ILE 65 Cb -0.06 -1.41 0.11 0.00 0.01 0.00 0.00 42.46 41.11 3dze s ILE 65 CO 0.00 0.47 0.11 -0.62 0.00 0.00 0.00 174.94 174.90 3dze s ASP 66 N 0.06 4.15 -0.69 3.58 -1.08 -0.19 -0.91 116.67 121.59 3dze s ASP 66 Ca -0.06 -1.93 -0.13 0.00 -0.52 0.00 0.00 52.55 49.91 3dze s ASP 66 Cb -0.13 -1.08 0.18 0.00 -1.46 0.00 0.00 42.92 40.43 3dze s ASP 66 CO 0.03 -0.38 0.61 0.00 0.52 0.00 0.00 175.17 175.95 3dze s ALA 67 N 1.23 3.83 -0.15 3.66 0.00 0.19 -0.81 121.76 129.70 3dze s ALA 67 Ca 0.11 -3.02 -0.01 0.00 0.00 0.00 0.00 51.96 49.04 3dze s ALA 67 Cb -0.19 -3.26 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 3dze s ALA 67 CO -0.17 -2.15 -0.11 0.99 0.00 0.00 0.00 175.76 174.33 3dze s THR 68 N 0.64 3.15 -1.29 0.00 2.01 -1.25 -0.64 115.64 118.27 3dze s THR 68 Ca 0.13 -0.61 -0.02 0.00 0.31 0.00 0.00 61.69 61.49 3dze s THR 68 Cb -0.18 -2.35 0.01 0.00 0.01 0.00 0.00 72.50 69.98 3dze s THR 68 CO -0.04 0.50 0.90 0.47 -0.69 0.00 0.00 174.62 175.76 3dze n ASP 69 N 3.78 -2.39 -4.54 3.53 8.00 -0.30 -4.71 116.55 119.92 3dze n ASP 69 Ca -0.18 -0.70 -0.28 0.00 0.71 0.00 0.00 54.79 54.34 3dze n ASP 69 Cb 0.52 -4.59 -0.10 0.00 -0.02 0.00 0.00 41.12 36.93 3dze n ASP 69 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3dze s SER 70 N -4.16 4.10 -0.17 -2.24 0.15 -1.24 -4.82 113.70 105.32 3dze s SER 70 Ca 0.12 -0.58 0.17 0.00 0.70 0.00 0.00 55.95 56.36 3dze s SER 70 Cb -0.06 -0.64 0.78 0.00 -1.71 0.00 0.00 66.02 64.39 3dze s SER 70 CO 0.77 0.13 1.69 0.00 1.20 0.00 0.00 173.24 177.04 3dze s ILE 72 N -2.24 2.11 -0.19 0.00 -4.36 -1.26 -4.93 121.20 110.34 3dze s ILE 72 Ca 0.53 0.09 -0.30 0.00 -0.26 0.00 0.00 60.65 60.71 3dze s ILE 72 Cb 0.37 -3.05 0.14 0.00 1.25 0.00 0.00 42.46 41.18 3dze s ILE 72 CO 0.21 0.00 1.07 0.00 0.24 0.00 0.00 174.94 176.47 3dze s MET 73 N -2.81 0.49 2.34 0.37 0.23 -1.26 -4.16 119.30 114.50 3dze s MET 73 Ca 0.69 0.13 0.00 0.00 -1.03 0.00 0.00 55.69 55.48 3dze s MET 73 Cb -0.41 0.23 0.00 0.00 -1.53 0.00 0.00 34.83 33.12 3dze s MET 73 CO 0.49 -0.15 0.00 -1.13 -2.03 0.00 0.00 175.02 172.20 3dze n SER 74 N 0.74 0.00 0.13 -1.18 3.41 -1.26 -0.91 113.62 114.55 3dze n SER 74 Ca -0.08 0.00 0.19 0.00 -0.26 0.00 0.00 58.87 58.72 3dze n SER 74 Cb 0.58 0.00 0.77 0.00 -0.26 0.00 0.00 64.21 65.30 3dze n SER 74 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3dze h ILE 75 N 0.00 0.41 -0.77 -1.33 1.08 -1.99 -0.99 117.51 113.92 3dze h ILE 75 Ca 0.00 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.58 3dze h ILE 75 Cb 0.00 0.71 -0.05 0.00 -3.07 0.00 0.00 36.82 34.41 3dze h ILE 75 CO 0.00 0.00 0.51 1.23 -0.69 0.00 0.00 178.15 179.20 3dze h GLY 76 N 0.00 0.95 2.00 5.37 0.00 -1.08 -1.59 103.07 108.72 3dze h GLY 76 Ca 0.16 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.22 3dze h GLY 76 CO -0.00 0.14 0.00 0.69 0.00 0.00 0.00 176.54 177.37 3dze n PHE 77 N -4.50 0.19 0.33 5.60 3.72 -0.37 -1.51 117.46 120.91 3dze n PHE 77 Ca 0.13 0.08 0.21 0.00 -0.05 0.00 0.00 57.45 57.83 3dze n PHE 77 Cb 0.37 -0.63 1.14 0.00 -0.94 0.00 0.00 39.48 39.42 3dze n PHE 77 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3dze h ASP 78 N 0.00 0.00 0.49 4.37 3.32 -1.46 -0.42 116.42 122.71 3dze h ASP 78 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3dze h ASP 78 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3dze h ASP 78 CO 0.00 0.00 0.00 0.45 -1.72 0.00 0.00 179.24 177.97 3dze h HIS 79 N 0.00 0.00 0.00 4.55 3.86 -1.47 -2.44 115.15 119.66 3dze h HIS 79 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3dze h HIS 79 Cb 0.04 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.51 3dze h HIS 79 CO 0.00 0.00 0.00 -1.33 0.86 