#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zex s HIS 2 N 0.00 3.23 -0.10 0.00 3.76 -1.26 -5.08 115.29 115.85 2zex s HIS 2 Ca 0.00 -0.86 -0.14 0.00 -0.15 0.00 0.00 55.06 53.91 2zex s HIS 2 Cb 0.00 -2.44 -0.05 0.00 1.11 0.00 0.00 32.58 31.20 2zex s HIS 2 CO 0.00 -0.61 0.34 -1.64 -0.85 0.00 0.00 174.74 171.98 2zex s MET 3 N 1.58 4.06 0.09 1.40 1.00 -1.26 -5.03 119.30 121.13 2zex s MET 3 Ca 0.03 0.23 -0.31 0.00 0.00 0.00 0.00 55.69 55.64 2zex s MET 3 Cb -0.19 -3.33 -0.08 0.00 0.00 0.00 0.00 34.83 31.23 2zex s MET 3 CO 0.07 0.44 1.57 0.54 0.00 0.00 0.00 175.02 177.64 2zex s VAL 4 N -0.21 3.05 -0.20 -6.03 0.11 -1.26 -4.98 120.40 110.88 2zex s VAL 4 Ca 0.20 0.60 -0.25 0.00 -2.93 0.00 0.00 61.98 59.61 2zex s VAL 4 Cb -0.14 -3.39 -0.01 0.00 -1.53 0.00 0.00 36.38 31.31 2zex s VAL 4 CO 0.08 0.02 0.81 0.21 -3.33 0.00 0.00 175.10 172.89 2zex s ASN 5 N 1.88 6.88 0.09 3.54 3.04 -1.26 -4.38 114.94 124.73 2zex s ASN 5 Ca 0.71 1.09 0.26 0.00 0.04 0.00 0.00 52.86 54.95 2zex s ASN 5 Cb -0.39 -2.44 1.00 0.00 -1.54 0.00 0.00 41.25 37.88 2zex s ASN 5 CO 0.31 -0.44 1.80 0.23 -3.04 0.00 0.00 177.10 175.97 2zex n MET 6 N 5.54 0.10 -2.74 0.43 2.81 0.24 -4.81 117.12 118.69 2zex n MET 6 Ca 0.04 0.14 -0.42 0.00 -1.81 0.00 0.00 57.70 55.66 2zex n MET 6 Cb 0.48 -1.63 -0.03 0.00 -0.71 0.00 0.00 33.22 31.33 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 -3.06 4.86 0.17 2.03 1.01 -1.26 -4.99 120.40 119.15 2zex s VAL 7 Ca 0.11 2.01 -0.26 0.00 0.00 0.00 0.00 61.98 63.84 2zex s VAL 7 Cb 0.15 -4.30 -0.08 0.00 0.00 0.00 0.00 36.38 32.15 2zex s VAL 7 CO 0.51 0.18 0.81 -0.44 0.00 0.00 0.00 175.10 176.16 2zex s SER 8 N 0.92 7.43 -1.25 3.32 0.01 -1.26 -4.02 113.70 118.85 2zex s SER 8 Ca 0.51 1.70 -0.13 0.00 1.31 0.00 0.00 55.95 59.34 2zex s SER 8 Cb -0.21 -2.52 -0.00 0.00 0.21 0.00 0.00 66.02 63.50 2zex s SER 8 CO 0.27 0.18 0.64 -3.20 0.41 0.00 0.00 173.24 171.54 2zex n ASN 9 N 1.70 -3.09 0.22 2.44 5.15 -1.26 -4.86 115.26 115.56 2zex n ASN 9 Ca -0.04 -1.02 0.15 0.00 -0.60 0.00 0.00 54.58 53.07 2zex n ASN 9 Cb 0.48 -3.20 0.59 0.00 -0.53 0.00 0.00 39.78 37.12 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 -1.91 0.00 -0.22 1.20 0.13 -1.86 -2.72 132.00 126.61 2zex h PRO 10 Ca -0.65 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 2zex h PRO 10 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2zex h PRO 10 CO 0.54 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.72 2zex n GLY 11 N 0.13 2.95 2.49 1.56 0.00 -1.26 -1.20 105.19 109.85 2zex n GLY 11 Ca 0.01 -0.30 -0.20 0.00 0.00 0.00 0.00 46.02 45.54 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 0.10 -0.18 0.23 1.61 3.72 -1.03 -4.51 117.46 117.41 2zex n PHE 12 Ca 0.08 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.60 2zex n PHE 12 Cb 0.40 -3.38 0.48 0.00 -0.94 0.00 0.00 39.48 36.03 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 -0.92 -1.08 4.39 -1.83 -0.62 114.58 114.52 2zex h GLU 13 Ca -0.41 0.00 -0.36 0.00 0.34 0.00 0.00 59.36 58.94 2zex h GLU 13 Cb 1.28 0.00 -0.21 0.00 -0.10 0.00 0.00 28.75 29.72 2zex h GLU 13 CO 0.58 0.16 0.45 -0.25 -1.16 0.00 0.00 179.01 178.79 2zex n ASP 14 N -3.28 4.02 0.00 1.42 8.00 -1.26 -4.97 116.55 120.48 2zex n ASP 14 Ca 0.01 -3.29 0.00 0.00 0.71 0.00 0.00 54.79 52.22 2zex n ASP 14 Cb 0.42 -0.77 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 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 -0.61 1.99 0.72 0.44 0.00 -0.24 -2.02 105.19 105.47 2zex n GLY 15 Ca 0.47 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 46.18 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 2.14 -4.60 0.99 4.77 -1.26 -4.58 117.00 114.47 2zex n LEU 16 Ca 0.00 -0.97 -0.52 0.00 -0.03 0.00 0.00 56.01 54.49 2zex n LEU 16 Cb 0.00 -0.19 -0.06 0.00 -2.33 0.00 0.00 43.42 40.84 2zex n LEU 16 CO 0.00 0.48 0.92 0.47 -1.33 0.00 0.00 177.39 177.93 2zex n ASP 17 N 0.64 1.66 0.00 -1.43 9.92 -0.85 -1.57 116.55 124.92 2zex n ASP 17 Ca 0.16 1.12 0.00 0.00 -0.53 0.00 0.00 54.79 55.54 2zex n ASP 17 Cb 0.38 -1.18 0.00 0.00 -0.64 0.00 0.00 41.12 39.68 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 2.66 0.00 -4.44 -2.24 7.64 -1.26 -4.64 113.62 111.33 2zex n SER 18 Ca 0.19 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.72 2zex n SER 18 Cb 0.19 -0.12 -0.13 0.00 -1.01 0.00 0.00 64.21 63.14 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 -3.59 3.02 0.30 1.43 0.52 -0.61 -4.68 118.94 115.33 2zex s TRP 19 Ca 0.00 -0.47 -0.29 0.00 0.02 0.00 0.00 56.10 55.36 2zex s TRP 19 Cb 0.00 -2.06 -0.09 0.00 -1.15 0.00 0.00 33.47 30.17 2zex s TRP 19 CO 0.00 -0.23 1.11 -0.65 0.02 0.00 0.00 176.95 177.20 2zex s GLN 20 N 0.90 4.55 -0.44 4.98 -0.21 0.31 -4.88 119.66 124.88 2zex s GLN 20 Ca 0.01 1.80 -0.01 0.00 0.02 0.00 