#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zex n ALA 1 N 0.00 2.10 -2.50 4.61 0.00 -1.26 -4.93 120.51 118.53 2zex n ALA 1 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 53.44 53.29 2zex n ALA 1 Cb 0.00 -1.43 -0.11 0.00 0.00 0.00 0.00 19.45 17.92 2zex n ALA 1 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2zex s HIS 2 N -3.11 0.84 -0.22 0.00 4.02 -1.26 -5.13 115.29 110.43 2zex s HIS 2 Ca 0.10 -0.71 -0.06 0.00 1.02 0.00 0.00 55.06 55.41 2zex s HIS 2 Cb 0.13 -0.48 -0.03 0.00 -1.02 0.00 0.00 32.58 31.18 2zex s HIS 2 CO 0.50 -0.10 0.04 1.41 1.02 0.00 0.00 174.74 177.62 2zex s MET 3 N -2.76 3.67 -0.17 1.40 -2.45 -1.26 -5.08 119.30 112.64 2zex s MET 3 Ca 0.02 -0.48 -0.26 0.00 -1.25 0.00 0.00 55.69 53.72 2zex s MET 3 Cb -0.02 -3.22 -0.01 0.00 1.25 0.00 0.00 34.83 32.83 2zex s MET 3 CO -0.02 -0.06 0.89 0.08 1.05 0.00 0.00 175.02 176.96 2zex s VAL 4 N 1.25 4.83 -0.18 10.11 1.01 -1.26 -4.98 120.40 131.19 2zex s VAL 4 Ca 0.04 1.75 -0.08 0.00 0.00 0.00 0.00 61.98 63.69 2zex s VAL 4 Cb -0.15 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.01 2zex s VAL 4 CO 0.03 -0.01 0.07 0.21 0.00 0.00 0.00 175.10 175.39 2zex s ASN 5 N 1.17 5.69 0.00 3.32 2.47 -1.26 -1.13 114.94 125.20 2zex s ASN 5 Ca 0.40 0.10 0.23 0.00 0.42 0.00 0.00 52.86 54.02 2zex s ASN 5 Cb -0.16 -1.97 0.22 0.00 -1.45 0.00 0.00 41.25 37.89 2zex s ASN 5 CO 0.12 0.18 1.21 0.23 -3.72 0.00 0.00 177.10 175.13 2zex n MET 6 N 3.47 0.25 -3.02 0.43 2.81 0.77 -4.88 117.12 116.95 2zex n MET 6 Ca -0.17 -0.18 -0.41 0.00 -1.81 0.00 0.00 57.70 55.13 2zex n MET 6 Cb 0.52 -1.50 -0.05 0.00 -0.71 0.00 0.00 33.22 31.48 2zex n MET 6 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2zex s VAL 7 N -2.87 4.95 0.21 2.03 1.01 -1.26 -4.92 120.40 119.55 2zex s VAL 7 Ca 0.13 1.35 -0.30 0.00 0.00 0.00 0.00 61.98 63.16 2zex s VAL 7 Cb 0.17 -4.02 -0.08 0.00 0.00 0.00 0.00 36.38 32.45 2zex s VAL 7 CO 0.72 0.04 1.06 -0.44 0.00 0.00 0.00 175.10 176.49 2zex s SER 8 N 1.26 7.35 -1.23 3.32 0.01 -1.26 -3.91 113.70 119.23 2zex s SER 8 Ca 0.32 2.09 -0.07 0.00 1.31 0.00 0.00 55.95 59.59 2zex s SER 8 Cb -0.16 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.45 2zex s SER 8 CO 0.10 -0.13 0.72 -3.20 0.41 0.00 0.00 173.24 171.14 2zex n ASN 9 N 1.95 -3.02 0.26 2.44 5.15 -1.26 -4.87 115.26 115.90 2zex n ASN 9 Ca 0.01 -0.89 0.15 0.00 -0.60 0.00 0.00 54.58 53.24 2zex n ASN 9 Cb 0.46 -3.85 0.66 0.00 -0.53 0.00 0.00 39.78 36.52 2zex n ASN 9 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2zex h PRO 10 N -1.78 0.00 -0.47 1.20 0.13 -1.81 -2.65 132.00 126.63 2zex h PRO 10 Ca -0.63 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 2zex h PRO 10 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2zex h PRO 10 CO 0.53 0.09 0.00 0.41 -0.23 0.00 0.00 178.00 178.80 2zex n GLY 11 N -0.10 2.23 2.53 1.56 0.00 -1.26 -1.08 105.19 109.07 2zex n GLY 11 Ca -0.00 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.23 2zex n GLY 11 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2zex n PHE 12 N 1.11 -0.05 0.26 1.61 3.72 -1.00 -4.51 117.46 118.61 2zex n PHE 12 Ca 0.17 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.73 2zex n PHE 12 Cb 0.52 -3.36 0.58 0.00 -0.94 0.00 0.00 39.48 36.28 2zex n PHE 12 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2zex h GLU 13 N 0.00 0.00 -0.99 -1.08 4.39 -1.83 -1.41 114.58 113.66 2zex h GLU 13 Ca -0.40 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 58.72 2zex h GLU 13 Cb 1.30 0.00 -0.30 0.00 -0.10 0.00 0.00 28.75 29.65 2zex h GLU 13 CO 0.59 0.02 0.73 -0.25 -1.16 0.00 0.00 179.01 178.94 2zex n ASP 14 N -3.11 5.36 0.00 1.42 8.00 -1.26 -4.97 116.55 121.98 2zex n ASP 14 Ca 0.01 -3.69 0.00 0.00 0.71 0.00 0.00 54.79 51.82 2zex n ASP 14 Cb 0.36 -0.89 0.00 0.00 -0.02 0.00 0.00 41.12 40.57 2zex n ASP 14 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2zex n GLY 15 N -1.05 2.24 0.95 0.44 0.00 -0.53 -2.16 105.19 105.08 2zex n GLY 15 Ca 0.61 -0.44 0.07 0.00 0.00 0.00 0.00 46.02 46.27 2zex n GLY 15 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2zex n LEU 16 N 0.00 2.77 -4.63 0.99 4.77 -1.26 -4.61 117.00 115.03 2zex n LEU 16 Ca 0.00 -1.39 -0.46 0.00 -0.03 0.00 0.00 56.01 54.13 2zex n LEU 16 Cb 0.00 -0.36 -0.03 0.00 -2.33 0.00 0.00 43.42 40.70 2zex n LEU 16 CO 0.00 0.63 0.85 0.47 -1.33 0.00 0.00 177.39 178.01 2zex n ASP 17 N 0.86 2.06 0.00 -1.43 9.92 -0.92 -1.56 116.55 125.49 2zex n ASP 17 Ca 0.16 1.15 0.00 0.00 -0.53 0.00 0.00 54.79 55.57 2zex n ASP 17 Cb 0.46 -1.33 0.00 0.00 -0.64 0.00 0.00 41.12 39.61 2zex n ASP 17 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2zex n SER 18 N 1.95 0.00 -4.51 -2.24 7.64 -1.26 -4.70 113.62 110.49 2zex n SER 18 Ca 0.12 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.67 2zex n SER 18 Cb 0.29 -0.38 -0.12 0.00 -1.01 0.00 0.00 64.21 62.99 2zex n SER 18 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2zex s TRP 19 N -3.06 