0.00 0.00 177.93 177.46 3dze n MET 80 N -2.61 0.20 -0.15 2.45 2.81 -0.17 -4.28 117.12 115.37 3dze n MET 80 Ca -0.00 0.20 0.01 0.00 -1.81 0.00 0.00 57.70 56.10 3dze n MET 80 Cb 0.17 -1.75 0.29 0.00 -0.71 0.00 0.00 33.22 31.23 3dze n MET 80 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 3dze h GLU 81 N 0.00 0.85 -0.15 0.03 4.22 -1.59 -2.76 114.58 115.18 3dze h GLU 81 Ca 0.00 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 59.38 3dze h GLU 81 Cb 0.64 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.70 3dze h GLU 81 CO 0.00 0.58 0.00 0.41 -2.18 0.00 0.00 179.01 177.82 3dze n GLY 82 N -1.39 0.68 3.70 1.92 0.00 -1.26 -4.83 105.19 104.01 3dze n GLY 82 Ca 0.06 -0.55 -0.40 0.00 0.00 0.00 0.00 46.02 45.13 3dze n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dze s LEU 83 N -1.74 4.28 -0.02 0.99 1.43 -1.04 -4.83 118.68 117.75 3dze s LEU 83 Ca 0.34 1.17 0.18 0.00 -1.03 0.00 0.00 54.13 54.79 3dze s LEU 83 Cb 0.20 -3.10 -0.25 0.00 0.03 0.00 0.00 46.19 43.06 3dze s LEU 83 CO 0.30 -0.18 0.54 0.00 0.23 0.00 0.00 176.35 177.24 3dze n GLN 84 N 4.13 0.74 -0.18 1.70 1.13 -1.26 -4.58 117.38 119.06 3dze n GLN 84 Ca -0.00 -0.11 0.06 0.00 -1.94 0.00 0.00 57.00 55.01 3dze n GLN 84 Cb 0.51 -1.41 0.09 0.00 0.11 0.00 0.00 30.24 29.54 3dze n GLN 84 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3dze n TYR 85 N -1.88 0.00 -2.37 1.08 4.01 -1.26 -4.75 117.16 111.99 3dze n TYR 85 Ca -0.01 -0.65 -0.43 0.00 -0.16 0.00 0.00 57.90 56.66 3dze n TYR 85 Cb 0.41 -0.11 -0.02 0.00 -0.31 0.00 0.00 39.34 39.30 3dze n TYR 85 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3dze s VAL 86 N -1.84 4.18 -0.08 -0.72 1.01 -1.20 -4.35 120.40 117.39 3dze s VAL 86 Ca 0.20 1.44 0.09 0.00 0.00 0.00 0.00 61.98 63.71 3dze s VAL 86 Cb 0.17 -3.93 -0.13 0.00 0.00 0.00 0.00 36.38 32.49 3dze s VAL 86 CO 0.02 -0.11 0.07 -0.62 0.00 0.00 0.00 175.10 174.46 3dze n GLU 87 N 6.43 2.05 -4.16 2.72 1.02 0.10 -3.29 120.64 125.51 3dze n GLU 87 Ca 0.14 -0.02 -0.20 0.00 -0.02 0.00 0.00 57.16 57.05 3dze n GLU 87 Cb 0.45 -1.25 -0.16 0.00 -0.02 0.00 0.00 31.44 30.46 3dze n GLU 87 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3dze s LYS 88 N -2.32 0.87 -0.05 3.49 1.02 -0.92 -0.96 119.74 120.87 3dze s LYS 88 Ca -0.05 -0.11 0.01 0.00 0.02 0.00 0.00 55.97 55.85 3dze s LYS 88 Cb 0.04 -0.88 0.02 0.00 -0.52 0.00 0.00 37.83 36.48 3dze s LYS 88 CO 0.40 -0.09 -0.07 0.42 -0.92 0.00 0.00 175.35 175.09 3dze s ILE 89 N 0.96 0.74 -0.14 2.17 1.01 -0.67 -1.08 121.20 124.19 3dze s ILE 89 Ca -0.10 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.30 3dze s ILE 89 Cb -0.14 -0.73 -0.01 0.00 0.01 0.00 0.00 42.46 41.59 3dze s ILE 89 CO -0.00 0.27 -0.14 -0.60 0.00 0.00 0.00 174.94 174.47 3dze s ARG 90 N 0.82 3.31 -0.26 2.79 3.52 -0.09 -1.07 118.95 127.98 3dze s ARG 90 Ca -0.12 -0.72 0.02 0.00 -0.13 0.00 0.00 55.73 54.78 3dze s ARG 90 Cb -0.15 -2.61 0.05 0.00 -1.56 0.00 0.00 34.95 30.68 3dze s ARG 90 CO 0.01 0.14 -0.11 -0.51 -0.81 0.00 0.00 175.30 174.03 3dze s LEU 91 N 0.52 3.35 -0.08 -0.88 1.43 0.33 -0.64 118.68 122.72 3dze s LEU 91 Ca -0.09 -1.29 -0.01 0.00 -1.03 0.00 0.00 54.13 51.71 3dze s LEU 91 Cb -0.16 -1.56 0.03 0.00 0.03 0.00 0.00 46.19 44.52 3dze s LEU 91 CO 0.04 -0.18 -0.03 0.00 0.23 0.00 0.00 176.35 176.41 3dze n LYS 93 N 4.85 -5.59 -3.33 0.00 5.02 -0.13 -1.15 118.16 117.84 3dze n LYS 93 Ca -0.12 0.65 -0.47 0.00 -2.02 0.00 0.00 58.31 56.35 3dze n LYS 93 Cb 0.50 -5.42 -0.02 0.00 -0.02 0.00 0.00 35.03 30.07 3dze n LYS 93 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dze h HIS 95 N 7.87 0.00 0.00 0.00 3.86 -1.88 -2.89 115.15 122.12 3dze h HIS 95 Ca 0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 3dze h HIS 95 Cb 1.