#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jzf s GLU 2 N 0.00 3.12 -0.45 0.00 2.12 -1.26 -4.93 118.70 117.30 1jzf s GLU 2 Ca 0.00 -0.91 0.03 0.00 0.36 0.00 0.00 54.97 54.45 1jzf s GLU 2 Cb 0.00 -4.10 0.62 0.00 0.26 0.00 0.00 34.13 30.91 1jzf s GLU 2 CO 0.00 -1.23 1.89 0.00 -0.54 0.00 0.00 175.26 175.39 1jzf s SER 4 N -1.24 -0.43 -0.15 0.00 1.04 -1.26 -1.51 113.70 110.15 1jzf s SER 4 Ca 0.55 -0.09 -0.12 0.00 0.48 0.00 0.00 55.95 56.78 1jzf s SER 4 Cb 0.46 0.54 0.05 0.00 0.10 0.00 0.00 66.02 67.16 1jzf s SER 4 CO 0.09 -0.89 0.39 0.54 0.98 0.00 0.00 173.24 174.35 1jzf s VAL 5 N -3.56 -0.01 -0.26 5.02 0.11 -0.21 -4.94 120.40 116.54 1jzf s VAL 5 Ca 0.01 0.04 -0.12 0.00 -2.93 0.00 0.00 61.98 58.98 1jzf s VAL 5 Cb 0.00 -0.55 -0.05 0.00 -1.53 0.00 0.00 36.38 34.25 1jzf s VAL 5 CO -0.11 0.02 0.23 -1.81 -3.33 0.00 0.00 175.10 170.09 1jzf s ASP 6 N 0.67 6.11 0.04 3.54 1.01 -1.26 -0.80 116.67 125.99 1jzf s ASP 6 Ca -0.04 0.11 0.08 0.00 0.71 0.00 0.00 52.55 53.41 1jzf s ASP 6 Cb -0.05 -2.14 -0.03 0.00 1.01 0.00 0.00 42.92 41.71 1jzf s ASP 6 CO -0.04 -0.04 -0.23 -0.63 0.21 0.00 0.00 175.17 174.44 1jzf s ILE 7 N 1.59 1.82 0.08 0.77 1.01 0.14 -4.96 121.20 121.65 1jzf s ILE 7 Ca 0.09 -1.26 0.10 0.00 0.00 0.00 0.00 60.65 59.58 1jzf s ILE 7 Cb -0.15 -1.57 -0.03 0.00 0.01 0.00 0.00 42.46 40.71 1jzf s ILE 7 CO 0.09 0.25 -0.26 -1.10 0.00 0.00 0.00 174.94 173.92 1jzf s GLN 8 N -1.20 1.64 -0.12 2.79 -0.21 -1.26 -1.52 119.66 119.78 1jzf s GLN 8 Ca 0.09 -1.21 0.01 0.00 0.02 0.00 0.00 55.36 54.27 1jzf s GLN 8 Cb -0.09 -1.95 0.02 0.00 1.00 0.00 0.00 33.01 31.98 1jzf s GLN 8 CO 0.02 0.49 -0.13 0.20 -2.12 0.00 0.00 175.29 173.75 1jzf s GLY 9 N -1.60 1.00 0.00 3.09 0.00 -0.28 -2.33 107.32 107.20 1jzf s GLY 9 Ca 0.13 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 44.13 1jzf s GLY 9 CO 0.04 0.46 0.00 1.16 0.00 0.00 0.00 173.10 174.76 1jzf n ASN 10 N 4.54 1.31 0.09 1.64 0.23 -1.02 -3.53 115.26 118.52 1jzf n ASN 10 Ca -0.17 -0.99 0.12 0.00 -0.53 0.00 0.00 54.58 53.00 1jzf n ASN 10 Cb 0.51 0.00 0.45 0.00 -2.08 0.00 0.00 39.78 38.66 1jzf n ASN 10 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1jzf n ASP 11 N -1.68 0.52 -0.63 0.53 8.00 -1.26 -2.53 116.55 119.51 1jzf n ASP 11 Ca 0.00 0.59 0.06 0.00 0.71 0.00 0.00 54.79 56.15 1jzf n ASP 11 Cb 0.00 -0.72 0.17 0.00 -0.02 0.00 0.00 41.12 40.55 1jzf n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jzf n GLN 