#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jzg s GLU 2 N 0.00 3.10 -0.39 0.00 2.12 -1.26 -4.94 118.70 117.34 1jzg s GLU 2 Ca 0.00 -0.98 0.04 0.00 0.36 0.00 0.00 54.97 54.39 1jzg s GLU 2 Cb 0.00 -4.12 0.61 0.00 0.26 0.00 0.00 34.13 30.88 1jzg s GLU 2 CO 0.00 -1.24 1.80 0.00 -0.54 0.00 0.00 175.26 175.28 1jzg s SER 4 N -1.02 -0.35 -0.13 0.00 1.04 -1.26 -1.65 113.70 110.32 1jzg s SER 4 Ca 0.51 -0.28 -0.12 0.00 0.48 0.00 0.00 55.95 56.54 1jzg s SER 4 Cb 0.42 0.56 0.04 0.00 0.10 0.00 0.00 66.02 67.14 1jzg s SER 4 CO 0.10 -0.97 0.35 0.54 0.98 0.00 0.00 173.24 174.24 1jzg s VAL 5 N -3.81 -0.00 -0.23 5.02 0.11 -0.41 -4.94 120.40 116.13 1jzg s VAL 5 Ca 0.05 0.01 -0.10 0.00 -2.93 0.00 0.00 61.98 59.01 1jzg s VAL 5 Cb -0.00 -0.50 -0.05 0.00 -1.53 0.00 0.00 36.38 34.30 1jzg s VAL 5 CO -0.09 0.00 0.14 -1.81 -3.33 0.00 0.00 175.10 170.01 1jzg s ASP 6 N 0.30 5.93 0.03 3.54 1.01 -1.26 -0.88 116.67 125.33 1jzg s ASP 6 Ca -0.01 0.07 0.06 0.00 0.71 0.00 0.00 52.55 53.38 1jzg s ASP 6 Cb -0.03 -2.06 -0.02 0.00 1.01 0.00 0.00 42.92 41.81 1jzg s ASP 6 CO -0.01 0.07 -0.18 -0.51 0.21 0.00 0.00 175.17 174.75 1jzg s ILE 7 N 1.04 1.41 0.05 0.77 2.07 0.16 -4.95 121.20 121.75 1jzg s ILE 7 Ca 0.07 -1.01 0.09 0.00 -1.41 0.00 0.00 60.65 58.39 1jzg s ILE 7 Cb -0.14 -1.22 -0.03 0.00 0.13 0.00 0.00 42.46 41.20 1jzg s ILE 7 CO 0.04 0.19 -0.26 -1.10 -1.91 0.00 0.00 174.94 171.90 1jzg s GLN 8 N -0.96 1.72 -0.09 3.50 -0.21 -1.26 -1.23 119.66 121.13 1jzg s GLN 8 Ca 0.05 -1.10 0.03 0.00 0.02 0.00 0.00 55.36 54.36 1jzg s GLN 8 Cb -0.08 -1.91 0.01 0.00 1.00 0.00 0.00 33.01 32.03 1jzg s GLN 8 CO 0.01 0.49 -0.20 0.20 -2.12 0.00 0.00 175.29 173.67 1jzg s GLY 9 N -1.28 1.15 0.00 3.09 0.00 -0.60 -1.99 107.32 107.68 1jzg s GLY 9 Ca 0.11 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 44.05 1jzg s GLY 9 CO 0.02 -0.14 0.00 1.16 0.00 0.00 0.00 173.10 174.14 1jzg n ASN 10 N 3.67 1.88 0.04 1.64 0.23 -0.95 -3.61 115.26 118.16 1jzg n ASN 10 Ca -0.20 -1.00 0.11 0.00 -0.53 0.00 0.00 54.58 52.96 1jzg n ASN 10 Cb 0.52 0.00 0.44 0.00 -2.08 0.00 0.00 39.78 38.66 1jzg n ASN 10 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1jzg n ASP 11 N -1.12 0.25 -0.61 0.53 8.00 -1.26 -2.43 116.55 119.92 1jzg n ASP 11 Ca 0.00 0.55 0.05 0.00 0.71 0.00 0.00 54.79 56.10 1jzg n ASP 11 Cb 0.00 -0.61 0.14 0.00 -0.02 0.00 0.00 41.12 40.64 1jzg n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jzg n GLN 12 N -1.76 1.76 -3.60 -1.24 3.00 -1.26 -4.92 117.38 109.35 1jzg n GLN 12 Ca 0.04 -1.18 -0.21 0.00 -0.01 0.00 0.00 57.00 55.64 1jzg n GLN 12 Cb 0.26 -1.26 0.06 0.00 0.00 0.00 0.00 30.24 29.31 1jzg n GLN 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 1jzg n MET 13 N 0.46 -6.32 -4.04 -1.09 1.56 -1.02 -5.01 117.12 101.66 1jzg n MET 13 Ca 0.11 0.75 -0.13 0.00 -0.27 0.00 0.00 57.70 58.16 1jzg n MET 13 Cb 0.28 -5.64 -0.13 0.00 2.15 0.00 0.00 33.22 29.88 1jzg n MET 13 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 1jzg s GLN 14 N -5.89 0.34 0.46 2.12 -0.21 -1.26 -4.25 119.66 110.96 1jzg s GLN 14 Ca 0.21 -0.36 -0.01 0.00 0.02 0.00 0.00 55.36 55.22 1jzg s GLN 14 Cb -0.10 -0.21 -0.01 0.00 1.00 0.00 0.00 33.01 33.70 1jzg s GLN 14 CO 0.77 0.05 0.69 -0.06 -2.12 0.00 0.00 175.29 174.61 1jzg s PHE 15 N -0.64 3.27 -0.28 0.91 0.08 -1.26 -2.25 117.98 117.82 1jzg s PHE 15 Ca -0.04 0.32 0.13 0.00 0.12 0.00 0.00 56.93 57.46 1jzg s PHE 15 Cb -0.05 -2.31 0.79 0.00 -0.57 0.00 0.00 43.02 40.87 1jzg s PHE 15 CO -0.00 -0.35 1.71 0.27 -0.10 0.00 0.00 175.22 176.75 1jzg n ASN 16 N -2.11 5.50 -3.72 1.36 6.94 -0.84 -4.86 115.26 117.53 1jzg n ASN 16 Ca 0.01 -2.93 -0.14 0.00 -0.02 0.00 0.00 54.58 51.51 1jzg n ASN 16 Cb 0.57 -0.69 -0.09 0.00 -2.36 0.00 0.00 39.78 37.22 1jzg n ASN 16 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1jzg s THR 17 N -2.72 0.02 -1.12 5.53 -1.32 -1.26 -4.96 115.64 109.81 1jzg s THR 17 Ca 0.53 -0.15 0.14 0.00 -1.21 0.00 0.00 61.69 60.99 1jzg s THR 17 Cb 0.40 -0.65 -0.04 0.00 -1.51 0.00 0.00 72.50 70.71 1jzg s THR 17 CO 0.15 -0.08 0.72 0.59 -2.21 0.00 0.00 174.62 173.79 1jzg n ASN 18 N 2.16 1.28 -3.66 8.08 3.02 -1.26 -4.82 115.26 120.06 1jzg n ASN 18 Ca -0.16 -1.14 -0.12 0.00 -0.03 0.00 0.00 54.58 