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.52 3dze h HIS 95 CO 1.00 0.00 -1.04 0.66 0.86 0.00 0.00 177.93 179.41 3dze n TYR 96 N -2.45 0.03 -2.34 2.45 4.01 -1.26 -4.80 117.16 112.79 3dze n TYR 96 Ca 0.03 0.01 -0.33 0.00 -0.16 0.00 0.00 57.90 57.45 3dze n TYR 96 Cb 0.31 -0.13 -0.02 0.00 -0.31 0.00 0.00 39.34 39.19 3dze n TYR 96 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 3dze s ILE 97 N -3.07 4.00 0.32 -0.72 -4.36 -1.09 -4.83 121.20 111.44 3dze s ILE 97 Ca 0.06 1.06 0.04 0.00 -0.26 0.00 0.00 60.65 61.56 3dze s ILE 97 Cb 0.16 -3.49 -0.02 0.00 1.25 0.00 0.00 42.46 40.35 3dze s ILE 97 CO 0.84 -0.44 0.31 -1.61 0.24 0.00 0.00 174.94 174.28 3dze s GLU 98 N -3.73 1.73 0.30 0.37 2.02 -1.26 -4.38 118.70 113.75 3dze s GLU 98 Ca 0.64 -1.92 0.03 0.00 0.02 0.00 0.00 54.97 53.73 3dze s GLU 98 Cb -0.14 0.35 0.60 0.00 0.10 0.00 0.00 34.13 35.03 3dze s GLU 98 CO 0.28 -0.65 1.85 -0.44 0.02 0.00 0.00 175.26 176.32 3dze h ASP 99 N 2.18 0.88 0.05 -0.19 3.32 -1.94 -0.26 116.42 120.45 3dze h ASP 99 Ca -0.27 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.82 3dze h ASP 99 Cb 1.24 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.65 3dze h ASP 99 CO 0.38 0.47 -0.04 1.23 -1.72 0.00 0.00 179.24 179.57 3dze h GLY 100 N 0.95 0.00 0.80 2.75 0.00 -1.98 0.53 103.07 106.12 3dze h GLY 100 Ca 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.78 3dze h GLY 100 CO -0.24 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.29 3dze h LEU 102 N 0.07 0.91 -0.22 0.00 3.38 -1.21 -1.72 115.31 116.52 3dze h LEU 102 Ca 0.05 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 3dze h LEU 102 Cb 0.41 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 3dze h LEU 102 CO 0.01 0.92 0.13 -0.33 0.09 0.00 0.00 178.44 179.26 3dze h GLU 103 N 0.90 0.30 -0.29 1.13 5.08 -0.81 -0.48 114.58 120.42 3dze h GLU 103 Ca 0.18 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.43 3dze h GLU 103 Cb 0.41 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3dze h GLU 103 CO 0.01 0.27 -0.18 -0.09 -1.00 0.00 0.00 179.01 178.02 3dze h ARG 104 N 0.26 0.52 -0.52 2.33 2.43 -1.06 -2.16 114.38 116.18 3dze h ARG 104 Ca 0.08 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 59.04 3dze h ARG 104 Cb 0.05 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 3dze h ARG 104 CO -0.01 0.69 0.19 -0.07 -1.51 0.00 0.00 179.97 179.25 3dze h LEU 105 N 0.47 0.74 -1.99 3.80 3.38 -1.11 -3.07 115.31 117.54 3dze h LEU 105 Ca 0.08 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3dze h LEU 105 Cb 0.59 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 3dze h LEU 105 CO 0.04 0.73 -0.10 0.77 0.09 0.00 0.00 178.44 179.97 3dze h SER 106 N 0.71 0.00 0.16 -0.43 4.64 -0.46 -2.22 113.55 115.95 3dze h SER 106 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 3dze h SER 106 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 3dze h SER 106 CO -0.01 0.10 -0.11 0.00 -0.87 0.00 0.00 176.83 175.94 3dze n GLN 107 N -3.81 1.11 -2.72 4.77 1.13 -0.96 -4.72 117.38 112.19 3dze n GLN 107 Ca -0.02 -0.57 -0.43 0.00 -1.94 0.00 0.00 57.00 54.04 3dze n GLN 107 Cb 0.20 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.03 3dze n GLN 107 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3dze s LEU 108 N -2.28 3.83 0.47 1.08 1.43 -0.84 -4.90 118.68 117.48 3dze s LEU 108 Ca 0.32 0.25 0.15 0.00 -1.03 0.00 0.00 54.13 53.82 3dze s LEU 108 Cb 0.20 -3.34 1.10 0.00 0.03 0.00 0.00 46.19 44.18 3dze s LEU 108 CO 0.43 -1.16 2.04 -0.33 0.23 0.00 0.00 176.35 177.57 3dze h GLU 109 N 9.17 0.00 -0.75 1.70 5.08 -1.88 -0.59 114.58 127.30 3dze h GLU 109 Ca -0.24 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.13 3dze h GLU 109 Cb 1.07 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.28 3dze h GLU 109 CO 1.08 0.13 0.50 -2.95 -1.00 0.00 0.00 179.01 176.76 3dze h ASN 110 N 0.00 0.86 0.01 1.42 -1.07 -1.88 -1.13 115.58 113.78 3dze h ASN 110 Ca -0.00 -0.02 -0.20 0.00 0.07 0.00 0.00 56.30 56.15 3dze h ASN 110 Cb 0.22 -0.21 0.00 0.00 -2.07 0.00 0.00 38.32 36.26 3dze h ASN 110 CO 0.02 0.62 -0.71 -0.07 0.07 0.00 0.00 177.43 177.35 3dze h LEU 111 N 1.01 0.74 -1.15 6.14 3.38 -1.45 -2.97 115.31 121.02 3dze h LEU 111 Ca 0.28 -0.47 0.07 0.00 0.09 0.00 0.00 57.88 57.86 3dze h LEU 111 Cb -0.10 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.37 3dze h LEU 111 CO -0.07 1.23 0.59 1.56 0.09 0.00 0.00 178.44 181.85 3dze h GLN 112 N 0.44 0.97 -0.29 1.13 4.20 -0.72 -0.53 115.11 120.32 3dze h GLN 112 Ca -0.03 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.47 3dze h GLN 112 Cb 1.31 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.86 3dze h GLN 112 CO 0.14 0.64 -0.42 0.87 -0.67 0.00 0.00 178.83 179.40 3dze h LYS 113 N 1.00 0.70 0.00 1.46 1.57 -1.17 -3.37 116.57 116.77 3dze h LYS 113 Ca 0.40 -0.37 -0.28 0.00 -1.87 0.00 0.00 60.65 58.53 3dze h LYS 113 Cb 0.25 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.52 3dze h LYS 113 CO -0.16 0.99 -2.28 -1.13 -0.57 0.00 0.00 179.45 176.30 3dze n SER 114 N -4.03 0.02 -4.73 0.86 3.41 -1.00 -4.91 113.62 103.24 3dze n SER 114 Ca -0.02 0.01 -0.42 0.00 -0.26 0.00 0.00 58.87 58.18 3dze n SER 114 Cb 0.54 1.22 -0.03 0.00 -0.26 0.00 0.00 64.21 65.67 3dze n SER 114 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3dze s MET 115 N -2.74 4.39 -0.04 4.33 -1.94 -0.24 -4.34 119.30 118.73 3dze s MET 115 Ca -0.09 1.98 0.02 0.00 -1.71 0.00 0.00 55.69 55.88 3dze s MET 115 Cb 0.08 -3.25 -0.04 0.00 2.01 0.00 0.00 34.83 33.64 3dze s MET 115 CO 0.85 -0.29 -0.01 1.28 -0.01 0.00 0.00 175.02 176.85 3dze n LEU 116 N 3.27 1.18 -3.78 -0.03 4.77 -0.14 -3.16 117.00 119.12 3dze n LEU 116 Ca 0.08 -0.01 -0.13 0.00 -0.03 0.00 0.00 56.01 55.92 3dze n LEU 116 Cb 0.44 -0.01 -0.13 0.00 -2.33 0.00 0.00 43.42 41.39 3dze n LEU 116 CO 0.57 0.28 -0.18 -1.61 -1.33 0.00 0.00 177.39 175.12 3dze s GLU 117 N -2.08 0.17 0.01 3.23 2.02 -0.37 -0.31 118.70 121.37 3dze s GLU 117 Ca -0.03 0.33 0.01 0.00 0.02 0.00 0.00 54.97 55.29 3dze s GLU 117 Cb 0.01 -0.01 -0.01 0.00 0.10 0.00 0.00 34.13 34.22 3dze s GLU 117 CO 0.12 -0.09 -0.04 1.41 0.02 0.00 0.00 175.26 176.69 3dze s MET 118 N 0.58 0.30 -0.03 1.61 1.75 -0.40 -1.67 119.30 121.43 3dze s MET 118 Ca -0.04 -0.38 0.01 0.00 -1.25 0.00 0.00 55.69 54.03 3dze s MET 118 Cb -0.05 -0.13 0.02 0.00 2.84 0.00 0.00 34.83 37.51 3dze s MET 118 CO -0.03 0.02 -0.03 -1.21 -0.65 0.00 0.00 175.02 173.13 3dze s GLU 119 N -0.78 0.57 -0.16 4.11 2.02 -0.23 -1.44 118.70 122.77 3dze s GLU 119 Ca -0.06 -0.03 -0.02 0.00 0.02 0.00 0.00 54.97 54.88 3dze s GLU 119 Cb -0.05 -0.64 0.05 0.00 0.10 0.00 0.00 34.13 33.58 3dze s GLU 119 CO -0.00 -0.09 0.01 0.42 0.02 0.00 0.00 175.26 175.62 3dze s ILE 120 N 0.87 0.66 -0.07 -1.63 1.01 0.06 -0.51 121.20 121.60 3dze s ILE 120 Ca -0.10 -0.46 -0.01 0.00 0.00 0.00 0.00 60.65 60.09 3dze s ILE 120 Cb -0.13 -1.01 0.03 0.00 0.01 0.00 0.00 42.46 41.35 3dze s ILE 120 CO -0.01 -0.03 -0.02 -0.63 0.00 0.00 0.00 174.94 174.25 3dze s ILE 121 N 1.81 0.50 -1.38 2.92 1.01 0.09 -1.51 121.20 124.64 3dze s ILE 121 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 60.65 60.58 3dze s ILE 121 Cb -0.16 -0.60 0.03 0.00 0.01 0.00 0.00 42.46 41.74 3dze s ILE 121 CO -0.07 0.26 1.06 -1.20 0.00 