12 N -2.03 1.79 -3.45 -1.24 3.00 -1.26 -4.92 117.38 109.27 1jzf n GLN 12 Ca 0.04 -1.22 -0.17 0.00 -0.01 0.00 0.00 57.00 55.63 1jzf n GLN 12 Cb 0.29 -1.28 0.09 0.00 0.00 0.00 0.00 30.24 29.35 1jzf n GLN 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 1jzf n MET 13 N 0.49 -6.61 -3.93 -1.09 1.56 -1.05 -5.02 117.12 101.47 1jzf n MET 13 Ca 0.12 0.84 -0.10 0.00 -0.27 0.00 0.00 57.70 58.28 1jzf n MET 13 Cb 0.29 -5.84 -0.12 0.00 2.15 0.00 0.00 33.22 29.69 1jzf n MET 13 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 1jzf s GLN 14 N -5.42 0.18 0.35 2.12 -0.21 -1.26 -4.23 119.66 111.19 1jzf s GLN 14 Ca 0.02 -0.32 -0.02 0.00 0.02 0.00 0.00 55.36 55.05 1jzf s GLN 14 Cb -0.01 0.07 -0.04 0.00 1.00 0.00 0.00 33.01 34.03 1jzf s GLN 14 CO 0.73 -0.03 0.59 -0.06 -2.12 0.00 0.00 175.29 174.41 1jzf s PHE 15 N -0.79 3.50 -0.38 0.91 0.08 -1.26 -2.43 117.98 117.61 1jzf s PHE 15 Ca -0.09 0.53 0.07 0.00 0.12 0.00 0.00 56.93 57.56 1jzf s PHE 15 Cb -0.05 -2.04 0.59 0.00 -0.57 0.00 0.00 43.02 40.95 1jzf s PHE 15 CO -0.00 0.07 1.63 0.27 -0.10 0.00 0.00 175.22 177.08 1jzf n ASN 16 N -1.59 4.17 -3.62 1.36 6.94 -0.98 -4.85 115.26 116.68 1jzf n ASN 16 Ca -0.03 -3.03 -0.14 0.00 -0.02 0.00 0.00 54.58 51.36 1jzf n ASN 16 Cb 0.55 -0.71 -0.07 0.00 -2.36 0.00 0.00 39.78 37.19 1jzf n ASN 16 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1jzf s THR 17 N -2.53 0.00 -1.09 5.53 -1.32 -1.26 -4.95 115.64 110.02 1jzf s THR 17 Ca 0.45 0.00 0.13 0.00 -1.21 0.00 0.00 61.69 61.06 1jzf s THR 17 Cb 0.36 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 70.32 1jzf s THR 17 CO 0.11 0.00 0.71 0.59 -2.21 0.00 0.00 174.62 173.81 1jzf n ASN 18 N 2.59 1.26 -3.68 8.08 3.02 -1.26 -4.82 115.26 120.44 1jzf n ASN 18 Ca -0.14 -1.13 -0.12 0.00 -0.03 0.00 0.00 54.58 53.16 1jzf n ASN 18 Cb 0.55 0.59 -0.09 0.00 -0.61 0.00 0.00 39.78 40.22 1jzf n ASN 18 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jzf s ALA 19 N -1.78 -1.35 -0.06 5.41 0.00 -1.26 -1.75 121.76 120.98 1jzf s ALA 19 Ca 0.10 1.66 0.04 0.00 0.00 0.00 0.00 51.96 53.76 1jzf s ALA 19 Cb 0.11 -0.98 -0.00 0.00 0.00 0.00 0.00 23.12 22.25 1jzf s ALA 19 CO 0.38 -0.28 -0.19 0.42 0.00 0.00 0.00 175.76 176.09 1jzf s ILE 20 N 0.77 1.65 -0.20 0.00 1.01 0.52 -4.96 121.20 119.98 1jzf s ILE 20 Ca -0.04 -0.81 -0.03 0.00 0.00 0.00 0.00 60.65 59.77 1jzf s ILE 20 Cb -0.05 -1.