2.97 0.06 1.43 0.52 -0.60 -4.66 118.94 115.60 2zex s TRP 19 Ca 0.00 -0.23 -0.24 0.00 0.02 0.00 0.00 56.10 55.65 2zex s TRP 19 Cb 0.00 -1.86 -0.06 0.00 -1.15 0.00 0.00 33.47 30.40 2zex s TRP 19 CO 0.00 0.07 0.72 -0.65 0.02 0.00 0.00 176.95 177.11 2zex s GLN 20 N -0.05 4.45 -0.59 4.98 -0.21 0.26 -4.91 119.66 123.60 2zex s GLN 20 Ca 0.01 0.99 -0.09 0.00 0.02 0.00 0.00 55.36 56.29 2zex s GLN 20 Cb -0.13 -3.33 0.15 0.00 1.00 0.00 0.00 33.01 30.69 2zex s GLN 20 CO 0.03 0.37 0.46 0.34 -2.12 0.00 0.00 175.29 174.37 2zex s ASP 21 N -0.32 5.81 0.21 5.90 -1.08 -1.26 -2.13 116.67 123.79 2zex s ASP 21 Ca 0.36 -2.32 0.02 0.00 -0.52 0.00 0.00 52.55 50.09 2zex s ASP 21 Cb -0.20 -2.01 0.17 0.00 -1.46 0.00 0.00 42.92 39.42 2zex s ASP 21 CO 0.22 -0.59 1.51 -0.50 0.52 0.00 0.00 175.17 176.34 2zex h TRP 22 N 7.95 0.41 -0.09 -5.34 6.55 -1.77 -3.26 115.95 120.39 2zex h TRP 22 Ca -0.10 -0.16 0.00 0.00 0.95 0.00 0.00 58.89 59.58 2zex h TRP 22 Cb 1.03 -0.07 0.00 0.00 -0.86 0.00 0.00 29.16 29.27 2zex h TRP 22 CO 0.74 0.86 0.00 1.04 -1.05 0.00 0.00 178.44 180.03 2zex n GLN 23 N -3.86 2.17 -3.85 0.49 3.00 -1.25 -4.99 117.38 109.09 2zex n GLN 23 Ca -0.03 -2.36 -0.25 0.00 -0.01 0.00 0.00 57.00 54.36 2zex n GLN 23 Cb 0.65 -1.45 0.00 0.00 0.00 0.00 0.00 30.24 29.44 2zex n GLN 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2zex n GLN 24 N -0.84 -3.56 -0.71 -1.09 1.13 -1.23 -4.88 117.38 106.20 2zex n GLN 24 Ca 0.13 0.48 0.01 0.00 -1.94 0.00 0.00 57.00 55.68 2zex n GLN 24 Cb 0.59 -4.68 0.00 0.00 0.11 0.00 0.00 30.24 26.26 2zex n GLN 24 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2zex n ASP 25 N -2.98 0.20 -4.36 1.08 2.03 -1.26 -5.08 116.55 106.18 2zex n ASP 25 Ca -0.29 -1.96 -0.31 0.00 0.52 0.00 0.00 54.79 52.75 2zex n ASP 25 Cb 0.67 -0.21 -0.15 0.00 -0.72 0.00 0.00 41.12 40.72 2zex n ASP 25 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2zex s MET 26 N 0.00 1.97 -0.04 -0.67 -1.94 -1.26 -1.42 119.30 115.94 2zex s MET 26 Ca 0.07 -1.02 -0.12 0.00 -1.71 0.00 0.00 55.69 52.91 2zex s MET 26 Cb 0.08 -2.05 0.02 0.00 2.01 0.00 0.00 34.83 34.89 2zex s MET 26 CO -0.03 0.54 0.27 -1.54 -0.01 0.00 0.00 175.02 174.25 2zex s SER 27 N -1.06 -0.18 -0.42 3.03 1.04 -0.58 -5.01 113.70 110.51 2zex s SER 27 Ca 0.12 0.18 -0.16 0.00 0.48 0.00 0.00 55.95 56.56 2zex s SER 27 Cb -0.10 0.38 0.03 0.00 0.10 0.00 0.00 66.02 66.42 2zex s SER 27 CO 0.02 -0.33 0.38 0.00 0.98 0.00 0.00 173.24 174.28 2zex s ALA 28 N -0.91 3.46 0.04 5.32 0.00 -1.26 -0.41 121.76 128.00 2zex s ALA 28 Ca -0.10 -1.65 0.01 0.00 0.00 0.00 0.00 51.96 50.22 2zex s ALA 28 Cb -0.05 -2.99 -0.03 0.00 0.00 0.00 0.00 23.12 20.06 2zex s ALA 28 CO 0.03 -1.55 -0.06 0.14 0.00 0.00 0.00 175.76 174.32 2zex s VAL 29 N 1.91 0.40 0.35 0.00 -7.23 -0.35 -4.88 120.40 110.60 2zex s VAL 29 Ca 0.08 -1.22 0.06 0.00 -1.81 0.00 0.00 61.98 59.09 2zex s VAL 29 Cb -0.18 -0.75 0.30 0.00 0.56 0.00 0.00 36.38 36.31 2zex s VAL 29 CO 0.11 -0.55 1.91 -0.65 -0.31 0.00 0.00 175.10 175.62 2zex h PRO 30 N 4.19 0.76 -1.04 4.82 0.11 -1.86 -1.63 132.00 137.35 2zex h PRO 30 Ca -0.34 -0.05 0.27 0.00 0.11 0.00 0.00 66.00 65.99 2zex h PRO 30 Cb 1.19 -0.17 -0.09 0.00 0.11 0.00 0.00 31.00 32.04 2zex h PRO 30 CO 0.47 0.51 0.68 1.49 -0.21 0.00 0.00 178.00 180.93 2zex h GLU 31 N 0.79 0.34 -0.32 1.05 4.81 -1.92 -1.13 114.58 118.19 2zex h GLU 31 Ca 0.39 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.60 2zex h GLU 31 Cb 0.45 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2zex h GLU 31 CO -0.16 0.23 0.00 0.00 -0.73 0.00 0.00 179.01 178.35 2zex n ALA 32 N -2.50 2.45 -2.33 2.92 0.00 -0.90 -4.96 120.51 115.19 2zex n ALA 32 Ca 0.25 -0.83 -0.42 0.00 0.00 0.00 0.00 53.44 52.44 2zex n ALA 32 Cb 0.90 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 19.37 2zex n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zex s ALA 33 N -1.59 3.33 -0.15 0.00 0.00 -0.43 -3.90 121.76 119.04 2zex s ALA 33 Ca 0.36 0.77 0.18 0.00 0.00 0.00 0.00 51.96 53.27 2zex s ALA 33 Cb 0.21 -3.38 -0.27 0.00 0.00 0.00 0.00 23.12 19.68 2zex s ALA 33 CO 0.29 -0.29 0.18 1.58 0.00 0.00 0.00 175.76 177.52 2zex n HIS 34 N 3.28 0.00 -3.83 0.00 -0.00 -1.26 -4.89 115.22 108.52 2zex n HIS 34 Ca 0.06 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.12 2zex n HIS 34 Cb 0.47 -0.83 -0.10 0.00 -0.12 0.00 0.00 29.99 29.42 2zex n HIS 34 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 2zex s ASN 35 N -5.12 -0.09 0.39 0.26 2.47 -1.26 -5.12 114.94 106.47 2zex s ASN 35 Ca -0.09 0.04 0.00 0.00 0.42 0.00 0.00 52.86 53.23 2zex s ASN 35 Cb 0.08 0.30 0.00 0.00 -1.45 0.00 0.00 41.25 40.18 2zex s ASN 35 CO 0.82 -0.30 0.00 0.61 -3.72 0.00 0.00 177.10 174.51 2zex n GLY 36 N 1.85 -0.34 0.11 1.21 0.00 -1.26 -4.23 105.19 102.53 2zex n GLY 36 Ca -0.20 -1.06 0.09 0.00 0.00 0.00 0.00 46.02 44.85 2zex n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zex h ALA 37 N -0.39 0.54 -2.53 4.61 0.00 -1.96 -3.48 119.26 