0.00 55.36 57.17 2zex s GLN 20 Cb -0.14 -3.10 0.12 0.00 1.00 0.00 0.00 33.01 30.89 2zex s GLN 20 CO 0.02 0.13 0.22 0.34 -2.12 0.00 0.00 175.29 173.88 2zex s ASP 21 N -0.93 5.12 0.12 5.90 -1.08 -1.26 -2.14 116.67 122.39 2zex s ASP 21 Ca 0.47 -2.24 0.09 0.00 -0.52 0.00 0.00 52.55 50.34 2zex s ASP 21 Cb -0.31 -1.79 -0.18 0.00 -1.46 0.00 0.00 42.92 39.17 2zex s ASP 21 CO 0.40 -0.47 1.22 -0.50 0.52 0.00 0.00 175.17 176.34 2zex h TRP 22 N 7.72 0.00 -0.06 -5.34 6.55 -1.77 -3.34 115.95 119.71 2zex h TRP 22 Ca -0.09 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.75 2zex h TRP 22 Cb 1.02 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.32 2zex h TRP 22 CO 0.56 0.94 0.00 1.04 -1.05 0.00 0.00 178.44 179.93 2zex n GLN 23 N -3.29 1.19 -3.14 0.49 3.00 -1.25 -4.99 117.38 109.38 2zex n GLN 23 Ca -0.02 -1.20 -0.23 0.00 -0.01 0.00 0.00 57.00 55.55 2zex n GLN 23 Cb 0.93 -1.09 0.04 0.00 0.00 0.00 0.00 30.24 30.13 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 0.05 -5.52 -0.19 -1.09 1.13 -1.25 -4.89 117.38 105.62 2zex n GLN 24 Ca 0.03 0.90 0.07 0.00 -1.94 0.00 0.00 57.00 56.06 2zex n GLN 24 Cb 0.20 -5.80 0.10 0.00 0.11 0.00 0.00 30.24 24.85 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 -2.63 1.69 -4.49 1.08 2.03 -1.26 -5.05 116.55 107.92 2zex n ASP 25 Ca -0.09 -2.76 -0.32 0.00 0.52 0.00 0.00 54.79 52.14 2zex n ASP 25 Cb 0.61 -0.36 -0.12 0.00 -0.72 0.00 0.00 41.12 40.53 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 -2.04 2.37 -0.07 -0.67 -1.94 -1.26 -1.39 119.30 114.31 2zex s MET 26 Ca 0.22 -0.79 -0.15 0.00 -1.71 0.00 0.00 55.69 53.26 2zex s MET 26 Cb 0.20 -2.34 0.03 0.00 2.01 0.00 0.00 34.83 34.73 2zex s MET 26 CO 0.02 0.59 0.36 -1.54 -0.01 0.00 0.00 175.02 174.44 2zex s SER 27 N -1.10 -0.30 -0.33 3.03 1.04 -0.60 -5.01 113.70 110.44 2zex s SER 27 Ca 0.14 0.38 -0.16 0.00 0.48 0.00 0.00 55.95 56.79 2zex s SER 27 Cb -0.11 0.50 -0.02 0.00 0.10 0.00 0.00 66.02 66.50 2zex s SER 27 CO 0.03 -0.33 0.41 0.00 0.98 0.00 0.00 173.24 174.33 2zex s ALA 28 N -0.71 3.51 0.03 5.32 0.00 -1.26 -0.48 121.76 128.16 2zex s ALA 28 Ca -0.08 -1.06 -0.03 0.00 0.00 0.00 0.00 51.96 50.79 2zex s ALA 28 Cb -0.04 -2.85 -0.02 0.00 0.00 0.00 0.00 23.12 20.21 2zex s ALA 28 CO 0.03 -1.02 0.03 0.14 0.00 0.00 0.00 175.76 174.94 2zex s VAL 29 N 2.14 0.14 0.26 0.00 -7.23 -0.42 -4.90 120.40 110.40 2zex s VAL 29 Ca 0.15 -1.16 -0.05 0.00 -1.81 0.00 0.00 61.98 59.11 2zex s VAL 29 Cb -0.16 -0.79 0.25 0.00 0.56 0.00 0.00 36.38 36.23 2zex s VAL 29 CO 0.12 -0.64 1.92 1.55 -0.31 0.00 0.00 175.10 177.74 2zex h PRO 30 N 3.91 1.23 0.00 4.82 0.13 -1.86 -1.53 132.00 138.69 2zex h PRO 30 Ca -0.33 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2zex h PRO 30 Cb 1.18 -0.27 0.00 0.00 0.13 0.00 0.00 31.00 32.05 2zex h PRO 30 CO 0.50 0.84 0.00 1.05 -0.23 0.00 0.00 178.00 180.16 2zex h GLU 31 N 1.25 0.00 -0.18 0.86 9.09 -1.93 -0.98 114.58 122.70 2zex h GLU 31 Ca 0.33 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.74 2zex h GLU 31 Cb -0.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.00 2zex h GLU 31 CO -0.07 0.00 0.00 0.00 0.05 0.00 0.00 179.01 178.99 2zex n ALA 32 N -2.02 2.50 -2.68 1.06 0.00 -1.06 -4.92 120.51 113.38 2zex n ALA 32 Ca -0.01 -0.63 -0.42 0.00 0.00 0.00 0.00 53.44 52.38 2zex n ALA 32 Cb 0.18 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 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 -1.78 3.43 -0.08 0.00 0.00 -0.37 -3.86 121.76 119.10 2zex s ALA 33 Ca 0.34 0.29 0.07 0.00 0.00 0.00 0.00 51.96 52.67 2zex s ALA 33 Cb 0.19 -3.38 -0.24 0.00 0.00 0.00 0.00 23.12 19.70 2zex s ALA 33 CO 0.29 -0.60 0.51 1.58 0.00 0.00 0.00 175.76 177.53 2zex n HIS 34 N 5.03 0.97 -4.05 0.00 -0.00 -1.26 -4.90 115.22 111.01 2zex n HIS 34 Ca 0.08 0.30 -0.08 0.00 0.46 0.00 0.00 57.72 58.47 2zex n HIS 34 Cb 0.49 -1.16 -0.10 0.00 -0.12 0.00 0.00 29.99 29.09 2zex n HIS 34 CO 0.00 0.00 0.00 -0.80 0.46 0.00 0.00 176.34 176.00 2zex s ASN 35 N -6.32 0.43 0.46 0.26 0.02 -1.26 -5.11 114.94 103.42 2zex s ASN 35 Ca -0.11 -0.81 0.00 0.00 -1.02 0.00 0.00 52.86 50.92 2zex s ASN 35 Cb 0.07 0.16 0.00 0.00 0.02 0.00 0.00 41.25 41.50 2zex s ASN 35 CO 0.80 -0.48 0.00 0.61 0.02 0.00 0.00 177.10 178.06 2zex n GLY 36 N 0.67 -0.20 0.10 0.66 0.00 -1.26 -4.23 105.19 100.93 2zex n GLY 36 Ca -0.18 -1.03 0.07 0.00 0.00 0.00 0.00 46.02 44.88 2zex n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zex n ALA 37 N 2.81 2.31 -2.37 4.61 0.00 -1.26 -4.95 120.51 121.65 2zex n ALA 37 Ca 0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 53.44 52.96 2zex n ALA 37 Cb 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.35 2zex n ALA 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2zex s LEU 38 N -5.43 2.42 0.30 0.00 1.43 -1.26 -4.11 118.68 112.02 2zex s LEU 38 Ca -0.02 -0.85 0.04 0.00 -1.03 0.00 0.00 54.13 52.27 2zex s LEU 38 Cb 0.10 0.10 -0.03 0.00 0.03 0.00 0.00 46.19 46.39 2zex s LEU 38 CO 0.81 -0.48 0.25 -0.83 0.23 0.00 0.00 176.35 176.34 2zex s GLY 39 N -2.49 2.03 -0.17 -3.19 0.00 -0.60 -4.36 107.32 98.53 2zex s GLY 39 Ca 0.01 -1.93 -0.17 0.00 0.00 0.00 0.00 44.72 42.63 2zex s GLY 39 CO -0.06 -1.42 0.42 -2.27 0.00 0.00 0.00 173.10 169.77 2zex s LEU 40 N -3.30 4.20 -0.22 0.66 2.96 -0.22 -1.30 118.68 121.46 2zex s LEU 40 Ca 0.40 0.62 -0.07 0.00 -0.22 0.00 0.00 54.13 54.85 2zex s LEU 40 Cb 0.03 -2.57 -0.03 0.00 0.50 0.00 0.00 46.19 44.12 2zex s LEU 40 CO 0.23 -0.04 0.07 -0.75 -1.32 0.00 0.00 176.35 174.54 2zex s LYS 41 N 1.02 3.80 -0.27 1.98 2.20 0.36 -1.19 119.74 127.65 2zex s LYS 41 Ca 0.21 -0.42 -0.07 0.00 -0.36 0.00 0.00 55.97 55.34 2zex s LYS 41 Cb -0.15 -3.27 -0.01 0.00 -1.51 0.00 0.00 37.83 32.90 2zex s LYS 41 CO 0.08 0.03 0.06 0.42 -0.36 0.00 0.00 175.35 175.59 2zex s ILE 42 N 1.02 4.05 0.35 5.43 1.01 0.25 -1.56 121.20 131.75 2zex s ILE 42 Ca 0.04 -0.46 -0.27 0.00 0.00 0.00 0.00 60.65 59.95 2zex s ILE 42 Cb -0.14 -2.99 -0.09 0.00 0.01 0.00 0.00 42.46 39.25 2zex s ILE 42 CO 0.03 0.22 1.22 -0.83 0.00 0.00 0.00 174.94 175.58 2zex s GLY 43 N 1.55 2.96 0.99 6.18 0.00 -0.48 -1.56 107.32 116.95 2zex s GLY 43 Ca 0.04 1.09 -0.14 0.00 0.00 0.00 0.00 44.72 45.72 2zex s GLY 43 CO 0.02 1.68 1.14 -0.32 0.00 0.00 0.00 173.10 175.63 2zex s GLY 44 N -0.80 1.59 0.00 0.20 0.00 -1.22 -4.60 107.32 102.49 2zex s GLY 44 Ca 0.52 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.59 2zex s GLY 44 CO 0.45 0.01 0.00 0.61 0.00 0.00 0.00 173.10 174.17 2zex n GLY 45 N -1.92 1.19 3.50 0.20 0.00 0.52 -4.92 105.19 103.75 2zex n GLY 45 Ca 0.08 0.00 -0.12 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 -0.64 0.97 0.33 1.61 -2.85 -1.26 -4.85 119.74 113.05 2zex s LYS 46 Ca 0.00 -0.15 -0.29 0.00 -1.00 0.00 0.00 55.97 54.54 2zex s LYS 46 Cb 0.00 0.45 -0.11 0.00 -2.06 0.00 0.00 37.83 36.11 2zex s LYS 46 CO 0.00 -0.38 1.51 0.00 0.10 0.00 0.00 175.35 176.58 2zex s ALA 47 N -2.52 3.63 0.04 0.59 0.00 -1.25 -4.72 121.76 117.53 2zex s ALA 47 Ca -0.01 1.53 -0.27 0.00 0.00 0.00 0.00 51.96 53.21 2zex s ALA 47 Cb -0.01 -3.61 0.08 0.00 0.00 0.00 0.00 23.12 19.58 2zex s ALA 47 CO -0.04 -0.98 0.71 0.00 0.00 0.00 0.00 175.76 175.45 2zex s ALA 48 N -0.64 -1.72 0.00 0.00 0.00 -0.69 -5.00 121.76 113.71 2zex s ALA 48 Ca 0.57 0.94 0.00 0.00 0.00 0.00 0.00 51.96 53.46 2zex s ALA 48 Cb -0.46 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.04 2zex s ALA 48 CO 0.56 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 176.14 2zex n GLY 49 N 0.16 1.24 3.53 0.00 0.00 -1.26 -0.58 105.19 108.28 2zex n GLY 49 Ca -0.16 -0.72 -0.05 0.00 0.00 0.00 0.00 46.02 45.09 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 0.81 2.16 -0.02 0.00 -0.64 -1.94 105.19 105.56 2zex n GLY 50 Ca 0.00 -1.17 0.02 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.60 0.25 3.26 -0.02 0.00 -0.91 -0.18 105.19 106.99 2zex n GLY 51 Ca -0.04 -0.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.00 0.74 -0.13 1.61 -2.07 -0.35 -0.53 119.66 116.93 2zex s GLN 52 Ca 0.17 -0.26 -0.17 0.00 -1.82 0.00 0.00 55.36 53.28 2zex s GLN 52 Cb -0.00 0.33 -0.04 0.00 -1.09 0.00 0.00 33.01 32.20 2zex s GLN 52 CO -0.01 -0.22 0.44 -0.51 -1.32 0.00 0.00 175.29 173.67 2zex s ASP 53 N -1.55 6.63 -0.29 12.60 1.01 -1.26 -0.67 116.67 133.14 2zex s ASP 53 Ca -0.11 0.75 -0.02 0.00 0.71 0.00 0.00 52.55 53.88 2zex s ASP 53 Cb -0.04 -2.27 0.10 0.00 1.01 0.00 0.00 42.92 41.72 2zex s ASP 53 CO 0.02 0.01 0.11 -0.63 0.21 0.00 0.00 175.17 174.89 2zex s ILE 54 N 0.64 0.43 0.22 0.77 1.01 -0.36 -4.97 121.20 118.94 2zex s ILE 54 Ca 0.24 -1.04 -0.32 0.00 0.00 0.00 0.00 60.65 59.53 2zex s ILE 54 Cb -0.15 -1.31 -0.13 0.00 0.01 0.00 0.00 42.46 40.88 2zex s ILE 54 CO 0.09 -0.65 1.51 -2.65 0.00 0.00 0.00 174.94 173.23 2zex n PRO 55 N 5.04 2.19 -4.46 2.79 -0.02 -1.26 -4.20 135.00 135.08 2zex n PRO 55 Ca -0.04 0.78 -0.23 0.00 -2.02 0.00 0.00 63.50 61.99 2zex n PRO 55 Cb 0.43 -2.51 -0.10 0.00 -0.02 0.00 0.00 33.50 31.30 2zex n PRO 55 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2zex s LEU 56 N 0.38 2.60 0.33 2.45 1.43 -1.26 -5.03 118.68 119.58 2zex s LEU 56 Ca 0.72 -1.06 -0.26 0.00 -1.03 0.00 0.00 54.13 52.50 2zex s LEU 56 Cb -0.64 -1.01 -0.10 0.00 0.03 0.00 0.00 46.19 44.47 2zex s LEU 56 CO 0.44 -0.03 0.97 -0.54 0.23 0.00 0.00 176.35 177.42 2zex s LYS 57 N -3.55 4.53 0.78 1.70 1.02 -1.26 -5.05 119.74 117.90 2zex s LYS 57 Ca 0.29 1.39 -0.11 0.00 0.02 0.00 0.00 55.97 57.56 2zex s LYS 57 Cb -0.03 -2.79 0.06 0.00 -0.52 0.00 0.00 37.83 34.55 2zex s LYS 57 CO 0.14 0.22 1.09 -1.25 -0.92 0.00 0.00 175.35 