53.12 1jzg n ASN 18 Cb 0.57 0.59 -0.08 0.00 -0.61 0.00 0.00 39.78 40.24 1jzg n ASN 18 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jzg s ALA 19 N -1.82 -1.55 -0.06 5.41 0.00 -1.26 -1.65 121.76 120.82 1jzg s ALA 19 Ca 0.10 1.85 0.03 0.00 0.00 0.00 0.00 51.96 53.94 1jzg s ALA 19 Cb 0.11 -1.08 0.01 0.00 0.00 0.00 0.00 23.12 22.16 1jzg s ALA 19 CO 0.39 -0.31 -0.16 0.42 0.00 0.00 0.00 175.76 176.11 1jzg s ILE 20 N 0.65 1.38 -0.17 0.00 1.01 0.34 -4.96 121.20 119.45 1jzg s ILE 20 Ca -0.03 -0.64 -0.02 0.00 0.00 0.00 0.00 60.65 59.96 1jzg s ILE 20 Cb -0.05 -1.22 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 1jzg s ILE 20 CO -0.04 0.41 -0.07 -0.89 0.00 0.00 0.00 174.94 174.34 1jzg s THR 21 N 0.42 3.36 -0.29 2.92 2.01 -1.26 -1.56 115.64 121.23 1jzg s THR 21 Ca -0.12 -0.53 -0.09 0.00 0.31 0.00 0.00 61.69 61.26 1jzg s THR 21 Cb -0.15 -2.47 -0.02 0.00 0.01 0.00 0.00 72.50 69.87 1jzg s THR 21 CO 0.04 0.48 0.14 -0.69 -0.69 0.00 0.00 174.62 173.90 1jzg s VAL 22 N 0.84 4.69 0.14 3.82 1.01 0.91 -4.95 120.40 126.86 1jzg s VAL 22 Ca -0.02 -0.25 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 1jzg s VAL 22 Cb -0.15 -3.32 -0.08 0.00 0.00 0.00 0.00 36.38 32.83 1jzg s VAL 22 CO 0.01 0.16 1.28 -0.62 0.00 0.00 0.00 175.10 175.93 1jzg s ASP 23 N 1.64 6.95 0.63 3.32 -1.08 -1.26 -1.14 116.67 125.74 1jzg s ASP 23 Ca 0.05 2.27 0.35 0.00 -0.52 0.00 0.00 52.55 54.70 1jzg s ASP 23 Cb -0.16 -2.60 1.95 0.00 -1.46 0.00 0.00 42.92 40.65 1jzg s ASP 23 CO 0.07 -0.52 2.19 0.11 0.52 0.00 0.00 175.17 177.54 1jzg h LYS 24 N 6.03 0.00 0.00 4.34 1.57 -1.24 -0.74 116.57 126.53 1jzg h LYS 24 Ca -0.43 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.30 1jzg h LYS 24 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 1jzg h LYS 24 CO 0.80 0.00 -0.24 0.77 -0.57 0.00 0.00 179.45 180.21 1jzg h SER 25 N 0.00 0.00 -3.43 0.86 0.02 -1.91 -3.44 113.55 105.65 1jzg h SER 25 Ca 0.03 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.46 1jzg h SER 25 Cb 0.28 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.85 1jzg h SER 25 CO -0.00 0.24 0.62 0.00 -1.14 0.00 0.00 176.83 176.54 1jzg n LYS 27 N 2.57 0.70 -4.24 0.00 5.02 -1.26 -4.64 118.16 116.32 1jzg n LYS 27 Ca 0.05 0.28 -0.16 0.00 -2.02 0.00 0.00 58.31 56.46 1jzg n LYS 27 Cb 0.43 -1.75 -0.11 0.00 -0.02 0.00 0.00 35.03 33.59 1jzg n LYS 27 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1jzg s GLN 28 N -2.58 1.02 -0.01 1.97 1.11 -1.26 -0.99 119.66 118.93 1jzg s GLN 28 Ca -0.15 -1.30 0.02 0.00 0.01 0.00 0.00 55.36 53.94 1jzg s GLN 28 Cb 0.07 -0.79 0.00 0.00 -1.01 0.00 0.00 33.01 31.29 1jzg s GLN 28 CO 0.79 0.13 -0.06 0.12 0.01 0.00 0.00 175.29 176.29 1jzg s PHE 29 N -2.54 0.57 -0.05 0.91 5.36 -0.43 -4.82 117.98 116.98 1jzg s PHE 29 Ca 0.11 -0.11 0.05 0.00 -0.96 0.00 0.00 56.93 56.02 1jzg s PHE 29 Cb -0.02 -0.40 -0.01 0.00 -0.34 0.00 0.00 43.02 42.25 1jzg s PHE 29 CO 0.02 -0.04 -0.21 0.99 -1.46 0.00 0.00 175.22 174.52 1jzg s THR 30 N 0.06 1.72 -0.16 0.12 2.01 -0.66 -1.33 115.64 117.40 1jzg s THR 30 Ca -0.00 -0.88 -0.00 0.00 0.31 0.00 0.00 61.69 61.11 1jzg s THR 30 Cb -0.05 -1.47 -0.00 0.00 0.01 0.00 0.00 72.50 70.99 1jzg s THR 30 CO -0.00 0.49 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.59 1jzg s VAL 31 N -0.03 2.78 -0.41 3.82 1.01 0.15 -1.28 120.40 126.45 1jzg s VAL 31 Ca -0.05 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.15 1jzg s VAL 31 Cb -0.13 -2.19 0.09 0.00 0.00 0.00 0.00 36.38 34.15 1jzg s VAL 31 CO 0.03 0.50 0.22 0.20 0.00 0.00 0.00 175.10 176.05 1jzg s ASN 32 N 0.91 5.42 -0.02 3.32 0.01 -0.06 -1.69 114.94 122.82 1jzg s ASN 32 Ca -0.03 -1.73 -0.13 0.00 -0.71 0.00 0.00 52.86 50.26 1jzg s ASN 32 Cb -0.15 -1.90 -0.05 0.00 0.41 0.00 0.00 41.25 39.56 1jzg s ASN 32 CO -0.01 -0.53 0.35 -0.22 -1.51 0.00 0.00 177.10 175.18 1jzg s LEU 33 N 1.29 4.46 0.08 0.60 2.96 -0.00 -0.66 118.68 127.40 1jzg s LEU 33 Ca 0.04 0.87 -0.01 0.00 -0.22 0.00 0.00 54.13 54.80 1jzg s LEU 33 Cb -0.23 -2.49 -0.04 0.00 0.50 0.00 0.00 46.19 43.94 1jzg s LEU 33 CO -0.01 0.34 0.01 -0.94 -1.32 0.00 0.00 176.35 174.43 1jzg s SER 34 N -1.07 0.41 -0.39 3.68 1.04 -0.36 -1.10 113.70 115.91 1jzg s SER 34 Ca 0.22 -1.05 0.02 0.00 0.48 0.00 