116.05 2zex h ALA 37 Ca 0.00 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 2zex h ALA 37 Cb 0.00 0.05 -0.17 0.00 0.00 0.00 0.00 17.79 17.67 2zex h ALA 37 CO 0.00 0.18 -0.62 -0.51 0.00 0.00 0.00 179.25 178.29 2zex s LEU 38 N -5.47 2.18 0.30 0.00 1.43 -1.26 -3.95 118.68 111.91 2zex s LEU 38 Ca -0.01 -0.73 0.05 0.00 -1.03 0.00 0.00 54.13 52.41 2zex s LEU 38 Cb 0.09 0.34 -0.03 0.00 0.03 0.00 0.00 46.19 46.62 2zex s LEU 38 CO 0.79 -0.51 0.22 -0.83 0.23 0.00 0.00 176.35 176.25 2zex s GLY 39 N -2.36 2.12 -0.18 -3.19 0.00 -0.66 -4.40 107.32 98.65 2zex s GLY 39 Ca -0.02 -1.91 -0.18 0.00 0.00 0.00 0.00 44.72 42.61 2zex s GLY 39 CO -0.06 -1.49 0.50 -2.27 0.00 0.00 0.00 173.10 169.78 2zex s LEU 40 N -3.34 4.18 -0.23 0.66 2.96 -0.22 -1.21 118.68 121.48 2zex s LEU 40 Ca 0.39 0.70 -0.07 0.00 -0.22 0.00 0.00 54.13 54.92 2zex s LEU 40 Cb 0.04 -2.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.00 2zex s LEU 40 CO 0.22 -0.13 0.07 -0.75 -1.32 0.00 0.00 176.35 174.44 2zex s LYS 41 N 1.39 3.74 -0.31 1.98 2.20 0.45 -1.11 119.74 128.09 2zex s LYS 41 Ca 0.24 -0.44 -0.09 0.00 -0.36 0.00 0.00 55.97 55.32 2zex s LYS 41 Cb -0.15 -3.29 0.00 0.00 -1.51 0.00 0.00 37.83 32.88 2zex s LYS 41 CO 0.10 -0.06 0.13 0.42 -0.36 0.00 0.00 175.35 175.57 2zex s ILE 42 N 1.28 4.35 0.35 5.43 1.01 0.34 -1.53 121.20 132.43 2zex s ILE 42 Ca 0.05 -0.55 -0.27 0.00 0.00 0.00 0.00 60.65 59.88 2zex s ILE 42 Cb -0.15 -3.24 -0.09 0.00 0.01 0.00 0.00 42.46 39.00 2zex s ILE 42 CO 0.03 0.06 1.22 -0.83 0.00 0.00 0.00 174.94 175.43 2zex s GLY 43 N 1.57 2.96 1.03 6.18 0.00 -0.51 -1.51 107.32 117.05 2zex s GLY 43 Ca 0.04 1.10 -0.14 0.00 0.00 0.00 0.00 44.72 45.71 2zex s GLY 43 CO 0.05 1.69 1.12 -0.32 0.00 0.00 0.00 173.10 175.64 2zex s GLY 44 N -0.80 1.58 0.00 0.20 0.00 -1.22 -4.51 107.32 102.57 2zex s GLY 44 Ca 0.52 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.61 2zex s GLY 44 CO 0.46 0.06 0.00 0.61 0.00 0.00 0.00 173.10 174.22 2zex n GLY 45 N -1.52 1.66 3.40 0.20 0.00 0.17 -4.93 105.19 104.16 2zex n GLY 45 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 2zex n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2zex s LYS 46 N -0.83 1.15 0.23 1.61 -2.85 -1.26 -4.88 119.74 112.90 2zex s LYS 46 Ca 0.00 -0.40 -0.30 0.00 -1.00 0.00 0.00 55.97 54.26 2zex s LYS 46 Cb 0.00 0.52 -0.10 0.00 -2.06 0.00 0.00 37.83 36.20 2zex s LYS 46 CO 0.00 -0.46 1.43 0.00 0.10 0.00 0.00 175.35 176.42 2zex s ALA 47 N -3.21 3.62 0.10 0.59 0.00 -1.25 -4.75 121.76 116.87 2zex s ALA 47 Ca -0.01 1.29 -0.25 0.00 0.00 0.00 0.00 51.96 52.99 2zex s ALA 47 Cb -0.00 -3.55 0.07 0.00 0.00 0.00 0.00 23.12 19.64 2zex s ALA 47 CO -0.08 -0.71 0.65 0.00 0.00 0.00 0.00 175.76 175.63 2zex s ALA 48 N 0.15 -1.66 0.00 0.00 0.00 -0.82 -4.97 121.76 114.46 2zex s ALA 48 Ca 0.60 0.70 0.00 0.00 0.00 0.00 0.00 51.96 53.26 2zex s ALA 48 Cb -0.41 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.37 2zex s ALA 48 CO 0.41 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.89 2zex n GLY 49 N -0.13 1.20 3.37 0.00 0.00 -1.26 -0.42 105.19 107.94 2zex n GLY 49 Ca -0.16 -0.86 -0.07 0.00 0.00 0.00 0.00 46.02 44.93 2zex n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zex n GLY 50 N 0.00 1.02 2.71 -0.02 0.00 -0.48 -1.93 105.19 106.49 2zex n GLY 50 Ca 0.00 -1.21 0.03 0.00 0.00 0.00 0.00 46.02 44.83 2zex n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2zex n GLY 51 N -0.51 0.28 3.28 -0.02 0.00 -0.91 -0.32 105.19 106.99 2zex n GLY 51 Ca -0.07 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 2zex n GLY 51 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2zex s GLN 52 N -2.01 0.80 0.03 1.61 -2.07 -0.51 -0.58 119.66 116.94 2zex s GLN 52 Ca 0.21 -0.30 -0.20 0.00 -1.82 0.00 0.00 55.36 53.25 2zex s GLN 52 Cb -0.00 0.35 -0.06 0.00 -1.09 0.00 0.00 33.01 32.21 2zex s GLN 52 CO -0.01 -0.25 0.59 -0.51 -1.32 0.00 0.00 175.29 173.79 2zex s ASP 53 N -1.72 7.02 -0.09 12.60 1.01 -1.26 -0.56 116.67 133.67 2zex s ASP 53 Ca -0.09 1.21 -0.00 0.00 0.71 0.00 0.00 52.55 54.39 2zex s ASP 53 Cb -0.02 -2.36 0.02 0.00 1.01 0.00 0.00 42.92 41.56 2zex s ASP 53 CO 0.01 0.18 -0.06 -0.63 0.21 0.00 0.00 175.17 174.87 2zex s ILE 54 N -0.61 0.85 -1.35 0.77 1.01 -0.07 -4.94 121.20 116.86 2zex s ILE 54 Ca 0.30 -0.21 -0.16 0.00 0.00 0.00 0.00 60.65 60.58 2zex s ILE 54 Cb -0.19 -0.88 0.07 0.00 0.01 0.00 0.00 42.46 41.46 2zex s ILE 54 CO 0.18 0.33 1.89 -0.81 0.00 0.00 0.00 174.94 176.53 2zex n PRO 55 N 4.72 3.10 -2.33 2.79 -0.04 -1.26 -3.82 135.00 138.17 2zex n PRO 55 Ca -0.14 -3.08 -0.35 0.00 -0.04 0.00 0.00 63.50 59.89 2zex n PRO 55 Cb 0.50 -3.40 -0.01 0.00 -0.04 0.00 0.00 33.50 30.56 2zex n PRO 55 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2zex s LEU 56 N 3.34 3.79 0.34 1.53 1.43 -1.26 -5.02 118.68 122.83 2zex s LEU 56 Ca 0.51 2.13 -0.23 0.00 -1.03 0.00 0.00 54.13 55.51 2zex s LEU 56 Cb 0.07 -4.55 -0.10 0.00 0.03 0.00 0.00 46.19 41.64 2zex s LEU 