#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1azz s VAL 17 N 0.00 4.98 -1.55 1.39 1.01 0.05 -4.08 120.40 122.20 1azz s VAL 17 Ca 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 61.98 61.90 1azz s VAL 17 Cb 0.00 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.24 1azz s VAL 17 CO 0.00 0.58 0.60 0.61 0.00 0.00 0.00 175.10 176.89 1azz n GLY 18 N 1.95 -0.52 0.00 4.51 0.00 -1.14 -1.56 105.19 108.43 1azz n GLY 18 Ca -0.19 0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1azz n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1azz n GLY 19 N -1.50 6.87 3.47 -0.02 0.00 -1.26 -4.76 105.19 107.99 1azz n GLY 19 Ca -0.11 -1.89 -0.22 0.00 0.00 0.00 0.00 46.02 43.80 1azz n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1azz s VAL 20 N 0.31 1.41 0.24 1.61 0.11 -0.27 -4.94 120.40 118.87 1azz s VAL 20 Ca 0.00 -2.03 -0.25 0.00 -2.93 0.00 0.00 61.98 56.77 1azz s VAL 20 Cb 0.00 -2.73 -0.09 0.00 -1.53 0.00 0.00 36.38 32.04 1azz s VAL 20 CO 0.00 -0.08 0.84 -0.70 -3.33 0.00 0.00 175.10 171.82 1azz s GLU 21 N -3.82 4.54 0.42 1.54 2.12 -1.26 -1.42 118.70 120.81 1azz s GLU 21 Ca 0.34 1.19 -0.22 0.00 0.36 0.00 0.00 54.97 56.64 1azz s GLU 21 Cb 0.08 -3.04 -0.10 0.00 0.26 0.00 0.00 34.13 31.33 1azz s GLU 21 CO 0.15 0.44 0.99 0.00 -0.54 0.00 0.00 175.26 176.30 1azz s ALA 22 N -1.38 3.04 0.29 6.30 0.00 -0.90 -4.84 121.76 124.26 1azz s ALA 22 Ca 0.42 0.54 -0.30 0.00 0.00 0.00 0.00 51.96 52.63 1azz s ALA 22 Cb -0.21 -3.21 -0.11 0.00 0.00 0.00 0.00 23.12 19.59 1azz s ALA 22 CO 0.25 -0.05 1.60 0.08 0.00 0.00 0.00 175.76 177.64 1azz s VAL 23 N -1.91 2.05 0.22 0.00 1.01 -1.26 -4.85 120.40 115.65 1azz s VAL 23 Ca 0.60 0.04 -0.32 0.00 0.00 0.00 0.00 61.98 62.31 1azz s VAL 23 Cb -0.15 -3.03 -0.14 0.00 0.00 0.00 0.00 36.38 33.06 1azz s VAL 23 CO 0.20 0.01 1.39 -2.65 0.00 0.00 0.00 175.10 174.05 1azz n PRO 24 N 2.26 1.93 -1.63 2.72 -0.02 -1.26 -1.85 135.00 137.15 1azz n PRO 24 Ca 0.09 0.69 -0.19 0.00 -2.02 0.00 0.00 63.50 62.06 1azz n PRO 24 Cb 0.37 -2.34 -0.08 0.00 -0.02 0.00 0.00 33.50 31.44 1azz n PRO 24 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1azz n ASN 25 N 2.26 -5.06 0.20 2.55 4.13 -1.26 -4.85 115.26 113.23 1azz n ASN 25 Ca 0.13 0.43 0.14 0.00 1.68 0.00 0.00 54.58 56.96 1azz n ASN 25 Cb 0.30 -4.49 0.41 0.00 -1.54 0.00 0.00 39.78 34.46 1azz n ASN 25 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 1azz h SER 26 N 0.00 0.00 -2.73 6.41 4.64 -1.73 -3.29 113.55 116.85 1azz h SER 26 Ca -0.40 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.28 1azz h SER 26 Cb 1.25 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.95 1azz h SER 26 CO 0.57 0.00 -0.38 0.79 -0.87 0.00 0.00 176.83 176.94 1azz n TRP 27 N -2.83 3.52 0.56 4.77 7.02 -1.26 -4.93 117.44 124.29 1azz n TRP 27 Ca 0.03 -4.07 0.07 0.00 -1.02 0.00 0.00 57.50 52.51 1azz n TRP 27 Cb 0.41 -0.74 0.32 0.00 -2.42 0.00 0.00 31.31 28.88 1azz n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 1azz n PRO 28 N 1.49 0.08 0.00 -0.99 -0.04 -1.24 -1.46 135.00 132.84 1azz n PRO 28 Ca 0.25 0.22 0.12 0.00 -0.04 0.00 0.00 63.50 64.05 1azz n PRO 28 Cb 0.38 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.54 1azz n PRO 28 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1azz n HIS 29 N -1.42 0.00 -2.42 0.54 1.44 -1.16 -1.88 115.22 110.32 1azz n HIS 29 Ca 0.05 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.33 1azz n HIS 29 Cb 0.14 -0.14 -0.03 0.00 0.12 0.00 0.00 29.99 30.09 1azz n HIS 29 CO 0.00 0.00 0.00 -1.14 -2.81 0.00 0.00 176.34 172.39 1azz s GLN 30 N -2.77 4.36 0.09 -1.40 2.00 -0.53 -0.92 119.66 120.49 1azz s GLN 30 Ca 0.16 1.73 0.06 0.00 -2.00 0.00 0.00 55.36 55.30 1azz s GLN 30 Cb 0.18 -3.53 -0.04 0.00 0.80 0.00 0.00 33.01 30.42 1azz s GLN 30 CO 0.65 -0.43 -0.04 0.00 -0.50 0.00 0.00 175.29 174.96 1azz s ALA 31 N 2.06 3.15 -0.17 1.58 0.00 0.25 -4.47 121.76 124.17 1azz s ALA 31 Ca 0.57 -1.16 -0.06 0.00 0.00 0.00 0.00 51.96 51.31 1azz s ALA 31 Cb -0.26 -1.08 -0.04 0.00 0.00 0.00 0.00 23.12 21.75 1azz s ALA 31 CO 0.24 0.68 0.04 0.00 0.00 0.00 0.00 175.76 176.71 1azz s ALA 32 N -1.27 3.31 -0.14 0.00 0.00 -0.79 -1.43 121.76 121.45 1azz s ALA 32 Ca 0.24 -0.76 0.02 0.00 0.00 0.00 0.00 51.96 51.46 1azz s ALA 32 Cb -0.11 -1.81 0.01 0.00 0.00 0.00 0.00 23.12 21.20 1azz s ALA 32 CO 0.16 0.21 -0.21 -0.51 0.00 0.00 0.00 175.76 175.41 1azz s LEU 33 N 0.30 2.17 -0.48 0.00 1.43 0.42 -0.64 118.68 121.89 1azz s LEU 33 Ca 0.02 -0.58 -0.12 0.00 -1.03 0.00 0.00 54.13 52.42 1azz s LEU 33 Cb -0.13 -1.46 0.11 0.00 0.03 0.00 0.00 46.19 44.74 1azz s LEU 33 CO 0.01 0.08 0.37 -0.36 0.23 0.00 0.00 176.35 176.68 1azz s PHE 34 N 0.81 3.34 -0.25 0.29 0.08 -0.20 -2.26 117.98 119.79 1azz s PHE 34 Ca -0.07 -1.53 -0.21 0.00 0.12 0.00 0.00 56.93 55.25 1azz s PHE 34 Cb -0.16 -3.40 -0.02 0.00 -0.57 0.00 0.00 43.02 38.88 1azz s PHE 34 CO -0.02 -0.94 0.64 0.42 -0.10 0.00 0.00 175.22 175.23 1azz s ILE 35 N 1.47 4.98 -1.54 0.64 -1.09 0.40 -2.35 121.20 123.71 1azz s ILE 35 Ca 0.04 1.17 -0.09 0.00 -2.23 0.00 0.00 60.65 59.54 1azz s ILE 35 Cb -0.26 -3.95 0.07 0.00 -1.58 0.00 0.00 42.46 36.75 1azz s ILE 35 CO 0.02 0.03 0.62 0.47 -1.23 0.00 0.00 174.94 174.84 1azz n ASP 37 N 5.69 -1.95 0.00 3.58 8.00 -0.73 -1.05 116.55 130.09 1azz n ASP 37 Ca -0.00 -0.99 0.00 0.00 0.71 0.00 0.00 54.79 54.51 1azz n ASP 37 Cb 0.49 -2.99 0.00 0.00 -0.02 0.00 0.00 41.12 38.59 1azz n ASP 37 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1azz n ASP 38 N -2.84 -2.69 0.00 -2.24 8.00 -1.26 -4.70 116.55 110.83 1azz n ASP 38 Ca -0.12 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.38 1azz n ASP 38 Cb 0.59 -1.88 0.00 0.00 -0.02 0.00 0.00 41.12 39.81 1azz n ASP 38 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1azz n MET 39 N 0.43 3.31 -4.45 -1.24 2.81 -0.21 -5.10 117.12 112.66 1azz n MET 39 Ca 0.00 0.00 -0.24 0.00 -1.81 0.00 0.00 57.70 55.65 1azz n MET 39 Cb 0.22 -0.98 -0.10 0.00 -0.71 0.00 0.00 33.22 31.66 1azz n MET 39 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 1azz s TYR 40 N -1.95 2.25 -0.02 2.03 2.02 -0.29 -4.96 117.35 116.43 1azz s TYR 40 Ca 0.00 -0.35 0.03 0.00 -0.37 0.00 0.00 57.07 56.38 1azz s TYR 40 Cb 0.00 -0.99 -0.00 0.00 -0.40 0.00 0.00 41.96 40.56 1azz s TYR 40 CO 0.00 0.66 -0.11 0.12 -1.57 0.00 0.00 175.55 174.65 1azz s PHE 41 N -2.43 1.04 0.19 2.71 5.36 -1.26 -0.45 117.98 123.13 1azz s PHE 41 Ca 0.28 -0.23 -0.12 0.00 -0.96 0.00 0.00 56.93 55.91 1azz s PHE 41 Cb -0.05 -0.70 0.00 0.00 -0.34 0.00 0.00 43.02 41.93 1azz s PHE 41 CO 0.14 -0.06 0.38 0.00 -1.46 0.00 0.00 175.22 174.22 1azz s GLY 43 N -2.96 2.00 0.33 0.00 0.00 0.10 -0.43 107.32 106.36 1azz s GLY 43 Ca 0.17 -1.81 -0.18 0.00 0.00 0.00 0.00 44.72 42.90 1azz s GLY 43 CO 0.02 -1.70 0.78 -0.32 0.00 0.00 0.00 173.10 171.88 1azz s GLY 44 N -4.40 0.17 -0.07 0.20 0.00 -0.51 -3.45 107.32 99.26 1azz s GLY 44 Ca 0.52 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.70 1azz s GLY 44 CO 0.32 -0.11 -0.04 -0.56 0.00 0.00 0.00 173.10 172.70 1azz s SER 45 N -3.02 1.42 -0.27 1.64 0.01 -0.15 -0.58 113.70 112.75 1azz s SER 45 Ca 0.14 -0.16 -0.29 0.00 1.31 0.00 0.00 55.95 56.95 1azz s SER 45 Cb -0.05 -0.55 -0.02 0.00 0.21 0.00 0.00 66.02 65.61 1azz s SER 45 CO 0.09 -0.10 1.68 -0.22 0.41 0.00 0.00 173.24 175.11 1azz s LEU 46 N 1.33 3.73 -0.02 2.44 0.20 -0.09 -0.12 118.68 126.14 1azz s LEU 46 Ca -0.04 1.46 0.19 0.00 0.69 0.00 0.00 54.13 56.44 1azz s LEU 46 Cb -0.14 -3.53 -0.29 0.00 -0.43 0.00 0.00 46.19 41.80 1azz s LEU 46 CO -0.02 -1.45 0.46 2.30 -0.29 0.00 0.00 176.35 177.35 1azz n ILE 47 N 6.85 0.00 -3.68 6.68 -5.35 0.02 -1.57 119.36 122.31 1azz n ILE 47 Ca 0.20 -0.40 -0.10 0.00 -0.27 0.00 0.00 62.75 62.18 1azz n ILE 47 Cb 0.46 0.15 -0.04 0.00 -1.74 0.00 0.00 39.64 38.47 1azz n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1azz s SER 48 N -4.08 -0.30 0.64 7.28 1.04 -1.17 -4.56 113.70 112.55 1azz s SER 48 Ca -0.06 -0.39 0.20 0.00 0.48 0.00 0.00 55.95 56.18 1azz s SER 48 Cb 0.13 0.57 0.98 0.00 0.10 0.00 0.00 66.02 67.79 1azz s SER 48 CO 0.80 -1.02 1.52 1.55 0.98 0.00 0.00 173.24 177.07 1azz h PRO 49 N 2.19 0.00 -0.00 4.02 0.13 -1.94 -0.66 132.00 135.73 1azz h PRO 49 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1azz h PRO 49 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1azz h PRO 49 CO 0.38 0.00 -0.34 0.39 -0.23 0.00 0.00 178.00 178.20 1azz n GLU 50 N -2.98 2.74 -4.75 0.86 1.02 -1.26 -1.23 120.64 115.04 1azz n GLU 50 Ca 0.05 -0.35 -0.25 0.00 -0.02 0.00 0.00 57.16 56.60 1azz n GLU 50 Cb 0.83 -1.05 -0.16 0.00 -0.02 0.00 0.00 31.44 31.04 1azz n GLU 50 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1azz s TRP 51 N -1.67 1.53 -0.11 -0.32 0.52 -0.26 -0.51 118.94 118.12 1azz s TRP 51 Ca 0.07 -0.39 -0.02 0.00 0.02 0.00 0.00 56.10 55.77 1azz s TRP 51 Cb 0.08 -1.03 -0.03 0.00 -1.15 0.00 0.00 33.47 31.35 1azz s TRP 51 CO 0.34 -0.12 -0.04 0.42 0.02 0.00 0.00 176.95 177.57 1azz s ILE 52 N -0.05 3.93 -0.17 2.03 -1.09 -0.44 -0.80 121.20 124.60 1azz s ILE 52 Ca -0.01 -0.37 -0.08 0.00 -2.23 0.00 0.00 60.65 57.96 1azz s ILE 52 Cb -0.10 -2.67 -0.04 0.00 -1.58 0.00 0.00 42.46 38.07 1azz s ILE 52 CO 0.01 0.55 0.09 -0.22 -1.23 0.00 0.00 174.94 174.14 1azz s LEU 53 N -0.26 3.99 0.00 2.97 2.96 0.83 -0.91 118.68 128.26 1azz s LEU 53 Ca 0.05 0.19 0.00 0.00 -0.22 0.00 0.00 54.13 54.14 1azz s LEU 53 Cb -0.13 -2.00 0.00 0.00 0.50 0.00 0.00 46.19 44.56 1azz s LEU 53 CO 0.02 0.23 0.00 1.07 -1.32 0.00 0.00 176.35 176.35 1azz n THR 54 N 3.17 0.00 -3.72 3.68 5.66 -0.60 -0.97 114.28 121.50 1azz n THR 54 Ca -0.17 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.51 1azz n THR 54 Cb 0.53 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.26 1azz n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1azz s ALA 55 N -1.48 3.84 0.11 1.79 0.00 -1.26 -1.64 121.76 123.11 1azz s ALA 55 Ca 0.00 -0.61 -0.15 0.00 0.00 0.00 0.00 51.96 51.20 1azz s ALA 55 Cb 0.00 -2.07 -0.06 0.00 0.00 0.00 0.00 23.12 20.99 1azz s ALA 55 CO 0.00 0.70 1.47 0.00 0.00 0.00 0.00 175.76 177.93 1azz h ALA 56 N 2.89 0.47 -0.30 0.00 0.00 -1.72 -2.53 119.26 118.07 1azz h ALA 56 Ca -0.46 -0.35 0.09 0.00 0.00 0.00 0.00 54.91 54.19 1azz h ALA 56 Cb 1.16 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1azz h ALA 56 CO 0.73 0.39 0.31 1.12 0.00 0.00 0.00 179.25 181.80 1azz h HIS 57 N 0.47 0.00 -0.10 0.00 2.07 -1.93 0.17 115.15 115.83 1azz h HIS 57 Ca 0.07 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.41 1azz h HIS 57 Cb 0.72 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.70 1azz h HIS 57 CO 0.06 0.00 -0.71 0.00 -3.07 0.00 0.00 177.93 174.21 1azz n MET 59 N -3.86 0.59 0.00 0.00 2.00 0.37 -4.80 117.12 111.43 1azz n MET 59 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 57.70 57.63 1azz n MET 59 Cb 0.70 -1.68 0.00 0.00 0.00 0.00 0.00 33.22 32.24 1azz n MET 59 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1azz n ASP 60 N -2.43 0.00 -1.57 7.83 2.03 -0.00 -1.38 116.55 121.01 1azz n ASP 60 Ca -0.01 0.15 -0.11 0.00 0.52 0.00 0.00 54.79 55.34 1azz n ASP 60 Cb 0.55 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 41.01 1azz n ASP 60 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1azz n GLY 61 N -0.36 3.21 3.81 0.27 0.00 -1.26 -4.97 105.19 105.88 1azz n GLY 61 Ca 0.00 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 45.13 1azz n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1azz s ALA 61 N -1.37 2.95 -0.14 4.61 0.00 -0.48 -5.01 121.76 122.31 1azz s ALA 61 Ca 0.24 0.50 -0.09 0.00 0.00 0.00 0.00 51.96 52.60 1azz s ALA 61 Cb 0.20 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 20.08 1azz s ALA 61 CO 0.03 -0.12 -0.18 0.41 0.00 0.00 0.00 175.76 175.90 1azz n GLY 61 N -0.47 -0.95 3.22 0.00 0.00 -1.26 -5.05 105.19 100.68 1azz n GLY 61 Ca 0.08 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 1azz n GLY 61 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1azz s PHE 62 N -2.25 0.51 -0.02 1.61 -0.71 -1.26 -4.67 117.98 111.19 1azz s PHE 62 Ca -0.15 -0.92 0.01 0.00 -1.04 0.00 0.00 56.93 54.83 1azz s PHE 62 Cb 0.02 -0.24 0.01 0.00 -1.21 0.00 0.00 43.02 41.60 1azz s PHE 62 CO 0.23 -0.57 -0.05 0.08 -1.34 0.00 0.00 175.22 173.56 1azz s VAL 63 N -3.96 0.46 -0.35 -2.49 1.01 -0.48 -1.78 120.40 112.81 1azz s VAL 63 Ca 0.15 -0.17 -0.09 0.00 0.00 0.00 0.00 61.98 61.86 1azz s VAL 63 Cb 0.06 -0.44 0.02 0.00 0.00 0.00 0.00 36.38 36.01 1azz s VAL 63 CO -0.03 0.17 0.17 -1.81 0.00 0.00 0.00 175.10 173.59 1azz s ASP 64 N 0.34 5.56 -0.18 3.32 1.01 -0.99 -0.88 116.67 124.86 1azz s ASP 64 Ca -0.04 -0.91 -0.14 0.00 0.71 0.00 0.00 52.55 52.17 1azz s ASP 64 Cb -0.08 -1.98 -0.04 0.00 1.01 0.00 0.00 42.92 41.83 1azz s ASP 64 CO -0.00 -0.32 0.31 0.68 0.21 0.00 0.00 175.17 176.04 1azz s VAL 65 N 1.53 5.28 -0.17 -1.27 -7.23 0.17 -1.03 120.40 117.69 1azz s VAL 65 Ca 0.02 0.55 -0.04 0.00 -1.81 0.00 0.00 61.98 60.70 1azz s VAL 65 Cb -0.19 -3.64 -0.02 0.00 0.56 0.00 0.00 36.38 33.08 1azz s VAL 65 CO 0.05 0.35 -0.03 -0.69 -0.31 0.00 0.00 175.10 174.47 1azz s VAL 66 N 0.76 3.82 0.20 1.32 1.01 0.18 -0.86 120.40 126.83 1azz s VAL 66 Ca 0.16 -0.37 0.11 0.00 0.00 0.00 0.00 61.98 61.88 1azz s VAL 66 Cb -0.13 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1azz s VAL 66 CO 0.05 0.47 -0.24 -0.76 0.00 0.00 0.00 175.10 174.63 1azz s LEU 68 N 0.60 2.45 -1.21 3.92 1.43 0.26 -1.88 118.68 124.25 1azz s LEU 68 Ca -0.02 -0.88 -0.07 0.00 -1.03 0.00 0.00 54.13 52.13 1azz s LEU 68 Cb -0.14 -1.16 0.01 0.00 0.03 0.00 0.00 46.19 44.93 1azz s LEU 68 CO 0.02 0.11 0.87 0.61 0.23 0.00 0.00 176.35 178.20 1azz n GLY 69 N 0.18 -0.33 3.77 -3.19 0.00 -1.25 -1.57 105.19 102.79 1azz n GLY 69 Ca -0.12 0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 1azz n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1azz s ALA 70 N -3.22 3.54 0.01 4.61 0.00 -1.26 -3.24 121.76 122.20 1azz s ALA 70 Ca 0.43 -0.88 -0.06 0.00 0.00 0.00 0.00 51.96 51.46 1azz s ALA 70 Cb -0.19 -1.55 -0.02 0.00 0.00 0.00 0.00 23.12 21.36 1azz s ALA 70 CO 0.54 0.68 -0.11 1.58 0.00 0.00 0.00 175.76 178.45 1azz n HIS 71 N 1.24 0.00 -3.35 0.00 -0.00 -1.26 -4.73 115.22 107.12 1azz n HIS 71 Ca -0.13 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.62 1azz n HIS 71 Cb 0.53 -0.16 -0.09 0.00 -0.12 0.00 0.00 29.99 30.15 1azz n HIS 71 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1azz s ASN 72 N -5.94 6.18 0.26 0.26 3.84 -1.26 -2.10 114.94 116.18 1azz s ASN 72 Ca -0.09 -0.71 0.24 0.00 0.21 0.00 0.00 52.86 52.51 1azz s ASN 72 Cb 0.01 -2.21 0.98 0.00 -0.55 0.00 0.00 41.25 39.48 1azz s ASN 72 CO 0.13 -0.55 1.72 2.30 -2.79 0.00 0.00 177.10 177.92 1azz n ILE 73 N 5.37 0.80 0.04 -5.21 -5.35 0.57 -2.71 119.36 112.87 1azz n ILE 73 Ca -0.08 0.18 -0.13 0.00 -0.27 