#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1azc n GLN 2 N 0.00 0.03 -0.39 0.00 0.00 -1.26 -4.30 117.38 111.47 1azc n GLN 2 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 57.00 57.01 1azc n GLN 2 Cb 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 30.24 29.21 1azc n GLN 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1azc s GLU 4 N 0.18 0.83 -0.08 0.00 2.02 -1.26 -0.47 118.70 119.91 1azc s GLU 4 Ca 0.00 -0.83 -0.21 0.00 0.02 0.00 0.00 54.97 53.94 1azc s GLU 4 Cb 0.00 0.34 0.05 0.00 0.10 0.00 0.00 34.13 34.62 1azc s GLU 4 CO 0.00 -0.27 0.50 0.00 0.02 0.00 0.00 175.26 175.52 1azc s ALA 5 N -3.48 -1.28 -0.14 5.21 0.00 -0.21 -4.95 121.76 116.91 1azc s ALA 5 Ca 0.02 1.03 -0.01 0.00 0.00 0.00 0.00 51.96 52.99 1azc s ALA 5 Cb 0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 1azc s ALA 5 CO -0.09 -0.29 -0.10 0.99 0.00 0.00 0.00 175.76 176.26 1azc s THR 6 N -0.78 3.29 0.01 0.00 2.01 -1.26 0.34 115.64 119.25 1azc s THR 6 Ca -0.08 -0.57 0.05 0.00 0.31 0.00 0.00 61.69 61.39 1azc s THR 6 Cb -0.03 -2.40 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 1azc s THR 6 CO 0.05 0.51 -0.16 -0.51 -0.69 0.00 0.00 174.62 173.82 1azc s ILE 7 N 0.39 1.27 -0.03 1.82 2.07 0.65 -4.94 121.20 122.43 1azc s ILE 7 Ca -0.09 -0.86 0.01 0.00 -1.41 0.00 0.00 60.65 58.31 1azc s ILE 7 Cb -0.15 -1.09 -0.03 0.00 0.13 0.00 0.00 42.46 41.31 1azc s ILE 7 CO 0.05 0.22 -0.04 -1.61 -1.91 0.00 0.00 174.94 171.65 1azc s GLU 8 N -0.73 2.73 0.08 3.50 2.02 -1.26 -1.08 118.70 123.96 1azc s GLU 8 Ca 0.05 -0.60 0.09 0.00 0.02 0.00 0.00 54.97 54.52 1azc s GLU 8 Cb -0.07 -2.61 -0.03 0.00 0.10 0.00 0.00 34.13 31.52 1azc s GLU 8 CO 0.00 0.64 -0.23 -1.54 0.02 0.00 0.00 175.26 174.15 1azc s SER 9 N -1.23 2.82 0.04 -0.19 1.04 -0.02 -0.95 113.70 115.20 1azc s SER 9 Ca 0.16 -0.64 0.01 0.00 0.48 0.00 0.00 55.95 55.96 1azc s SER 9 Cb -0.11 -0.20 -0.00 0.00 0.10 0.00 0.00 66.02 65.80 1azc s SER 9 CO 0.06 0.15 0.02 -0.46 0.98 0.00 0.00 173.24 174.00 1azc n ASN 10 N 1.39 0.27 0.00 7.02 0.23 -0.97 -0.72 115.26 122.48 1azc n ASN 10 Ca -0.18 -1.22 0.15 0.00 -0.53 0.00 0.00 54.58 52.79 1azc n ASN 10 Cb 0.53 0.15 0.80 0.00 -2.08 0.00 0.00 39.78 39.18 1azc n ASN 10 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1azc n ASP 11 N -2.58 0.00 -0.97 0.53 8.00 -1.26 -2.76 116.55 117.50 1azc n ASP 11 Ca 0.00 -0.46 0.12 0.00 0.71 0.00 0.00 54.79 55.16 1azc n ASP 11 Cb 0.06 -0.17 0.25 0.00 -0.02 0.00 0.00 41.12 41.24 1azc n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1azc n ALA 12 N -1.17 2.45 -3.08 2.24 0.00 -1.26 -4.96 120.51 114.73 1azc n ALA 12 Ca 0.17 -0.83 -0.13 0.00 0.00 0.00 0.00 53.44 52.65 1azc n ALA 12 Cb 0.18 -0.93 0.07 0.00 0.00 0.00 0.00 19.45 18.77 1azc n ALA 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1azc n MET 13 N 1.17 -5.00 -4.10 0.00 1.56 -1.11 -5.03 117.12 104.61 1azc n MET 13 Ca 0.18 0.62 -0.10 0.00 -0.27 0.00 0.00 57.70 58.13 1azc n MET 13 Cb 0.53 -4.97 -0.10 0.00 2.15 0.00 0.00 33.22 30.83 1azc n MET 13 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 1azc s GLN 14 N -5.13 0.65 0.24 2.12 -0.21 -1.26 -4.44 119.66 111.63 1azc s GLN 14 Ca 0.06 -1.11 0.06 0.00 0.02 0.00 0.00 55.36 54.39 1azc s GLN 14 Cb -0.03 -0.06 -0.03 0.00 1.00 0.00 0.00 33.01 33.89 1azc s GLN 14 CO 0.54 -0.04 0.29 0.71 -2.12 0.00 0.00 175.29 174.67 1azc s TYR 15 N -3.04 3.31 -1.48 0.91 2.02 -1.26 -2.29 117.35 115.52 1azc s TYR 15 Ca 0.03 -0.05 0.24 0.00 -0.37 0.00 0.00 57.07 56.91 1azc s TYR 15 Cb 0.01 -1.50 0.22 0.00 -0.40 0.00 0.00 41.96 40.29 1azc s TYR 15 CO -0.05 0.48 1.22 0.27 -1.57 0.00 0.00 175.55 175.90 1azc n ASN 16 N -1.28 1.20 -4.28 2.29 6.94 -0.12 -4.87 115.26 115.14 1azc n ASN 16 Ca -0.08 -0.97 -0.32 0.00 -0.02 0.00 0.00 54.58 53.19 1azc n ASN 16 Cb 0.57 0.49 -0.16 0.00 -2.36 0.00 0.00 39.78 38.32 1azc n ASN 16 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1azc s LEU 17 N -2.73 2.16 -0.01 -4.53 1.43 -1.26 -4.98 118.68 108.76 1azc s LEU 17 Ca 0.16 -0.49 0.20 0.00 -1.03 0.00 0.00 54.13 52.97 1azc s LEU 17 Cb 0.18 -1.41 -0.26 0.00 0.03 0.00 0.00 46.19 44.73 1azc s LEU 17 CO 0.67 0.23 0.70 0.29 0.23 0.00 0.00 176.35 178.46 1azc n LYS 18 N 3.04 0.50 -3.78 1.70 4.76 -1.26 -4.79 118.16 