56 CO 0.02 -1.09 0.89 -0.54 0.23 0.00 0.00 176.35 175.86 2zex s LYS 57 N -3.23 4.38 0.76 1.70 1.02 -1.26 -5.03 119.74 118.07 2zex s LYS 57 Ca 0.71 1.14 -0.11 0.00 0.02 0.00 0.00 55.97 57.73 2zex s LYS 57 Cb -0.22 -2.60 0.05 0.00 -0.52 0.00 0.00 37.83 34.54 2zex s LYS 57 CO 0.26 0.19 1.10 -1.25 -0.92 0.00 0.00 175.35 174.73 2zex s PRO 58 N -2.46 2.31 -1.49 -1.68 0.04 -1.26 -4.05 135.00 126.42 2zex s PRO 58 Ca 0.53 1.22 -0.12 0.00 0.04 0.00 0.00 61.00 62.67 2zex s PRO 58 Cb -0.15 -1.90 0.08 0.00 0.04 0.00 0.00 34.50 32.57 2zex s PRO 58 CO 0.20 -1.60 0.86 0.09 0.04 0.00 0.00 177.00 176.58 2zex n ASN 59 N -3.35 -4.81 -4.09 6.66 5.03 -0.34 -4.95 115.26 109.41 2zex n ASN 59 Ca 0.09 -0.66 -0.22 0.00 0.87 0.00 0.00 54.58 54.67 2zex n ASN 59 Cb 0.53 -3.86 -0.15 0.00 -1.02 0.00 0.00 39.78 35.28 2zex n ASN 59 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2zex s THR 60 N -3.22 1.05 -0.10 3.41 2.01 -1.25 -4.88 115.64 112.66 2zex s THR 60 Ca 0.59 -0.56 -0.24 0.00 0.31 0.00 0.00 61.69 61.78 2zex s THR 60 Cb -0.29 -0.88 -0.03 0.00 0.01 0.00 0.00 72.50 71.31 2zex s THR 60 CO 0.72 0.30 0.74 -0.89 -0.69 0.00 0.00 174.62 174.80 2zex s THR 61 N -0.29 4.99 0.08 -0.82 2.01 -1.26 -1.11 115.64 119.24 2zex s THR 61 Ca 0.05 1.51 0.07 0.00 0.31 0.00 0.00 61.69 63.63 2zex s THR 61 Cb -0.05 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.35 2zex s THR 61 CO -0.00 0.18 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.59 2zex s TYR 62 N 1.25 1.71 -0.22 4.92 2.02 0.03 -1.50 117.35 125.56 2zex s TYR 62 Ca 0.38 -0.41 -0.02 0.00 -0.37 0.00 0.00 57.07 56.66 2zex s TYR 62 Cb -0.17 -0.96 0.01 0.00 -0.40 0.00 0.00 41.96 40.43 2zex s TYR 62 CO 0.17 0.15 -0.09 0.42 -1.57 0.00 0.00 175.55 174.63 2zex s ILE 63 N -1.06 2.84 -0.13 2.71 -1.09 -0.02 -1.27 121.20 123.18 2zex s ILE 63 Ca 0.06 -0.80 -0.16 0.00 -2.23 0.00 0.00 60.65 57.51 2zex s ILE 63 Cb -0.10 -2.33 -0.04 0.00 -1.58 0.00 0.00 42.46 38.41 2zex s ILE 63 CO 0.03 0.37 0.39 -0.22 -1.23 0.00 0.00 174.94 174.29 2zex s LEU 64 N 1.37 4.27 0.03 2.97 2.96 -0.01 -1.51 118.68 128.77 2zex s LEU 64 Ca 0.04 0.68 -0.05 0.00 -0.22 0.00 0.00 54.13 54.58 2zex s LEU 64 Cb -0.15 -2.55 -0.01 0.00 0.50 0.00 0.00 46.19 43.98 2zex s LEU 64 CO -0.06 0.06 0.08 -0.83 -1.32 0.00 0.00 176.35 174.27 2zex s GLY 65 N 0.50 0.19 -0.01 7.98 0.00 -0.15 -0.78 107.32 115.05 2zex s GLY 65 Ca 0.22 -0.57 -0.28 0.00 0.00 0.00 0.00 44.72 44.09 2zex s GLY 65 CO 0.07 -0.70 0.75 0.00 0.00 0.00 0.00 173.10 173.23 2zex s ALA 66 N -2.50 -1.76 -0.10 3.20 0.00 -0.74 -0.91 121.76 118.95 2zex s ALA 66 Ca -0.06 1.10 -0.02 0.00 0.00 0.00 0.00 51.96 52.99 2zex s ALA 66 Cb -0.02 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.24 2zex s ALA 66 CO -0.04 -0.51 -0.02 -1.58 0.00 0.00 0.00 175.76 173.60 2zex s TRP 67 N -2.16 3.08 0.07 0.00 0.52 -0.84 -1.86 118.94 117.75 2zex s TRP 67 Ca -0.04 0.02 -0.16 0.00 0.02 0.00 0.00 56.10 55.95 2zex s TRP 67 Cb -0.01 -1.83 0.03 0.00 -1.15 0.00 0.00 33.47 30.52 2zex s TRP 67 CO -0.01 0.30 0.37 0.00 0.02 0.00 0.00 176.95 177.63 2zex s ALA 68 N -0.49 -0.85 -0.12 0.98 0.00 -0.42 -1.41 121.76 119.45 2zex s ALA 68 Ca 0.08 0.06 -0.25 0.00 0.00 0.00 0.00 51.96 51.85 2zex s ALA 68 Cb -0.12 0.46 0.06 0.00 0.00 0.00 0.00 23.12 23.52 2zex s ALA 68 CO 0.02 -0.51 0.61 -1.59 0.00 0.00 0.00 175.76 174.30 2zex s LYS 69 N -3.01 0.89 0.26 0.00 -2.85 -0.36 -1.35 119.74 113.31 2zex s LYS 69 Ca -0.02 0.44 -0.13 0.00 -1.00 0.00 0.00 55.97 55.25 2zex s LYS 69 Cb 0.00 0.42 -0.08 0.00 -2.06 0.00 0.00 37.83 36.11 2zex s LYS 69 CO -0.06 -0.22 0.65 -0.06 0.10 0.00 0.00 175.35 175.76 2zex s PHE 70 N -0.63 3.44 -2.35 1.78 0.08 0.10 -0.48 117.98 119.93 2zex s PHE 70 Ca -0.07 1.09 0.29 0.00 0.12 0.00 0.00 56.93 58.36 2zex s PHE 70 Cb -0.02 -2.42 1.22 0.00 -0.57 0.00 0.00 43.02 41.22 2zex s PHE 70 CO 0.06 0.22 1.84 -0.40 -0.10 0.00 0.00 175.22 176.84 2zex n ASP 71 N -0.04 1.15 -3.84 1.36 5.75 -0.12 -4.30 116.55 116.50 2zex n ASP 71 Ca 0.01 -1.35 -0.07 0.00 -0.01 0.00 0.00 54.79 53.37 2zex n ASP 71 Cb 0.52 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.60 2zex n ASP 71 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2zex s SER 72 N -2.03 -0.25 0.04 -1.12 1.04 -1.26 -4.93 113.70 105.18 2zex s SER 72 Ca 0.39 -0.58 -0.30 0.00 0.48 0.00 0.00 55.95 55.95 2zex s SER 72 Cb 0.21 0.70 -0.09 0.00 0.10 0.00 0.00 66.02 66.94 2zex s SER 72 CO 0.35 -1.29 1.91 -0.75 0.98 0.00 0.00 173.24 174.45 2zex s LYS 73 N -3.84 4.15 0.59 4.02 2.47 -1.26 -4.79 119.74 121.07 2zex s LYS 73 Ca 0.11 2.56 -0.08 0.00 -1.56 0.00 0.00 55.97 57.00 2zex s LYS 73 Cb -0.05 -4.07 -0.02 0.00 -1.46 0.00 0.00 37.83 32.23 2zex s LYS 73 CO 0.06 -0.93 0.94 -1.25 0.16 0.00 0.00 175.35 174.34 2zex s PRO 74 N 4.18 3.32 -0.09 4.03 0.04 -1.26 -4.79 135.00 140.43 2zex s PRO 74 Ca 0.86 0.39 -0.16 0.00 0.04 0.00 0.00 61.00 62.13 2zex s PRO 74 Cb -0.42 -2.19 -0.28 0.00 0.04 0.00 0.00 34.50 31.65 2zex s