174.63 2zex s PRO 58 N -2.07 2.23 -1.63 -1.68 0.04 -1.26 -4.05 135.00 126.58 2zex s PRO 58 Ca 0.51 1.12 -0.15 0.00 0.04 0.00 0.00 61.00 62.51 2zex s PRO 58 Cb -0.20 -1.90 0.12 0.00 0.04 0.00 0.00 34.50 32.57 2zex s PRO 58 CO 0.25 -1.65 0.78 0.09 0.04 0.00 0.00 177.00 176.52 2zex n ASN 59 N -3.52 -3.24 -4.01 6.66 5.03 -0.34 -4.94 115.26 110.90 2zex n ASN 59 Ca 0.09 -0.96 -0.19 0.00 0.87 0.00 0.00 54.58 54.39 2zex n ASN 59 Cb 0.53 -3.04 -0.15 0.00 -1.02 0.00 0.00 39.78 36.11 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 -3.38 0.71 -0.06 3.41 2.01 -1.26 -4.88 115.64 112.19 2zex s THR 60 Ca 0.63 -0.37 -0.16 0.00 0.31 0.00 0.00 61.69 62.10 2zex s THR 60 Cb -0.34 -0.60 -0.05 0.00 0.01 0.00 0.00 72.50 71.52 2zex s THR 60 CO 0.90 0.21 0.43 -0.89 -0.69 0.00 0.00 174.62 174.58 2zex s THR 61 N -0.13 5.11 0.07 -0.82 2.01 -1.26 -1.09 115.64 119.53 2zex s THR 61 Ca 0.02 0.87 0.06 0.00 0.31 0.00 0.00 61.69 62.95 2zex s THR 61 Cb -0.04 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 2zex s THR 61 CO -0.00 0.46 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.90 2zex s TYR 62 N -0.22 1.50 -0.18 4.92 2.02 0.33 -4.53 117.35 121.20 2zex s TYR 62 Ca 0.24 -0.40 -0.17 0.00 -0.37 0.00 0.00 57.07 56.37 2zex s TYR 62 Cb -0.16 -0.86 -0.04 0.00 -0.40 0.00 0.00 41.96 40.50 2zex s TYR 62 CO 0.11 0.10 0.42 0.42 -1.57 0.00 0.00 175.55 175.04 2zex s ILE 63 N -1.04 5.19 -0.17 2.71 1.01 0.87 -1.44 121.20 128.32 2zex s ILE 63 Ca 0.03 0.79 -0.02 0.00 0.00 0.00 0.00 60.65 61.45 2zex s ILE 63 Cb -0.09 -3.76 -0.01 0.00 0.01 0.00 0.00 42.46 38.61 2zex s ILE 63 CO 0.03 0.27 -0.09 -0.22 0.00 0.00 0.00 174.94 174.93 2zex s LEU 64 N 1.09 2.80 0.11 2.97 2.96 -0.06 -0.88 118.68 127.67 2zex s LEU 64 Ca 0.21 -0.35 -0.09 0.00 -0.22 0.00 0.00 54.13 53.68 2zex s LEU 64 Cb -0.15 -1.67 -0.00 0.00 0.50 0.00 0.00 46.19 44.87 2zex s LEU 64 CO 0.08 0.09 0.23 -0.83 -1.32 0.00 0.00 176.35 174.60 2zex s GLY 65 N 0.83 0.17 -0.00 7.98 0.00 -0.36 -0.83 107.32 115.11 2zex s GLY 65 Ca -0.03 -0.65 -0.28 0.00 0.00 0.00 0.00 44.72 43.76 2zex s GLY 65 CO 0.01 -0.77 0.82 0.00 0.00 0.00 0.00 173.10 173.15 2zex s ALA 66 N -3.89 -1.79 -0.12 3.20 0.00 -0.72 -0.44 121.76 118.01 2zex s ALA 66 Ca 0.08 1.05 -0.10 0.00 0.00 0.00 0.00 51.96 53.00 2zex s ALA 66 Cb 0.04 0.25 -0.05 0.00 0.00 0.00 0.00 23.12 23.36 2zex s ALA 66 CO -0.08 -0.59 0.21 -1.58 0.00 0.00 0.00 175.76 173.72 2zex s TRP 67 N -2.60 3.57 0.09 0.00 0.52 -0.80 -2.00 118.94 117.72 2zex s TRP 67 Ca 0.01 0.59 -0.17 0.00 0.02 0.00 0.00 56.10 56.55 2zex s TRP 67 Cb -0.01 -2.11 0.03 0.00 -1.15 0.00 0.00 33.47 30.24 2zex s TRP 67 CO -0.05 0.56 0.40 0.00 0.02 0.00 0.00 176.95 177.88 2zex s ALA 68 N -0.56 -0.94 -0.05 0.98 0.00 -0.31 -1.38 121.76 119.50 2zex s ALA 68 Ca 0.16 0.09 -0.31 0.00 0.00 0.00 0.00 51.96 51.90 2zex s ALA 68 Cb -0.13 0.53 0.07 0.00 0.00 0.00 0.00 23.12 23.60 2zex s ALA 68 CO 0.05 -0.56 0.69 -1.59 0.00 0.00 0.00 175.76 174.35 2zex s LYS 69 N -3.22 1.04 0.21 0.00 -2.85 -0.27 -1.51 119.74 113.14 2zex s LYS 69 Ca -0.01 0.26 -0.12 0.00 -1.00 0.00 0.00 55.97 55.10 2zex s LYS 69 Cb 0.01 0.49 -0.07 0.00 -2.06 0.00 0.00 37.83 36.20 2zex s LYS 69 CO -0.08 -0.32 0.57 -0.06 0.10 0.00 0.00 175.35 175.56 2zex s PHE 70 N -1.18 3.49 -1.55 1.78 0.08 0.41 -0.40 117.98 120.61 2zex s PHE 70 Ca -0.11 0.98 0.29 0.00 0.12 0.00 0.00 56.93 58.22 2zex s PHE 70 Cb -0.00 -2.33 1.33 0.00 -0.57 0.00 0.00 43.02 41.46 2zex s PHE 70 CO 0.10 0.32 1.93 -0.40 -0.10 0.00 0.00 175.22 177.06 2zex n ASP 71 N 0.21 0.28 -3.79 1.36 5.75 0.10 -4.34 116.55 116.12 2zex n ASP 71 Ca -0.01 -0.40 -0.08 0.00 -0.01 0.00 0.00 54.79 54.29 2zex n ASP 71 Cb 0.52 -0.15 -0.02 0.00 -1.03 0.00 0.00 41.12 40.44 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 -2.52 -0.30 0.05 -1.12 1.04 -1.26 -4.95 113.70 104.63 2zex s SER 72 Ca 0.29 -0.50 -0.32 0.00 0.48 0.00 0.00 55.95 55.89 2zex s SER 72 Cb 0.20 0.70 -0.11 0.00 0.10 0.00 0.00 66.02 66.91 2zex s SER 72 CO 0.47 -1.27 1.88 0.29 0.98 0.00 0.00 173.24 175.60 2zex n LYS 73 N -0.45 2.64 -2.01 4.02 5.02 -1.26 -4.79 118.16 121.33 2zex n LYS 73 Ca -0.06 0.96 -0.29 0.00 -2.02 0.00 0.00 58.31 56.90 2zex n LYS 73 Cb 0.60 -2.86 0.05 0.00 -0.02 0.00 0.00 35.03 32.80 2zex n LYS 73 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2zex s PRO 74 N 3.53 2.68 -0.09 1.97 0.04 -1.26 -4.70 135.00 137.17 2zex s PRO 74 Ca 0.87 0.26 -0.15 0.00 0.04 0.00 0.00 61.00 62.01 2zex s PRO 74 Cb -0.53 -2.07 -0.28 0.00 0.04 0.00 0.00 34.50 31.66 2zex s PRO 74 CO 0.42 -1.07 0.59 0.00 0.04 0.00 0.00 177.00 176.99 2zex h ALA 75 N -0.62 0.16 -3.00 8.56 0.00 -1.94 -3.49 119.26 118.93 2zex h ALA 75 Ca -0.45 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.38 2zex h ALA 75 Cb 1.27 