118.33 1azc n LYS 18 Ca -0.18 -0.07 -0.13 0.00 -2.87 0.00 0.00 58.31 55.06 1azc n LYS 18 Cb 0.52 -1.46 -0.10 0.00 -1.84 0.00 0.00 35.03 32.16 1azc n LYS 18 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1azc s GLU 19 N -3.09 0.51 -0.00 1.97 -1.05 -1.26 -0.40 118.70 115.38 1azc s GLU 19 Ca 0.02 0.03 0.04 0.00 -0.15 0.00 0.00 54.97 54.91 1azc s GLU 19 Cb 0.14 0.23 -0.01 0.00 -0.44 0.00 0.00 34.13 34.05 1azc s GLU 19 CO 0.83 -0.11 -0.13 -1.64 0.95 0.00 0.00 175.26 175.16 1azc s MET 20 N -0.72 1.02 -0.12 -4.83 -1.94 -0.31 -4.95 119.30 107.46 1azc s MET 20 Ca -0.08 -0.49 0.02 0.00 -1.71 0.00 0.00 55.69 53.43 1azc s MET 20 Cb -0.04 -0.99 -0.01 0.00 2.01 0.00 0.00 34.83 35.80 1azc s MET 20 CO 0.02 0.27 -0.19 0.08 -0.01 0.00 0.00 175.02 175.19 1azc s VAL 21 N -0.37 2.46 -0.24 -6.03 1.01 -1.26 -1.75 120.40 114.22 1azc s VAL 21 Ca 0.04 -0.87 -0.12 0.00 0.00 0.00 0.00 61.98 61.03 1azc s VAL 21 Cb -0.05 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 1azc s VAL 21 CO -0.00 0.54 0.22 -0.69 0.00 0.00 0.00 175.10 175.17 1azc s VAL 22 N 0.39 5.32 0.33 2.92 1.01 0.74 -4.95 120.40 126.15 1azc s VAL 22 Ca -0.15 0.30 -0.28 0.00 0.00 0.00 0.00 61.98 61.85 1azc s VAL 22 Cb -0.17 -3.56 -0.10 0.00 0.00 0.00 0.00 36.38 32.56 1azc s VAL 22 CO 0.07 0.31 1.21 -0.62 0.00 0.00 0.00 175.10 176.07 1azc s ASP 23 N 1.14 6.87 0.27 3.32 2.15 -1.26 -1.46 116.67 127.69 1azc s ASP 23 Ca 0.10 2.49 0.19 0.00 0.43 0.00 0.00 52.55 55.76 1azc s ASP 23 Cb -0.14 -2.63 0.99 0.00 -0.30 0.00 0.00 42.92 40.83 1azc s ASP 23 CO 0.06 -0.45 1.58 0.29 -0.17 0.00 0.00 175.17 176.48 1azc n LYS 24 N 0.76 0.13 0.02 4.34 5.02 -0.68 -0.81 118.16 126.93 1azc n LYS 24 Ca 0.01 0.59 0.14 0.00 -2.02 0.00 0.00 58.31 57.02 1azc n LYS 24 Cb 0.44 -1.88 0.52 0.00 -0.02 0.00 0.00 35.03 34.09 1azc n LYS 24 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1azc n SER 25 N -2.14 0.22 -4.74 4.39 3.41 -1.26 -4.86 113.62 108.64 1azc n SER 25 Ca -0.01 0.41 -0.41 0.00 -0.26 0.00 0.00 58.87 58.60 1azc n SER 25 Cb 0.06 -0.43 -0.05 0.00 -0.26 0.00 0.00 64.21 63.53 1azc n SER 25 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1azc n LYS 27 N 2.78 0.67 -5.01 0.00 3.00 -1.26 -4.74 118.16 113.60 1azc n LYS 27 Ca 0.00 0.14 -0.31 0.00 -0.00 0.00 0.00 58.31 58.14 1azc n LYS 27 Cb 0.50 -1.63 -0.14 0.00 0.00 0.00 0.00 35.03 33.75 1azc n LYS 27 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 1azc s GLN 28 N -2.54 2.17 -0.03 1.64 -0.21 -1.26 -0.58 119.66 118.86 1azc s GLN 28 Ca -0.14 -0.90 0.02 0.00 0.02 0.00 0.00 55.36 54.37 1azc s GLN 28 Cb 0.07 -2.16 0.00 0.00 1.00 0.00 0.00 33.01 31.93 1azc s GLN 28 CO 0.78 0.57 -0.09 0.12 -2.12 0.00 0.00 175.29 174.55 1azc s PHE 29 N -0.73 0.95 -0.11 0.91 5.36 -0.36 -4.71 117.98 119.29 1azc s PHE 29 Ca 0.12 -0.24 0.03 0.00 -0.96 0.00 0.00 56.93 55.87 1azc s PHE 29 Cb -0.10 -0.68 -0.00 0.00 -0.34 0.00 0.00 43.02 41.89 1azc s PHE 29 CO 0.01 -0.11 -0.20 0.99 -1.46 0.00 0.00 175.22 174.45 1azc s THR 30 N 0.24 2.39 -0.16 0.12 2.01 0.38 -0.36 115.64 120.26 1azc s THR 30 Ca -0.04 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.03 1azc s THR 30 Cb -0.09 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.44 1azc s THR 30 CO 0.01 0.55 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.75 1azc s VAL 31 N 0.38 3.81 -0.33 3.82 1.01 0.51 -1.04 120.40 128.56 1azc s VAL 31 Ca -0.16 -0.38 -0.10 0.00 0.00 0.00 0.00 61.98 61.35 1azc s VAL 31 Cb -0.17 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.54 1azc s VAL 31 CO 0.07 0.48 0.16 -1.00 0.00 0.00 0.00 175.10 174.82 1azc s HIS 32 N 0.48 3.20 -0.18 5.22 3.76 0.15 -1.23 115.29 126.70 1azc s HIS 32 Ca -0.04 -0.78 -0.11 0.00 -0.15 0.00 0.00 55.06 53.98 1azc s HIS 32 Cb -0.14 -2.37 -0.05 0.00 1.11 0.00 0.00 32.58 31.13 1azc s HIS 32 CO 0.03 -0.54 0.18 -1.17 -0.85 0.00 0.00 174.74 172.39 1azc s LEU 33 N 1.57 4.24 -0.03 0.89 2.96 0.16 -0.26 118.68 128.22 1azc s LEU 33 Ca 0.03 0.35 0.08 0.00 -0.22 0.00 0.00 54.13 54.36 1azc s LEU 33 Cb -0.18 -2.17 -0.02 0.00 0.50 0.00 0.00 46.19 44.32 1azc s LEU 33 CO 0.06 0.19 -0.26 -0.54 -1.32 0.00 0.00 176.35 174.48 1azc s LYS 34 N 0.20 2.19 -0.45 1.98 1.02 -0.24 -0.45 119.74 124.00 1azc s LYS 34 Ca 0.11 -0.92 -0.11 0.00 0.02 