PRO 74 CO 0.40 -0.57 0.59 0.00 0.04 0.00 0.00 177.00 177.46 2zex h ALA 75 N -0.19 0.15 -3.00 8.56 0.00 -1.96 -3.49 119.26 119.34 2zex h ALA 75 Ca -0.45 -1.06 0.00 0.00 0.00 0.00 0.00 54.91 53.40 2zex h ALA 75 Cb 1.22 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.45 2zex h ALA 75 CO 0.62 0.81 0.00 0.41 0.00 0.00 0.00 179.25 181.08 2zex n GLY 76 N 1.74 2.73 3.28 0.00 0.00 -1.26 -5.06 105.19 106.63 2zex n GLY 76 Ca -0.24 -1.55 -0.15 0.00 0.00 0.00 0.00 46.02 44.07 2zex n GLY 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2zex s THR 77 N 4.64 0.32 -0.14 2.61 -4.23 -1.26 -4.80 115.64 112.77 2zex s THR 77 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2zex s THR 77 Cb 0.00 -2.57 -0.01 0.00 1.34 0.00 0.00 72.50 71.27 2zex s THR 77 CO 0.00 0.00 -0.15 0.12 -0.54 0.00 0.00 174.62 174.05 2zex s PHE 78 N -3.86 2.77 -0.06 3.99 5.36 0.04 -2.40 117.98 123.82 2zex s PHE 78 Ca 0.38 -0.86 0.05 0.00 -0.96 0.00 0.00 56.93 55.54 2zex s PHE 78 Cb 0.07 -1.85 -0.01 0.00 -0.34 0.00 0.00 43.02 40.88 2zex s PHE 78 CO 0.14 -0.35 -0.21 -0.51 -1.46 0.00 0.00 175.22 172.83 2zex s ASP 79 N 0.56 3.39 -0.20 6.13 1.01 0.15 -0.18 116.67 127.53 2zex s ASP 79 Ca -0.09 -0.42 -0.04 0.00 0.71 0.00 0.00 52.55 52.71 2zex s ASP 79 Cb -0.16 -0.92 -0.02 0.00 1.01 0.00 0.00 42.92 42.84 2zex s ASP 79 CO 0.04 0.26 -0.03 -0.69 0.21 0.00 0.00 175.17 174.95 2zex s VAL 80 N -0.23 3.59 -0.02 -1.27 1.01 -0.32 -0.40 120.40 122.75 2zex s VAL 80 Ca -0.01 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.55 2zex s VAL 80 Cb -0.13 -2.62 0.01 0.00 0.00 0.00 0.00 36.38 33.64 2zex s VAL 80 CO 0.03 0.43 -0.03 -0.69 0.00 0.00 0.00 175.10 174.85 2zex s VAL 81 N 1.17 0.34 -0.19 2.92 1.01 -0.00 -0.66 120.40 124.99 2zex s VAL 81 Ca 0.02 -0.08 -0.07 0.00 0.00 0.00 0.00 61.98 61.86 2zex s VAL 81 Cb -0.14 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 2zex s VAL 81 CO -0.00 0.15 0.04 -0.69 0.00 0.00 0.00 175.10 174.60 2zex s VAL 82 N 0.55 4.52 0.01 2.92 1.01 -0.43 -0.47 120.40 128.51 2zex s VAL 82 Ca -0.06 -0.12 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 2zex s VAL 82 Cb -0.09 -3.04 -0.01 0.00 0.00 0.00 0.00 36.38 33.24 2zex s VAL 82 CO -0.01 0.45 -0.00 0.00 0.00 0.00 0.00 175.10 175.54 2zex s GLN 83 N 0.57 0.19 -0.02 2.72 -2.07 -0.21 -0.56 119.66 120.28 2zex s GLN 83 Ca 0.02 -0.32 -0.29 0.00 -1.82 0.00 0.00 55.36 52.95 2zex s GLN 83 Cb -0.13 0.07 0.11 0.00 -1.09 0.00 0.00 33.01 31.96 2zex s GLN 83 CO 0.02 -0.03 0.90 1.52 -1.32 0.00 0.00 175.29 176.38 2zex s TYR 84 N -0.81 -0.34 0.23 9.60 -0.85 -0.73 -1.00 117.35 123.45 2zex s TYR 84 Ca -0.09 0.25 -0.13 0.00 -0.52 0.00 0.00 57.07 56.58 2zex s TYR 84 Cb -0.06 0.53 -0.08 0.00 0.38 0.00 0.00 41.96 42.74 2zex s TYR 84 CO -0.00 -0.52 0.61 -1.01 -1.52 0.00 0.00 175.55 173.11 2zex s HIS 85 N -2.92 3.48 0.54 -3.49 3.76 -1.26 -0.34 115.29 115.06 2zex s HIS 85 Ca 0.04 1.05 -0.11 0.00 -0.15 0.00 0.00 55.06 55.89 2zex s HIS 85 Cb -0.01 -2.38 -0.05 0.00 1.11 0.00 0.00 32.58 31.25 2zex s HIS 85 CO -0.08 0.27 0.93 -0.51 -0.85 0.00 0.00 174.74 174.51 2zex s LEU 86 N -2.57 3.47 -1.07 0.89 1.43 0.58 0.23 118.68 121.64 2zex s LEU 86 Ca 0.46 1.29 -0.02 0.00 -1.03 0.00 0.00 54.13 54.83 2zex s LEU 86 Cb -0.12 -4.28 0.28 0.00 0.03 0.00 0.00 46.19 42.10 2zex s LEU 86 CO 0.20 -0.69 1.96 0.29 0.23 0.00 0.00 176.35 178.33 2zex n LYS 87 N -2.24 5.13 -3.73 1.70 5.02 -1.26 -4.15 118.16 118.64 2zex n LYS 87 Ca 0.04 -4.36 -0.24 0.00 -2.02 0.00 0.00 58.31 51.74 2zex n LYS 87 Cb 0.54 -2.49 -0.01 0.00 -0.02 0.00 0.00 35.03 33.05 2zex n LYS 87 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2zex n ASP 88 N 0.27 2.70 -0.26 4.39 5.75 -1.26 -5.01 116.55 123.13 2zex n ASP 88 Ca 0.50 -2.72 0.06 0.00 -0.01 0.00 0.00 54.79 52.62 2zex n ASP 88 Cb 0.26 0.05 0.29 0.00 -1.03 0.00 0.00 41.12 40.69 2zex n ASP 88 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2zex h ALA 89 N 0.82 1.61 -0.26 2.12 0.00 -2.02 -2.51 119.26 119.02 2zex h ALA 89 Ca -0.32 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2zex h ALA 89 Cb 1.11 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2zex h ALA 89 CO 0.51 0.24 0.00 0.09 0.00 0.00 0.00 179.25 180.09 2zex n ASN 90 N -4.50 2.67 -3.91 0.00 3.02 -1.26 -4.95 115.26 106.33 2zex n ASN 90 Ca 0.13 -1.87 -0.28 0.00 -0.03 0.00 0.00 54.58 52.53 2zex n ASN 90 Cb 0.24 -0.16 -0.01 0.00 -0.61 0.00 0.00 39.78 39.24 2zex n ASN 90 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2zex n ASN 91 N 0.99 -1.61 -4.70 6.41 5.03 -0.95 -4.80 115.26 115.64 2zex n ASN 91 Ca 0.18 -1.03 -0.43 0.00 0.87 0.00 0.00 54.58 54.16 2zex n ASN 91 Cb 0.49 -3.00 -0.03 0.00 -1.02 0.00 0.00 39.78 36.22 2zex n ASN 91 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 2zex n THR 92 N -4.40 0.16 -3.17 3.41 -1.04 -1.26 -4.67 114.28 103.31 2zex n THR 92 Ca -0.25 -0.03 -0.40 0.00 -2.04 0.00 0.00 64.05 61.33 2zex n THR 92 Cb 0.66 -1.93 -0.06 0.00 -1.82 0.00 0.00 