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.52 2zex h ALA 75 CO 0.63 0.84 0.00 0.41 0.00 0.00 0.00 179.25 181.14 2zex n GLY 76 N 1.76 2.29 3.25 0.00 0.00 -1.26 -5.05 105.19 106.18 2zex n GLY 76 Ca -0.24 -0.72 -0.14 0.00 0.00 0.00 0.00 46.02 44.92 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 4.21 0.44 -0.13 2.61 -4.23 -1.26 -4.75 115.64 112.52 2zex s THR 77 Ca 0.00 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 58.52 2zex s THR 77 Cb 0.00 -2.36 -0.02 0.00 1.34 0.00 0.00 72.50 71.46 2zex s THR 77 CO 0.00 -0.22 -0.09 0.12 -0.54 0.00 0.00 174.62 173.89 2zex s PHE 78 N -3.83 2.90 -0.06 3.99 5.36 0.26 -2.12 117.98 124.48 2zex s PHE 78 Ca 0.32 -0.47 0.06 0.00 -0.96 0.00 0.00 56.93 55.88 2zex s PHE 78 Cb 0.07 -1.88 -0.01 0.00 -0.34 0.00 0.00 43.02 40.86 2zex s PHE 78 CO 0.09 -0.11 -0.25 -0.51 -1.46 0.00 0.00 175.22 172.98 2zex s ASP 79 N 0.28 3.09 -0.19 6.13 1.01 0.23 -0.04 116.67 127.17 2zex s ASP 79 Ca -0.07 -0.51 -0.05 0.00 0.71 0.00 0.00 52.55 52.64 2zex s ASP 79 Cb -0.15 -0.84 -0.02 0.00 1.01 0.00 0.00 42.92 42.91 2zex s ASP 79 CO 0.04 0.25 -0.01 -0.69 0.21 0.00 0.00 175.17 174.97 2zex s VAL 80 N -0.17 3.88 -0.00 -1.27 1.01 -0.40 -0.64 120.40 122.81 2zex s VAL 80 Ca -0.03 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.62 2zex s VAL 80 Cb -0.14 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.50 2zex s VAL 80 CO 0.04 0.44 -0.03 -0.69 0.00 0.00 0.00 175.10 174.86 2zex s VAL 81 N 0.92 0.25 -0.16 2.92 1.01 -0.22 -0.75 120.40 124.38 2zex s VAL 81 Ca 0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 2zex s VAL 81 Cb -0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 36.38 35.99 2zex s VAL 81 CO 0.02 0.08 -0.05 -0.69 0.00 0.00 0.00 175.10 174.46 2zex s VAL 82 N 0.02 3.74 0.01 2.92 1.01 -0.60 -0.54 120.40 126.97 2zex s VAL 82 Ca 0.00 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.58 2zex s VAL 82 Cb -0.02 -2.64 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 2zex s VAL 82 CO -0.00 0.49 -0.03 0.00 0.00 0.00 0.00 175.10 175.56 2zex s GLN 83 N 0.44 0.25 0.00 2.72 -2.07 -0.38 -0.72 119.66 119.90 2zex s GLN 83 Ca -0.05 -0.36 -0.29 0.00 -1.82 0.00 0.00 55.36 52.85 2zex s GLN 83 Cb -0.14 -0.06 0.10 0.00 -1.09 0.00 0.00 33.01 31.81 2zex s GLN 83 CO 0.03 0.01 0.93 1.52 -1.32 0.00 0.00 175.29 176.46 2zex s TYR 84 N -0.75 -0.29 0.25 9.60 -0.85 -0.72 -1.02 117.35 123.58 2zex s TYR 84 Ca -0.07 0.14 -0.06 0.00 -0.52 0.00 0.00 57.07 56.56 2zex s TYR 84 Cb -0.05 0.55 -0.06 0.00 0.38 0.00 0.00 41.96 42.78 2zex s TYR 84 CO -0.00 -0.55 0.52 -1.01 -1.52 0.00 0.00 175.55 172.99 2zex s HIS 85 N -3.07 3.46 0.50 -3.49 3.76 -1.26 -0.37 115.29 114.82 2zex s HIS 85 Ca 0.07 0.67 -0.06 0.00 -0.15 0.00 0.00 55.06 55.58 2zex s HIS 85 Cb -0.01 -2.11 -0.04 0.00 1.11 0.00 0.00 32.58 31.53 2zex s HIS 85 CO -0.07 0.24 0.82 -0.51 -0.85 0.00 0.00 174.74 174.37 2zex s LEU 86 N -3.25 3.58 -0.99 0.89 1.43 0.97 -0.17 118.68 121.15 2zex s LEU 86 Ca 0.44 1.00 -0.00 0.00 -1.03 0.00 0.00 54.13 54.54 2zex s LEU 86 Cb -0.11 -3.97 0.32 0.00 0.03 0.00 0.00 46.19 42.46 2zex s LEU 86 CO 0.27 -0.62 1.74 1.17 0.23 0.00 0.00 176.35 179.14 2zex n LYS 87 N -2.31 5.23 -3.94 1.70 0.00 -1.26 -4.13 118.16 113.45 2zex n LYS 87 Ca 0.01 -4.69 -0.24 0.00 0.00 0.00 0.00 58.31 53.39 2zex n LYS 87 Cb 0.55 -2.45 -0.05 0.00 0.00 0.00 0.00 35.03 33.09 2zex n LYS 87 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2zex n ASP 88 N -0.06 2.99 -0.13 3.14 5.68 -1.26 -5.00 116.55 121.91 2zex n ASP 88 Ca 0.45 -2.65 -0.01 0.00 -0.50 0.00 0.00 54.79 52.08 2zex n ASP 88 Cb 0.27 0.24 0.24 0.00 -1.14 0.00 0.00 41.12 40.73 2zex n ASP 88 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2zex h ALA 89 N 1.15 1.35 -0.01 2.12 0.00 -2.03 -2.60 119.26 119.24 2zex h ALA 89 Ca -0.31 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2zex h ALA 89 Cb 0.96 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2zex h ALA 89 CO 0.52 0.49 0.00 0.09 0.00 0.00 0.00 179.25 180.35 2zex n ASN 90 N -4.34 1.11 -4.12 0.00 3.02 -1.26 -4.94 115.26 104.73 2zex n ASN 90 Ca 0.05 -1.37 -0.37 0.00 -0.03 0.00 0.00 54.58 52.86 2zex n ASN 90 Cb 0.15 -0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.29 2zex n ASN 90 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2zex n ASN 91 N -0.13 -1.84 -4.67 6.41 6.94 -0.98 -4.83 115.26 116.16 2zex n ASN 91 Ca 0.20 -1.23 -0.46 0.00 -0.02 0.00 0.00 54.58 53.07 2zex n ASN 91 Cb 0.29 -1.97 -0.04 0.00 -2.36 0.00 0.00 39.78 35.70 2zex n ASN 91 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2zex n THR 92 N -4.73 0.13 -3.28 5.53 -1.04 -1.26 -4.67 114.28 104.96 2zex n THR 92 Ca -0.22 -0.02 -0.39 0.00 -2.04 0.00 0.00 64.05 61.38 2zex n THR 92 Cb 0.63 -1.61 -0.07 0.00 -1.82 0.00 0.00 70.33 