0.00 0.00 62.75 62.46 1azz n ILE 73 Cb 0.47 -1.11 -0.14 0.00 -1.74 0.00 0.00 39.64 37.12 1azz n ILE 73 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 1azz h ARG 74 N 0.00 0.13 -7.70 6.28 2.47 -1.93 -3.47 114.38 110.15 1azz h ARG 74 Ca 0.00 -0.22 -0.46 0.00 -1.26 0.00 0.00 59.98 58.04 1azz h ARG 74 Cb 0.40 0.08 0.12 0.00 -1.65 0.00 0.00 29.97 28.93 1azz h ARG 74 CO 0.00 0.92 0.42 -1.21 0.56 0.00 0.00 179.97 180.66 1azz s GLU 75 N -2.63 1.45 -0.42 0.04 2.02 -1.10 -5.03 118.70 113.03 1azz s GLU 75 Ca -0.06 -0.09 -0.01 0.00 0.02 0.00 0.00 54.97 54.83 1azz s GLU 75 Cb 0.08 -1.91 0.11 0.00 0.10 0.00 0.00 34.13 32.51 1azz s GLU 75 CO 0.83 -1.91 0.20 0.34 0.02 0.00 0.00 175.26 174.74 1azz s ASP 76 N -4.70 5.11 0.16 -0.19 2.15 -1.26 -4.95 116.67 112.98 1azz s ASP 76 Ca 0.67 -2.19 -0.01 0.00 0.43 0.00 0.00 52.55 51.44 1azz s ASP 76 Cb -0.08 -1.78 -0.04 0.00 -0.30 0.00 0.00 42.92 40.71 1azz s ASP 76 CO 0.51 -0.48 0.34 -1.61 -0.17 0.00 0.00 175.17 173.76 1azz s GLU 77 N 0.90 3.52 0.50 4.34 2.02 -1.26 -5.01 118.70 123.70 1azz s GLU 77 Ca 0.10 -0.33 0.20 0.00 0.02 0.00 0.00 54.97 54.96 1azz s GLU 77 Cb -0.22 -2.89 1.29 0.00 0.10 0.00 0.00 34.13 32.41 1azz s GLU 77 CO -0.05 0.47 2.09 0.00 0.02 0.00 0.00 175.26 177.79 1azz h ALA 78 N 2.41 1.66 0.00 5.21 0.00 -1.98 -2.19 119.26 124.37 1azz h ALA 78 Ca -0.47 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1azz h ALA 78 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1azz h ALA 78 CO 0.71 0.12 -0.17 1.79 0.00 0.00 0.00 179.25 181.70 1azz h THR 79 N 0.00 0.00 -3.89 0.00 1.35 -1.94 -3.47 112.91 104.96 1azz h THR 79 Ca -0.00 -0.57 -0.49 0.00 -0.55 0.00 0.00 66.41 64.80 1azz h THR 79 Cb 0.20 1.46 0.02 0.00 -1.73 0.00 0.00 68.15 68.09 1azz h THR 79 CO 0.01 0.00 0.44 -1.10 -0.25 0.00 0.00 175.52 174.62 1azz s GLN 80 N -3.14 4.38 -0.01 4.72 -0.21 -0.83 -4.45 119.66 120.12 1azz s GLN 80 Ca 0.09 1.64 0.02 0.00 0.02 0.00 0.00 55.36 57.13 1azz s GLN 80 Cb 0.11 -2.84 -0.00 0.00 1.00 0.00 0.00 33.01 31.28 1azz s GLN 80 CO 0.64 0.02 -0.06 0.54 -2.12 0.00 0.00 175.29 174.31 1azz s VAL 81 N -1.43 0.53 -0.15 1.09 0.11 -0.61 -4.95 120.40 115.00 1azz s VAL 81 Ca 0.52 -0.27 -0.03 0.00 -2.93 0.00 0.00 61.98 59.27 1azz s VAL 81 Cb -0.27 -0.46 -0.03 0.00 -1.53 0.00 0.00 36.38 34.10 1azz s VAL 81 CO 0.34 0.16 -0.05 -0.89 -3.33 0.00 0.00 175.10 171.32 1azz s THR 82 N -0.03 3.76 -0.02 5.04 2.01 -1.26 -0.57 115.64 124.57 1azz s THR 82 Ca 0.01 -0.40 0.01 0.00 0.31 0.00 0.00 61.69 61.61 1azz s THR 82 Cb -0.04 -2.64 0.02 0.00 0.01 0.00 0.00 72.50 69.85 1azz s THR 82 CO -0.00 0.50 -0.01 -0.51 -0.69 0.00 0.00 174.62 173.90 1azz s ILE 83 N 0.36 0.22 0.03 1.82 2.07 -0.04 -4.94 121.20 120.71 1azz s ILE 83 Ca -0.05 -0.00 -0.10 0.00 -1.41 0.00 0.00 60.65 59.09 1azz s ILE 83 Cb -0.14 -0.26 -0.05 0.00 0.13 0.00 0.00 42.46 42.13 1azz s ILE 83 CO 0.03 0.12 0.35 -1.58 -1.91 0.00 0.00 174.94 171.96 1azz s GLN 84 N 0.62 3.73 0.02 3.50 0.74 -1.26 -0.65 119.66 126.35 1azz s GLN 84 Ca -0.06 0.14 0.00 0.00 0.05 0.00 0.00 55.36 55.49 1azz s GLN 84 Cb -0.09 -3.07 -0.02 0.00 1.10 0.00 0.00 33.01 30.93 1azz s GLN 84 CO -0.01 0.62 -0.03 0.45 -0.55 0.00 0.00 175.29 175.77 1azz s SER 85 N -1.57 0.25 -0.05 6.67 0.15 -0.06 -4.66 113.70 114.43 1azz s SER 85 Ca 0.29 -0.50 0.07 0.00 0.70 0.00 0.00 55.95 56.51 1azz s SER 85 Cb -0.14 0.10 0.11 0.00 -1.71 0.00 0.00 66.02 64.37 1azz s SER 85 CO 0.16 -0.30 0.99 0.35 1.20 0.00 0.00 173.24 175.65 1azz n THR 86 N 1.61 1.09 -3.96 6.45 -2.24 -1.26 -1.38 114.28 114.58 1azz n THR 86 Ca -0.24 -1.23 -0.33 0.00 -2.27 0.00 0.00 64.05 59.98 1azz n THR 86 Cb 0.55 0.29 -0.14 0.00 -2.10 0.00 0.00 70.33 68.93 1azz n THR 86 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1azz s ASP 87 N -1.56 4.78 -0.02 3.42 2.15 -1.26 -4.98 116.67 119.20 1azz s ASP 87 Ca 0.12 -1.60 -0.11 0.00 0.43 0.00 0.00 52.55 51.39 1azz s ASP 87 Cb 0.10 -1.66 0.01 0.00 -0.30 0.00 0.00 42.92 41.07 1azz s ASP 87 CO 0.01 -0.30 0.23 0.72 -0.17 0.00 0.00 175.17 175.65 1azz s PHE 88 N 1.12 -0.10 -0.14 -5.34 -0.12 -1.26 -0.51 117.98 111.63 1azz s PHE 88 Ca -0.01 0.16 0.02 0.00 -0.05 0.00 0.00 56.93 57.05 1azz s PHE 88 Cb -0.20 0.03 0.01 0.00 -0.63 0.00 0.00 43.02 42.24 1azz s PHE 88 CO -0.04 -0.30 -0.19 0.99 -0.05 0.00 0.00 175.22 175.62 1azz s THR 89 N -1.10 1.88 0.17 -4.49 2.01 -0.30 -4.96 115.64 108.85 1azz s THR 89 Ca -0.12 -0.86 -0.08 0.00 0.31 0.00 0.00 61.69 60.93 1azz s THR 89 Cb -0.06 -1.69 -0.06 0.00 0.01 0.00 0.00 72.50 70.70 1azz s THR 89 CO 0.02 0.51 0.47 0.68 -0.69 0.00 0.00 174.62 175.62 1azz s VAL 90 N 0.98 5.03 0.10 3.82 -7.23 -1.26 -1.48 120.40 120.36 1azz s VAL 90 Ca -0.04 0.36 -0.36 0.00 -1.81 0.00 0.00 61.98 60.13 1azz s VAL 90 Cb -0.15 -3.63 -0.15 0.00 0.56 0.00 0.00 36.38 33.00 1azz s VAL 90 CO -0.04 0.05 1.46 1.57 -0.31 0.00 0.00 175.10 177.82 1azz n HIS 91 N 0.18 1.85 0.28 2.82 -0.00 -0.77 -4.86 115.22 114.72 1azz n HIS 91 Ca -0.02 0.47 0.11 0.00 0.46 0.00 0.00 57.72 58.74 1azz n HIS 91 Cb 0.52 -2.43 0.76 0.00 -0.12 0.00 0.00 29.99 28.73 1azz n HIS 91 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 1azz h GLU 92 N 5.27 0.00 -0.64 1.57 3.07 -1.93 -0.42 114.58 121.51 1azz h GLU 92 Ca -0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.39 1azz h GLU 92 Cb 1.30 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.21 1azz h GLU 92 CO 0.83 0.01 0.00 -1.71 -1.40 0.00 0.00 179.01 176.74 1azz n ASN 93 N -4.19 4.16 -4.72 1.42 5.15 -1.26 -4.96 115.26 110.86 1azz n ASN 93 Ca -0.03 -2.43 -0.42 0.00 -0.60 0.00 0.00 54.58 51.10 1azz n ASN 93 Cb 0.10 -0.54 -0.03 0.00 -0.53 0.00 0.00 39.78 38.77 1azz n ASN 93 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1azz s TYR 94 N -1.89 2.83 -0.33 1.20 5.04 -0.17 -4.76 117.35 119.27 1azz s TYR 94 Ca 0.43 0.31 0.03 0.00 -2.44 0.00 0.00 57.07 55.40 1azz s TYR 94 Cb 0.28 -4.14 0.10 0.00 0.35 0.00 0.00 41.96 38.55 1azz s TYR 94 CO 0.19 -4.37 0.06 1.21 -1.34 0.00 0.00 175.55 171.31 1azz s ASN 95 N 1.33 4.61 0.56 4.32 3.84 -1.01 -4.98 114.94 123.61 1azz s ASN 95 Ca 0.75 -2.05 0.33 0.00 0.21 0.00 0.00 52.86 52.10 1azz s ASN 95 Cb -0.49 -1.46 1.67 0.00 -0.55 0.00 0.00 41.25 40.42 1azz s ASN 95 CO 0.32 -0.39 2.13 0.77 -2.79 0.00 0.00 177.10 177.15 1azz h SER 96 N 7.71 0.00 -0.78 -4.21 4.64 -1.93 0.30 113.55 119.28 1azz h SER 96 Ca -0.06 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.23 1azz h SER 96 Cb 1.02 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.07 1azz h SER 96 CO 0.51 0.06 0.37 0.15 -0.87 0.00 0.00 176.83 177.05 1azz h PHE 97 N 0.00 1.14 0.00 4.77 3.57 -1.97 -3.13 116.94 121.32 1azz h PHE 97 Ca -0.00 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.44 1azz h PHE 97 Cb 0.28 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.67 1azz h PHE 97 CO 0.00 0.83 -0.02 1.55 -2.23 0.00 0.00 178.31 178.44 1azz n VAL 98 N -4.31 1.06 -4.03 1.41 3.14 -1.03 -5.02 118.33 109.54 1azz n VAL 98 Ca 0.08 -1.15 -0.32 0.00 -2.96 0.00 0.00 64.34 59.98 1azz n VAL 98 Cb 0.15 0.37 -0.02 0.00 -1.06 0.00 0.00 33.84 33.27 1azz n VAL 98 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 1azz n ILE 99 N -0.65 -2.90 -4.07 1.55 5.41 0.10 -4.98 119.36 113.82 1azz n ILE 99 Ca 0.04 -0.60 -0.29 0.00 1.00 0.00 0.00 62.75 62.91 1azz n ILE 99 Cb 0.40 -2.41 -0.06 0.00 -0.71 0.00 0.00 39.64 36.85 1azz n ILE 99 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1azz