0.00 0.00 174.94 174.99 3dze n SER 122 N 4.80 -4.83 -4.16 3.58 7.64 0.02 -0.95 113.62 119.72 3dze n SER 122 Ca -0.13 -0.65 -0.39 0.00 1.01 0.00 0.00 58.87 58.71 3dze n SER 122 Cb 0.50 -4.63 -0.08 0.00 -1.01 0.00 0.00 64.21 58.99 3dze n SER 122 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dze h GLY 124 N 7.56 0.00 1.76 0.00 0.00 -1.85 -2.43 103.07 108.12 3dze h GLY 124 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3dze h GLY 124 CO 0.75 0.00 -0.21 3.43 0.00 0.00 0.00 176.54 180.51 3dze h ASN 125 N 0.00 0.00 -3.60 0.19 -0.26 -1.87 -3.38 115.58 106.65 3dze h ASN 125 Ca -0.00 -0.03 -0.52 0.00 -0.56 0.00 0.00 56.30 55.19 3dze h ASN 125 Cb 0.22 0.00 0.05 0.00 -1.06 0.00 0.00 38.32 37.53 3dze h ASN 125 CO 0.00 0.02 0.65 -0.69 -1.06 0.00 0.00 177.43 176.35 3dze s VAL 126 N -3.18 2.98 0.51 2.81 1.01 -0.92 -4.61 120.40 119.00 3dze s VAL 126 Ca 0.07 0.88 0.01 0.00 0.00 0.00 0.00 61.98 62.94 3dze s VAL 126 Cb 0.09 -3.56 -0.00 0.00 0.00 0.00 0.00 36.38 32.91 3dze s VAL 126 CO 0.67 0.17 0.02 0.42 0.00 0.00 0.00 175.10 176.37 3dze s THR 127 N -0.48 0.96 0.38 3.92 -4.23 -1.26 -3.45 115.64 111.48 3dze s THR 127 Ca 0.53 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 59.16 3dze s THR 127 Cb -0.38 -2.06 0.34 0.00 1.34 0.00 0.00 72.50 71.74 3dze s THR 127 CO 0.44 0.00 1.87 0.44 -0.54 0.00 0.00 174.62 176.83 3dze h ASP 128 N 1.34 0.56 -0.38 3.99 5.19 -1.93 -1.71 116.42 123.49 3dze h ASP 128 Ca -0.43 0.04 0.01 0.00 -0.62 0.00 0.00 57.03 56.03 3dze h ASP 128 Cb 1.32 -0.07 -0.02 0.00 0.18 0.00 0.00 39.33 40.74 3dze h ASP 128 CO 0.71 0.27 0.24 0.50 -3.12 0.00 0.00 179.24 177.83 3dze h LYS 129 N 0.58 0.48 -0.63 3.56 3.64 -1.95 -0.55 116.57 121.70 3dze h LYS 129 Ca 0.45 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.72 3dze h LYS 129 Cb 0.86 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 3dze h LYS 129 CO -0.19 0.32 0.07 0.78 -2.27 0.00 0.00 179.45 178.15 3dze h GLY 130 N 0.49 1.15 0.88 5.01 0.00 -1.60 -2.89 103.07 106.11 3dze h GLY 130 Ca 0.14 -0.78 -0.00 0.00 0.00 0.00 0.00 47.33 46.69 3dze h GLY 130 CO -0.04 0.72 0.00 -2.22 0.00 0.00 0.00 176.54 175.00 3dze h ILE 131 N 0.99 1.09 -0.26 2.60 1.08 -1.20 -2.99 117.51 118.82 3dze h ILE 131 Ca 0.19 -0.28 0.05 0.00 -0.39 0.00 0.00 64.86 64.43 3dze h ILE 131 Cb 0.48 1.28 -0.01 0.00 -3.07 0.00 0.00 36.82 35.49 3dze h ILE 131 CO 0.02 0.07 0.18 0.40 -0.69 0.00 0.00 178.15 178.13 3dze h ILE 132 N -0.11 0.94 -0.12 -0.67 1.08 -1.03 -1.11 117.51 116.49 3dze h ILE 132 Ca 0.00 -0.04 0.04 0.00 -0.39 0.00 0.00 64.86 64.46 3dze h ILE 132 Cb 0.12 0.80 -0.00 0.00 -3.07 0.00 0.00 36.82 34.66 3dze h ILE 132 CO -0.00 0.02 0.11 0.00 -0.69 0.00 0.00 178.15 177.59 3dze h ALA 133 N 1.86 1.88 0.00 1.87 0.00 -1.35 -2.07 119.26 121.46 3dze h ALA 133 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3dze h ALA 133 Cb 0.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3dze h ALA 133 CO -0.01 -0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.34 3dze n LEU 134 N -4.11 0.00 0.33 0.00 4.77 -0.42 -2.61 117.00 114.96 3dze n LEU 134 Ca 0.00 0.39 0.22 0.00 -0.03 0.00 0.00 56.01 56.58 3dze n LEU 134 Cb 0.23 -0.39 1.13 0.00 -2.33 0.00 0.00 43.42 42.06 3dze n LEU 134 CO 0.31 -0.24 1.16 1.12 -1.33 0.00 0.00 177.39 178.40 3dze h HIS 135 N 0.00 0.00 0.00 -1.77 2.07 -1.55 -0.79 115.15 113.11 3dze h HIS 135 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3dze h HIS 135 Cb 0.15 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.13 3dze h HIS 135 CO 0.00 0.00 0.00 0.45 -3.07 0.00 0.00 177.93 175.31 3dze h HIS 136 N 0.00 0.00 -0.72 6.12 3.86 -1.76 -3.34 115.15 119.31 3dze h HIS 136 