0.00 55.95 55.62 1jzg s SER 34 Cb -0.16 0.24 0.11 0.00 0.10 0.00 0.00 66.02 66.32 1jzg s SER 34 CO 0.12 -0.65 0.15 -2.28 0.98 0.00 0.00 173.24 171.55 1jzg s HIS 35 N -3.96 2.59 -2.00 5.02 2.46 -0.98 -1.55 115.29 116.86 1jzg s HIS 35 Ca 0.13 -2.50 0.05 0.00 0.47 0.00 0.00 55.06 53.21 1jzg s HIS 35 Cb 0.08 -2.27 0.31 0.00 -0.13 0.00 0.00 32.58 30.56 1jzg s HIS 35 CO -0.06 -0.85 1.20 -0.35 -2.47 0.00 0.00 174.74 172.21 1jzg n PRO 36 N 4.06 1.03 -1.57 2.88 -0.04 -1.24 -1.31 135.00 138.81 1jzg n PRO 36 Ca 0.04 -0.04 -0.22 0.00 -0.04 0.00 0.00 63.50 63.23 1jzg n PRO 36 Cb 0.38 -1.09 0.15 0.00 -0.04 0.00 0.00 33.50 32.91 1jzg n PRO 36 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1jzg n GLY 37 N 0.60 -1.12 0.01 0.55 0.00 -1.26 -4.90 105.19 99.06 1jzg n GLY 37 Ca 0.04 -1.75 0.07 0.00 0.00 0.00 0.00 46.02 44.39 1jzg n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jzg n ASN 38 N -3.56 1.72 -4.77 1.61 5.03 -1.26 -4.13 115.26 109.89 1jzg n ASN 38 Ca 0.13 -0.07 -0.38 0.00 0.87 0.00 0.00 54.58 55.13 1jzg n ASN 38 Cb 0.45 1.58 -0.04 0.00 -1.02 0.00 0.00 39.78 40.75 1jzg n ASN 38 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1jzg s LEU 39 N -3.86 4.32 0.83 3.41 1.43 -1.26 -4.76 118.68 118.79 1jzg s LEU 39 Ca -0.04 2.08 -0.11 0.00 -1.03 0.00 0.00 54.13 55.02 1jzg s LEU 39 Cb 0.09 -3.96 0.09 0.00 0.03 0.00 0.00 46.19 42.44 1jzg s LEU 39 CO 0.58 -0.29 1.10 -2.16 0.23 0.00 0.00 176.35 175.80 1jzg s PRO 40 N -2.04 1.85 0.52 1.29 0.04 -1.26 -1.39 135.00 134.01 1jzg s PRO 40 Ca 0.52 0.69 0.35 0.00 0.04 0.00 0.00 61.00 62.59 1jzg s PRO 40 Cb -0.25 -1.89 1.67 0.00 0.04 0.00 0.00 34.50 34.07 1jzg s PRO 40 CO 0.32 -1.80 2.05 1.57 0.04 0.00 0.00 177.00 179.17 1jzg h LYS 41 N -1.22 0.00 0.00 4.56 2.10 -1.84 -0.59 116.57 119.58 1jzg h LYS 41 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1jzg h LYS 41 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1jzg h LYS 41 CO 0.58 0.00 0.00 -2.95 -2.00 0.00 0.00 179.45 175.08 1jzg h ASN 42 N 0.00 0.00 0.00 7.07 7.08 -1.94 -2.10 115.58 125.69 1jzg h ASN 42 Ca 0.00 0.00 -0.06 0.00 -3.08 0.00 0.00 56.30 53.16 1jzg h ASN 42 Cb 0.25 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.48 1jzg h ASN 42 CO 0.00 0.00 -1.24 0.52 -2.08 0.00 0.00 177.43 174.63 1jzg n VAL 43 N -2.61 0.24 -2.78 6.14 0.31 -0.90 -4.82 118.33 113.90 1jzg n VAL 43 Ca 0.04 -0.14 -0.03 0.00 -0.01 0.00 0.00 64.34 64.20 1jzg n VAL 43 Cb 0.41 -0.87 0.05 0.00 -0.91 0.00 0.00 33.84 32.51 1jzg n VAL 43 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 1jzg n MET 44 N -2.19 1.55 -2.45 5.55 0.00 -0.28 -5.03 117.12 114.27 1jzg n MET 44 Ca -0.06 -3.32 -0.37 0.00 -0.00 0.00 0.00 57.70 53.96 1jzg n MET 44 Cb 0.61 -1.40 -0.03 0.00 0.00 0.00 0.00 33.22 32.40 1jzg n MET 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1jzg s GLY 45 N -3.47 2.77 -0.00 -5.12 0.00 -0.79 -4.71 107.32 96.00 1jzg s GLY 45 Ca 0.26 0.79 0.02 0.00 0.00 0.00 0.00 44.72 45.79 1jzg s GLY 45 CO -0.02 1.23 -0.07 0.30 0.00 0.00 0.00 173.10 174.54 1jzg s HIS 46 N -1.59 0.61 0.23 1.90 3.76 -0.25 -4.65 115.29 115.29 1jzg s HIS 46 Ca 0.59 -0.14 0.03 0.00 -0.15 0.00 0.00 55.06 55.39 1jzg s HIS 46 Cb -0.25 -0.39 -0.05 0.00 1.11 0.00 0.00 32.58 33.00 1jzg s HIS 46 CO 0.31 -0.01 0.00 0.54 -0.85 0.00 0.00 174.74 174.73 1jzg s ASN 47 N -0.27 1.76 -0.26 1.40 2.20 -1.26 -0.50 114.94 118.01 1jzg s ASN 47 Ca 0.02 -1.23 0.03 0.00 -0.94 0.00 0.00 52.86 50.74 1jzg s ASN 47 Cb -0.03 0.02 0.06 0.00 -2.00 0.00 0.00 41.25 39.30 1jzg s ASN 47 CO -0.00 -0.53 -0.10 0.86 -2.94 0.00 0.00 177.10 174.39 1jzg s TRP 48 N -3.45 3.26 -0.05 1.54 -0.00 -1.26 -3.94 118.94 115.04 1jzg s TRP 48 Ca 0.29 -2.29 0.06 0.00 -0.00 0.00 0.00 56.10 54.16 1jzg s TRP 48 Cb 0.06 -1.94 -0.01 0.00 -0.00 0.00 0.00 33.47 31.57 1jzg s TRP 48 CO 0.09 -0.87 -0.23 0.08 -0.00 0.00 0.00 176.95 176.01 1jzg s VAL 49 N 1.11 2.26 -0.07 5.86 1.01 -0.01 -1.41 120.40 129.16 1jzg s VAL 49 Ca -0.09 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 60.93 1jzg s VAL 49 Cb -0.20 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 1jzg s VAL 49 CO -0.05 0.57 -0.20 -0.22 0.00 0.00 0.00 175.10 175.20 1jzg s LEU 50 N -0.30 2.36 0.30 3.92 2.96 -0.32 -1.04 118.68 126.55 1jzg s LEU 50 Ca 0.01 -0.40 -0.14 0.00 -0.22 0.00 0.00 54.13 53.37 1jzg s LEU 50 Cb -0.13 -1.47 0.01 0.00 0.50 0.00 0.00 46.19 45.11 1jzg s LEU 50 CO 0.02 0.24 0.60 -0.94 -1.32 0.00 0.00 176.35 174.96 1jzg s SER 51 N -0.14 0.03 0.70 3.68 1.04 -0.75 -0.46 113.70 117.81 1jzg s SER 51 Ca -0.03 -0.97 -0.13 0.00 0.48 0.00 0.00 55.95 55.30 1jzg s SER 51 Cb -0.14 0.68 0.02 0.00 0.10 0.00 0.00 66.02 66.69 1jzg s SER 51 CO 0.04 -1.32 1.09 0.42 0.98 0.00 0.00 173.24 174.44 1jzg s THR 52 N -3.53 3.49 0.37 2.02 -4.23 -1.26 -0.83 115.64 111.67 1jzg s THR 52 Ca 0.19 0.57 0.04 0.00 -1.18 0.00 0.00 61.69 61.32 1jzg s THR 52 Cb -0.03 -3.12 0.27 0.00 1.34 0.00 0.00 72.50 70.97 1jzg s THR 52 CO 0.11 -0.55 2.01 0.00 -0.54 0.00 0.00 174.62 175.65 1jzg h ALA 53 N -0.51 1.62 -0.36 3.99 0.00 -1.02 -2.15 119.26 120.84 1jzg h ALA 53 Ca -0.45 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 1jzg h ALA 53 Cb 1.23 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1jzg h ALA 53 CO 0.54 0.33 0.06 0.00 0.00 0.00 0.00 179.25 180.18 1jzg h ALA 54 N 1.64 1.43 -0.01 0.00 0.00 -1.91 -2.92 119.26 117.50 1jzg h ALA 54 Ca 0.23 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1jzg h ALA 54 Cb -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1jzg h ALA 54 CO -0.06 0.41 -0.37 -0.25 0.00 0.00 0.00 179.25 178.99 1jzg n ASP 55 N -4.32 1.09 -0.01 0.00 8.00 -0.85 -4.55 116.55 115.92 1jzg n ASP 55 Ca 0.02 -0.89 -0.09 0.00 0.71 0.00 0.00 54.79 54.54 1jzg n ASP 55 Cb 0.21 0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.53 1jzg n ASP 55 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 1jzg h MET 56 N 1.14 -0.26 -0.94 -1.24 4.05 -1.25 -2.01 114.93 114.42 1jzg h MET 56 Ca 0.00 0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.50 1jzg h MET 56 Cb 0.54 0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 31.34 1jzg h MET 56 CO 0.00 -0.17 0.60 0.37 0.23 0.00 0.00 176.91 177.94 1jzg h GLN 57 N -0.27 1.05 -0.35 0.39 5.75 -1.80 -0.75 115.11 119.14 1jzg h GLN 57 Ca 0.11 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 1jzg h GLN 57 Cb 0.43 -0.24 -0.01 0.00 1.07 0.00 0.00 27.48 28.73 1jzg h GLN 57 CO -0.32 0.70 0.05 0.78 -2.65 0.00 0.00 178.83 177.39 1jzg h GLY 58 N 1.09 0.63 1.00 2.39 0.00 -1.78 -1.10 103.07 105.29 1jzg h GLY 58 Ca 0.41 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 1jzg h GLY 58 CO -0.17 0.39 0.38 -2.08 0.00 0.00 0.00 176.54 175.05 1jzg h VAL 59 N 0.41 1.20 -0.13 4.60 2.07 -0.88 -1.53 116.25 121.99 1jzg h VAL 59 Ca 0.11 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 67.12 1jzg h VAL 59 Cb 0.37 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1jzg h VAL 59 CO 0.01 0.22 -0.00 0.58 0.02 0.00 0.00 177.57 178.39 1jzg h VAL 60 N 0.90 1.25 0.11 2.57 2.07 -1.03 -0.57 116.25 121.56 1jzg h VAL 60 Ca 0.23 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1jzg h VAL 60 Cb 0.02 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1jzg h VAL 60 CO -0.04 0.24 -0.11 0.74 0.02 0.00 0.00 177.57 178.42 1jzg h THR 61 N -0.04 0.75 0.00 2.57 2.02 -1.11 -1.65 112.91 115.44 1jzg h THR 61 Ca 0.04 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.13 1jzg h THR 61 Cb 0.37 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1jzg h THR 61 CO 0.01 0.00 -0.42 0.44 0.37 0.00 0.00 175.52 175.92 1jzg h ASP 62 N -0.25 0.00 -0.33 4.18 3.32 -1.32 -3.14 116.42 118.88 1jzg h ASP 62 Ca 0.01 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.00 1jzg h ASP 62 Cb 0.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1jzg h ASP 62 CO -0.03 0.42 -0.02 1.23 -1.72 0.00 0.00 179.24 179.11 1jzg h GLY 63 N 1.74 0.65 0.79 2.75 0.00 -0.72 -2.92 103.07 105.35 1jzg h GLY 63 Ca -0.00 -0.49 0.05 0.00 0.00 0.00 0.00 47.33 46.89 1jzg h GLY 63 CO 0.05 0.45 0.56 1.98 0.00 0.00 0.00 176.54 179.58 1jzg h MET 64 N 0.39 1.01 0.00 4.80 1.85 -1.26 -1.51 114.93 120.22 1jzg h MET 64 Ca 0.09 -0.06 0.00 0.00 -0.61 0.00 0.00 59.70 59.12 1jzg h MET 64 Cb 0.48 -0.23 0.00 0.00 0.43 0.00 0.00 31.60 32.28 1jzg h MET 64 CO 0.02 0.67 0.00 0.00 -0.40 0.00 0.00 176.91 177.20 1jzg n ALA 65 N -2.35 1.96 0.11 0.39 0.00 -1.15 -3.39 120.51 116.08 1jzg n ALA 65 Ca 