0.00 0.00 55.97 55.07 1azc s LYS 34 Cb -0.12 -2.07 0.09 0.00 -0.52 0.00 0.00 37.83 35.22 1azc s LYS 34 CO 0.01 0.53 0.32 -1.58 -0.92 0.00 0.00 175.35 173.70 1azc s HIS 35 N -0.53 3.34 -2.04 3.18 2.46 0.00 -0.84 115.29 120.86 1azc s HIS 35 Ca 0.08 -1.49 0.14 0.00 0.47 0.00 0.00 55.06 54.25 1azc s HIS 35 Cb -0.11 -3.17 0.40 0.00 -0.13 0.00 0.00 32.58 29.58 1azc s HIS 35 CO -0.00 -0.88 1.33 1.33 -2.47 0.00 0.00 174.74 174.04 1azc n VAL 36 N 4.98 0.51 -1.93 0.89 0.24 0.10 -1.02 118.33 122.10 1azc n VAL 36 Ca -0.10 -0.53 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 1azc n VAL 36 Cb 0.42 0.30 0.00 0.00 -1.47 0.00 0.00 33.84 33.09 1azc n VAL 36 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1azc n GLY 37 N 1.16 0.95 0.10 7.63 0.00 -1.26 -4.80 105.19 108.97 1azc n GLY 37 Ca 0.14 -1.95 0.03 0.00 0.00 0.00 0.00 46.02 44.24 1azc n GLY 37 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1azc n LYS 38 N -0.60 1.36 -3.24 1.61 2.85 -1.26 -2.23 118.16 116.65 1azc n LYS 38 Ca 0.00 -1.47 -0.32 0.00 -1.05 0.00 0.00 58.31 55.47 1azc n LYS 38 Cb 0.00 -0.93 -0.05 0.00 -0.65 0.00 0.00 35.03 33.39 1azc n LYS 38 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 177.40 175.71 1azc s MET 39 N -1.09 3.88 0.63 -1.58 -1.94 -1.26 -4.76 119.30 113.18 1azc s MET 39 Ca 0.08 0.46 -0.17 0.00 -1.71 0.00 0.00 55.69 54.36 1azc s MET 39 Cb 0.07 -2.52 -0.01 0.00 2.01 0.00 0.00 34.83 34.37 1azc s MET 39 CO 0.01 0.21 1.14 0.00 -0.01 0.00 0.00 175.02 176.37 1azc s ALA 40 N -1.95 2.48 0.52 3.03 0.00 -1.26 -1.02 121.76 123.55 1azc s ALA 40 Ca 0.51 0.73 0.24 0.00 0.00 0.00 0.00 51.96 53.44 1azc s ALA 40 Cb -0.11 -3.37 1.51 0.00 0.00 0.00 0.00 23.12 21.16 1azc s ALA 40 CO 0.21 -1.22 2.16 1.57 0.00 0.00 0.00 175.76 178.47 1azc h LYS 41 N 0.39 0.00 0.00 0.00 2.10 -1.86 0.62 116.57 117.82 1azc h LYS 41 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1azc h LYS 41 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1azc h LYS 41 CO 0.54 0.05 0.00 -0.39 -2.00 0.00 0.00 179.45 177.66 1azc h VAL 42 N 0.00 0.00 0.00 0.07 -1.51 -1.95 -0.98 116.25 111.88 1azc h VAL 42 Ca -0.00 -0.72 -0.31 0.00 -1.23 0.00 0.00 66.70 64.44 1azc h VAL 42 Cb 0.12 1.70 -0.06 0.00 -2.13 0.00 0.00 31.29 30.93 1azc h VAL 42 CO 0.01 0.00 -2.17 0.00 -1.23 0.00 0.00 177.57 174.18 1azc n ALA 43 N -2.06 1.57 -2.68 5.19 0.00 -0.40 -4.78 120.51 117.35 1azc n ALA 43 Ca 0.03 -1.04 -0.08 0.00 0.00 0.00 0.00 53.44 52.35 1azc n ALA 43 Cb 0.41 -0.07 0.07 0.00 0.00 0.00 0.00 19.45 19.87 1azc n ALA 43 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1azc n MET 44 N -2.79 1.18 -1.65 0.00 0.00 0.07 -5.00 117.12 108.93 1azc n MET 44 Ca -0.31 -2.62 -0.31 0.00 -0.00 0.00 0.00 57.70 54.46 1azc n MET 44 Cb 0.99 -0.72 0.04 0.00 0.00 0.00 0.00 33.22 33.54 1azc n MET 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1azc s GLY 45 N -2.30 1.71 0.02 -5.12 0.00 -0.37 -4.77 107.32 96.49 1azc s GLY 45 Ca 0.25 0.09 0.01 0.00 0.00 0.00 0.00 44.72 45.07 1azc s GLY 45 CO -0.02 0.40 -0.04 0.30 0.00 0.00 0.00 173.10 173.74 1azc s HIS 46 N -3.00 0.36 0.16 1.90 3.76 -0.57 -4.78 115.29 113.12 1azc s HIS 46 Ca 0.58 -0.48 0.03 0.00 -0.15 0.00 0.00 55.06 55.04 1azc s HIS 46 Cb -0.14 -0.24 -0.01 0.00 1.11 0.00 0.00 32.58 33.30 1azc s HIS 46 CO 0.53 -0.15 0.11 0.27 -0.85 0.00 0.00 174.74 174.66 1azc n ASN 47 N 1.69 0.04 -3.67 1.40 0.23 -1.26 -0.43 115.26 113.25 1azc n ASN 47 Ca -0.23 -1.99 -0.18 0.00 -0.53 0.00 0.00 54.58 51.65 1azc n ASN 47 Cb 0.55 0.68 -0.17 0.00 -2.08 0.00 0.00 39.78 38.77 1azc n ASN 47 CO 0.00 0.00 0.00 0.86 -0.93 0.00 0.00 177.26 177.19 1azc s TRP 48 N -2.52 -0.06 -0.03 -2.53 -0.00 -1.26 -4.34 118.94 108.20 1azc s TRP 48 Ca 0.16 0.43 0.05 0.00 -0.00 0.00 0.00 56.10 56.74 1azc s TRP 48 Cb 0.01 -0.36 -0.01 0.00 -0.00 0.00 0.00 33.47 33.12 1azc s TRP 48 CO 0.11 -0.23 -0.18 0.08 -0.00 0.00 0.00 176.95 176.74 1azc s VAL 49 N 2.17 1.44 -0.17 5.86 1.01 -0.11 -1.38 120.40 129.23 1azc s VAL 49 Ca 0.03 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.28 1azc s VAL 49 Cb -0.12 -1.23 0.01 0.00 0.00 0.00 0.00 36.38 35.04 1azc s VAL 49 CO -0.04 0.41 -0.18 -0.22 0.00 0.00 0.00 175.10 175.07 1azc s LEU 50 N -0.11 2.27 0.20 3.92 2.96 -0.38 -0.69 118.68 