s SER 100 N -4.06 5.48 -1.29 4.38 1.04 -0.88 -4.52 113.70 113.85 1azz s SER 100 Ca 0.18 -0.08 -0.08 0.00 0.48 0.00 0.00 55.95 56.45 1azz s SER 100 Cb -0.08 -1.44 -0.00 0.00 0.10 0.00 0.00 66.02 64.60 1azz s SER 100 CO 0.93 0.13 0.60 0.59 0.98 0.00 0.00 173.24 176.47 1azz n ASN 101 N 0.13 -2.36 -4.47 7.02 5.03 -1.26 -2.39 115.26 116.96 1azz n ASN 101 Ca -0.09 -0.99 -0.44 0.00 0.87 0.00 0.00 54.58 53.94 1azz n ASN 101 Cb 0.53 -3.29 -0.01 0.00 -1.02 0.00 0.00 39.78 35.98 1azz n ASN 101 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1azz s ASP 102 N -4.02 6.86 -0.18 6.41 2.15 -1.26 -4.23 116.67 122.39 1azz s ASP 102 Ca 0.19 -2.52 -0.14 0.00 0.43 0.00 0.00 52.55 50.51 1azz s ASP 102 Cb -0.07 -2.41 0.05 0.00 -0.30 0.00 0.00 42.92 40.19 1azz s ASP 102 CO 0.87 -0.92 0.46 -0.51 -0.17 0.00 0.00 175.17 174.90 1azz s ILE 103 N 2.27 -0.01 0.15 4.11 2.07 -1.26 -4.04 121.20 124.50 1azz s ILE 103 Ca 0.39 0.03 -0.03 0.00 -1.41 0.00 0.00 60.65 59.63 1azz s ILE 103 Cb -0.03 -0.66 -0.03 0.00 0.13 0.00 0.00 42.46 41.86 1azz s ILE 103 CO -0.04 0.01 0.14 0.00 -1.91 0.00 0.00 174.94 173.14 1azz s ALA 104 N 0.79 0.65 0.02 1.50 0.00 -0.65 -1.85 121.76 122.22 1azz s ALA 104 Ca -0.04 -1.34 0.03 0.00 0.00 0.00 0.00 51.96 50.61 1azz s ALA 104 Cb -0.05 0.94 -0.01 0.00 0.00 0.00 0.00 23.12 24.00 1azz s ALA 104 CO -0.06 -0.55 -0.10 0.54 0.00 0.00 0.00 175.76 175.59 1azz s VAL 105 N -4.04 0.74 -0.08 0.00 0.11 -0.55 -1.56 120.40 115.02 1azz s VAL 105 Ca 0.24 -0.69 0.04 0.00 -2.93 0.00 0.00 61.98 58.64 1azz s VAL 105 Cb 0.06 -0.68 0.00 0.00 -1.53 0.00 0.00 36.38 34.24 1azz s VAL 105 CO 0.03 0.00 -0.20 -0.63 -3.33 0.00 0.00 175.10 170.97 1azz s ILE 106 N -0.64 1.76 -0.18 7.04 1.01 -0.09 -1.15 121.20 128.96 1azz s ILE 106 Ca -0.00 -0.85 -0.17 0.00 0.00 0.00 0.00 60.65 59.63 1azz s ILE 106 Cb -0.06 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 1azz s ILE 106 CO 0.00 0.49 0.43 -0.60 0.00 0.00 0.00 174.94 175.27 1azz s ARG 107 N 0.39 4.23 0.30 2.79 3.52 0.33 -1.33 118.95 129.19 1azz s ARG 107 Ca -0.16 0.29 -0.28 0.00 -0.13 0.00 0.00 55.73 55.46 1azz s ARG 107 Cb -0.17 -3.50 -0.09 0.00 -1.56 0.00 0.00 34.95 29.62 1azz s ARG 107 CO 0.07 0.02 0.99 -0.51 -0.81 0.00 0.00 175.30 175.06 1azz s LEU 108 N 1.10 4.44 0.39 -0.88 1.43 0.34 -4.54 118.68 120.96 1azz s LEU 108 Ca 0.21 1.99 0.16 0.00 -1.03 0.00 0.00 54.13 55.46 1azz s LEU 108 Cb -0.15 -3.85 1.03 0.00 0.03 0.00 0.00 46.19 43.26 1azz s LEU 108 CO 0.08 -0.08 1.81 -0.65 0.23 0.00 0.00 176.35 177.74 1azz h PRO 109 N 3.48 0.45 -3.39 1.29 0.11 -1.90 -3.42 132.00 128.62 1azz h PRO 109 Ca -0.46 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 65.45 1azz h PRO 109 Cb 1.20 -0.10 -0.24 0.00 0.11 0.00 0.00 31.00 31.97 1azz h PRO 109 CO 0.66 0.30 -0.50 0.08 -0.21 0.00 0.00 178.00 178.33 1azz s VAL 110 N -5.53 0.04 0.13 3.15 1.01 -1.26 -5.12 120.40 112.82 1azz s VAL 110 Ca -0.09 -0.31 -0.35 0.00 0.00 0.00 0.00 61.98 61.23 1azz s VAL 110 Cb 0.24 -0.34 -0.15 0.00 0.00 0.00 0.00 36.38 36.13 1azz s VAL 110 CO 0.79 -0.17 1.41 -0.81 0.00 0.00 0.00 175.10 176.32 1azz n PRO 111 N 2.29 1.57 -2.44 2.72 -0.04 -1.26 -4.81 135.00 133.02 1azz n PRO 111 Ca -0.17 0.57 -0.34 0.00 -0.04 0.00 0.00 63.50 63.52 1azz n PRO 111 Cb 0.57 -2.24 -0.02 0.00 -0.04 0.00 0.00 33.50 31.77 1azz n PRO 111 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1azz s VAL 112 N 0.53 3.79 -0.45 0.52 1.01 -0.37 -4.98 120.40 120.44 1azz s VAL 112 Ca 0.80 1.06 -0.28 0.00 0.00 0.00 0.00 61.98 63.56 1azz s VAL 112 Cb -0.82 -3.44 0.03 0.00 0.00 0.00 0.00 36.38 32.15 1azz s VAL 112 CO 0.44 -0.30 1.08 -0.89 0.00 0.00 0.00 175.10 175.44 1azz s THR 113 N -2.07 4.31 0.19 3.92 2.01 -1.26 -4.84 115.64 117.89 1azz s THR 113 Ca 0.67 1.19 -0.30 0.00 0.31 0.00 0.00 61.69 63.55 1azz s THR 113 Cb -0.16 -4.54 -0.09 0.00 0.01 0.00 0.00 72.50 67.72 1azz s THR 113 CO 0.23 -0.89 1.34 -0.76 -0.69 0.00 0.00 174.62 173.86 1azz s LEU 114 N 4.17 4.40 0.00 4.42 1.02 -1.26 -4.91 118.68 126.53 1azz s LEU 114 Ca 0.45 2.42 0.00 0.00 0.02 0.00 0.00 54.13 57.02 1azz s LEU 114 Cb -0.09 -3.61 -0.00 0.00 0.02 0.00 0.00 46.19 42.52 1azz s LEU 114 CO 0.28 -0.58 0.01 0.35 0.02 0.00 0.00 176.35 176.43 1azz n THR 115 N 2.89 0.00 0.21 5.49 -2.24 -0.30 -4.97 114.28 115.37 1azz n THR 115 Ca 0.07 -0.17 0.07 0.00 -2.27 0.00 0.00 64.05 61.75 1azz n THR 115 Cb 0.42 0.05 0.48 0.00 -2.10 0.00 0.00 70.33 69.18 1azz n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1azz h ALA 116 N 1.04 1.27 -0.01 6.98 0.00 -2.00 -3.09 119.26 123.44 1azz h ALA 116 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1azz h ALA 116 Cb 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1azz h ALA 116 CO 0.04 0.35 -0.82 0.00 0.00 0.00 0.00 179.25 178.81 1azz n ALA 117 N -2.36 4.37 -3.77 0.00 0.00 -1.26 -4.73 120.51 112.75 1azz n ALA 117 Ca -0.01 -0.61 -0.30 0.00 0.00 0.00 0.00 53.44 52.52 1azz n ALA 117 Cb 0.37 -0.78 -0.15 0.00 0.00 0.00 0.00 19.45 18.89 1azz n ALA 117 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1azz s ILE 118 N -2.83 0.98 0.17 0.00 1.01 -1.17 -3.93 121.20 115.44 1azz s ILE 118 Ca 0.11 -1.32 -0.01 0.00 0.00 0.00 0.00 60.65 59.44 1azz s ILE 118 Cb 0.17 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.94 1azz s ILE 118 CO 0.77 -0.54 0.09 0.00 0.00 0.00 0.00 174.94 175.26 1azz s ALA 119 N 1.58 1.08 0.78 9.38 0.00 -0.79 -1.14 121.76 132.65 1azz s ALA 119 Ca 0.07 -1.61 -0.04 0.00 0.00 0.00 0.00 51.96 50.38 1azz s ALA 119 Cb -0.17 1.13 0.15 0.00 0.00 0.00 0.00 23.12 24.22 1azz s ALA 119 CO -0.20 -0.53 1.08 0.95 0.00 0.00 0.00 175.76 177.06 1azz s THR 120 N -4.07 2.06 0.11 0.00 -4.23 -1.26 -2.96 115.64 105.29 1azz s THR 120 Ca 0.32 -0.49 0.08 0.00 -1.18 0.00 0.00 61.69 60.42 1azz s THR 120 Cb 0.07 -2.58 -0.04 0.00 1.34 0.00 0.00 72.50 71.30 1azz s THR 120 CO 0.08 0.00 -0.19 0.54 -0.54 0.00 0.00 174.62 174.51 1azz s VAL 121 N -3.32 1.61 0.35 2.29 0.11 -0.61 -4.61 120.40 116.22 1azz s VAL 121 Ca 0.69 -1.62 -0.08 0.00 -2.93 0.00 0.00 61.98 58.04 1azz s VAL 121 Cb -0.04 -1.55 -0.06 0.00 -1.53 0.00 0.00 36.38 33.20 1azz s VAL 121 CO 0.46 -0.18 0.67 -0.83 -3.33 0.00 0.00 175.10 171.89 1azz s GLY 122 N -2.12 1.93 0.03 6.54 0.00 -1.06 -4.72 107.32 107.93 1azz s GLY 122 Ca 0.08 -0.35 -0.03 0.00 0.00 0.00 0.00 44.72 44.41 1azz s GLY 122 CO 0.04 -0.19 0.24 1.08 0.00 0.00 0.00 173.10 174.27 1azz s LEU 123 N -3.66 4.35 0.37 0.66 1.43 -1.26 -1.75 118.68 118.83 1azz s LEU 123 Ca 0.48 0.42 -0.08 0.00 -1.03 0.00 0.00 54.13 53.92 1azz s LEU 123 Cb -0.10 -2.81 -0.06 0.00 0.03 0.00 0.00 46.19 43.25 1azz s LEU 123 CO 0.30 0.21 0.70 -2.84 0.23 0.00 0.00 176.35 174.94 1azz s PRO 124 N -2.13 3.70 -0.16 1.29 0.02 -1.26 -4.53 135.00 131.92 1azz s PRO 124 Ca 0.31 0.27 0.14 0.00 0.02 0.00 0.00 61.00 61.74 1azz s PRO 124 Cb -0.13 -2.48 -0.20 0.00 0.02 0.00 0.00 34.50 31.72 1azz s PRO 124 CO 0.21 0.03 0.04 -1.13 -0.33 0.00 0.00 177.00 175.82 1azz n SER 125 N -1.30 1.10 -4.32 2.53 3.41 -1.26 -4.67 113.62 109.11 1azz n SER 125 Ca 0.01 -0.01 -0.29 0.00 -0.26 0.00 0.00 58.87 58.32 1azz n SER 125 Cb 0.54 0.83 -0.15 0.00 -0.26 0.00 0.00 64.21 65.17 1azz n SER 125 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1azz s THR 127 N -2.39 2.03 0.92 6.66 -4.23 -1.26 -5.00 115.64 112.37 1azz s THR 127 Ca -0.09 -1.33 -0.12 0.00 -1.18 0.00 0.00 61.69 58.97 1azz