67.46 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 1.60 3.36 -0.14 -1.42 5.04 -1.26 -0.02 117.35 124.51 2zex s TYR 93 Ca 0.82 0.72 -0.04 0.00 -2.44 0.00 0.00 57.07 56.13 2zex s TYR 93 Cb -0.68 -2.64 -0.03 0.00 0.35 0.00 0.00 41.96 38.95 2zex s TYR 93 CO 0.41 -0.10 -0.02 0.08 -1.34 0.00 0.00 175.55 174.57 2zex s VAL 94 N 1.65 4.06 -0.06 3.14 1.01 0.50 -4.99 120.40 125.70 2zex s VAL 94 Ca 0.23 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.91 2zex s VAL 94 Cb -0.15 -2.77 0.02 0.00 0.00 0.00 0.00 36.38 33.48 2zex s VAL 94 CO 0.09 0.51 -0.07 -1.10 0.00 0.00 0.00 175.10 174.53 2zex s GLN 95 N 0.11 1.15 -0.32 2.72 -0.21 -1.26 -1.75 119.66 120.09 2zex s GLN 95 Ca 0.00 -0.21 -0.08 0.00 0.02 0.00 0.00 55.36 55.10 2zex s GLN 95 Cb -0.13 -1.08 0.02 0.00 1.00 0.00 0.00 33.01 32.81 2zex s GLN 95 CO 0.02 -0.07 0.12 -1.01 -2.12 0.00 0.00 175.29 172.24 2zex s HIS 96 N 0.94 3.19 -0.11 0.91 3.76 0.10 -4.99 115.29 119.11 2zex s HIS 96 Ca -0.10 -0.98 0.03 0.00 -0.15 0.00 0.00 55.06 53.86 2zex s HIS 96 Cb -0.15 -2.31 0.01 0.00 1.11 0.00 0.00 32.58 31.24 2zex s HIS 96 CO 0.00 -0.60 -0.19 0.42 -0.85 0.00 0.00 174.74 173.53 2zex s ILE 97 N 1.51 1.75 -0.19 0.60 1.01 -1.26 -1.55 121.20 123.07 2zex s ILE 97 Ca 0.02 -0.81 -0.08 0.00 0.00 0.00 0.00 60.65 59.78 2zex s ILE 97 Cb -0.18 -1.55 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 2zex s ILE 97 CO 0.04 0.49 0.07 -0.76 0.00 0.00 0.00 174.94 174.78 2zex s LEU 98 N 0.70 3.86 -0.15 2.97 1.43 0.07 -4.98 118.68 122.58 2zex s LEU 98 Ca -0.12 0.10 -0.05 0.00 -1.03 0.00 0.00 54.13 53.03 2zex s LEU 98 Cb -0.16 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 2zex s LEU 98 CO 0.02 0.17 0.01 0.20 0.23 0.00 0.00 176.35 176.98 2zex s ASN 99 N 0.38 5.21 -0.04 2.29 0.01 -1.26 -1.27 114.94 120.26 2zex s ASN 99 Ca 0.04 0.01 0.06 0.00 -0.71 0.00 0.00 52.86 52.25 2zex s ASN 99 Cb -0.12 -1.79 -0.01 0.00 0.41 0.00 0.00 41.25 39.73 2zex s ASN 99 CO -0.00 0.22 -0.22 -0.36 -1.51 0.00 0.00 177.10 175.23 2zex s PHE 100 N 0.10 2.06 -0.01 2.20 0.08 0.94 -4.98 117.98 118.37 2zex s PHE 100 Ca 0.02 -0.53 0.01 0.00 0.12 0.00 0.00 56.93 56.55 2zex s PHE 100 Cb -0.13 -1.35 0.02 0.00 -0.57 0.00 0.00 43.02 40.99 2zex s PHE 100 CO 0.02 -0.14 0.77 0.27 -0.10 0.00 0.00 175.22 176.04 2zex n ASN 101 N 2.87 0.31 -4.81 1.36 0.23 -1.26 -0.58 115.26 113.39 2zex n ASN 101 Ca -0.17 -1.60 -0.34 0.00 -0.53 0.00 0.00 54.58 51.94 2zex n ASN 101 Cb 0.52 -0.10 -0.05 0.00 -2.08 0.00 0.00 39.78 38.07 2zex n ASN 101 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2zex s GLU 102 N -0.27 4.03 0.00 -3.83 8.01 -1.26 -4.59 118.70 120.79 2zex s GLU 102 Ca 0.02 1.24 0.16 0.00 0.01 0.00 0.00 54.97 56.40 2zex s GLU 102 Cb 0.02 -2.15 0.41 0.00 -4.31 0.00 0.00 34.13 28.10 2zex s GLU 102 CO 0.00 -0.22 1.33 0.25 0.01 0.00 0.00 175.26 176.63 2zex n THR 103 N -0.78 0.86 -4.57 3.63 -2.24 -1.26 -0.44 114.28 109.47 2zex n THR 103 Ca 0.08 -0.93 -0.25 0.00 -2.27 0.00 0.00 64.05 60.68 2zex n THR 103 Cb 0.53 0.62 -0.14 0.00 -2.10 0.00 0.00 70.33 69.25 2zex n THR 103 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2zex s ASP 104 N -1.05 2.50 0.07 3.42 2.15 -1.26 -4.73 116.67 117.76 2zex s ASP 104 Ca 0.32 -0.56 -0.35 0.00 0.43 0.00 0.00 52.55 52.40 2zex s ASP 104 Cb 0.17 -0.19 -0.14 0.00 -0.30 0.00 0.00 42.92 42.46 2zex s ASP 104 CO 0.23 0.14 1.61 0.79 -0.17 0.00 0.00 175.17 177.77 2zex n TRP 105 N 1.69 2.16 -3.81 -5.34 7.02 -1.26 -4.60 117.44 113.29 2zex n TRP 105 Ca -0.18 0.28 -0.14 0.00 -1.02 0.00 0.00 57.50 56.45 2zex n TRP 105 Cb 0.53 -2.53 -0.15 0.00 -2.42 0.00 0.00 31.31 26.74 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 1.66 -0.03 -0.16 -0.99 2.01 -0.57 -4.95 115.64 112.60 2zex s THR 106 Ca 0.84 0.12 -0.07 0.00 0.31 0.00 0.00 61.69 62.89 2zex s THR 106 Cb -0.74 -0.05 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 2zex s THR 106 CO 0.44 0.05 0.06 -0.47 -0.69 0.00 0.00 174.62 174.01 2zex s TYR 107 N 0.59 3.28 0.04 4.92 5.04 -1.26 -1.16 117.35 128.80 2zex s TYR 107 Ca -0.05 0.13 0.03 0.00 -2.44 0.00 0.00 57.07 54.75 2zex s TYR 107 Cb -0.07 -2.03 -0.02 0.00 0.35 0.00 0.00 41.96 40.19 2zex s TYR 107 CO -0.02 0.25 -0.10 0.15 -1.34 0.00 0.00 175.55 174.50 2zex s LYS 108 N 0.06 0.62 0.06 4.97 1.02 -0.85 -5.01 119.74 120.63 2zex s LYS 108 Ca 0.05 -0.74 -0.08 0.00 0.02 0.00 0.00 55.97 55.22 2zex s LYS 108 Cb -0.12 -0.49 -0.00 0.00 -0.52 0.00 0.00 37.83 36.70 2zex s LYS 108 CO 0.01 0.10 0.17 1.14 -0.92 0.00 0.00 175.35 175.86 2zex s GLN 109 N -1.42 0.75 0.17 1.68 -2.07 -1.26 -1.76 119.66 115.75 2zex s GLN 109 Ca -0.06 -0.83 0.00 0.00 -1.82 0.00 0.00 55.36 52.66 2zex s GLN 109 Cb -0.09 0.31 -0.04 0.00 -1.09 0.00 0.00 33.01 32.09 2zex s GLN 109 CO 0.01 -0.22 0.05 -0.48 -1.32 0.00 