126.84 1azc s LEU 50 Ca -0.00 -0.58 -0.04 0.00 -0.22 0.00 0.00 54.13 53.29 1azc s LEU 50 Cb -0.10 -1.51 -0.03 0.00 0.50 0.00 0.00 46.19 45.05 1azc s LEU 50 CO 0.01 0.04 0.22 0.42 -1.32 0.00 0.00 176.35 175.72 1azc s THR 51 N 1.07 0.02 0.57 3.68 -4.23 -0.48 0.65 115.64 116.91 1azc s THR 51 Ca -0.01 -1.80 -0.18 0.00 -1.18 0.00 0.00 61.69 58.52 1azc s THR 51 Cb -0.14 -2.33 -0.05 0.00 1.34 0.00 0.00 72.50 71.32 1azc s THR 51 CO -0.06 -0.07 1.09 -0.54 -0.54 0.00 0.00 174.62 174.50 1azc s LYS 52 N -4.10 3.31 0.42 3.99 1.02 -1.26 0.28 119.74 123.40 1azc s LYS 52 Ca 0.32 1.43 0.18 0.00 0.02 0.00 0.00 55.97 57.92 1azc s LYS 52 Cb 0.05 -2.02 1.10 0.00 -0.52 0.00 0.00 37.83 36.44 1azc s LYS 52 CO 0.09 -0.85 1.84 1.49 -0.92 0.00 0.00 175.35 177.00 1azc h GLU 53 N 0.85 0.38 -0.20 1.68 4.81 -1.77 -0.27 114.58 120.06 1azc h GLU 53 Ca -0.49 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1azc h GLU 53 Cb 1.24 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.53 1azc h GLU 53 CO 0.57 0.25 0.12 0.00 -0.73 0.00 0.00 179.01 179.22 1azc h ALA 54 N 1.61 0.26 0.00 2.92 0.00 -1.89 -3.11 119.26 119.05 1azc h ALA 54 Ca 0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1azc h ALA 54 Cb 1.27 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1azc h ALA 54 CO -0.20 -0.24 0.00 -0.25 0.00 0.00 0.00 179.25 178.57 1azc n ASP 55 N -4.92 0.00 -0.14 0.00 8.00 -0.12 -4.39 116.55 114.98 1azc n ASP 55 Ca -0.03 -0.29 -0.07 0.00 0.71 0.00 0.00 54.79 55.11 1azc n ASP 55 Cb 0.05 -0.16 -0.05 0.00 -0.02 0.00 0.00 41.12 40.94 1azc n ASP 55 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1azc h LYS 56 N 0.00 -0.12 -0.60 -1.24 3.64 -1.53 -1.61 116.57 115.11 1azc h LYS 56 Ca 0.00 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.44 1azc h LYS 56 Cb 0.11 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.90 1azc h LYS 56 CO 0.00 -0.08 0.33 1.96 -2.27 0.00 0.00 179.45 179.39 1azc h GLN 57 N -0.12 0.61 -0.18 1.90 4.20 -1.86 -0.62 115.11 119.05 1azc h GLN 57 Ca 0.06 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1azc h GLN 57 Cb 0.27 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1azc h GLN 57 CO -0.40 0.41 0.01 0.78 -0.67 0.00 0.00 178.83 178.95 1azc h GLY 58 N 0.63 0.34 1.11 3.46 0.00 -1.84 -0.72 103.07 106.05 1azc h GLY 58 Ca 0.26 -0.24 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 1azc h GLY 58 CO -0.16 0.23 -0.06 -2.08 0.00 0.00 0.00 176.54 174.47 1azc h VAL 59 N 0.07 1.27 -0.38 4.60 2.07 -1.14 -1.01 116.25 121.73 1azc h VAL 59 Ca 0.05 -1.21 0.02 0.00 0.82 0.00 0.00 66.70 66.37 1azc h VAL 59 Cb 0.37 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1azc h VAL 59 CO 0.01 0.44 0.22 0.00 0.02 0.00 0.00 177.57 178.25 1azc h ALA 60 N 0.97 0.48 0.69 1.67 0.00 -0.99 0.24 119.26 122.33 1azc h ALA 60 Ca 0.16 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1azc h ALA 60 Cb 0.62 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1azc h ALA 60 CO 0.04 -0.12 -0.33 1.15 0.00 0.00 0.00 179.25 179.99 1azc h THR 61 N 0.45 0.27 -0.37 0.00 2.02 -0.88 -0.82 112.91 113.59 1azc h THR 61 Ca 0.15 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1azc h THR 61 Cb 0.01 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 66.72 1azc h THR 61 CO -0.07 0.02 0.20 0.44 0.37 0.00 0.00 175.52 176.47 1azc h ASP 62 N -1.03 0.44 0.04 4.18 5.19 -1.19 -2.24 116.42 121.81 1azc h ASP 62 Ca -0.09 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.29 1azc h ASP 62 Cb 0.73 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.13 1azc h ASP 62 CO 0.15 0.36 -0.02 1.23 -3.12 0.00 0.00 179.24 177.84 1azc h GLY 63 N 0.58 -0.05 0.28 2.75 0.00 -0.71 -1.47 103.07 104.44 1azc h GLY 63 Ca 0.13 0.02 0.15 0.00 0.00 0.00 0.00 47.33 47.63 1azc h GLY 63 CO -0.02 -0.02 0.54 1.98 0.00 0.00 0.00 176.54 179.02 1azc h MET 64 N -0.23 0.75 0.00 4.80 1.85 -0.85 0.35 114.93 121.60 1azc h MET 64 Ca -0.01 -0.05 0.00 0.00 -0.61 0.00 0.00 59.70 59.04 1azc h MET 64 Cb 0.21 -0.17 0.00 0.00 0.43 0.00 0.00 31.60 32.07 1azc h MET 64 CO 0.01 0.50 0.00 0.09 -0.40 0.00 0.00 176.91 177.10 1azc n ASN 65 N -4.77 0.18 0.18 1.39 3.02 -0.87 -3.18 115.26 111.21 1azc n ASN 65 Ca 0.19 0.53 0.08 0.00 -0.03 0.00 0.00 54.58 55.36 1azc n ASN 65 