0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 53.44 53.48 1jzg n ALA 65 Cb 0.14 -1.32 -0.02 0.00 0.00 0.00 0.00 19.45 18.25 1jzg n ALA 65 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1jzg h SER 66 N 0.00 0.00 -4.52 0.00 0.02 -1.08 -3.51 113.55 104.46 1jzg h SER 66 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1jzg h SER 66 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1jzg h SER 66 CO 0.00 0.65 0.00 0.61 -1.14 0.00 0.00 176.83 176.95 1jzg n GLY 67 N 1.27 -0.13 0.33 -3.77 0.00 -1.22 -4.32 105.19 97.36 1jzg n GLY 67 Ca 0.01 -1.70 -0.03 0.00 0.00 0.00 0.00 46.02 44.30 1jzg n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jzg h LEU 68 N 0.00 0.99 -2.49 0.99 5.85 -1.93 -1.08 115.31 117.65 1jzg h LEU 68 Ca 0.00 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 1jzg h LEU 68 Cb 0.00 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 1jzg h LEU 68 CO 0.00 0.71 -0.00 -2.24 -0.34 0.00 0.00 178.44 176.57 1jzg h ASP 69 N 1.17 0.00 -0.61 1.25 2.03 -2.02 -1.02 116.42 117.22 1jzg h ASP 69 Ca 0.33 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.63 1jzg h ASP 69 Cb -0.10 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.40 1jzg h ASP 69 CO -0.08 0.00 0.00 0.29 -1.03 0.00 0.00 179.24 178.42 1jzg n LYS 70 N -3.12 3.05 -2.33 4.15 4.76 -0.88 -4.93 118.16 118.85 1jzg n LYS 70 Ca -0.02 -2.60 -0.21 0.00 -2.87 0.00 0.00 58.31 52.61 1jzg n LYS 70 Cb 0.15 -1.60 -0.02 0.00 -1.84 0.00 0.00 35.03 31.72 1jzg n LYS 70 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1jzg n ASP 71 N 1.17 -5.87 -3.91 4.39 9.92 -0.39 -2.51 116.55 119.36 1jzg n ASP 71 Ca 0.22 0.03 -0.28 0.00 -0.53 0.00 0.00 54.79 54.23 1jzg n ASP 71 Cb 0.67 -4.91 0.01 0.00 -0.64 0.00 0.00 41.12 36.25 1jzg n ASP 71 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1jzg n TYR 72 N -3.87 -2.01 -3.91 1.24 4.01 -0.46 -4.84 117.16 107.31 1jzg n TYR 72 Ca -0.24 0.85 -0.13 0.00 -0.16 0.00 0.00 57.90 58.22 1jzg n TYR 72 Cb 0.69 -3.92 -0.14 0.00 -0.31 0.00 0.00 39.34 35.66 1jzg n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1jzg s LEU 73 N -7.06 1.98 -0.03 7.72 1.43 -1.04 -4.25 118.68 117.42 1jzg s LEU 73 Ca 0.38 -0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 53.17 1jzg s LEU 73 Cb -0.20 -0.04 -0.05 0.00 0.03 0.00 0.00 46.19 45.93 1jzg s LEU 73 CO 0.85 0.01 1.50 -0.75 0.23 0.00 0.00 176.35 178.19 1jzg s LYS 74 N 0.00 4.23 0.03 1.70 2.20 -1.26 -4.83 119.74 121.81 1jzg s LYS 74 Ca 0.00 2.05 -0.37 0.00 -0.36 0.00 0.00 55.97 57.29 1jzg s LYS 74 Cb -0.01 -3.75 -0.16 0.00 -1.51 0.00 0.00 37.83 32.40 1jzg s LYS 74 CO -0.00 -0.71 1.43 -2.30 -0.36 0.00 0.00 175.35 173.41 1jzg n PRO 75 N 6.20 1.23 -2.02 4.03 -0.02 -1.26 -1.52 135.00 141.64 1jzg n PRO 75 Ca 0.15 0.45 -0.19 0.00 -2.02 0.00 0.00 63.50 61.88 1jzg n PRO 75 Cb 0.43 -2.11 -0.04 0.00 -0.02 0.00 0.00 33.50 31.76 1jzg n PRO 75 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1jzg n ASP 76 N 3.11 -5.38 -4.54 2.55 9.92 -1.26 -4.88 116.55 116.06 1jzg n ASP 76 Ca 0.20 0.23 -0.46 0.00 -0.53 0.00 0.00 54.79 54.23 1jzg n ASP 76 Cb 0.19 -4.62 -0.05 0.00 -0.64 0.00 0.00 41.12 36.00 1jzg n ASP 76 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1jzg n ASP 77 N -1.63 2.83 0.11 -2.24 -0.08 -0.58 -4.82 116.55 110.15 1jzg n ASP 77 Ca -0.21 0.30 0.10 0.00 -1.51 0.00 0.00 54.79 53.46 1jzg n ASP 77 Cb 0.66 -1.44 0.45 0.00 2.34 0.00 0.00 41.12 43.13 1jzg n ASP 77 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1jzg n SER 78 N 10.90 0.49 0.16 1.67 3.41 -1.26 -2.31 113.62 126.69 1jzg n SER 78 Ca 0.34 0.66 0.12 0.00 -0.26 0.00 0.00 58.87 59.74 1jzg n SER 78 Cb 0.36 -0.75 0.27 0.00 -0.26 0.00 0.00 64.21 63.83 1jzg n SER 78 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1jzg h ARG 79 N 0.00 0.00 -5.97 4.33 3.08 -1.97 -3.43 114.38 110.41 1jzg h ARG 79 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1jzg h ARG 79 Cb 0.21 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.19 1jzg h ARG 79 CO 0.00 0.00 0.65 0.08 -1.07 0.00 0.00 179.97 179.63 1jzg s VAL 80 N -3.16 4.75 0.01 2.04 1.01 -0.98 -4.46 120.40 119.61 1jzg s VAL 80 Ca 0.08 1.84 -0.14 0.00 0.00 0.00 0.00 61.98 63.77 1jzg s VAL 80 Cb 0.09 -4.23 -0.34 0.00 0.00 0.00 