s THR 127 Cb 0.05 -1.74 0.14 0.00 1.34 0.00 0.00 72.50 72.29 1azz s THR 127 CO 0.65 0.35 1.10 -1.81 -0.54 0.00 0.00 174.62 174.37 1azz s ASP 128 N -1.18 3.35 0.19 3.99 1.01 -1.26 -5.04 116.67 117.73 1azz s ASP 128 Ca 0.11 1.22 0.06 0.00 0.71 0.00 0.00 52.55 54.65 1azz s ASP 128 Cb -0.10 -1.88 -0.04 0.00 1.01 0.00 0.00 42.92 41.91 1azz s ASP 128 CO 0.02 -2.68 0.09 0.54 0.21 0.00 0.00 175.17 173.34 1azz s VAL 129 N -3.07 4.15 0.60 -1.27 0.11 -1.26 -5.09 120.40 114.58 1azz s VAL 129 Ca 0.64 -1.30 -0.10 0.00 -2.93 0.00 0.00 61.98 58.29 1azz s VAL 129 Cb -0.17 -3.13 -0.03 0.00 -1.53 0.00 0.00 36.38 31.52 1azz s VAL 129 CO 0.56 -0.16 0.98 -0.83 -3.33 0.00 0.00 175.10 172.32 1azz s GLY 130 N -3.19 1.62 0.25 6.54 0.00 -1.26 -4.95 107.32 106.33 1azz s GLY 130 Ca 0.30 -0.24 -0.31 0.00 0.00 0.00 0.00 44.72 44.47 1azz s GLY 130 CO 0.22 0.02 1.54 -0.62 0.00 0.00 0.00 173.10 174.26 1azz n VAL 132 N -2.68 0.78 0.00 1.40 0.31 -1.26 -1.65 118.33 115.24 1azz n VAL 132 Ca 0.05 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1azz n VAL 132 Cb 0.55 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.73 1azz n VAL 132 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1azz n GLY 133 N 2.49 2.25 3.70 2.92 0.00 -0.27 -4.97 105.19 111.29 1azz n GLY 133 Ca 0.11 -0.21 -0.44 0.00 0.00 0.00 0.00 46.02 45.48 1azz n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1azz n THR 134 N 0.00 0.07 -3.32 2.61 -1.04 -0.66 -4.58 114.28 107.37 1azz n THR 134 Ca 0.00 -0.01 -0.38 0.00 -2.04 0.00 0.00 64.05 61.61 1azz n THR 134 Cb 0.00 -1.85 -0.07 0.00 -1.82 0.00 0.00 70.33 66.59 1azz n THR 134 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1azz s VAL 135 N 1.38 5.16 0.36 12.58 0.11 -1.26 -0.73 120.40 138.01 1azz s VAL 135 Ca 0.78 0.87 0.08 0.00 -2.93 0.00 0.00 61.98 60.78 1azz s VAL 135 Cb -0.56 -3.79 -0.06 0.00 -1.53 0.00 0.00 36.38 30.44 1azz s VAL 135 CO 0.35 0.25 0.05 0.68 -3.33 0.00 0.00 175.10 173.11 1azz s VAL 136 N 1.20 2.52 -0.27 2.04 -7.23 0.10 -4.84 120.40 113.91 1azz s VAL 136 Ca 0.23 -1.91 0.03 0.00 -1.81 0.00 0.00 61.98 58.52 1azz s VAL 136 Cb -0.15 -2.87 0.06 0.00 0.56 0.00 0.00 36.38 33.99 1azz s VAL 136 CO 0.09 -0.14 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.77 1azz s THR 137 N -2.55 2.21 0.43 5.32 2.01 -0.35 -0.54 115.64 122.17 1azz s THR 137 Ca 0.36 -1.72 -0.16 0.00 0.31 0.00 0.00 61.69 60.48 1azz s THR 137 Cb 0.02 -2.35 -0.09 0.00 0.01 0.00 0.00 72.50 70.09 1azz s THR 137 CO 0.20 -0.10 0.89 -2.16 -0.69 0.00 0.00 174.62 172.75 1azz s PRO 138 N 1.08 4.00 0.13 4.92 0.04 -1.00 -0.73 135.00 143.43 1azz s PRO 138 Ca -0.06 0.85 0.06 0.00 0.04 0.00 0.00 61.00 61.88 1azz s PRO 138 Cb -0.20 -2.25 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 1azz s PRO 138 CO -0.05 -0.08 -0.13 0.95 0.04 0.00 0.00 177.00 177.73 1azz s THR 139 N -2.33 1.28 0.00 1.26 -4.23 -1.22 -2.53 115.64 107.87 1azz s THR 139 Ca 0.57 -1.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1azz s THR 139 Cb -0.10 -1.58 0.00 0.00 1.34 0.00 0.00 72.50 72.16 1azz s THR 139 CO 0.24 -0.49 0.00 0.61 -0.54 0.00 0.00 174.62 174.44 1azz n GLY 140 N 0.39 1.75 1.64 3.99 0.00 -0.44 -4.49 105.19 108.01 1azz n GLY 140 Ca -0.14 -1.01 0.09 0.00 0.00 0.00 0.00 46.02 44.96 1azz n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1azz n TRP 141 N -0.75 1.57 -0.71 1.61 8.01 -1.26 -1.51 117.44 124.40 1azz n TRP 141 Ca 0.00 -0.63 -0.30 0.00 -1.31 0.00 0.00 57.50 55.26 1azz n TRP 141 Cb 0.00 -0.28 0.26 0.00 -2.01 0.00 0.00 31.31 29.28 1azz n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1azz s GLY 142 N -0.90 1.50 0.29 6.99 0.00 -1.26 -0.54 107.32 113.40 1azz s GLY 142 Ca 0.52 -0.80 -0.29 0.00 0.00 0.00 0.00 44.72 44.14 1azz s GLY 142 CO 0.24 0.12 1.30 1.04 0.00 0.00 0.00 173.10 175.80 1azz n LEU 143 N -5.17 3.13 -0.13 0.66 4.32 0.40 -2.83 117.00 117.37 1azz n LEU 143 Ca 0.12 1.18 0.12 0.00 -0.02 0.00 0.00 56.01 57.40 1azz n LEU 143 Cb 0.59 -1.43 0.16 0.00 -1.62 0.00 0.00 43.42 41.12 1azz n LEU 143 CO 0.45 -0.61 0.36 -0.81 -1.22 0.00 0.00 177.39 175.57 1azz n PRO 144 N 1.21 0.39 -3.55 3.23 -0.04 -1.26 -0.76 135.00 134.22 1azz n PRO 144 Ca 0.08 -0.27 -0.11 0.00 -0.04 0.00 0.00 63.50 63.17 1azz n PRO 144 Cb 0.33 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.28 1azz n PRO 144 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1azz s SER 145 N -2.80 -0.45 0.55 3.54 1.04 -1.26 -4.00 113.70 110.33 1azz s SER 145 Ca 0.15 -0.18 0.26 0.00 0.48 0.00 0.00 55.95 56.66 1azz s SER 145 Cb 0.18 0.60 1.60 0.00 0.10 0.00 0.00 66.02 68.50 1azz s SER 145 CO 0.68 -1.02 2.18 0.44 0.98 0.00 0.00 173.24 176.49 1azz h ASP 146 N 2.06 0.00 -0.57 7.02 3.32 -1.96 -1.52 116.42 124.77 1azz h ASP 146 Ca -0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1azz h ASP 146 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1azz h ASP 146 CO 0.37 0.04 0.00 -1.54 -1.72 0.00 0.00 179.24 176.39 1azz n SER 147 N -3.92 3.58 -4.77 6.45 3.41 -1.26 -4.97 113.62 112.14 1azz n SER 147 Ca -0.03 -2.17 -0.39 0.00 -0.26 0.00 0.00 58.87 56.02 1azz n SER 147 Cb 0.13 -0.46 -0.01 0.00 -0.26 0.00 0.00 64.21 63.62 1azz n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1azz s ALA 148 N -1.47 3.25 -0.85 7.33 0.00 -0.58 -4.91 121.76 124.54 1azz s ALA 148 Ca 0.41 1.16 0.22 0.00 0.00 0.00 0.00 51.96 53.76 1azz s ALA 148 Cb 0.24 -3.46 0.90 0.00 0.00 0.00 0.00 23.12 20.80 1azz s ALA 148 CO 0.24 -0.73 1.69 1.28 0.00 0.00 0.00 175.76 178.25 1azz n LEU 149 N 0.19 0.26 0.00 0.00 4.32 -1.26 -4.93 117.00 115.58 1azz n LEU 149 Ca 0.03 0.55 -0.00 0.00 -0.02 0.00 0.00 56.01 56.57 1azz n LEU 149 Cb 0.44 -0.49 0.01 0.00 -1.62 0.00 0.00 43.42 41.77 1azz n LEU 149 CO 0.55 -0.23 0.82 0.61 -1.22 0.00 0.00 177.39 177.91 1azz n GLY 150 N 0.63 0.48 3.78 -0.72 0.00 -1.26 -5.15 105.19 102.95 1azz n GLY 150 Ca 0.05 -1.06 -0.31 0.00 0.00 0.00 0.00 46.02 44.69 1azz n GLY 150 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1azz s ILE 151 N -2.08 3.40 0.54 -0.61 -4.36 -1.26 -4.56 121.20 112.27 1azz s ILE 151 Ca 0.23 0.45 -0.20 0.00 -0.26 0.00 0.00 60.65 60.87 1azz s ILE 151 Cb -0.02 -3.01 -0.05 0.00 1.25 0.00 0.00 42.46 40.64 1azz s ILE 151 CO 0.02 -0.59 1.19 -0.55 0.24 0.00 0.00 174.94 175.25 1azz s SER 152 N -3.51 5.58 -0.11 4.36 0.15 0.30 -4.92 113.70 115.55 1azz s SER 152 Ca 0.61 2.35 -0.03 0.00 0.70 0.00 0.00 55.95 59.57 1azz s SER 152 Cb -0.16 -2.60 -0.25 0.00 -1.71 0.00 0.00 66.02 61.29 1azz s SER 152 CO 0.56 -1.32 0.39 -0.90 1.20 0.00 0.00 173.24 173.16 1azz n ASP 153 N -1.19 1.93 -4.87 5.45 5.75 -1.26 -4.81 116.55 117.55 1azz n ASP 153 Ca 0.11 0.23 -0.34 0.00 -0.01 0.00 0.00 54.79 54.78 1azz n ASP 153 Cb 0.49 -0.72 -0.05 0.00 -1.03 0.00 0.00 41.12 39.80 1azz n ASP 153 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 1azz s VAL 154 N -2.56 5.11 0.38 2.12 -7.23 -1.26 -0.31 120.40 116.65 1azz s VAL 154 Ca -0.20 0.39 -0.28 0.00 -1.81 0.00 0.00 61.98 60.08 1azz s VAL 154 Cb 0.07 -3.64 -0.10 0.00 0.56 0.00 0.00 36.38 33.27 1azz s VAL 154 CO 0.77 0.26 1.46 -0.22 -0.31 0.00 0.00 175.10 177.06 1azz s LEU 155 N -2.01 4.30 0.32 1.32 2.96 -0.89 -4.76 118.68 119.91 1azz s LEU 155 Ca 0.34 3.00 0.08 0.00 -0.22 0.00 0.00 54.13 57.32 1azz s LEU 155 Cb -0.14 -3.71 -0.06 0.00 0.50 0.00 0.00 46.19 42.78 1azz s LEU 155 CO 0.19 -0.89 -0.06 -0.13 -1.32 0.00 0.00 176.35 174.14 1azz s ARG 156 