Ca -0.00 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.55 3dze h HIS 136 Cb 0.08 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.48 3dze h HIS 136 CO 0.00 0.00 2.24 1.19 0.86 0.00 0.00 177.93 182.22 3dze n PHE 137 N -2.64 4.38 0.41 2.45 3.72 -0.30 -4.73 117.46 120.75 3dze n PHE 137 Ca 0.01 -2.75 0.11 0.00 -0.05 0.00 0.00 57.45 54.76 3dze n PHE 137 Cb 0.22 -2.62 0.46 0.00 -0.94 0.00 0.00 39.48 36.60 3dze n PHE 137 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 3dze n ARG 138 N 8.11 0.16 -0.22 -1.08 1.85 -1.26 -1.52 116.66 122.71 3dze n ARG 138 Ca 0.49 0.39 0.10 0.00 -1.00 0.00 0.00 57.85 57.83 3dze n ARG 138 Cb 0.45 -1.81 0.21 0.00 -1.05 0.00 0.00 32.46 30.27 3dze n ARG 138 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3dze n ASN 139 N -2.11 3.34 -4.73 2.89 3.02 -1.26 -5.00 115.26 111.41 3dze n ASN 139 Ca 0.02 -1.95 -0.42 0.00 -0.03 0.00 0.00 54.58 52.21 3dze n ASN 139 Cb 0.22 -0.28 -0.03 0.00 -0.61 0.00 0.00 39.78 39.08 3dze n ASN 139 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3dze s LEU 140 N -1.21 4.37 -0.05 3.41 2.96 -0.58 -4.53 118.68 123.06 3dze s LEU 140 Ca 0.36 2.73 0.11 0.00 -0.22 0.00 0.00 54.13 57.11 3dze s LEU 140 Cb 0.20 -3.61 -0.16 0.00 0.50 0.00 0.00 46.19 43.11 3dze s LEU 140 CO 0.27 -0.83 0.18 0.29 -1.32 0.00 0.00 176.35 174.94 3dze n LYS 141 N 3.16 1.04 -3.76 1.98 5.02 0.58 -4.48 118.16 121.69 3dze n LYS 141 Ca 0.11 -0.07 -0.15 0.00 -2.02 0.00 0.00 58.31 56.18 3dze n LYS 141 Cb 0.38 -1.28 -0.15 0.00 -0.02 0.00 0.00 35.03 33.96 3dze n LYS 141 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3dze s TYR 142 N -2.61 -0.05 -0.06 2.13 5.04 -0.96 -1.14 117.35 119.69 3dze s TYR 142 Ca -0.05 0.29 -0.01 0.00 -2.44 0.00 0.00 57.07 54.86 3dze s TYR 142 Cb 0.06 -0.19 0.03 0.00 0.35 0.00 0.00 41.96 42.21 3dze s TYR 142 CO 0.47 -0.13 0.01 -1.17 -1.34 0.00 0.00 175.55 173.39 3dze s LEU 143 N 1.19 0.64 -0.18 6.97 2.96 -0.39 -1.28 118.68 128.59 3dze s LEU 143 Ca -0.08 -0.05 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 3dze s LEU 143 Cb -0.12 -0.36 0.01 0.00 0.50 0.00 0.00 46.19 46.22 3dze s LEU 143 CO -0.04 -0.18 -0.18 0.12 -1.32 0.00 0.00 176.35 174.75 3dze s PHE 144 N 1.80 2.80 -0.10 5.38 5.36 -0.52 -0.75 117.98 131.93 3dze s PHE 144 Ca 0.02 -1.51 0.04 0.00 -0.96 0.00 0.00 56.93 54.51 3dze s PHE 144 Cb -0.13 -1.94 -0.00 0.00 -0.34 0.00 0.00 43.02 40.62 3dze s PHE 144 CO -0.04 -0.75 -0.23 -0.51 -1.46 0.00 0.00 175.22 172.23 3dze s LEU 145 N 1.27 2.12 -0.10 6.12 1.43 -0.37 -0.76 118.68 128.39 3dze s LEU 145 Ca 0.04 -0.55 -0.06 0.00 -1.03 0.00 0.00 54.13 52.53 3dze s LEU 145 Cb -0.13 -1.42 0.04 0.00 0.03 0.00 0.00 46.19 44.70 3dze s LEU 145 CO -0.10 0.16 0.23 -0.55 0.23 0.00 0.00 176.35 176.31 3dze s SER 146 N 0.36 -0.24 -1.17 2.29 0.15 -0.57 -0.61 113.70 113.90 3dze s SER 146 Ca -0.18 0.49 -0.06 0.00 0.70 0.00 0.00 55.95 56.90 3dze s SER 146 Cb -0.18 0.40 -0.02 0.00 -1.71 0.00 0.00 66.02 64.51 3dze s SER 146 CO 0.08 -0.15 0.84 -0.67 1.20 0.00 0.00 173.24 174.55 3dze n ASP 147 N 3.96 -3.79 -3.97 5.45 2.03 -0.64 -0.80 116.55 118.80 3dze n ASP 147 Ca -0.23 -0.78 -0.31 0.00 0.52 0.00 0.00 54.79 53.99 3dze n ASP 147 Cb 0.54 -4.51 -0.12 0.00 -0.72 0.00 0.00 41.12 36.31 3dze n ASP 147 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3dze s LEU 148 N -6.18 4.74 0.62 -2.67 1.43 -1.26 -2.62 118.68 112.74 3dze s LEU 148 Ca 0.23 -3.37 0.40 0.00 -1.03 0.00 0.00 54.13 50.36 3dze s LEU 148 Cb -0.05 -1.69 2.03 0.00 0.03 0.00 0.00 46.19 46.51 3dze s LEU 148 CO 0.78 -0.19 2.23 1.55 0.23 0.00 0.00 176.35 180.95 3dze h PRO 149 N 6.11 0.00 0.00 1.29 0.13 -1.85 -0.60 132.00 