70.33 67.18 2zex n THR 92 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2zex s TYR 93 N 1.80 3.40 -0.15 -1.42 5.04 -1.26 -0.31 117.35 124.45 2zex s TYR 93 Ca 0.79 0.89 -0.04 0.00 -2.44 0.00 0.00 57.07 56.27 2zex s TYR 93 Cb -0.55 -2.73 -0.03 0.00 0.35 0.00 0.00 41.96 39.00 2zex s TYR 93 CO 0.36 -0.10 0.01 0.08 -1.34 0.00 0.00 175.55 174.56 2zex s VAL 94 N 1.63 4.31 -0.07 3.14 1.01 0.54 -4.99 120.40 125.97 2zex s VAL 94 Ca 0.27 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.05 2zex s VAL 94 Cb -0.16 -2.89 0.02 0.00 0.00 0.00 0.00 36.38 33.36 2zex s VAL 94 CO 0.11 0.51 -0.08 -1.10 0.00 0.00 0.00 175.10 174.54 2zex s GLN 95 N 0.03 1.27 -0.32 2.72 -0.21 -1.26 -1.77 119.66 120.12 2zex s GLN 95 Ca 0.03 -0.24 -0.08 0.00 0.02 0.00 0.00 55.36 55.09 2zex s GLN 95 Cb -0.13 -1.19 0.02 0.00 1.00 0.00 0.00 33.01 32.71 2zex s GLN 95 CO 0.02 -0.08 0.13 -1.01 -2.12 0.00 0.00 175.29 172.22 2zex s HIS 96 N 1.02 3.20 -0.09 0.91 3.76 0.28 -4.98 115.29 119.38 2zex s HIS 96 Ca -0.09 -0.99 0.03 0.00 -0.15 0.00 0.00 55.06 53.87 2zex s HIS 96 Cb -0.14 -2.32 0.00 0.00 1.11 0.00 0.00 32.58 31.23 2zex s HIS 96 CO -0.00 -0.60 -0.21 0.42 -0.85 0.00 0.00 174.74 173.50 2zex s ILE 97 N 1.51 1.80 -0.18 0.60 1.01 -1.26 -1.31 121.20 123.37 2zex s ILE 97 Ca 0.02 -0.86 -0.06 0.00 0.00 0.00 0.00 60.65 59.74 2zex s ILE 97 Cb -0.18 -1.57 -0.04 0.00 0.01 0.00 0.00 42.46 40.68 2zex s ILE 97 CO 0.04 0.50 0.03 -0.76 0.00 0.00 0.00 174.94 174.76 2zex s LEU 98 N 0.47 3.60 -0.13 2.97 1.43 0.17 -4.99 118.68 122.20 2zex s LEU 98 Ca -0.17 -0.01 -0.02 0.00 -1.03 0.00 0.00 54.13 52.90 2zex s LEU 98 Cb -0.17 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.12 2zex s LEU 98 CO 0.07 0.15 -0.04 0.20 0.23 0.00 0.00 176.35 176.96 2zex s ASN 99 N 0.48 4.80 -0.03 2.29 0.01 -1.26 -1.18 114.94 120.05 2zex s ASN 99 Ca 0.01 -0.08 0.06 0.00 -0.71 0.00 0.00 52.86 52.14 2zex s ASN 99 Cb -0.13 -1.62 -0.01 0.00 0.41 0.00 0.00 41.25 39.89 2zex s ASN 99 CO 0.01 0.23 -0.21 -0.36 -1.51 0.00 0.00 177.10 175.27 2zex s PHE 100 N -0.01 1.94 0.00 2.20 0.08 0.75 -4.98 117.98 117.95 2zex s PHE 100 Ca 0.01 -0.43 0.00 0.00 0.12 0.00 0.00 56.93 56.63 2zex s PHE 100 Cb -0.13 -1.26 0.00 0.00 -0.57 0.00 0.00 43.02 41.06 2zex s PHE 100 CO 0.03 -0.08 0.72 0.27 -0.10 0.00 0.00 175.22 176.05 2zex n ASN 101 N 2.72 0.00 -4.84 1.36 6.94 -1.26 -0.78 115.26 119.41 2zex n ASN 101 Ca -0.16 -1.47 -0.32 0.00 -0.02 0.00 0.00 54.58 52.60 2zex n ASN 101 Cb 0.53 -0.09 -0.05 0.00 -2.36 0.00 0.00 39.78 37.80 2zex n ASN 101 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2zex s GLU 102 N 0.00 4.06 0.00 -3.83 8.01 -1.26 -4.61 118.70 121.07 2zex s GLU 102 Ca 0.00 0.92 0.17 0.00 0.01 0.00 0.00 54.97 56.07 2zex s GLU 102 Cb 0.00 -2.24 0.27 0.00 -4.31 0.00 0.00 34.13 27.86 2zex s GLU 102 CO 0.00 -0.07 1.19 0.25 0.01 0.00 0.00 175.26 176.64 2zex n THR 103 N -0.94 0.41 -4.28 3.63 -2.24 -1.26 -0.72 114.28 108.87 2zex n THR 103 Ca 0.06 -0.70 -0.29 0.00 -2.27 0.00 0.00 64.05 60.84 2zex n THR 103 Cb 0.54 1.01 -0.11 0.00 -2.10 0.00 0.00 70.33 69.67 2zex n THR 103 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2zex s ASP 104 N -1.26 4.05 0.05 3.42 1.01 -1.26 -4.71 116.67 117.96 2zex s ASP 104 Ca 0.27 -0.52 -0.34 0.00 0.71 0.00 0.00 52.55 52.66 2zex s ASP 104 Cb 0.16 -0.63 -0.13 0.00 1.01 0.00 0.00 42.92 43.32 2zex s ASP 104 CO 0.23 0.17 1.67 0.79 0.21 0.00 0.00 175.17 178.23 2zex n TRP 105 N 0.69 2.22 -4.23 4.23 7.02 -1.26 -4.60 117.44 121.51 2zex n TRP 105 Ca -0.14 0.22 -0.18 0.00 -1.02 0.00 0.00 57.50 56.38 2zex n TRP 105 Cb 0.53 -2.56 -0.15 0.00 -2.42 0.00 0.00 31.31 26.71 2zex n TRP 105 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2zex s THR 106 N 2.06 0.54 -0.16 -0.99 2.01 -0.46 -4.95 115.64 113.69 2zex s THR 106 Ca 0.85 -0.25 -0.06 0.00 0.31 0.00 0.00 61.69 62.55 2zex s THR 106 Cb -0.73 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.26 2zex s THR 106 CO 0.45 0.17 0.03 -0.47 -0.69 0.00 0.00 174.62 174.11 2zex s TYR 107 N 0.14 3.20 0.07 4.92 5.04 -1.26 -1.30 117.35 128.16 2zex s TYR 107 Ca -0.02 0.03 0.03 0.00 -2.44 0.00 0.00 57.07 54.67 2zex s TYR 107 Cb -0.06 -2.00 -0.03 0.00 0.35 0.00 0.00 41.96 40.22 2zex s TYR 107 CO -0.00 0.19 -0.09 0.15 -1.34 0.00 0.00 175.55 174.46 2zex s LYS 108 N 0.09 0.70 0.10 4.97 1.02 -0.78 -5.01 119.74 120.83 2zex s LYS 108 Ca 0.04 -0.99 -0.13 0.00 0.02 0.00 0.00 55.97 54.91 2zex s LYS 108 Cb -0.13 -0.39 0.02 0.00 -0.52 0.00 0.00 37.83 36.82 2zex s LYS 108 CO 0.01 0.06 0.31 1.14 -0.92 0.00 0.00 175.35 175.95 2zex s GLN 109 N -2.33 0.96 0.09 1.68 -2.07 -1.26 -1.79 119.66 114.93 2zex s GLN 109 Ca -0.01 -0.80 -0.11 0.00 -1.82 0.00 0.00 55.36 52.62 2zex s GLN 109 Cb -0.05 0.41 0.01 0.00 -1.09 0.00 0.00 33.01 32.28 2zex s GLN 109 CO -0.01 -0.34 0.24 -0.48 -1.32 0.00 0.00 175.29 173.38 2zex s LEU 110 N -2.78 1.16 -0.03 2.60 0.05 0.04 -5.00 118.68 114.73 2zex s LEU 110 Ca 0.03 -0.51 0.04 0.00 