0.00 36.38 31.90 1jzg s VAL 80 CO 0.64 -0.12 0.90 0.40 0.00 0.00 0.00 175.10 176.92 1jzg h ILE 81 N 5.41 1.18 -2.22 2.22 2.04 -1.05 -3.49 117.51 121.60 1jzg h ILE 81 Ca -0.22 -2.66 0.08 0.00 1.00 0.00 0.00 64.86 63.07 1jzg h ILE 81 Cb 1.08 2.95 -0.16 0.00 -0.74 0.00 0.00 36.82 39.95 1jzg h ILE 81 CO 0.93 0.83 0.46 0.00 0.00 0.00 0.00 178.15 180.37 1jzg s ALA 82 N -2.60 -1.82 -0.05 1.87 0.00 -1.24 -5.02 121.76 112.91 1jzg s ALA 82 Ca -0.11 1.07 -0.29 0.00 0.00 0.00 0.00 51.96 52.63 1jzg s ALA 82 Cb 0.05 0.26 0.10 0.00 0.00 0.00 0.00 23.12 23.52 1jzg s ALA 82 CO 0.92 -0.62 0.82 -3.38 0.00 0.00 0.00 175.76 173.50 1jzg s HIS 83 N -2.76 -0.48 0.63 0.00 -3.43 -1.26 -1.18 115.29 106.81 1jzg s HIS 83 Ca 0.03 0.68 0.04 0.00 -0.80 0.00 0.00 55.06 55.01 1jzg s HIS 83 Cb -0.01 0.47 0.10 0.00 -1.43 0.00 0.00 32.58 31.70 1jzg s HIS 83 CO -0.07 -0.53 0.87 0.95 -2.00 0.00 0.00 174.74 173.96 1jzg s THR 84 N -1.85 2.26 0.68 -5.38 -4.23 -0.50 -4.84 115.64 101.78 1jzg s THR 84 Ca -0.03 -0.77 -0.06 0.00 -1.18 0.00 0.00 61.69 59.65 1jzg s THR 84 Cb -0.00 -2.49 0.05 0.00 1.34 0.00 0.00 72.50 71.39 1jzg s THR 84 CO 0.01 0.00 0.99 -1.59 -0.54 0.00 0.00 174.62 173.49 1jzg s LYS 85 N -4.88 2.37 -0.02 3.99 -2.85 -1.26 -4.51 119.74 112.57 1jzg s LYS 85 Ca 0.63 -0.20 -0.30 0.00 -1.00 0.00 0.00 55.97 55.11 1jzg s LYS 85 Cb -0.06 -2.19 -0.03 0.00 -2.06 0.00 0.00 37.83 33.49 1jzg s LYS 85 CO 0.41 -1.11 0.97 -1.17 0.10 0.00 0.00 175.35 174.55 1jzg s LEU 86 N -5.19 4.34 0.15 2.77 2.96 -1.26 -4.43 118.68 118.03 1jzg s LEU 86 Ca 0.59 1.61 0.08 0.00 -0.22 0.00 0.00 54.13 56.19 1jzg s LEU 86 Cb -0.11 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 1jzg s LEU 86 CO 0.45 -0.29 -0.18 0.27 -1.32 0.00 0.00 176.35 175.28 1jzg s ILE 87 N 1.20 1.72 0.16 6.68 -4.36 0.34 -4.88 121.20 122.06 1jzg s ILE 87 Ca 0.51 -1.86 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 1jzg s ILE 87 Cb -0.20 -1.77 0.00 0.00 1.25 0.00 0.00 42.46 41.74 1jzg s ILE 87 CO 0.26 -0.32 0.03 0.61 0.24 0.00 0.00 174.94 175.76 1jzg n GLY 88 N 0.38 3.75 3.49 6.27 0.00 -1.26 -1.09 105.19 116.73 1jzg n GLY 88 Ca -0.14 -2.25 -0.56 0.00 0.00 0.00 0.00 46.02 43.08 1jzg n GLY 88 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1jzg n SER 89 N -1.30 -0.03 0.00 1.61 2.88 -0.49 -1.72 113.62 114.57 1jzg n SER 89 Ca -0.05 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.64 1jzg n SER 89 Cb 0.20 -0.97 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 1jzg n SER 89 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jzg n GLY 90 N 1.71 0.59 4.00 0.46 0.00 -0.43 -4.99 105.19 106.53 1jzg n GLY 90 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.03 1jzg n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jzg s GLU 91 N -0.41 2.88 0.05 1.61 2.02 -0.70 -4.94 118.70 119.21 1jzg s GLU 91 Ca 0.00 -1.09 -0.16 0.00 0.02 0.00 0.00 54.97 53.74 1jzg s GLU 91 Cb 0.00 -2.73 0.03 0.00 0.10 0.00 0.00 34.13 31.53 1jzg s GLU 91 CO 0.00 -0.24 0.37 -1.59 0.02 0.00 0.00 175.26 173.82 1jzg s LYS 92 N -4.36 0.89 -0.14 1.61 -2.85 -1.26 -2.33 119.74 111.30 1jzg s LYS 92 Ca 0.52 -0.45 -0.28 0.00 -1.00 0.00 0.00 55.97 54.77 1jzg s LYS 92 Cb -0.10 0.39 0.07 0.00 -2.06 0.00 0.00 37.83 36.13 1jzg s LYS 92 CO 0.33 -0.30 0.69 0.34 0.10 0.00 0.00 175.35 176.51 1jzg s ASP 93 N -2.09 -0.69 0.15 0.03 2.15 -0.25 -5.00 116.67 110.96 1jzg s ASP 93 Ca -0.04 1.00 0.09 0.00 0.43 0.00 0.00 52.55 54.03 1jzg s ASP 93 Cb -0.01 0.91 -0.04 0.00 -0.30 0.00 0.00 42.92 43.49 1jzg s ASP 93 CO -0.03 -0.46 -0.19 -0.44 -0.17 0.00 0.00 175.17 173.87 1jzg s SER 94 N -0.55 2.69 -0.01 -0.34 0.01 -1.26 -0.82 113.70 113.41 1jzg s SER 94 Ca -0.07 -0.81 -0.00 0.00 1.31 0.00 0.00 55.95 56.38 1jzg s SER 94 Cb -0.02 -0.16 0.02 0.00 0.21 0.00 0.00 66.02 66.07 1jzg s SER 94 CO 0.06 0.00 0.03 0.54 0.41 0.00 0.00 173.24 174.28 1jzg s VAL 95 N -1.77 -0.03 -0.07 3.43 0.11 -0.68 -4.91 120.40 116.48 1jzg s VAL 95 Ca 0.13 0.12 0.05 0.00 -2.93 0.00 0.00 61.98 59.36 1jzg s VAL 95 Cb -0.07 -0.06 -0.01 0.00 -1.53 0.00 0.00 36.38 34.71 1jzg s VAL 95 CO 0.06 0.05 -0.24 -0.89 -3.33 0.00 0.00 175.10 170.75 1jzg s THR 96 N 0.61 2.15 0.10 5.04 2.01 -1.26 -0.67 115.64 123.62 1jzg s THR 96 Ca -0.05 -1.02 0.02 0.00 0.31 0.00 0.00 61.69 60.95 1jzg s THR 96 Cb -0.07 -1.80 -0.04 0.00 0.01 0.00 0.00 72.50 70.60 1jzg s THR 96 CO -0.02 0.57 -0.07 0.72 -0.69 0.00 0.00 174.62 175.13 1jzg s PHE 97 N -0.02 0.88 0.06 4.92 -0.71 -0.44 -4.96 117.98 117.71 1jzg s PHE 97 Ca -0.08 -0.91 -0.30 0.00 -1.04 0.00 0.00 56.93 54.60 1jzg s PHE 97 Cb -0.15 -0.51 -0.05 0.00 -1.21 0.00 0.00 43.02 41.10 1jzg s PHE 97 CO 0.05 -0.15 1.11 0.34 -1.34 0.00 0.00 175.22 175.23 1jzg s ASP 98 N -3.00 7.21 0.58 1.98 3.68 -1.26 -1.32 116.67 124.54 1jzg s ASP 98 Ca 0.11 1.92 0.35 0.00 2.13 0.00 0.00 52.55 57.06 1jzg s ASP 98 Cb 0.05 -2.58 1.77 0.00 -1.45 0.00 0.00 42.92 40.71 1jzg s ASP 98 CO -0.05 -0.36 2.16 0.58 0.13 0.00 0.00 175.17 177.63 1jzg h VAL 99 N 4.45 0.24 0.00 1.11 2.07 -1.32 -1.14 116.25 121.66 1jzg h VAL 99 Ca -0.42 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1jzg h VAL 99 Cb 1.22 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1jzg h VAL 99 CO 0.78 0.04 0.00 -1.54 0.02 0.00 0.00 177.57 176.87 1jzg n SER 100 N -3.33 0.00 -0.11 0.57 3.41 -1.26 -1.06 113.62 111.84 1jzg n SER 100 Ca -0.02 -0.12 0.15 0.00 -0.26 0.00 0.00 58.87 58.62 1jzg n SER 100 Cb 0.19 -0.19 0.71 0.00 -0.26 0.00 0.00 64.21 64.66 1jzg n SER 100 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1jzg n LYS 101 N -1.19 0.84 -4.43 4.33 5.02 -0.43 -4.84 118.16 117.46 1jzg n LYS 101 Ca 0.09 -0.22 -0.25 0.00 -2.02 0.00 0.00 58.31 55.91 1jzg n LYS 101 Cb 0.10 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.51 1jzg n LYS 101 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1jzg s LEU 102 N -2.31 2.65 0.04 -0.35 1.43 -0.22 -5.11 118.68 114.80 1jzg s LEU 102 Ca 0.35 -0.92 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 1jzg s LEU 102 Cb 0.21 -1.22 -0.03 0.00 0.03 0.00 0.00 46.19 45.17 1jzg s LEU 102 CO 0.43 0.06 -0.04 -1.59 0.23 0.00 0.00 176.35 175.44 1jzg s LYS 103 N -3.28 0.51 0.51 1.70 -2.85 -1.26 -5.03 119.74 110.03 1jzg s LYS 103 Ca 0.28 -0.93 -0.20 0.00 -1.00 0.00 0.00 55.97 54.12 1jzg s LYS 103 Cb -0.06 0.05 -0.08 0.00 -2.06 0.00 0.00 37.83 35.68 1jzg s LYS 103 CO 0.14 -0.05 1.07 -1.21 0.10 0.00 0.00 175.35 175.40 1jzg s GLU 104 N -2.62 3.65 0.00 1.78 2.02 -1.26 -3.60 118.70 118.66 1jzg s GLU 104 Ca -0.04 1.43 0.00 0.00 0.02 0.00 0.00 54.97 56.39 1jzg s GLU 104 Cb -0.02 -2.06 0.00 0.00 0.10 0.00 0.00 34.13 32.15 1jzg s GLU 104 CO -0.04 -0.57 0.00 0.41 0.02 0.00 0.00 175.26 175.08 1jzg n GLY 105 N -0.15 0.76 3.22 -1.39 0.00 -1.26 -5.03 105.19 101.34 1jzg n GLY 105 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1jzg n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jzg s GLU 106 N -0.18 2.67 -0.12 1.61 2.12 -1.24 -5.11 118.70 118.45 1jzg s GLU 106 Ca 0.00 -0.84 -0.22 0.00 0.36 0.00 0.00 54.97 54.27 1jzg s GLU 106 Cb 0.00 -2.13 -0.03 0.00 0.26 0.00 0.00 34.13 32.22 1jzg s GLU 106 CO 0.00 0.26 0.65 -0.65 -0.54 0.00 0.00 175.26 174.98 1jzg s GLN 107 N 0.13 4.35 0.25 4.30 -0.21 -1.26 -4.74 119.66 122.48 1jzg s GLN 107 Ca -0.11 0.74 0.09 0.00 0.02 0.00 0.00 55.36 56.10 1jzg s GLN 107 Cb -0.16 -3.49 -0.04 0.00 1.00 0.00 0.00 33.01 30.33 1jzg s GLN 107 CO 0.06 -0.02 0.01 0.71 -2.12 0.00 0.00 175.29 173.93 1jzg s TYR 108 N 1.12 2.73 0.01 0.91 2.02 -0.95 -0.45 117.35 122.74 1jzg s TYR 108 Ca 0.33 -0.21 0.02 0.00 -0.37 0.00 0.00 57.07 56.84 1jzg s TYR 108 Cb -0.17 -1.23 -0.01 0.00 -0.40 0.00 0.00 41.96 40.16 1jzg s TYR 108 CO 0.14 0.60 -0.07 -1.64 -1.57 0.00 0.00 175.55 173.02 1jzg s MET 109 N -3.59 0.49 0.06 -0.62 -1.94 -0.01 -1.48 119.30 112.22 1jzg s MET 109 Ca 0.31 -0.38 0.07 0.00 -1.71 0.00 0.00 55.69 53.98 1jzg s MET 109 Cb -0.07 -0.42 -0.03 0.00 2.01 0.00 0.00 34.83 36.32 1jzg s MET 109 CO 0.20 0.10 -0.17 -0.59 -0.01 0.00 0.00 175.02 174.55 1jzg s PHE 110 N -0.52 2.57 0.13 -0.03 -0.71 -0.39 -1.80 117.98 117.23 1jzg s PHE 110 Ca -0.01 -0.25 -0.25 0.00 -1.04 0.00 0.00 56.93 55.37 1jzg s PHE 110 Cb -0.05 -1.43 0.07 0.00 -1.21 0.00 0.00 43.02 40.40 1jzg s PHE 110 CO 0.00 0.30 0.91 -0.59 -1.34 0.00 0.00 175.22 174.50 1jzg s PHE 111 N -0.99 -0.20 -0.12 3.49 -0.71 -0.21 -1.18 117.98 118.06 1jzg s PHE 111 Ca 0.16 -0.08 -0.06 0.00 -1.04 0.00 0.00 56.93 55.91 1jzg s PHE 111 