137.09 3dze h PRO 149 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 3dze h PRO 149 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 3dze h PRO 149 CO 0.72 0.01 0.00 0.41 -0.23 0.00 0.00 178.00 178.91 3dze n GLY 150 N -0.69 -1.33 3.42 1.56 0.00 -1.24 -4.53 105.19 102.37 3dze n GLY 150 Ca -0.02 -0.09 -0.44 0.00 0.00 0.00 0.00 46.02 45.47 3dze n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dze s VAL 151 N -2.93 4.53 -0.55 1.61 1.01 -0.23 -3.70 120.40 120.14 3dze s VAL 151 Ca 0.14 -0.68 0.22 0.00 0.00 0.00 0.00 61.98 61.66 3dze s VAL 151 Cb 0.17 -4.63 -0.22 0.00 0.00 0.00 0.00 36.38 31.70 3dze s VAL 151 CO 0.45 -1.35 0.82 0.29 0.00 0.00 0.00 175.10 175.31 3dze n LYS 152 N 7.13 0.31 -3.10 2.72 4.76 -1.26 -4.60 118.16 124.12 3dze n LYS 152 Ca -0.04 -0.06 -0.25 0.00 -2.87 0.00 0.00 58.31 55.10 3dze n LYS 152 Cb 0.45 -1.54 -0.05 0.00 -1.84 0.00 0.00 35.03 32.05 3dze n LYS 152 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3dze n GLU 153 N -1.92 2.38 0.24 1.97 -0.58 -1.26 -4.92 120.64 116.55 3dze n GLU 153 Ca 0.01 -4.34 0.07 0.00 -0.42 0.00 0.00 57.16 52.47 3dze n GLU 153 Cb 0.45 -2.03 0.57 0.00 -0.57 0.00 0.00 31.44 29.85 3dze n GLU 153 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 3dze h LYS 154 N 3.24 0.00 -0.07 3.49 2.10 -1.90 -1.76 116.57 121.67 3dze h LYS 154 Ca 0.13 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.63 3dze h LYS 154 Cb 0.67 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.99 3dze h LYS 154 CO 0.72 0.12 -0.60 0.93 -2.00 0.00 0.00 179.45 178.61 3dze h GLU 155 N 0.00 0.25 -0.35 0.07 3.07 -1.99 -1.45 114.58 114.19 3dze h GLU 155 Ca -0.00 -0.17 -0.09 0.00 -0.50 0.00 0.00 59.36 58.60 3dze h GLU 155 Cb 0.22 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.14 3dze h GLU 155 CO 0.02 0.78 -0.15 0.87 -1.40 0.00 0.00 179.01 179.13 3dze h LYS 156 N 0.19 0.62 -0.05 2.33 1.57 -1.75 -1.81 116.57 117.66 3dze h LYS 156 Ca -0.01 -0.20 -0.00 0.00 -1.87 0.00 0.00 60.65 58.57 3dze h LYS 156 Cb 1.11 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.36 3dze h LYS 156 CO 0.09 0.74 0.03 0.82 -0.57 0.00 0.00 179.45 180.57 3dze h ILE 157 N 0.56 1.05 -0.34 1.86 2.04 -1.08 -0.22 117.51 121.38 3dze h ILE 157 Ca 0.10 -0.13 0.05 0.00 1.00 0.00 0.00 64.86 65.88 3dze h ILE 157 Cb 0.58 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.65 3dze h ILE 157 CO 0.04 0.04 0.04 0.58 0.00 0.00 0.00 178.15 178.85 3dze h VAL 158 N 0.03 0.80 -0.30 1.67 2.07 -1.06 -0.95 116.25 118.50 3dze h VAL 158 Ca 0.02 -0.05 -0.11 0.00 0.82 0.00 0.00 66.70 67.38 3dze h VAL 158 Cb 0.04 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 3dze h VAL 158 CO -0.00 0.03 -0.26 1.56 0.02 0.00 0.00 177.57 178.91 3dze h GLN 159 N 0.15 0.60 -0.24 1.57 1.08 -1.18 -0.87 115.11 116.22 3dze h GLN 159 Ca 0.16 -0.24 0.01 0.00 -1.45 0.00 0.00 58.65 57.13 3dze h GLN 159 Cb 0.20 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 3dze h GLN 159 CO -0.24 0.81 0.12 0.00 -0.95 0.00 0.00 178.83 178.57 3dze h ALA 160 N 1.19 0.28 0.00 3.87 0.00 -0.58 -1.91 119.26 122.11 3dze h ALA 160 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3dze h ALA 160 Cb 0.73 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 3dze h ALA 160 CO 0.06 -0.28 -0.16 0.74 0.00 0.00 0.00 179.25 179.60 3dze h PHE 161 N 0.26 0.00 0.00 0.00 0.04 -1.01 -1.39 116.94 114.83 3dze h PHE 161 Ca 0.10 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.77 3dze h PHE 161 Cb 0.02 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 3dze h PHE 161 CO -0.09 0.16 -0.45 0.87 -0.60 0.00 0.00 178.31 178.20 3dze h LYS 162 N 0.00 0.00 0.03 1.51 1.57 -0.38 0.17 