0.05 0.00 0.00 54.13 53.75 2zex s LEU 110 Cb 0.03 1.22 -0.03 0.00 -2.05 0.00 0.00 46.19 45.36 2zex s LEU 110 CO -0.11 -0.72 -0.15 -0.22 -0.55 0.00 0.00 176.35 174.60 2zex s LEU 111 N -2.69 2.73 0.15 1.48 0.20 -1.26 -0.83 118.68 118.47 2zex s LEU 111 Ca 0.02 -0.24 -0.07 0.00 0.69 0.00 0.00 54.13 54.53 2zex s LEU 111 Cb 0.03 -1.57 -0.01 0.00 -0.43 0.00 0.00 46.19 44.21 2zex s LEU 111 CO -0.10 0.32 0.23 0.72 -0.29 0.00 0.00 176.35 177.24 2zex s PHE 112 N -0.79 0.47 -0.11 5.38 -0.12 -0.39 -5.01 117.98 117.41 2zex s PHE 112 Ca 0.13 -0.84 0.02 0.00 -0.05 0.00 0.00 56.93 56.19 2zex s PHE 112 Cb -0.11 -0.14 0.01 0.00 -0.63 0.00 0.00 43.02 42.15 2zex s PHE 112 CO 0.02 -0.67 -0.18 0.99 -0.05 0.00 0.00 175.22 175.33 2zex s THR 113 N -3.98 1.70 0.61 -4.49 2.01 -1.26 -0.79 115.64 109.44 2zex s THR 113 Ca 0.18 -0.78 -0.15 0.00 0.31 0.00 0.00 61.69 61.25 2zex s THR 113 Cb 0.04 -1.52 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 2zex s THR 113 CO -0.01 0.48 1.06 0.42 -0.69 0.00 0.00 174.62 175.88 2zex s THR 114 N 0.77 3.87 1.13 -0.82 -4.23 -0.27 -4.89 115.64 111.20 2zex s THR 114 Ca -0.10 0.82 -0.18 0.00 -1.18 0.00 0.00 61.69 61.05 2zex s THR 114 Cb -0.16 -3.39 0.26 0.00 1.34 0.00 0.00 72.50 70.55 2zex s THR 114 CO 0.01 -0.58 1.18 -2.16 -0.54 0.00 0.00 174.62 172.53 2zex s PRO 115 N -4.28 -0.65 0.25 3.99 0.04 -1.26 -2.58 135.00 130.51 2zex s PRO 115 Ca 0.62 -0.18 0.05 0.00 0.04 0.00 0.00 61.00 61.53 2zex s PRO 115 Cb -0.15 -1.67 0.28 0.00 0.04 0.00 0.00 34.50 32.99 2zex s PRO 115 CO 0.41 -3.31 1.58 0.22 0.04 0.00 0.00 177.00 175.94 2zex h ASP 116 N -2.29 0.27 -3.70 6.66 3.58 -1.96 -0.89 116.42 118.08 2zex h ASP 116 Ca -0.45 -0.15 -0.23 0.00 0.42 0.00 0.00 57.03 56.63 2zex h ASP 116 Cb 1.28 -0.08 -0.29 0.00 1.72 0.00 0.00 39.33 41.96 2zex h ASP 116 CO 0.35 0.78 -0.67 0.68 -2.88 0.00 0.00 179.24 177.50 2zex s VAL 117 N -3.82 -0.01 -0.06 2.25 -7.23 -1.26 -4.74 120.40 105.53 2zex s VAL 117 Ca -0.04 0.03 -0.09 0.00 -1.81 0.00 0.00 61.98 60.07 2zex s VAL 117 Cb 0.12 -0.08 -0.05 0.00 0.56 0.00 0.00 36.38 36.94 2zex s VAL 117 CO 0.79 0.01 0.24 -0.36 -0.31 0.00 0.00 175.10 175.48 2zex s PHE 118 N 0.20 3.63 -0.23 2.82 0.08 -1.26 -4.07 117.98 119.14 2zex s PHE 118 Ca -0.01 0.66 0.22 0.00 0.12 0.00 0.00 56.93 57.92 2zex s PHE 118 Cb -0.02 -2.04 -0.00 0.00 -0.57 0.00 0.00 43.02 40.38 2zex s PHE 118 CO -0.01 0.69 1.04 0.78 -0.10 0.00 0.00 175.22 177.62 2zex h GLY 119 N 4.67 0.00 -2.93 4.36 0.00 -0.39 -3.43 103.07 105.36 2zex h GLY 119 Ca -0.53 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.73 2zex h GLY 119 CO 0.61 0.00 -0.19 -1.35 0.00 0.00 0.00 176.54 175.61 2zex s SER 120 N -5.48 -0.09 0.05 0.19 1.04 -1.21 -4.84 113.70 103.36 2zex s SER 120 Ca -0.00 -0.56 -0.31 0.00 0.48 0.00 0.00 55.95 55.56 2zex s SER 120 Cb 0.09 0.45 -0.07 0.00 0.10 0.00 0.00 66.02 66.59 2zex s SER 120 CO 0.79 -0.87 1.50 -0.89 0.98 0.00 0.00 173.24 174.75 2zex s THR 121 N -3.87 3.33 0.51 2.02 2.01 -1.26 -4.40 115.64 113.98 2zex s THR 121 Ca 0.08 0.80 -0.22 0.00 0.31 0.00 0.00 61.69 62.66 2zex s THR 121 Cb 0.02 -3.52 -0.07 0.00 0.01 0.00 0.00 72.50 68.95 2zex s THR 121 CO -0.07 0.01 1.21 -2.65 -0.69 0.00 0.00 174.62 172.43 2zex n PRO 122 N 5.16 1.54 -4.85 4.92 -0.02 -1.25 -4.82 135.00 135.67 2zex n PRO 122 Ca 0.14 0.56 -0.25 0.00 -2.02 0.00 0.00 63.50 61.93 2zex n PRO 122 Cb 0.42 -2.37 -0.15 0.00 -0.02 0.00 0.00 33.50 31.38 2zex n PRO 122 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2zex s GLN 123 N -2.57 1.51 -0.32 -0.52 0.74 -0.17 -0.89 119.66 117.44 2zex s GLN 123 Ca 0.69 -0.63 -0.12 0.00 0.05 0.00 0.00 55.36 55.34 2zex s GLN 123 Cb -0.46 -1.43 -0.03 0.00 1.10 0.00 0.00 33.01 32.20 2zex s GLN 123 CO 0.52 0.36 0.22 -1.17 -0.55 0.00 0.00 175.29 174.67 2zex s LEU 124 N -0.33 4.38 -0.11 3.68 2.96 0.27 -1.05 118.68 128.48 2zex s LEU 124 Ca 0.05 -0.32 -0.01 0.00 -0.22 0.00 0.00 54.13 53.63 2zex s LEU 124 Cb -0.08 -2.13 -0.03 0.00 0.50 0.00 0.00 46.19 44.46 2zex s LEU 124 CO -0.00 -0.19 -0.06 0.00 -1.32 0.00 0.00 176.35 174.78 2zex s ALA 125 N 1.73 2.95 -0.42 5.97 0.00 0.38 -1.42 121.76 130.94 2zex s ALA 125 Ca 0.06 -0.86 -0.06 0.00 0.00 0.00 0.00 51.96 51.11 2zex s ALA 125 Cb -0.17 -1.37 0.10 0.00 0.00 0.00 0.00 23.12 21.69 2zex s ALA 125 CO 0.10 0.39 0.24 -0.51 0.00 0.00 0.00 175.76 175.98 2zex s LEU 126 N -0.19 5.27 -0.29 0.00 1.43 0.56 -0.82 118.68 124.63 2zex s LEU 126 Ca 0.03 -1.85 0.02 0.00 -1.03 0.00 0.00 54.13 51.30 2zex s LEU 126 Cb -0.13 -1.90 0.07 0.00 0.03 0.00 0.00 46.19 44.26 2zex s LEU 126 CO 0.03 -0.57 -0.05 0.86 0.23 0.00 0.00 176.35 176.85 2zex s TRP 127 N 1.26 3.40 -1.13 0.29 -0.11 0.46 -1.38 118.94 121.72 2zex s TRP 127 Ca 0.06 -2.44 -0.13 0.00 1.22 0.00 0.00 56.10 54.81 2zex s TRP 127 Cb -0.24 -2.23 0.21 0.00 -1.50 0.00 0.00 33.47 29.71 2zex s TRP 127 CO -0.02 -0.89 1.27 0.21 -4.62 0.00 0.00 176.95 172.90 2zex s LYS 128 N 1.07 4.07 0.54 5.86 2.20 0.44 -0.68 