N -2.12 1.69 0.07 1.98 0.52 -0.57 -2.12 118.95 118.39 1azz s ARG 156 Ca 0.54 -1.87 -0.08 0.00 -0.52 0.00 0.00 55.73 53.80 1azz s ARG 156 Cb -0.45 -1.37 -0.01 0.00 0.52 0.00 0.00 34.95 33.63 1azz s ARG 156 CO 0.61 0.06 0.15 1.14 0.02 0.00 0.00 175.30 177.28 1azz s GLN 157 N -3.69 0.77 -0.10 3.54 -2.07 -0.51 -1.33 119.66 116.27 1azz s GLN 157 Ca 0.31 -0.92 -0.19 0.00 -1.82 0.00 0.00 55.36 52.74 1azz s GLN 157 Cb 0.04 0.31 0.04 0.00 -1.09 0.00 0.00 33.01 32.31 1azz s GLN 157 CO 0.14 -0.23 0.47 0.54 -1.32 0.00 0.00 175.29 174.89 1azz s VAL 158 N -3.55 0.02 -0.14 3.63 0.11 -1.05 -1.11 120.40 118.30 1azz s VAL 158 Ca 0.03 -0.16 -0.03 0.00 -2.93 0.00 0.00 61.98 58.88 1azz s VAL 158 Cb 0.04 -0.72 -0.03 0.00 -1.53 0.00 0.00 36.38 34.14 1azz s VAL 158 CO -0.09 -0.09 -0.03 -1.81 -3.33 0.00 0.00 175.10 169.75 1azz s ASP 159 N -0.58 4.90 -0.05 3.54 1.11 -1.26 -2.38 116.67 121.96 1azz s ASP 159 Ca -0.07 -0.07 -0.30 0.00 0.18 0.00 0.00 52.55 52.30 1azz s ASP 159 Cb -0.03 -1.70 0.07 0.00 1.07 0.00 0.00 42.92 42.32 1azz s ASP 159 CO 0.04 0.21 0.65 0.54 1.18 0.00 0.00 175.17 177.79 1azz s VAL 160 N 0.09 0.00 0.18 -1.27 0.11 0.29 -4.93 120.40 114.88 1azz s VAL 160 Ca 0.00 -0.04 -0.06 0.00 -2.93 0.00 0.00 61.98 58.96 1azz s VAL 160 Cb -0.13 -0.97 -0.06 0.00 -1.53 0.00 0.00 36.38 33.69 1azz s VAL 160 CO 0.02 -0.02 0.44 -2.16 -3.33 0.00 0.00 175.10 170.05 1azz s PRO 161 N -1.21 3.66 0.14 1.54 0.04 -1.26 -0.73 135.00 137.18 1azz s PRO 161 Ca -0.11 -0.00 -0.30 0.00 0.04 0.00 0.00 61.00 60.62 1azz s PRO 161 Cb -0.00 -2.78 -0.07 0.00 0.04 0.00 0.00 34.50 31.68 1azz s PRO 161 CO 0.09 0.40 1.25 0.42 0.04 0.00 0.00 177.00 179.21 1azz s ILE 162 N -1.75 3.60 0.45 0.56 1.01 0.09 -0.74 121.20 124.42 1azz s ILE 162 Ca 0.43 1.24 0.07 0.00 0.00 0.00 0.00 60.65 62.39 1azz s ILE 162 Cb -0.12 -3.80 -0.01 0.00 0.01 0.00 0.00 42.46 38.55 1azz s ILE 162 CO 0.24 0.15 0.36 0.00 0.00 0.00 0.00 174.94 175.70 1azz s MET 163 N 0.39 2.42 0.44 2.79 0.23 -0.61 -1.12 119.30 123.84 1azz s MET 163 Ca 0.57 -1.69 -0.18 0.00 -1.03 0.00 0.00 55.69 53.36 1azz s MET 163 Cb -0.33 -2.27 -0.09 0.00 -1.53 0.00 0.00 34.83 30.61 1azz s MET 163 CO 0.34 -0.29 0.92 -1.54 -2.03 0.00 0.00 175.02 172.42 1azz s SER 164 N -4.14 6.79 0.30 -1.18 1.04 -1.26 -4.48 113.70 110.77 1azz s SER 164 Ca 0.45 1.56 -0.00 0.00 0.48 0.00 0.00 55.95 58.44 1azz s SER 164 Cb -0.02 -2.49 0.50 0.00 0.10 0.00 0.00 66.02 64.11 1azz s SER 164 CO 0.26 -0.42 1.92 0.78 0.98 0.00 0.00 173.24 176.77 1azz h ASN 165 N 1.59 0.92 0.01 7.02 4.21 -1.93 -1.77 115.58 125.62 1azz h ASN 165 Ca -0.48 -0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.05 1azz h ASN 165 Cb 1.18 -0.20 -0.02 0.00 -1.12 0.00 0.00 38.32 38.16 1azz h ASN 165 CO 0.62 0.61 -0.12 0.00 -1.29 0.00 0.00 177.43 177.25 1azz h ALA 166 N 1.50 -0.14 -0.50 -0.83 0.00 -1.98 0.17 119.26 117.49 1azz h ALA 166 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1azz h ALA 166 Cb 0.12 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1azz h ALA 166 CO -0.13 -0.61 0.31 -0.44 0.00 0.00 0.00 179.25 178.38 1azz h ASP 167 N -0.20 0.58 -0.24 0.00 3.32 -1.86 -0.50 116.42 117.52 1azz h ASP 167 Ca 0.04 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 1azz h ASP 167 Cb 0.25 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1azz h ASP 167 CO -0.11 0.44 -0.08 0.00 -1.72 0.00 0.00 179.24 177.77 1azz h ASP 169 N 0.22 0.00 -0.77 0.00 3.58 -0.29 -0.92 116.42 118.23 1azz h ASP 169 Ca 0.06 0.00 0.16 0.00 0.42 0.00 0.00 57.03 57.67 1azz h ASP 169 Cb 0.56 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.56 1azz h ASP 169 CO 0.03 0.37 0.52 0.00 -2.88 0.00 0.00 179.24 177.27 1azz h ALA 170 N 1.63 2.14 0.15 -0.78 0.00 -1.02 0.14 119.26 121.52 1azz h ALA 170 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.58 1azz h ALA 170 Cb 0.70 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1azz h ALA 170 CO 0.05 -0.36 -1.65 0.28 0.00 0.00 0.00 179.25 177.57 1azz h VAL 171 N 0.40 0.93 0.00 0.00 2.07 -1.22 -3.43 116.25 115.01 1azz h VAL 171 Ca 0.38 -2.44 -0.21 0.00 0.82 0.00 0.00 66.70 65.25 1azz h VAL 171 Cb 0.91 2.71 -0.04 0.00 -1.52 0.00 0.00 31.29 33.35 1azz h VAL 171 CO -0.12 0.80 -1.98 -1.22 0.02 0.00 0.00 177.57 175.06 1azz n TYR 172 N -3.72 0.00 -0.45 1.57 4.01 -0.75 -5.00 117.16 112.81 1azz n TYR 172 Ca -0.26 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.48 1azz n TYR 172 Cb 1.00 -0.66 0.00 0.00 -0.31 0.00 0.00 39.34 39.37 1azz n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1azz n GLY 174 N 1.90 1.71 0.18 2.72 0.00 0.42 -4.76 105.19 107.37 1azz n GLY 174 Ca -0.19 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.89 1azz n GLY 174 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1azz n ILE 175 N -2.00 1.22 -3.20 -0.61 -5.35 -1.26 -5.06 119.36 103.10 1azz n ILE 175 Ca 0.00 -1.45 -0.39 0.00 -0.27 0.00 0.00 62.75 60.64 1azz n ILE 175 Cb 0.00 0.07 -0.05 0.00 -1.74 0.00 0.00 39.64 37.92 1azz n ILE 175 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1azz s VAL 176 N -1.82 5.04 0.37 7.28 1.01 -1.26 -4.98 120.40 126.03 1azz s VAL 176 Ca 0.19 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.37 1azz s VAL 176 Cb 0.17 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1azz s VAL 176 CO 0.02 0.35 0.03 0.35 0.00 0.00 0.00 175.10 175.84 1azz n THR 177 N 3.29 0.00 0.39 3.92 -2.24 -1.26 -4.92 114.28 113.46 1azz n THR 177 Ca -0.06 -1.72 0.12 0.00 -2.27 0.00 0.00 64.05 60.12 1azz n THR 177 Cb 0.51 0.30 0.49 0.00 -2.10 0.00 0.00 70.33 69.54 1azz n THR 177 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1azz n ASP 178 N -1.28 0.65 0.00 3.42 8.00 -1.26 -1.00 116.55 125.08 1azz n ASP 178 Ca -0.14 0.67 0.11 0.00 0.71 0.00 0.00 54.79 56.13 1azz n ASP 178 Cb 0.46 -0.80 0.58 0.00 -0.02 0.00 0.00 41.12 41.34 1azz n ASP 178 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1azz n GLY 179 N -0.07 -0.86 3.61 0.44 0.00 -1.26 -4.81 105.19 102.24 1azz n GLY 179 Ca 0.02 -0.11 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 1azz n GLY 179 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1azz s ASN 180 N -2.35 4.48 -0.01 1.61 -0.87 -0.17 -0.26 114.94 117.38 1azz s ASN 180 Ca 0.25 -0.52 0.00 0.00 -1.57 0.00 0.00 52.86 51.02 1azz s ASN 180 Cb 0.14 -0.85 0.01 0.00 -0.02 0.00 0.00 41.25 40.54 1azz s ASN 180 CO 0.29 0.09 0.01 -0.51 -2.57 0.00 0.00 177.10 174.41 1azz s ILE 181 N -1.79 -0.01 0.24 0.60 2.07 -0.19 -4.68 121.20 117.44 1azz s ILE 181 Ca 0.27 0.07 0.12 0.00 -1.41 0.00 0.00 60.65 59.69 1azz s ILE 181 Cb -0.09 -0.04 -0.05 0.00 0.13 0.00 0.00 42.46 42.41 1azz s ILE 181 CO 0.17 0.03 -0.22 0.00 -1.91 0.00 0.00 174.94 173.02 1azz s ILE 183 N -2.10 3.04 -0.39 0.00 1.09 0.07 -1.58 121.20 121.33 1azz s ILE 183 Ca 0.26 -1.26 -0.21 0.00 -1.10 0.00 0.00 60.65 58.33 1azz s ILE 183 Cb -0.06 -2.36 0.01 0.00 -1.06 0.00 0.00 42.46 38.99 1azz s ILE 183 CO 0.13 0.21 0.66 -0.62 -0.10 0.00 0.00 174.94 175.22 1azz s ASP 184 N -1.84 6.39 -0.04 3.58 2.15 0.08 -1.94 116.67 125.05 1azz s ASP 184 Ca 0.18 -0.05 0.15 0.00 0.43 0.00 0.00 52.55 53.26 1azz s ASP 184 Cb -0.11 -2.33 0.49 0.00 -0.30 0.00 0.00 42.92 40.68 1azz s ASP 184 CO 0.09 -0.69 1.39 -1.54 -0.17 0.00 0.00 175.17 174.25 1azz n SER 185 N 6.20 3.19 -4.59 -0.34 3.41 -1.26 -4.36 113.62 115.87 1azz n SER 185 Ca -0.01 -2.15 -0.51 0.00 -0.26 0.00 0.00 58.87 55.94 1azz n SER 