116.57 119.46 3dze h LYS 162 Ca -0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 3dze h LYS 162 Cb 0.89 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 3dze h LYS 162 CO 0.02 0.45 -0.57 1.15 -0.57 0.00 0.00 179.45 179.93 3dze h THR 163 N 0.00 1.45 0.00 -0.16 2.02 -1.31 -3.28 112.91 111.64 3dze h THR 163 Ca -0.00 -2.33 -0.07 0.00 0.77 0.00 0.00 66.41 64.78 3dze h THR 163 Cb 0.82 2.99 -0.01 0.00 -1.74 0.00 0.00 68.15 70.21 3dze h THR 163 CO 0.06 0.55 -0.67 0.77 0.37 0.00 0.00 175.52 176.60 3dze h SER 164 N -0.87 0.00 -1.52 4.18 4.64 -1.10 -3.38 113.55 115.51 3dze h SER 164 Ca -0.14 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.71 3dze h SER 164 Cb 1.22 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 62.98 3dze h SER 164 CO -0.04 0.27 -0.96 0.18 -0.87 0.00 0.00 176.83 175.41 3dze n LEU 165 N -3.00 -0.53 0.16 5.97 4.77 0.58 -5.00 117.00 119.94 3dze n LEU 165 Ca -0.00 -4.38 0.12 0.00 -0.03 0.00 0.00 56.01 51.72 3dze n LEU 165 Cb 0.66 0.69 0.58 0.00 -2.33 0.00 0.00 43.42 43.03 3dze n LEU 165 CO 0.39 2.07 0.86 1.55 -1.33 0.00 0.00 177.39 180.92 3dze h PRO 166 N 3.93 0.00 -0.24 3.23 0.13 -1.61 -1.10 132.00 136.34 3dze h PRO 166 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3dze h PRO 166 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 3dze h PRO 166 CO 0.43 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.07 3dze n SER 167 N -2.30 2.76 -4.73 1.44 3.41 -1.26 -4.93 113.62 108.01 3dze n SER 167 Ca -0.00 -1.89 -0.42 0.00 -0.26 0.00 0.00 58.87 56.30 3dze n SER 167 Cb 0.10 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 63.87 3dze n SER 167 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3dze s LEU 168 N -1.63 4.40 -0.49 1.04 2.96 -0.42 -4.87 118.68 119.67 3dze s LEU 168 Ca 0.35 2.30 -0.24 0.00 -0.22 0.00 0.00 54.13 56.32 3dze s LEU 168 Cb 0.21 -3.60 0.03 0.00 0.50 0.00 0.00 46.19 43.33 3dze s LEU 168 CO 0.30 -0.53 0.88 -0.70 -1.32 0.00 0.00 176.35 174.98 3dze s GLU 169 N 0.39 3.40 -0.34 1.98 2.12 -0.29 -4.99 118.70 120.97 3dze s GLU 169 Ca 0.59 -0.12 -0.09 0.00 0.36 0.00 0.00 54.97 55.71 3dze s GLU 169 Cb -0.35 -3.98 0.02 0.00 0.26 0.00 0.00 34.13 30.08 3dze s GLU 169 CO 0.34 -1.29 0.14 -1.17 -0.54 0.00 0.00 175.26 172.75 3dze s LEU 170 N 3.64 4.30 -0.22 2.70 2.96 -1.26 -1.26 118.68 129.54 3dze s LEU 170 Ca 0.31 -0.88 -0.06 0.00 -0.22 0.00 0.00 54.13 53.29 3dze s LEU 170 Cb -0.12 -1.95 -0.02 0.00 0.50 0.00 0.00 46.19 44.60 3dze s LEU 170 CO 0.22 -0.29 0.02 -0.75 -1.32 0.00 0.00 176.35 174.23 3dze s LYS 171 N 1.51 3.59 -0.17 1.98 2.20 0.07 -5.00 119.74 123.93 3dze s LYS 171 Ca 0.02 -0.52 0.01 0.00 -0.36 0.00 0.00 55.97 55.12 3dze s LYS 171 Cb -0.18 -3.15 0.02 0.00 -1.51 0.00 0.00 37.83 33.01 3dze s LYS 171 CO 0.05 -0.09 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.24 3dze s LEU 172 N 1.27 2.13 -0.66 5.43 1.43 -1.26 -1.24 118.68 125.78 3dze s LEU 172 Ca 0.04 -0.64 0.06 0.00 -1.03 0.00 0.00 54.13 52.55 3dze s LEU 172 Cb -0.15 -1.47 0.24 0.00 0.03 0.00 0.00 46.19 44.84 3dze s LEU 172 CO 0.01 0.01 0.74 0.47 0.23 0.00 0.00 176.35 177.82 3dze n ASP 173 N 4.53 3.78 -4.23 2.29 8.00 0.22 -5.01 116.55 126.13 3dze n ASP 173 Ca -0.21 -3.42 -0.24 0.00 0.71 0.00 0.00 54.79 51.63 3dze n ASP 173 Cb 0.50 -0.70 -0.14 0.00 -0.02 0.00 0.00 41.12 40.76 3dze n ASP 173 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dze s LEU 174 N -2.37 2.18 0.00 0.64 1.43 -1.26 -1.62 118.68 117.68 3dze s LEU 174 Ca 0.38 -0.52 0.13 0.00 -1.03 0.00 0.00 54.13 53.09 3dze s LEU 174 Cb 0.12 -0.90 0.76 0.00 0.03 0.00 0.00 46.19 46.20 3dze s LEU 174 CO -0.03 0.13 1.19 0.29 0.23 0.00 0.00 176.35 178.16