0.00 175.29 173.32 2zex s LEU 110 N -2.51 1.83 0.03 2.60 0.05 -0.01 -4.99 118.68 115.69 2zex s LEU 110 Ca 0.00 -1.24 0.08 0.00 0.05 0.00 0.00 54.13 53.02 2zex s LEU 110 Cb 0.02 0.12 -0.03 0.00 -2.05 0.00 0.00 46.19 44.25 2zex s LEU 110 CO -0.08 -0.67 -0.21 -0.76 -0.55 0.00 0.00 176.35 174.08 2zex s LEU 111 N -3.15 2.44 0.05 1.48 1.02 -1.26 -0.88 118.68 118.38 2zex s LEU 111 Ca 0.28 -0.46 -0.04 0.00 0.02 0.00 0.00 54.13 53.93 2zex s LEU 111 Cb 0.07 -1.44 -0.02 0.00 0.02 0.00 0.00 46.19 44.82 2zex s LEU 111 CO 0.05 0.27 0.04 0.72 0.02 0.00 0.00 176.35 177.46 2zex s PHE 112 N -0.85 0.35 -0.13 0.29 -0.12 -0.52 -4.97 117.98 112.03 2zex s PHE 112 Ca 0.13 -0.79 0.03 0.00 -0.05 0.00 0.00 56.93 56.24 2zex s PHE 112 Cb -0.10 -0.25 0.01 0.00 -0.63 0.00 0.00 43.02 42.05 2zex s PHE 112 CO 0.03 -0.40 -0.22 0.99 -0.05 0.00 0.00 175.22 175.58 2zex s THR 113 N -3.41 2.08 0.66 -4.49 2.01 -1.26 -0.51 115.64 110.72 2zex s THR 113 Ca 0.02 -0.98 -0.13 0.00 0.31 0.00 0.00 61.69 60.91 2zex s THR 113 Cb 0.04 -1.82 -0.00 0.00 0.01 0.00 0.00 72.50 70.72 2zex s THR 113 CO -0.08 0.55 1.06 0.42 -0.69 0.00 0.00 174.62 175.88 2zex s THR 114 N 0.71 3.88 1.10 -0.82 -4.23 -0.25 -4.88 115.64 111.15 2zex s THR 114 Ca -0.09 0.71 -0.18 0.00 -1.18 0.00 0.00 61.69 60.94 2zex s THR 114 Cb -0.16 -3.35 0.26 0.00 1.34 0.00 0.00 72.50 70.59 2zex s THR 114 CO 0.00 -0.70 1.26 -2.16 -0.54 0.00 0.00 174.62 172.48 2zex s PRO 115 N -4.67 -0.43 0.18 3.99 0.04 -1.26 -2.70 135.00 130.14 2zex s PRO 115 Ca 0.60 -0.39 -0.07 0.00 0.04 0.00 0.00 61.00 61.18 2zex s PRO 115 Cb -0.15 -1.72 0.06 0.00 0.04 0.00 0.00 34.50 32.73 2zex s PRO 115 CO 0.48 -3.13 1.54 0.22 0.04 0.00 0.00 177.00 176.15 2zex h ASP 116 N -2.16 0.87 -4.21 6.66 3.58 -1.97 -0.89 116.42 118.31 2zex h ASP 116 Ca -0.43 -0.38 -0.30 0.00 0.42 0.00 0.00 57.03 56.34 2zex h ASP 116 Cb 1.24 -0.24 -0.26 0.00 1.72 0.00 0.00 39.33 41.79 2zex h ASP 116 CO 0.31 1.13 -0.74 -0.69 -2.88 0.00 0.00 179.24 176.36 2zex s VAL 117 N -4.42 0.43 -0.05 2.25 1.01 -1.26 -4.73 120.40 113.63 2zex s VAL 117 Ca -0.10 -0.51 -0.10 0.00 0.00 0.00 0.00 61.98 61.27 2zex s VAL 117 Cb 0.12 -0.42 -0.05 0.00 0.00 0.00 0.00 36.38 36.03 2zex s VAL 117 CO 0.86 -0.07 0.26 -0.36 0.00 0.00 0.00 175.10 175.80 2zex s PHE 118 N -0.56 3.64 -0.22 5.22 0.08 -1.26 -4.13 117.98 120.74 2zex s PHE 118 Ca -0.02 0.71 0.22 0.00 0.12 0.00 0.00 56.93 57.96 2zex s PHE 118 Cb -0.05 -2.08 -0.02 0.00 -0.57 0.00 0.00 43.02 40.30 2zex s PHE 118 CO -0.00 0.68 1.00 0.41 -0.10 0.00 0.00 175.22 177.21 2zex n GLY 119 N 1.74 -1.43 3.45 4.36 0.00 0.76 -4.63 105.19 109.45 2zex n GLY 119 Ca -0.16 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.52 2zex n GLY 119 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2zex s SER 120 N -5.35 -0.20 0.05 1.61 1.04 -1.23 -4.82 113.70 104.80 2zex s SER 120 Ca -0.01 -0.52 -0.31 0.00 0.48 0.00 0.00 55.95 55.59 2zex s SER 120 Cb 0.10 0.53 -0.06 0.00 0.10 0.00 0.00 66.02 66.68 2zex s SER 120 CO 0.80 -0.99 1.37 -0.89 0.98 0.00 0.00 173.24 174.51 2zex s THR 121 N -3.88 3.61 0.37 2.02 2.01 -1.26 -4.38 115.64 114.13 2zex s THR 121 Ca 0.09 1.09 -0.27 0.00 0.31 0.00 0.00 61.69 62.91 2zex s THR 121 Cb 0.00 -3.70 -0.11 0.00 0.01 0.00 0.00 72.50 68.70 2zex s THR 121 CO -0.04 0.04 1.26 -2.65 -0.69 0.00 0.00 174.62 172.54 2zex n PRO 122 N 4.67 2.00 -5.02 4.92 -0.02 -1.26 -4.80 135.00 135.49 2zex n PRO 122 Ca 0.12 0.70 -0.28 0.00 -2.02 0.00 0.00 63.50 62.02 2zex n PRO 122 Cb 0.44 -2.31 -0.16 0.00 -0.02 0.00 0.00 33.50 31.44 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 -1.98 2.01 -0.37 -0.52 0.74 -0.19 -1.22 119.66 118.14 2zex s GLN 123 Ca 0.58 -0.74 -0.17 0.00 0.05 0.00 0.00 55.36 55.09 2zex s GLN 123 Cb -0.55 -1.77 -0.00 0.00 1.10 0.00 0.00 33.01 31.79 2zex s GLN 123 CO 0.61 0.33 0.43 -1.17 -0.55 0.00 0.00 175.29 174.93 2zex s LEU 124 N -0.14 4.52 -0.11 3.68 0.20 0.15 -1.25 118.68 125.73 2zex s LEU 124 Ca -0.01 -0.29 -0.04 0.00 0.69 0.00 0.00 54.13 54.47 2zex s LEU 124 Cb -0.11 -2.42 -0.04 0.00 -0.43 0.00 0.00 46.19 43.19 2zex s LEU 124 CO 0.02 -0.44 0.04 0.00 -0.29 0.00 0.00 176.35 175.68 2zex s ALA 125 N 2.16 3.42 -0.46 5.97 0.00 0.30 -1.20 121.76 131.95 2zex s ALA 125 Ca 0.14 -0.76 -0.05 0.00 0.00 0.00 0.00 51.96 51.29 2zex s ALA 125 Cb -0.16 -1.67 0.12 0.00 0.00 0.00 0.00 23.12 21.41 2zex s ALA 125 CO 0.13 0.50 0.28 -0.51 0.00 0.00 0.00 175.76 176.16 2zex s LEU 126 N -0.63 5.39 -0.32 0.00 1.43 0.75 -1.06 118.68 124.25 2zex s LEU 126 Ca 0.11 -2.12 0.00 0.00 -1.03 0.00 0.00 54.13 51.09 2zex s LEU 126 Cb -0.12 -1.88 0.07 0.00 0.03 0.00 0.00 46.19 44.29 2zex s LEU 126 CO 0.02 -0.56 0.03 0.86 0.23 0.00 0.00 176.35 176.93 2zex s TRP 127 N 1.03 3.43 -1.19 0.29 -0.11 0.18 -1.62 118.94 120.96 2zex s TRP 