185 Cb 0.48 -0.42 -0.05 0.00 -0.26 0.00 0.00 64.21 63.96 1azz n SER 185 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1azz n THR 186 N 0.91 0.28 0.00 6.66 -1.04 -1.26 -1.72 114.28 118.11 1azz n THR 186 Ca 0.18 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 1azz n THR 186 Cb 0.56 -0.83 0.00 0.00 -1.82 0.00 0.00 70.33 68.24 1azz n THR 186 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1azz n GLY 187 N 2.37 0.54 1.49 3.41 0.00 -1.26 -4.27 105.19 107.46 1azz n GLY 187 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.17 1azz n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1azz n GLY 188 N -1.86 0.50 3.19 -0.02 0.00 -0.70 -4.97 105.19 101.32 1azz n GLY 188 Ca 0.00 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.22 1azz n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1azz s LYS 188 N -4.56 3.05 0.00 1.61 3.01 -0.81 -2.88 119.74 119.15 1azz s LYS 188 Ca 0.03 -0.81 0.00 0.00 -1.01 0.00 0.00 55.97 54.18 1azz s LYS 188 Cb -0.01 -2.77 0.00 0.00 -1.01 0.00 0.00 37.83 34.03 1azz s LYS 188 CO 0.09 -0.25 0.00 0.41 0.51 0.00 0.00 175.35 176.12 1azz n GLY 189 N 4.67 -0.70 3.93 -3.33 0.00 -0.60 -4.30 105.19 104.85 1azz n GLY 189 Ca -0.19 -0.85 -0.25 0.00 0.00 0.00 0.00 46.02 44.73 1azz n GLY 189 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1azz s THR 190 N -3.00 5.04 0.30 2.61 -4.23 -1.26 -0.77 115.64 114.33 1azz s THR 190 Ca 0.00 -0.25 -0.12 0.00 -1.18 0.00 0.00 61.69 60.13 1azz s THR 190 Cb 0.00 -3.86 0.01 0.00 1.34 0.00 0.00 72.50 69.99 1azz s THR 190 CO 0.00 -0.64 0.57 0.00 -0.54 0.00 0.00 174.62 174.01 1azz n ASN 192 N -0.80 1.75 0.00 0.00 3.02 -1.26 -1.00 115.26 116.97 1azz n ASN 192 Ca -0.03 1.13 0.00 0.00 -0.03 0.00 0.00 54.58 55.65 1azz n ASN 192 Cb 0.61 -1.02 0.00 0.00 -0.61 0.00 0.00 39.78 38.76 1azz n ASN 192 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1azz n GLY 193 N 3.92 2.44 0.03 7.41 0.00 -1.26 -0.45 105.19 117.27 1azz n GLY 193 Ca 0.28 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.42 1azz n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1azz n ASP 194 N 0.00 0.47 -4.52 1.61 8.00 -0.17 -3.66 116.55 118.27 1azz n ASP 194 Ca 0.00 0.18 -0.43 0.00 0.71 0.00 0.00 54.79 55.25 1azz n ASP 194 Cb 0.00 -0.14 -0.00 0.00 -0.02 0.00 0.00 41.12 40.95 1azz n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1azz n SER 195 N -1.78 0.24 0.00 -2.24 7.64 -1.26 -2.25 113.62 113.97 1azz n SER 195 Ca 0.05 1.05 0.00 0.00 1.01 0.00 0.00 58.87 60.98 1azz n SER 195 Cb 0.38 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 1azz n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1azz n GLY 196 N 1.50 3.17 1.89 0.23 0.00 -0.41 0.01 105.19 111.59 1azz n GLY 196 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 1azz n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1azz n GLY 197 N -1.96 -2.05 3.96 -0.02 0.00 -0.95 -3.82 105.19 100.34 1azz n GLY 197 Ca 0.00 -1.57 -0.21 0.00 0.00 0.00 0.00 46.02 44.25 1azz n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1azz s PRO 198 N -4.38 3.28 -0.42 1.61 0.04 -1.26 -2.17 135.00 131.70 1azz s PRO 198 Ca 0.38 -0.87 -0.07 0.00 0.04 0.00 0.00 61.00 60.48 1azz s PRO 198 Cb -0.02 -2.83 0.10 0.00 0.04 0.00 0.00 34.50 31.79 1azz s PRO 198 CO 0.28 0.32 0.24 -0.51 0.04 0.00 0.00 177.00 177.37 1azz s LEU 199 N -4.02 5.22 -0.07 -3.56 1.43 -1.01 -3.44 118.68 113.23 1azz s LEU 199 Ca 0.37 -1.75 -0.15 0.00 -1.03 0.00 0.00 54.13 51.57 1azz s LEU 199 Cb -0.09 -1.92 -0.05 0.00 0.03 0.00 0.00 46.19 44.16 1azz s LEU 199 CO 0.29 -0.56 0.38 0.20 0.23 0.00 0.00 176.35 176.90 1azz s ASN 200 N 2.10 6.68 -0.28 2.29 0.01 0.09 -0.58 114.94 125.24 1azz s ASN 200 Ca 0.05 0.80 -0.11 0.00 -0.71 0.00 0.00 52.86 52.89 1azz s ASN 200 Cb -0.23 -2.23 0.11 0.00 0.41 0.00 0.00 41.25 39.30 1azz s ASN 200 CO -0.01 0.21 0.63 -0.47 -1.51 0.00 0.00 177.10 175.95 1azz s TYR 201 N -0.35 -1.22 -1.44 2.20 5.04 -0.64 -1.21 117.35 119.73 1azz s TYR 201 Ca 0.22 2.19 -0.03 0.00 -2.44 0.00 0.00 57.07 57.02 1azz s TYR 201 Cb -0.15 0.71 0.02 0.00 0.35 0.00 0.00 41.96 42.89 1azz s TYR 201 CO 0.10 -0.61 0.50 -1.71 -1.34 0.00 0.00 175.55 172.48 1azz n ASN 202 N 5.16 -0.88 0.00 4.32 5.15 -1.26 -1.67 115.26 126.08 1azz n ASN 202 Ca -0.14 -0.99 0.00 0.00 -0.60 0.00 0.00 54.58 52.85 1azz n ASN 202 Cb 0.51 -3.10 0.00 0.00 -0.53 0.00 0.00 39.78 36.66 1azz n ASN 202 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1azz n GLY 203 N -1.89 1.58 3.58 8.20 0.00 -1.26 -5.00 105.19 110.41 1azz n GLY 203 Ca -0.25 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 1azz n GLY 203 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1azz s LEU 204 N 0.00 2.82 -0.13 0.99 2.01 -0.67 -2.55 118.68 121.15 1azz s LEU 204 Ca 0.00 -1.20 -0.02 0.00 0.01 0.00 0.00 54.13 52.93 1azz s LEU 204 Cb 0.00 -1.06 -0.02 0.00 0.01 0.00 0.00 46.19 45.12 1azz s LEU 204 CO 0.00 -0.28 -0.09 0.28 1.01 0.00 0.00 176.35 177.28 1azz s THR 209 N -2.62 3.47 -0.89 5.49 -1.32 -0.72 -1.62 115.64 117.45 1azz s THR 209 Ca 0.34 -0.52 0.22 0.00 -1.21 0.00 0.00 61.69 60.52 1azz s THR 209 Cb 0.04 -2.48 -0.21 0.00 -1.51 0.00 0.00 72.50 68.34 1azz s THR 209 CO 0.18 0.52 0.93 -1.22 -2.21 0.00 0.00 174.62 172.81 1azz n TYR 210 N 3.40 0.02 -3.68 9.09 4.02 0.25 -4.16 117.16 126.09 1azz n TYR 210 Ca -0.18 0.01 -0.10 0.00 -0.01 0.00 0.00 57.90 57.62 1azz n TYR 210 Cb 0.53 -0.10 -0.04 0.00 -0.02 0.00 0.00 39.34 39.70 1azz n TYR 210 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1azz s GLY 211 N -3.18 -0.18 -0.15 2.72 0.00 -1.26 -1.72 107.32 103.56 1azz s GLY 211 Ca 0.07 -0.13 0.01 0.00 0.00 0.00 0.00 44.72 44.67 1azz s GLY 211 CO 0.85 -0.26 -0.19 -0.42 0.00 0.00 0.00 173.10 173.09 1azz s ILE 212 N -3.84 2.35 0.11 0.90 1.01 -0.59 -2.42 121.20 118.73 1azz s ILE 212 Ca 0.07 -0.88 -0.32 0.00 0.00 0.00 0.00 60.65 59.52 1azz s ILE 212 Cb 0.00 -1.97 -0.12 0.00 0.01 0.00 0.00 42.46 40.38 1azz s ILE 212 CO -0.06 0.53 1.79 0.41 0.00 0.00 0.00 174.94 177.61 1azz n THR 213 N 4.09 0.29 0.04 2.92 -1.04 -0.92 -0.52 114.28 119.14 1azz n THR 213 Ca -0.20 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 1azz n THR 213 Cb 0.52 -1.98 0.00 0.00 -1.82 0.00 0.00 70.33 67.04 1azz n THR 213 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1azz n SER 214 N 5.20 0.71 -3.89 8.00 2.88 -0.74 -1.28 113.62 124.49 1azz n SER 214 Ca 0.18 0.13 -0.09 0.00 -1.33 0.00 0.00 58.87 57.76 1azz n SER 214 Cb 0.35 -0.18 -0.06 0.00 -0.75 0.00 0.00 64.21 63.56 1azz n SER 214 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1azz s PHE 215 N -1.73 0.25 0.00 0.66 -0.12 -1.03 -4.94 117.98 111.07 1azz s PHE 215 Ca 0.00 -0.62 0.00 0.00 -0.05 0.00 0.00 56.93 56.26 1azz s PHE 215 Cb 0.00 0.02 0.00 0.00 -0.63 0.00 0.00 43.02 42.41 1azz s PHE 215 CO 0.00 -0.71 0.00 0.41 -0.05 0.00 0.00 175.22 174.87 1azz n GLY 216 N -0.20 -1.20 0.02 1.99 0.00 -1.26 -1.32 105.19 103.22 1azz n GLY 216 Ca -0.10 0.29 -0.01 0.00 0.00 0.00 0.00 46.02 46.20 1azz n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1azz n ALA 217 N -2.16 1.97 0.13 4.61 0.00 -1.26 -5.02 120.51 118.78 1azz n ALA 217 Ca 0.00 -0.24 0.19 0.00 0.00 0.00 0.00 53.44 53.39 1azz n ALA 217 Cb 0.00 0.07 0.77 0.00 0.00 0.00 0.00 19.45 20.29 1azz n ALA 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1azz h ALA 218 N 0.27 2.02 0.00 0.00 0.00 -2.05 -3.47 119.26 116.04 1azz h ALA 218 