119.74 133.24 2zex s LYS 128 Ca -0.03 -2.73 0.33 0.00 -0.36 0.00 0.00 55.97 53.18 2zex s LYS 128 Cb -0.20 -4.85 1.29 0.00 -1.51 0.00 0.00 37.83 32.57 2zex s LYS 128 CO -0.05 -1.57 1.96 0.78 -0.36 0.00 0.00 175.35 176.11 2zex h GLY 129 N 8.64 0.00 -3.85 5.54 0.00 -1.70 -2.17 103.07 109.54 2zex h GLY 129 Ca 0.25 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.99 2zex h GLY 129 CO 1.13 0.00 0.11 1.34 0.00 0.00 0.00 176.54 179.12 2zex n ASP 130 N -3.09 1.07 -0.02 0.19 2.03 -1.08 -4.54 116.55 111.10 2zex n ASP 130 Ca 0.01 1.04 0.02 0.00 0.52 0.00 0.00 54.79 56.38 2zex n ASP 130 Cb 0.32 -1.32 0.03 0.00 -0.72 0.00 0.00 41.12 39.43 2zex n ASP 130 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2zex n THR 131 N -0.45 1.12 -0.89 5.18 -2.24 -1.26 -3.81 114.28 111.93 2zex n THR 131 Ca 0.10 -1.20 -0.30 0.00 -2.27 0.00 0.00 64.05 60.37 2zex n THR 131 Cb 0.38 0.37 0.26 0.00 -2.10 0.00 0.00 70.33 69.24 2zex n THR 131 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2zex s SER 132 N -1.34 0.19 0.00 3.42 1.04 -1.26 -4.42 113.70 111.33 2zex s SER 132 Ca 0.07 0.62 0.23 0.00 0.48 0.00 0.00 55.95 57.35 2zex s SER 132 Cb 0.06 -0.83 1.14 0.00 0.10 0.00 0.00 66.02 66.48 2zex s SER 132 CO 0.01 -4.57 1.75 0.29 0.98 0.00 0.00 173.24 171.70 2zex n LYS 133 N -5.06 0.28 -1.70 4.02 5.02 -1.26 -0.66 118.16 118.79 2zex n LYS 133 Ca 0.14 0.07 -0.43 0.00 -2.02 0.00 0.00 58.31 56.07 2zex n LYS 133 Cb 0.60 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.08 2zex n LYS 133 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2zex n ALA 134 N -1.32 2.24 -1.98 7.82 0.00 -1.26 -4.17 120.51 121.83 2zex n ALA 134 Ca 0.10 0.41 -0.33 0.00 0.00 0.00 0.00 53.44 53.62 2zex n ALA 134 Cb 0.20 -2.45 -0.06 0.00 0.00 0.00 0.00 19.45 17.14 2zex n ALA 134 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2zex s ASN 135 N 0.96 6.92 -0.13 0.00 0.01 -1.26 -3.41 114.94 118.03 2zex s ASN 135 Ca 0.75 1.50 0.00 0.00 -0.71 0.00 0.00 52.86 54.40 2zex s ASN 135 Cb -0.57 -2.46 -0.01 0.00 0.41 0.00 0.00 41.25 38.62 2zex s ASN 135 CO 0.37 -0.23 -0.13 -0.22 -1.51 0.00 0.00 177.10 175.37 2zex s LEU 136 N -2.88 2.70 -0.11 0.60 1.98 -0.57 -0.95 118.68 119.46 2zex s LEU 136 Ca 0.56 -0.33 -0.02 0.00 -2.89 0.00 0.00 54.13 51.44 2zex s LEU 136 Cb -0.11 -1.60 -0.03 0.00 0.66 0.00 0.00 46.19 45.10 2zex s LEU 136 CO 0.17 0.17 -0.02 -0.31 -1.89 0.00 0.00 176.35 174.47 2zex s TYR 137 N 0.33 3.09 0.01 5.38 2.02 0.37 -0.51 117.35 128.04 2zex s TYR 137 Ca -0.11 0.01 0.00 0.00 -0.37 0.00 0.00 57.07 56.60 2zex s TYR 137 Cb -0.16 -1.85 -0.01 0.00 -0.40 0.00 0.00 41.96 39.54 2zex s TYR 137 CO 0.06 0.27 -0.02 0.54 -1.57 0.00 0.00 175.55 174.83 2zex s VAL 138 N -0.39 0.06 0.13 0.71 0.11 -0.27 -1.22 120.40 119.54 2zex s VAL 138 Ca 0.07 -0.43 -0.17 0.00 -2.93 0.00 0.00 61.98 58.53 2zex s VAL 138 Cb -0.12 -0.14 0.04 0.00 -1.53 0.00 0.00 36.38 34.63 2zex s VAL 138 CO 0.02 -0.23 0.43 -0.62 -3.33 0.00 0.00 175.10 171.37 2zex s ASP 139 N -0.68 -0.26 -1.14 3.54 -1.08 -0.50 -1.05 116.67 115.50 2zex s ASP 139 Ca -0.07 -0.31 -0.22 0.00 -0.52 0.00 0.00 52.55 51.43 2zex s ASP 139 Cb -0.05 0.49 -0.01 0.00 -1.46 0.00 0.00 42.92 41.90 2zex s ASP 139 CO -0.00 -0.88 0.79 0.47 0.52 0.00 0.00 175.17 176.07 2zex n ASP 140 N -0.25 -5.30 -4.54 -0.34 8.00 -0.98 -1.99 116.55 111.15 2zex n ASP 140 Ca -0.15 -1.03 -0.43 0.00 0.71 0.00 0.00 54.79 53.88 2zex n ASP 140 Cb 0.64 -3.30 -0.05 0.00 -0.02 0.00 0.00 41.12 38.38 2zex n ASP 140 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2zex s VAL 141 N -3.46 4.62 0.09 2.53 1.01 -0.24 -4.03 120.40 120.92 2zex s VAL 141 Ca 0.48 0.42 0.10 0.00 0.00 0.00 0.00 61.98 62.98 2zex s VAL 141 Cb -0.18 -4.35 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 2zex s VAL 141 CO 0.87 -0.76 -0.24 -0.31 0.00 0.00 0.00 175.10 174.66 2zex s TYR 142 N 3.36 2.40 -0.29 5.22 1.51 -0.08 -4.59 117.35 124.87 2zex s TYR 142 Ca 0.30 -0.34 -0.03 0.00 -1.01 0.00 0.00 57.07 55.99 2zex s TYR 142 Cb -0.12 -1.34 0.11 0.00 -0.11 0.00 0.00 41.96 40.51 2zex s TYR 142 CO 0.23 0.29 0.19 -1.17 -1.11 0.00 0.00 175.55 173.97 2zex s LEU 143 N -1.79 0.33 -0.08 -1.29 2.96 -1.25 -0.97 118.68 116.58 2zex s LEU 143 Ca 0.14 -1.20 0.00 0.00 -0.22 0.00 0.00 54.13 52.86 2zex s LEU 143 Cb -0.10 -0.10 -0.03 0.00 0.50 0.00 0.00 46.19 46.46 2zex s LEU 143 CO 0.06 -0.42 -0.07 0.68 -1.32 0.00 0.00 176.35 175.28 2zex s VAL 144 N 2.10 3.66 -0.00 1.68 -7.23 -0.57 -0.16 120.40 119.88 2zex s VAL 144 Ca 0.10 -0.49 -0.27 0.00 -1.81 0.00 0.00 61.98 59.52 2zex s VAL 144 Cb -0.16 -2.51 -0.04 0.00 0.56 0.00 0.00 36.38 34.23 2zex s VAL 144 CO -0.33 0.58 0.83 -0.70 -0.31 0.00 0.00 175.10 175.17 2zex s GLU 145 N -0.60 4.51 0.00 4.82 2.12 -0.28 -0.84 118.70 128.44 2zex s GLU 145 Ca 0.09 1.15 0.00 0.00 0.36 0.00 0.00 54.97 56.57 2zex s GLU 145 Cb -0.12 -3.43 0.00 0.00 0.26 0.00 0.00 34.13 30.85 2zex s GLU 145 CO 0.02 0.09 0.19 1.33 -0.54 0.00 0.00 175.26 176.34