127 Ca 0.09 -2.31 -0.12 0.00 1.22 0.00 0.00 56.10 54.98 2zex s TRP 127 Cb -0.23 -2.47 0.20 0.00 -1.50 0.00 0.00 33.47 29.47 2zex s TRP 127 CO -0.03 -0.88 1.37 1.17 -4.62 0.00 0.00 176.95 173.96 2zex n LYS 128 N 4.50 3.44 0.28 5.86 4.81 0.25 -0.60 118.16 136.70 2zex n LYS 128 Ca -0.08 -4.01 0.17 0.00 -0.87 0.00 0.00 58.31 53.53 2zex n LYS 128 Cb 0.42 -2.90 0.68 0.00 0.02 0.00 0.00 35.03 33.25 2zex n LYS 128 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 2zex h GLY 129 N 8.80 0.00 -4.63 3.14 0.00 -1.74 -1.84 103.07 106.81 2zex h GLY 129 Ca 0.28 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 47.00 2zex h GLY 129 CO 1.20 0.00 0.29 1.34 0.00 0.00 0.00 176.54 179.37 2zex n ASP 130 N -3.09 1.70 -0.33 0.19 2.03 -0.90 -4.42 116.55 111.73 2zex n ASP 130 Ca 0.01 1.17 0.04 0.00 0.52 0.00 0.00 54.79 56.52 2zex n ASP 130 Cb 0.31 -1.31 0.05 0.00 -0.72 0.00 0.00 41.12 39.45 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 0.88 0.35 -0.72 5.18 -2.24 -1.26 -3.84 114.28 112.63 2zex n THR 131 Ca 0.11 -0.68 -0.30 0.00 -2.27 0.00 0.00 64.05 60.92 2zex n THR 131 Cb 0.30 0.92 0.25 0.00 -2.10 0.00 0.00 70.33 69.71 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 -0.74 0.40 0.06 3.42 1.04 -1.26 -4.05 113.70 112.57 2zex s SER 132 Ca 0.11 0.96 0.22 0.00 0.48 0.00 0.00 55.95 57.72 2zex s SER 132 Cb 0.07 -1.43 0.91 0.00 0.10 0.00 0.00 66.02 65.67 2zex s SER 132 CO 0.09 -4.48 1.70 0.29 0.98 0.00 0.00 173.24 171.82 2zex n LYS 133 N -5.05 0.06 -1.72 4.02 5.02 -1.26 -0.36 118.16 118.88 2zex n LYS 133 Ca 0.09 0.18 -0.43 0.00 -2.02 0.00 0.00 58.31 56.14 2zex n LYS 133 Cb 0.58 -1.59 -0.02 0.00 -0.02 0.00 0.00 35.03 33.99 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 -1.57 1.96 -2.32 7.82 0.00 -1.26 -4.33 120.51 120.80 2zex n ALA 134 Ca 0.05 0.38 -0.33 0.00 0.00 0.00 0.00 53.44 53.54 2zex n ALA 134 Cb 0.27 -2.38 -0.06 0.00 0.00 0.00 0.00 19.45 17.28 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 0.34 6.75 -0.12 0.00 -0.87 -1.26 -3.40 114.94 116.37 2zex s ASN 135 Ca 0.64 1.08 -0.01 0.00 -1.57 0.00 0.00 52.86 52.99 2zex s ASN 135 Cb -0.55 -2.29 -0.02 0.00 -0.02 0.00 0.00 41.25 38.37 2zex s ASN 135 CO 0.51 -0.04 -0.08 -0.22 -2.57 0.00 0.00 177.10 174.70 2zex s LEU 136 N -2.52 3.05 -0.10 0.60 2.96 -0.60 -0.72 118.68 121.34 2zex s LEU 136 Ca 0.45 -0.17 -0.00 0.00 -0.22 0.00 0.00 54.13 54.19 2zex s LEU 136 Cb -0.13 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.84 2zex s LEU 136 CO 0.20 0.22 -0.08 -0.31 -1.32 0.00 0.00 176.35 175.06 2zex s TYR 137 N 0.05 2.92 0.00 5.38 2.02 0.47 -0.59 117.35 127.60 2zex s TYR 137 Ca -0.02 -0.21 -0.01 0.00 -0.37 0.00 0.00 57.07 56.46 2zex s TYR 137 Cb -0.14 -1.80 -0.01 0.00 -0.40 0.00 0.00 41.96 39.61 2zex s TYR 137 CO 0.03 0.11 0.01 0.54 -1.57 0.00 0.00 175.55 174.67 2zex s VAL 138 N -0.24 0.05 0.18 0.71 0.11 -0.33 -1.11 120.40 119.76 2zex s VAL 138 Ca 0.03 -0.40 -0.19 0.00 -2.93 0.00 0.00 61.98 58.49 2zex s VAL 138 Cb -0.13 -0.15 0.04 0.00 -1.53 0.00 0.00 36.38 34.61 2zex s VAL 138 CO 0.03 -0.22 0.53 -0.62 -3.33 0.00 0.00 175.10 171.49 2zex s ASP 139 N -0.65 -0.32 -1.11 3.54 2.15 -0.48 -1.05 116.67 118.75 2zex s ASP 139 Ca -0.07 -0.37 -0.17 0.00 0.43 0.00 0.00 52.55 52.37 2zex s ASP 139 Cb -0.04 0.58 -0.02 0.00 -0.30 0.00 0.00 42.92 43.13 2zex s ASP 139 CO -0.00 -1.02 0.82 0.47 -0.17 0.00 0.00 175.17 175.27 2zex n ASP 140 N -0.34 -5.68 -4.74 -0.34 8.00 -1.07 -1.91 116.55 110.48 2zex n ASP 140 Ca -0.12 -0.94 -0.40 0.00 0.71 0.00 0.00 54.79 54.04 2zex n ASP 140 Cb 0.63 -3.80 -0.05 0.00 -0.02 0.00 0.00 41.12 37.88 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 -3.43 4.34 -0.03 2.53 1.01 -0.34 -3.81 120.40 120.66 2zex s VAL 141 Ca 0.47 1.99 0.04 0.00 0.00 0.00 0.00 61.98 64.48 2zex s VAL 141 Cb -0.14 -4.28 -0.01 0.00 0.00 0.00 0.00 36.38 31.95 2zex s VAL 141 CO 0.83 0.42 -0.16 -0.31 0.00 0.00 0.00 175.10 175.88 2zex s TYR 142 N -0.61 1.56 -0.18 5.22 2.02 0.42 -4.76 117.35 121.02 2zex s TYR 142 Ca 0.42 -0.39 -0.04 0.00 -0.37 0.00 0.00 57.07 56.69 2zex s TYR 142 Cb -0.24 -1.04 0.06 0.00 -0.40 0.00 0.00 41.96 40.35 2zex s TYR 142 CO 0.30 -0.11 0.08 -1.17 -1.57 0.00 0.00 175.55 173.07 2zex s LEU 143 N -0.10 0.60 -0.04 -1.29 2.96 -1.25 -1.23 118.68 118.34 2zex s LEU 143 Ca -0.00 -0.71 0.01 0.00 -0.22 0.00 0.00 54.13 53.21 2zex s LEU 143 Cb -0.09 -0.35 0.02 0.00 0.50 0.00 0.00 46.19 46.27 2zex s LEU 143 CO 0.01 -0.34 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.96 2zex s VAL 144 N 2.05 0.57 -2.00 1.68 1.01 -0.06 -0.59 120.40 123.07 2zex s VAL 144 Ca 0.02 -0.15 0.21 0.00 0.00 0.00 0.00 61.98 62.05 2zex s VAL 144 Cb -0.16 -0.59 0.61 0.00 0.00 0.00 0.00 36.38 36.24 2zex s VAL 144 CO -0.10 0.23 1.65 1.21 0.00 0.00 0.00 175.10 178.09