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1azz h ALA 218 Cb 0.96 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1azz h ALA 218 CO 0.00 -0.49 0.00 0.41 0.00 0.00 0.00 179.25 179.18 1azz n GLY 219 N -1.47 4.51 0.18 0.00 0.00 -1.26 -4.86 105.19 102.30 1azz n GLY 219 Ca 0.05 -1.31 0.02 0.00 0.00 0.00 0.00 46.02 44.78 1azz n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1azz n GLU 221 N -4.03 2.71 0.02 0.00 1.02 -1.26 -4.40 120.64 114.70 1azz n GLU 221 Ca -0.02 -2.63 0.09 0.00 -0.02 0.00 0.00 57.16 54.58 1azz n GLU 221 Cb 0.43 -1.56 0.37 0.00 -0.02 0.00 0.00 31.44 30.66 1azz n GLU 221 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1azz n ALA 222 N 1.64 1.76 -0.35 0.62 0.00 -1.10 -4.50 120.51 118.58 1azz n ALA 222 Ca 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1azz n ALA 222 Cb 0.62 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1azz n ALA 222 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1azz n GLY 223 N 0.21 0.77 3.88 0.00 0.00 -1.26 -5.06 105.19 103.73 1azz n GLY 223 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1azz n GLY 223 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1azz s TYR 224 N -2.24 3.50 0.88 1.61 2.02 -1.26 -4.23 117.35 117.63 1azz s TYR 224 Ca 0.00 1.06 -0.10 0.00 -0.37 0.00 0.00 57.07 57.66 1azz s TYR 224 Cb 0.00 -2.47 0.12 0.00 -0.40 0.00 0.00 41.96 39.21 1azz s TYR 224 CO 0.00 -0.22 1.14 -2.14 -1.57 0.00 0.00 175.55 172.76 1azz s PRO 225 N -4.17 1.33 -0.11 -1.71 0.02 -1.26 -4.10 135.00 125.00 1azz s PRO 225 Ca 0.52 1.49 0.02 0.00 0.02 0.00 0.00 61.00 63.04 1azz s PRO 225 Cb -0.10 -1.77 -0.01 0.00 0.02 0.00 0.00 34.50 32.64 1azz s PRO 225 CO 0.36 -2.39 -0.17 -0.51 -0.33 0.00 0.00 177.00 173.96 1azz s ASP 226 N -2.78 3.74 0.05 2.53 1.01 -0.82 -4.73 116.67 115.67 1azz s ASP 226 Ca 0.66 -0.37 0.03 0.00 0.71 0.00 0.00 52.55 53.58 1azz s ASP 226 Cb -0.22 -1.39 -0.04 0.00 1.01 0.00 0.00 42.92 42.29 1azz s ASP 226 CO 0.57 0.20 0.03 0.00 0.21 0.00 0.00 175.17 176.18 1azz s ALA 227 N 0.14 3.39 0.09 5.23 0.00 -0.43 -0.75 121.76 129.43 1azz s ALA 227 Ca -0.09 -1.02 0.03 0.00 0.00 0.00 0.00 51.96 50.89 1azz s ALA 227 Cb -0.15 -1.34 -0.03 0.00 0.00 0.00 0.00 23.12 21.59 1azz s ALA 227 CO 0.05 0.70 -0.10 -0.06 0.00 0.00 0.00 175.76 176.36 1azz s PHE 228 N -1.26 1.00 0.15 0.00 0.40 0.66 -1.80 117.98 117.13 1azz s PHE 228 Ca 0.25 -0.64 -0.30 0.00 -0.60 0.00 0.00 56.93 55.63 1azz s PHE 228 Cb -0.12 -0.56 -0.08 0.00 0.51 0.00 0.00 43.02 42.78 1azz s PHE 228 CO 0.17 -0.02 1.26 0.99 0.70 0.00 0.00 175.22 178.31 1azz s THR 229 N -2.32 3.56 -0.40 0.64 2.01 0.32 -1.02 115.64 118.43 1azz s THR 229 Ca 0.03 1.22 -0.27 0.00 0.31 0.00 0.00 61.69 62.98 1azz s THR 229 Cb -0.04 -3.78 0.02 0.00 0.01 0.00 0.00 72.50 68.72 1azz s THR 229 CO -0.00 0.15 1.02 -0.60 -0.69 0.00 0.00 174.62 174.50 1azz s ARG 230 N 0.33 3.83 0.22 4.92 3.52 0.64 -1.54 118.95 130.87 1azz s ARG 230 Ca 0.57 0.65 -0.07 0.00 -0.13 0.00 0.00 55.73 56.75 1azz s ARG 230 Cb -0.33 -3.83 0.18 0.00 -1.56 0.00 0.00 34.95 29.41 1azz s ARG 230 CO 0.34 -1.09 1.80 0.28 -0.81 0.00 0.00 175.30 175.82 1azz h VAL 231 N 5.94 1.26 -0.48 7.11 2.07 -1.66 -2.60 116.25 127.89 1azz h VAL 231 Ca -0.23 -0.79 0.05 0.00 0.82 0.00 0.00 66.70 66.55 1azz h VAL 231 Cb 1.07 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1azz h VAL 231 CO 1.04 0.33 0.32 0.71 0.02 0.00 0.00 177.57 179.99 1azz h THR 232 N 1.18 1.01 0.00 2.57 1.35 -1.83 -1.00 112.91 116.19 1azz h THR 232 Ca 0.28 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.97 1azz h THR 232 Cb 0.18 0.49 0.00 0.00 -1.73 0.00 0.00 68.15 67.09 1azz h THR 232 CO -0.03 0.09 0.00 0.22 -0.25 0.00 0.00 175.52 175.55 1azz h TYR 233 N 0.48 0.00 0.00 4.73 3.20 -1.81 -2.69 116.97 120.88 1azz h TYR 233 Ca 0.20 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.07 1azz h TYR 233 Cb 0.20 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1azz h TYR 233 CO -0.00 0.00 -0.01 1.19 -1.64 0.00 0.00 178.16 177.70 1azz n PHE 234 N -2.63 0.00 -0.35 -3.82 3.72 -0.39 -4.83 117.46 109.16 1azz n PHE 234 Ca -0.00 -0.66 0.12 0.00 -0.05 0.00 0.00 57.45 56.86 1azz n PHE 234 Cb 0.16 -0.08 0.31 0.00 -0.94 0.00 0.00 39.48 38.92 1azz n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1azz h LEU 235 N 0.00 0.81 -0.11 4.37 3.38 -1.31 -0.19 115.31 122.27 1azz h LEU 235 Ca 0.00 0.09 -0.21 0.00 0.09 0.00 0.00 57.88 57.85 1azz h LEU 235 Cb 0.70 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1azz h LEU 235 CO 0.00 0.32 -0.97 0.44 0.09 0.00 0.00 178.44 178.32 1azz h ASP 236 N 0.81 0.07 0.21 -0.43 3.32 -1.88 -0.49 116.42 118.04 1azz h ASP 236 Ca 0.57 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.54 1azz h ASP 236 Cb 0.82 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1azz h ASP 236 CO -0.36 0.99 -0.10 -0.25 -1.72 0.00 0.00 179.24 177.80 1azz h TRP 237 N 0.02 -0.26 -0.22 4.55 7.01 -1.58 -0.64 115.95 124.83 1azz h TRP 237 Ca -0.03 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.01 1azz h TRP 237 Cb 1.68 0.09 -0.04 0.00 -2.10 0.00 0.00 29.16 28.79 1azz h TRP 237 CO 0.01 -0.15 -0.03 0.82 -2.79 0.00 0.00 178.44 176.29 1azz h ILE 238 N -0.30 0.81 -0.76 2.65 2.04 -0.93 -1.80 117.51 119.21 1azz h ILE 238 Ca -0.03 -0.01 0.05 0.00 1.00 0.00 0.00 64.86 65.87 1azz h ILE 238 Cb 0.23 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.03 1azz h ILE 238 CO 0.05 0.01 0.46 -0.61 0.00 0.00 0.00 178.15 178.05 1azz h GLN 239 N 0.03 0.84 -0.19 2.37 4.15 -0.91 0.12 115.11 121.51 1azz h GLN 239 Ca 0.11 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.42 1azz h GLN 239 Cb 0.15 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 1azz h GLN 239 CO -0.21 0.55 -0.15 1.15 -1.93 0.00 0.00 178.83 178.25 1azz h THR 240 N 0.86 1.20 0.06 2.39 2.02 -0.53 0.22 112.91 119.13 1azz h THR 240 Ca 0.33 -0.91 -0.28 0.00 0.77 0.00 0.00 66.41 66.32 1azz h THR 240 Cb 0.13 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 1azz h THR 240 CO -0.16 0.29 -1.42 1.56 0.37 0.00 0.00 175.52 176.16 1azz h GLN 241 N 0.29 0.12 0.00 6.66 1.08 -0.45 -3.42 115.11 119.39 1azz h GLN 241 Ca 0.06 -0.21 -0.08 0.00 -1.45 0.00 0.00 58.65 56.97 1azz h GLN 241 Cb 0.44 0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 1azz h GLN 241 CO 0.03 0.94 -1.29 2.41 -0.95 0.00 0.00 178.83 179.97 1azz n THR 242 N -3.33 0.29 -0.02 -0.54 -1.04 0.32 -5.04 114.28 104.93 1azz n THR 242 Ca -0.12 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 1azz n THR 242 Cb 1.02 -0.77 0.00 0.00 -1.82 0.00 0.00 70.33 68.76 1azz n THR 242 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1azz n GLY 243 N 3.05 0.35 3.76 3.41 0.00 0.78 -5.02 105.19 111.52 1azz n GLY 243 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1azz n GLY 243 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1azz s ILE 244 N -2.12 4.67 0.44 -0.61 1.01 -1.26 -4.96 121.20 118.38 1azz s ILE 244 Ca 0.00 1.56 0.06 0.00 0.00 0.00 0.00 60.65 62.27 1azz s ILE 244 Cb 0.00 -4.08 -0.05 0.00 0.01 0.00 0.00 42.46 38.35 1azz s ILE 244 CO 0.00 0.42 0.11 0.42 0.00 0.00 0.00 174.94 175.90 1azz s THR 245 N -0.41 1.94 -2.00 2.92 -4.23 -1.26 -3.97 115.64 108.63 1azz s THR 245 Ca 0.36 -1.83 0.13 0.00 -1.18 0.00 0.00 61.69 59.17 1azz s THR 245 Cb -0.21 -2.77 0.38 0.00 1.34 0.00 0.00 72.50 71.24 1azz s THR 245 CO 0.23 0.00 1.22 -0.81 -0.54 0.00 0.00 174.62 174.71