Cb 0.44 -0.58 0.10 0.00 -0.61 0.00 0.00 39.78 39.14 1azc n ASN 65 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1azc h ALA 66 N 2.62 0.84 0.00 5.41 0.00 0.75 -3.50 119.26 125.38 1azc h ALA 66 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1azc h ALA 66 Cb 0.39 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1azc h ALA 66 CO 0.00 0.26 0.00 0.41 0.00 0.00 0.00 179.25 179.92 1azc n GLY 67 N 1.16 -0.33 0.29 0.00 0.00 -1.19 -4.29 105.19 100.83 1azc n GLY 67 Ca 0.03 -1.67 0.01 0.00 0.00 0.00 0.00 46.02 44.39 1azc n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1azc h LEU 68 N 0.00 0.53 -1.79 0.99 5.85 -1.92 -1.34 115.31 117.64 1azc h LEU 68 Ca 0.00 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1azc h LEU 68 Cb 0.00 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1azc h LEU 68 CO 0.00 0.50 0.00 0.00 -0.34 0.00 0.00 178.44 178.60 1azc h ALA 69 N 1.59 1.00 -0.62 1.25 0.00 -2.02 -0.65 119.26 119.81 1azc h ALA 69 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1azc h ALA 69 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1azc h ALA 69 CO -0.01 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.28 1azc n GLN 70 N -2.87 3.48 -2.29 0.00 1.13 -0.85 -4.93 117.38 111.04 1azc n GLN 70 Ca -0.00 -2.79 -0.20 0.00 -1.94 0.00 0.00 57.00 52.07 1azc n GLN 70 Cb 0.20 -1.79 -0.02 0.00 0.11 0.00 0.00 30.24 28.74 1azc n GLN 70 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1azc n ASP 71 N 1.07 -5.55 -3.77 1.08 8.00 -0.25 -2.25 116.55 114.87 1azc n ASP 71 Ca 0.24 0.08 -0.28 0.00 0.71 0.00 0.00 54.79 55.55 1azc n ASP 71 Cb 0.81 -4.67 0.04 0.00 -0.02 0.00 0.00 41.12 37.29 1azc n ASP 71 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1azc n TYR 72 N -3.69 -2.49 -3.76 1.24 4.01 -0.56 -4.59 117.16 107.32 1azc n TYR 72 Ca -0.23 0.92 -0.19 0.00 -0.16 0.00 0.00 57.90 58.24 1azc n TYR 72 Cb 0.67 -4.33 -0.17 0.00 -0.31 0.00 0.00 39.34 35.20 1azc n TYR 72 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1azc s VAL 73 N -3.29 0.06 0.03 -0.72 1.01 -0.95 -4.03 120.40 112.50 1azc s VAL 73 Ca 0.63 0.26 -0.34 0.00 0.00 0.00 0.00 61.98 62.54 1azc s VAL 73 Cb -0.30 -0.25 -0.12 0.00 0.00 0.00 0.00 36.38 35.71 1azc s VAL 73 CO 0.78 0.18 1.77 1.17 0.00 0.00 0.00 175.10 178.99 1azc n LYS 74 N 4.87 2.28 -1.73 2.72 4.81 -1.26 -4.85 118.16 125.00 1azc n LYS 74 Ca -0.12 0.83 -0.42 0.00 -0.87 0.00 0.00 58.31 57.73 1azc n LYS 74 Cb 0.50 -2.66 -0.01 0.00 0.02 0.00 0.00 35.03 32.88 1azc n LYS 74 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1azc n ALA 75 N 5.41 2.00 -1.49 3.14 0.00 -1.26 -1.31 120.51 126.99 1azc n ALA 75 Ca 0.20 0.36 -0.16 0.00 0.00 0.00 0.00 53.44 53.84 1azc n ALA 75 Cb 0.31 -2.37 -0.07 0.00 0.00 0.00 0.00 19.45 17.32 1azc n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1azc n GLY 76 N 1.22 1.53 3.68 0.00 0.00 -1.26 -4.91 105.19 105.45 1azc n GLY 76 Ca 0.05 -0.27 -0.44 0.00 0.00 0.00 0.00 46.02 45.37 1azc n GLY 76 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1azc n ASP 77 N -0.58 3.89 0.15 1.61 -0.08 -0.43 -4.81 116.55 116.30 1azc n ASP 77 Ca -0.16 0.97 0.12 0.00 -1.51 0.00 0.00 54.79 54.22 1azc n ASP 77 Cb 0.53 -1.50 0.25 0.00 2.34 0.00 0.00 41.12 42.73 1azc n ASP 77 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1azc h THR 78 N 4.93 0.00 0.00 5.18 1.35 -1.91 -2.93 112.91 119.53 1azc h THR 78 Ca -0.47 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 64.64 1azc h THR 78 Cb 1.24 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 1azc h THR 78 CO 0.94 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 176.75 1azc n ARG 79 N -2.64 0.57 -3.56 4.72 1.74 -1.26 -4.70 116.66 111.53 1azc n ARG 79 Ca 0.04 0.02 -0.39 0.00 -0.77 0.00 0.00 57.85 56.75 1azc n ARG 79 Cb 0.48 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.32 1azc n ARG 79 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1azc s VAL 80 N -2.35 5.22 -0.02 1.55 1.01 -1.11 -4.41 120.40 120.29 1azc s VAL 80 Ca 0.32 -0.12 -0.24 0.00 0.00 0.00 0.00 61.98 61.94 1azc s VAL 80 Cb 0.18 -3.62 -0.20 0.00 0.00 0.00 0.00 36.38 32.75 1azc s VAL 80 CO 0.37 0.08 1.20 0.40 0.00 0.00 0.00 175.10 177.15 1azc h ILE 81 N 5.47 1.44 -2.92 2.22 2.04 -0.06 -3.48 117.51 122.23 1azc