Cb -0.11 0.62 -0.04 0.00 -1.21 0.00 0.00 43.02 42.29 1jzg s PHE 111 CO 0.07 -0.80 0.09 0.00 -1.34 0.00 0.00 175.22 173.24 1jzg n THR 113 N 2.30 0.64 -1.87 0.00 -2.24 -1.26 -3.39 114.28 108.47 1jzg n THR 113 Ca -0.19 -0.82 -0.40 0.00 -2.27 0.00 0.00 64.05 60.37 1jzg n THR 113 Cb 0.54 0.85 0.01 0.00 -2.10 0.00 0.00 70.33 69.63 1jzg n THR 113 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1jzg s PHE 114 N -1.35 2.59 -0.40 4.78 2.19 -1.26 -4.33 117.98 120.20 1jzg s PHE 114 Ca 0.42 1.29 -0.43 0.00 0.33 0.00 0.00 56.93 58.54 1jzg s PHE 114 Cb 0.24 -3.86 -0.17 0.00 -1.31 0.00 0.00 43.02 37.91 1jzg s PHE 114 CO 0.32 -2.70 1.78 -2.30 1.83 0.00 0.00 175.22 174.16 1jzg n PRO 115 N 0.01 0.55 0.00 10.12 -0.02 -1.26 -1.67 135.00 142.73 1jzg n PRO 115 Ca 0.04 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1jzg n PRO 115 Cb 0.42 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 1jzg n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jzg n GLY 116 N 4.79 2.98 0.30 -1.23 0.00 -1.26 -4.90 105.19 105.87 1jzg n GLY 116 Ca 0.33 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.38 1jzg n GLY 116 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1jzg h HIS 117 N 0.00 0.53 0.00 1.61 3.86 -1.60 -2.92 115.15 116.63 1jzg h HIS 117 Ca 0.00 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1jzg h HIS 117 Cb 0.00 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.30 1jzg h HIS 117 CO 0.00 0.38 0.00 -1.13 0.86 0.00 0.00 177.93 178.04 1jzg n SER 118 N -4.43 0.49 0.26 2.45 3.41 -1.22 -0.27 113.62 114.32 1jzg n SER 118 Ca 0.03 0.71 0.08 0.00 -0.26 0.00 0.00 58.87 59.43 1jzg n SER 118 Cb 0.10 -0.78 0.64 0.00 -0.26 0.00 0.00 64.21 63.90 1jzg n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jzg h ALA 119 N 2.04 1.90 0.00 7.33 0.00 -1.87 -3.31 119.26 125.36 1jzg h ALA 119 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1jzg h ALA 119 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1jzg h ALA 119 CO 0.00 0.04 -0.94 -0.11 0.00 0.00 0.00 179.25 178.24 1jzg n LEU 120 N -4.44 1.92 -4.33 0.00 7.94 -0.68 -4.90 117.00 112.50 1jzg n LEU 120 Ca -0.03 0.00 -0.43 0.00 -1.11 0.00 0.00 56.01 54.44 1jzg n LEU 120 Cb 0.12 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.07 1jzg n LEU 120 CO 0.34 0.32 1.72 0.23 -1.11 0.00 0.00 177.39 178.89 1jzg n MET 121 N -2.27 3.34 -3.53 1.96 2.81 0.63 -4.77 117.12 115.30 1jzg n MET 121 Ca 0.00 -3.58 -0.11 0.00 -1.81 0.00 0.00 57.70 52.20 1jzg n MET 121 Cb 0.47 -3.14 -0.03 0.00 -0.71 0.00 0.00 33.22 29.81 1jzg n MET 121 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 1jzg s LYS 122 N 2.05 1.19 0.12 0.03 -2.85 -1.26 -2.09 119.74 116.93 1jzg s LYS 122 Ca 0.45 -0.59 -0.26 0.00 -1.00 0.00 0.00 55.97 54.57 1jzg s LYS 122 Cb 0.02 0.53 0.08 0.00 -2.06 0.00 0.00 37.83 36.40 1jzg s LYS 122 CO 0.01 -0.50 1.04 0.20 0.10 0.00 0.00 175.35 176.21 1jzg s GLY 123 N -2.78 -0.20 0.24 0.59 0.00 -0.33 -4.82 107.32 100.02 1jzg s GLY 123 Ca 0.02 0.15 -0.05 0.00 0.00 0.00 0.00 44.72 44.84 1jzg s GLY 123 CO -0.12 0.52 0.50 -0.51 0.00 0.00 0.00 173.10 173.49 1jzg s THR 124 N -2.90 5.06 -0.02 0.90 -4.23 -0.66 -1.26 115.64 112.53 1jzg s THR 124 Ca 0.15 0.05 0.01 0.00 -1.18 0.00 0.00 61.69 60.71 1jzg s THR 124 Cb -0.00 -3.70 0.01 0.00 1.34 0.00 0.00 72.50 70.15 1jzg s THR 124 CO 0.02 -0.20 -0.01 -0.22 -0.54 0.00 0.00 174.62 173.66 1jzg s LEU 125 N -3.26 1.53 -0.01 4.79 0.20 -0.55 -0.50 118.68 120.88 1jzg s LEU 125 Ca 0.43 -0.04 -0.03 0.00 0.69 0.00 0.00 54.13 55.18 1jzg s LEU 125 Cb -0.11 -0.20 0.00 0.00 -0.43 0.00 0.00 46.19 45.45 1jzg s LEU 125 CO 0.28 -0.04 0.07 -0.89 -0.29 0.00 0.00 176.35 175.47 1jzg s THR 126 N 0.54 0.04 -0.23 3.68 2.01 -0.60 -2.24 115.64 118.84 1jzg s THR 126 Ca -0.05 -0.33 -0.14 0.00 0.31 0.00 0.00 61.69 61.47 1jzg s THR 126 Cb -0.08 -0.21 -0.04 0.00 0.01 0.00 0.00 72.50 72.18 1jzg s THR 126 CO -0.01 -0.18 0.34 -0.22 -0.69 0.00 0.00 174.62 173.86 1jzg s LEU 127 N -0.56 4.11 0.00 4.42 2.96 -1.26 -0.06 118.68 128.29 1jzg s LEU 127 Ca -0.06 0.35 0.00 0.00 -0.22 0.00 0.00 54.13 54.20 1jzg s LEU 127 Cb -0.04 -2.39 0.00 0.00 0.50 0.00 0.00 46.19 44.26 1jzg s LEU 127 CO 0.00 -0.08 0.03 0.29 -1.32 0.00 0.00 176.35 175.27