h ILE 81 Ca -0.33 -1.50 -0.03 0.00 1.00 0.00 0.00 64.86 64.01 1azc h ILE 81 Cb 1.17 2.31 -0.13 0.00 -0.74 0.00 0.00 36.82 39.42 1azc h ILE 81 CO 0.61 0.41 0.17 0.00 0.00 0.00 0.00 178.15 179.34 1azc s ALA 82 N -3.83 -1.54 0.05 1.87 0.00 -1.21 -4.97 121.76 112.12 1azc s ALA 82 Ca -0.15 0.53 -0.27 0.00 0.00 0.00 0.00 51.96 52.07 1azc s ALA 82 Cb 0.02 0.75 0.08 0.00 0.00 0.00 0.00 23.12 23.97 1azc s ALA 82 CO 0.72 -0.70 0.68 -3.38 0.00 0.00 0.00 175.76 173.08 1azc s HIS 83 N -3.42 -0.56 0.63 0.00 -3.43 -1.26 -1.25 115.29 106.01 1azc s HIS 83 Ca -0.00 0.63 0.06 0.00 -0.80 0.00 0.00 55.06 54.95 1azc s HIS 83 Cb -0.01 0.50 0.11 0.00 -1.43 0.00 0.00 32.58 31.75 1azc s HIS 83 CO -0.10 -0.71 0.87 0.25 -2.00 0.00 0.00 174.74 173.05 1azc n THR 84 N 0.17 0.00 -2.12 -5.38 -2.24 -0.48 -4.85 114.28 99.39 1azc n THR 84 Ca -0.17 -1.82 -0.27 0.00 -2.27 0.00 0.00 64.05 59.52 1azc n THR 84 Cb 0.61 -0.64 0.09 0.00 -2.10 0.00 0.00 70.33 68.30 1azc n THR 84 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1azc s LYS 85 N -4.79 1.87 -0.09 -0.78 1.02 -1.26 -4.65 119.74 111.06 1azc s LYS 85 Ca 0.63 -0.26 -0.24 0.00 0.02 0.00 0.00 55.97 56.12 1azc s LYS 85 Cb -0.04 -2.08 -0.03 0.00 -0.52 0.00 0.00 37.83 35.15 1azc s LYS 85 CO 0.41 -1.51 0.75 0.08 -0.92 0.00 0.00 175.35 174.15 1azc s VAL 86 N -3.41 5.00 0.29 3.17 1.01 -1.26 -4.42 120.40 120.77 1azc s VAL 86 Ca 0.63 1.52 0.12 0.00 0.00 0.00 0.00 61.98 64.25 1azc s VAL 86 Cb -0.09 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.16 1azc s VAL 86 CO 0.47 0.19 -0.17 0.27 0.00 0.00 0.00 175.10 175.86 1azc s ILE 87 N 1.15 2.54 0.53 2.22 -4.36 0.42 -4.88 121.20 118.81 1azc s ILE 87 Ca 0.38 -2.34 0.06 0.00 -0.26 0.00 0.00 60.65 58.49 1azc s ILE 87 Cb -0.18 -2.38 0.03 0.00 1.25 0.00 0.00 42.46 41.18 1azc s ILE 87 CO 0.17 -0.38 0.44 -0.83 0.24 0.00 0.00 174.94 174.59 1azc s GLY 88 N -3.54 2.25 0.27 6.27 0.00 -1.26 -1.51 107.32 109.81 1azc s GLY 88 Ca 0.30 -1.49 -0.30 0.00 0.00 0.00 0.00 44.72 43.24 1azc s GLY 88 CO 0.16 -1.87 1.20 0.61 0.00 0.00 0.00 173.10 173.20 1azc n GLY 89 N -1.78 0.26 1.95 0.20 0.00 -0.19 -2.15 105.19 103.47 1azc n GLY 89 Ca 0.01 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.43 1azc n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1azc n GLY 90 N 1.47 1.69 3.96 -0.02 0.00 -0.19 -4.83 105.19 107.26 1azc n GLY 90 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1azc n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1azc s GLU 91 N -0.35 2.39 0.14 1.61 2.02 -0.92 -4.94 118.70 118.66 1azc s GLU 91 Ca 0.00 -1.69 -0.18 0.00 0.02 0.00 0.00 54.97 53.12 1azc s GLU 91 Cb 0.00 -2.44 0.04 0.00 0.10 0.00 0.00 34.13 31.83 1azc s GLU 91 CO 0.00 -0.60 0.46 -1.54 0.02 0.00 0.00 175.26 173.60 1azc s SER 92 N -4.41 -0.32 0.08 -0.19 1.04 -1.26 -0.82 113.70 107.83 1azc s SER 92 Ca 0.50 -0.26 -0.14 0.00 0.48 0.00 0.00 55.95 56.53 1azc s SER 92 Cb -0.05 0.52 0.02 0.00 0.10 0.00 0.00 66.02 66.61 1azc s SER 92 CO 0.31 -0.90 0.33 -0.62 0.98 0.00 0.00 173.24 173.34 1azc s ASP 93 N -2.80 -0.14 0.05 7.02 2.15 0.41 -4.99 116.67 118.37 1azc s ASP 93 Ca 0.03 -0.31 0.02 0.00 0.43 0.00 0.00 52.55 52.72 1azc s ASP 93 Cb 0.01 0.41 -0.03 0.00 -0.30 0.00 0.00 42.92 43.01 1azc s ASP 93 CO -0.11 -0.74 -0.08 -0.44 -0.17 0.00 0.00 175.17 173.63 1azc s SER 94 N -2.52 0.99 -0.00 -0.34 0.01 -1.26 0.38 113.70 110.96 1azc s SER 94 Ca 0.00 -0.61 0.01 0.00 1.31 0.00 0.00 55.95 56.66 1azc s SER 94 Cb 0.01 0.03 -0.00 0.00 0.21 0.00 0.00 66.02 66.27 1azc s SER 94 CO -0.08 -0.22 -0.04 0.54 0.41 0.00 0.00 173.24 173.85 1azc s VAL 95 N -1.65 0.30 -0.09 3.43 0.11 -0.36 -4.94 120.40 117.21 1azc s VAL 95 Ca -0.06 -0.20 0.04 0.00 -2.93 0.00 0.00 61.98 58.83 1azc s VAL 95 Cb -0.08 -0.27 -0.01 0.00 -1.53 0.00 0.00 36.38 34.49 1azc s VAL 95 CO 0.00 0.06 -0.22 -0.89 -3.33 0.00 0.00 175.10 170.73 1azc s THR 96 N -0.15 2.31 0.18 5.04 2.01 -1.26 -0.36 115.64 123.41 1azc s THR 96 Ca 0.01 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.09 1azc s THR 96 Cb -0.02 -1.89 -0.05 0.00 0.01 0.00 0.00 72.50 70.56 1azc s THR 96 CO -0.00 0.56 -0.02 0.72 -0.69 0.00 0.00 174.62 175.19 1azc s PHE 97 N 0.08 1.31 -0.19 4.92 -0.71 0.51 -4.95 117.98 118.96 1azc s PHE 97 Ca -0.10 -0.94 -0.24 0.00 -1.04 0.00 0.00 56.93 54.62 1azc s PHE 97 Cb -0.16 -0.74 -0.02 0.00 -1.21 0.00 0.00 43.02 40.90 1azc s PHE 97 CO 0.06 -0.11 0.77 0.34 -1.34 0.00 0.00 175.22 174.94 1azc s ASP 98 N -3.21 6.86 0.58 1.98 -1.08 -1.26 -1.23 116.67 119.31 1azc s ASP 98 Ca 0.23 1.06 0.27 0.00 -0.52 0.00 0.00 52.55 53.59 1azc s ASP 98 Cb 0.05 -2.42 1.70 0.00 -1.46 0.00 0.00 42.92 40.80 1azc s ASP 98 CO 0.04 -0.38 2.23 0.58 0.52 0.00 0.00 175.17 178.17 1azc h VAL 99 N 5.22 0.63 0.00 1.11 2.07 -1.13 -2.02 116.25 122.12 1azc h VAL 99 Ca -0.29 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1azc h VAL 99 Cb 1.13 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1azc h VAL 99 CO 0.82 0.00 0.00 -1.54 0.02 0.00 0.00 177.57 176.87 1azc n SER 100 N -4.00 0.45 0.23 0.57 3.41 -1.26 0.01 113.62 113.02 1azc n SER 100 Ca -0.03 0.71 0.12 0.00 -0.26 0.00 0.00 58.87 59.41 1azc n SER 100 Cb 0.09 -0.77 0.41 0.00 -0.26 0.00 0.00 64.21 63.68 1azc n SER 100 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1azc h LYS 101 N 0.00 0.00 -6.05 4.33 1.57 -1.75 -3.44 116.57 111.24 1azc h LYS 101 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 1azc h LYS 101 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1azc h LYS 101 CO 0.00 0.15 -0.35 -0.51 -0.57 0.00 0.00 179.45 178.17 1azc s LEU 102 N -6.45 4.32 -0.09 2.94 1.43 0.10 -5.09 118.68 115.84 1azc s LEU 102 Ca 0.03 0.57 0.01 0.00 -1.03 0.00 0.00 54.13 53.70 1azc s LEU 102 Cb 0.08 -3.03 -0.02 0.00 0.03 0.00 0.00 46.19 43.25 1azc s LEU 102 CO 0.63 0.14 -0.11 0.42 0.23 0.00 0.00 176.35 177.66 1azc s THR 103 N -1.50 3.31 0.52 5.49 -4.23 -1.26 -5.03 115.64 112.94 1azc s THR 103 Ca 0.35 -0.60 -0.21 0.00 -1.18 0.00 0.00 61.69 60.05 1azc s THR 103 Cb -0.13 -2.36 -0.08 0.00 1.34 0.00 0.00 72.50 71.27 1azc s THR 103 CO 0.22 0.56 0.93 -2.65 -0.54 0.00 0.00 174.62 173.13 1azc n PRO 104 N 2.86 1.04 -0.77 3.99 -0.02 -1.26 -2.00 135.00 138.84 1azc n PRO 104 Ca -0.18 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1azc n PRO 104 Cb 0.53 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 1azc n PRO 104 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1azc n GLY 105 N 1.31 0.57 3.92 -1.23 0.00 -1.26 -5.00 105.19 103.50 1azc n GLY 105 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 1azc n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1azc s GLU 106 N -0.44 3.53 -0.08 1.61 2.12 -0.85 -5.06 118.70 119.54 1azc s GLU 106 Ca 0.00 -0.30 0.03 0.00 0.36 0.00 0.00 54.97 55.06 1azc s GLU 106 Cb 0.00 -2.83 -0.02 0.00 0.26 0.00 0.00 34.13 31.54 1azc s GLU 106 CO 0.00 0.39 -0.16 0.00 -0.54 0.00 0.00 175.26 174.96 1azc s ALA 107 N -1.87 2.57 -0.02 6.30 0.00 -1.26 -4.59 121.76 122.89 1azc s ALA 107 Ca 0.39 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.44 1azc s ALA 107 Cb -0.11 -1.01 -0.03 0.00 0.00 0.00 0.00 23.12 21.98 1azc s ALA 107 CO 0.29 0.43 -0.14 0.71 0.00 0.00 0.00 175.76 177.04 1azc s TYR 108 N -0.27 2.69 -0.11 0.00 2.02 -1.15 -2.27 117.35 118.26 1azc s TYR 108 Ca 0.01 -0.17 -0.03 0.00 -0.37 0.00 0.00 57.07 56.52 1azc s TYR 108 Cb -0.13 -1.59 -0.03 0.00 -0.40 0.00 0.00 41.96 39.81 1azc s TYR 108 CO 0.03 0.22 0.00 0.00 -1.57 0.00 0.00 175.55 174.23 1azc s ALA 109 N -0.81 3.25 0.05 3.71 0.00 0.14 0.13 121.76 128.24 1azc s ALA 109 Ca 0.13 -0.80 0.08 0.00 0.00 0.00 0.00 51.96 51.37 1azc s ALA 109 Cb -0.11 -1.54 -0.03 0.00 0.00 0.00 0.00 23.12 21.45 1azc s ALA 109 CO 0.03 0.49 -0.23 1.52 0.00 0.00 0.00 175.76 177.56 1azc s TYR 110 N -0.55 2.05 0.24 0.00 -0.85 -0.66 -1.39 117.35 116.19 1azc s TYR 110 Ca 0.09 -0.39 -0.21 0.00 -0.52 0.00 0.00 57.07 56.04 1azc s TYR 110 Cb -0.12 -1.22 0.05 0.00 0.38 0.00 0.00 41.96 41.06 1azc s TYR 110 CO 0.02 0.12 0.86 -0.59 -1.52 0.00 0.00 175.55 174.44 1azc s PHE 111 N -0.82 -0.07 -0.24 -3.49 -0.71 0.13 -0.47 117.98 112.31 1azc s PHE 111 Ca 0.09 -0.37 -0.10 0.00 -1.04 0.00 0.00 56.93 55.52 1azc s PHE 111 Cb -0.09 0.71 -0.05 0.00 -1.21 0.00 0.00 43.02 42.38 1azc s PHE 111 CO 0.02 -1.12 0.14 0.00 -1.34 0.00 0.00 175.22 172.92 1azc n SER 113 N 4.38 1.64 -4.77 0.00 3.41 -1.26 -1.66 113.62 115.36 1azc n SER 113 Ca -0.15 -1.55 -0.40 0.00 -0.26 0.00 0.00 58.87 56.50 1azc n SER 113 Cb 0.52 -0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.47 1azc n SER 113 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1azc s PHE 114 N -1.99 2.55 -0.30 7.33 2.19 -1.26 -4.26 117.98 122.24 1azc s PHE 114 Ca 0.37 1.22 -0.40 0.00 0.33 0.00 0.00 56.93 58.45 1azc s PHE 114 Cb 0.21 -3.96 -0.18 0.00 -1.31 0.00 0.00 43.02 37.78 1azc s PHE 114 CO 0.33 -2.92 1.27 -2.30 1.83 0.00 0.00 175.22 173.43 1azc n PRO 115 N 0.18 0.00 -0.63 10.12 -0.02 -1.26 -0.66 135.00 142.73 1azc n PRO 115 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 1azc n PRO 115 Cb 0.40 -1.33 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 1azc n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1azc n GLY 116 N 2.84 0.79 0.13 -1.23 0.00 -1.26 -4.86 105.19 101.61 1azc n GLY 116 Ca 0.24 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.29 1azc n GLY 116 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1azc h HIS 117 N 0.00 0.00 -0.23 1.61 3.86 -1.10 -3.35 115.15 115.95 1azc h HIS 117 Ca 0.00 0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.28 1azc h HIS 117 Cb 0.00 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 1azc h HIS 117 CO 0.00 0.48 0.22 0.11 0.86 0.00 0.00 177.93 179.60 1azc h TRP 118 N 0.00 0.00 0.00 2.45 5.08 -1.49 -0.42 115.95 121.57 1azc h TRP 118 Ca -0.03 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 59.87 1azc h TRP 118 Cb 1.39 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.55 1azc h TRP 118 CO 0.00 0.00 -0.30 0.00 -1.28 0.00 0.00 178.44 176.86 1azc h ALA 119 N 1.78 1.09 0.00 0.11 0.00 -1.87 -3.29 119.26 117.08 1azc h ALA 119 Ca 0.11 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1azc h ALA 119 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1azc h ALA 119 CO -0.00 0.38 -1.04 -1.33 0.00 0.00 0.00 179.25 177.26 1azc n MET 120 N -3.58 1.61 -3.79 0.00 2.81 -0.58 -4.88 117.12 108.71 1azc n MET 120 Ca -0.01 -0.05 -0.34 0.00 -1.81 0.00 0.00 57.70 55.49 1azc n MET 120 Cb 0.44 -1.08 -0.11 0.00 -0.71 0.00 0.00 33.22 31.76 1azc n MET 120 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1azc s MET 121 N -2.29 2.39 -0.02 0.03 -1.94 -0.27 -4.71 119.30 112.49 1azc s MET 121 Ca -0.01 -2.59 -0.20 0.00 -1.71 0.00 0.00 55.69 51.18 1azc s MET 121 Cb 0.05 -3.60 0.04 0.00 2.01 0.00 0.00 34.83 33.33 1azc s MET 121 CO 0.33 -1.16 0.42 0.21 -0.01 0.00 0.00 175.02 174.82 1azc s LYS 122 N -0.19 0.80 0.28 2.03 2.36 -1.26 -1.58 119.74 122.18 1azc s LYS 122 Ca 0.17 -0.07 -0.06 0.00 -2.55 0.00 0.00 55.97 53.47 1azc s LYS 122 Cb -0.22 0.36 0.02 0.00 -1.05 0.00 0.00 37.83 36.95 1azc s LYS 122 CO -0.02 -0.23 0.47 0.41 1.55 0.00 0.00 175.35 177.52 1azc n GLY 123 N 1.13 1.84 3.30 5.54 0.00 0.37 -4.85 105.19 112.53 1azc n GLY 123 Ca -0.21 -1.39 -0.30 0.00 0.00 0.00 0.00 46.02 44.13 1azc n GLY 123 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1azc s THR 124 N -2.54 2.00 0.01 2.61 2.01 0.46 -1.65 115.64 118.55 1azc s THR 124 Ca 0.17 -1.17 0.08 0.00 0.31 0.00 0.00 61.69 61.08 1azc s THR 124 Cb -0.02 -1.68 -0.02 0.00 0.01 0.00 0.00 72.50 70.79 1azc s THR 124 CO 0.12 0.47 -0.24 -0.22 -0.69 0.00 0.00 174.62 174.07 1azc s LEU 125 N -0.82 2.11 0.07 4.42 0.20 0.12 -1.16 118.68 123.62 1azc s LEU 125 Ca 0.10 -0.50 -0.10 0.00 0.69 0.00 0.00 54.13 54.32 1azc s LEU 125 Cb -0.10 -1.19 0.01 0.00 -0.43 0.00 0.00 46.19 44.48 1azc s LEU 125 CO 0.00 0.25 0.23 -1.59 -0.29 0.00 0.00 176.35 174.95 1azc s LYS 126 N -0.90 0.83 -0.17 1.98 -2.85 -0.72 -2.93 119.74 114.99 1azc s LYS 126 Ca 0.10 -0.79 -0.18 0.00 -1.00 0.00 0.00 55.97 54.10 1azc s LYS 126 Cb -0.09 0.34 -0.04 0.00 -2.06 0.00 0.00 37.83 35.98 1azc s LYS 126 CO 0.01 -0.27 0.47 -1.17 0.10 0.00 0.00 175.35 174.49 1azc s LEU 127 N -2.57 4.20 0.18 2.77 0.20 -1.26 -0.19 118.68 122.01 1azc s LEU 127 Ca 0.01 0.68 -0.15 0.00 0.69 0.00 0.00 54.13 55.36 1azc s LEU 127 Cb 0.02 -2.65 0.02 0.00 -0.43 0.00 0.00 46.19 43.15 1azc s LEU 127 CO -0.08 -0.09 0.44 -0.55 -0.29 0.00 0.00 176.35 175.78 1azc s SER 128 N 0.92 -0.17 0.00 3.68 0.15 -0.53 -4.37 113.70 113.37 1azc s SER 128 Ca 0.23 -0.56 0.00 0.00 0.70 0.00 0.00 55.95 56.32 1azc s SER 128 Cb -0.15 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.69 1azc s SER 128 CO 0.09 -0.99 0.25 -0.46 1.20 0.00 0.00 173.24 173.33