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.98 1jzf s ILE 20 CO -0.06 0.47 -0.07 -0.89 0.00 0.00 0.00 174.94 174.39 1jzf s THR 21 N 0.20 3.24 -0.35 2.92 2.01 -1.26 -1.70 115.64 120.70 1jzf s THR 21 Ca -0.10 -0.55 -0.13 0.00 0.31 0.00 0.00 61.69 61.22 1jzf s THR 21 Cb -0.14 -2.44 -0.00 0.00 0.01 0.00 0.00 72.50 69.92 1jzf s THR 21 CO 0.05 0.45 0.24 -0.69 -0.69 0.00 0.00 174.62 173.98 1jzf s VAL 22 N 1.21 5.11 0.24 3.82 1.01 0.20 -4.97 120.40 127.01 1jzf s VAL 22 Ca 0.02 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.30 1jzf s VAL 22 Cb -0.14 -3.69 -0.10 0.00 0.00 0.00 0.00 36.38 32.45 1jzf s VAL 22 CO -0.02 -0.08 1.39 -0.62 0.00 0.00 0.00 175.10 175.76 1jzf s ASP 23 N 1.68 6.74 0.57 3.32 -1.08 -1.26 -1.51 116.67 125.14 1jzf s ASP 23 Ca 0.05 2.58 0.27 0.00 -0.52 0.00 0.00 52.55 54.92 1jzf s ASP 23 Cb -0.18 -2.62 1.66 0.00 -1.46 0.00 0.00 42.92 40.32 1jzf s ASP 23 CO 0.09 -0.63 2.19 0.11 0.52 0.00 0.00 175.17 177.45 1jzf h LYS 24 N 5.07 0.00 0.00 4.34 1.57 -1.14 -1.73 116.57 124.68 1jzf h LYS 24 Ca -0.46 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.31 1jzf h LYS 24 Cb 1.22 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.52 1jzf h LYS 24 CO 0.77 0.00 -0.06 0.77 -0.57 0.00 0.00 179.45 180.36 1jzf h SER 25 N 0.00 0.00 -3.58 0.86 0.02 -1.91 -3.44 113.55 105.51 1jzf h SER 25 Ca 0.03 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.46 1jzf h SER 25 Cb 0.15 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.71 1jzf h SER 25 CO -0.00 0.06 0.55 0.00 -1.14 0.00 0.00 176.83 176.29 1jzf n LYS 27 N 2.12 0.73 -4.22 0.00 4.01 -1.26 -4.65 118.16 114.89 1jzf n LYS 27 Ca 0.03 0.27 -0.17 0.00 -0.51 0.00 0.00 58.31 57.93 1jzf n LYS 27 Cb 0.44 -1.73 -0.11 0.00 -0.51 0.00 0.00 35.03 33.13 1jzf n LYS 27 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 1jzf s GLN 28 N -2.57 0.96 -0.03 1.97 1.11 -1.26 -0.75 119.66 119.09 1jzf s GLN 28 Ca -0.18 -1.20 0.03 0.00 0.01 0.00 0.00 55.36 54.01 1jzf s GLN 28 Cb 0.07 -0.77 0.00 0.00 -1.01 0.00 0.00 33.01 31.30 1jzf s GLN 28 CO 0.78 0.14 -0.10 0.12 0.01 0.00 0.00 175.29 176.24 1jzf s PHE 29 N -2.23 1.02 -0.08 0.91 5.36 -0.47 -4.84 117.98 117.65 1jzf s PHE 29 Ca 0.07 -0.25 0.05 0.00 -0.96 0.00 0.00 56.93 55.84 1jzf s PHE 29 Cb -0.04 -0.71 -0.01 0.00 -0.34 0.00 0.00 43.02 41.92 1jzf s PHE 29 CO 0.02 -0.10 -0.24 0.99 -1.46 0.00 0.00 175.22 174.44 1jzf s THR 30 N 0.13 2.13 -0.19 0.12 2.01 -0.57 -1.68 115.64 117.58 1jzf s THR 30 Ca -0.02 -1.02 -0.02 0.00 0.31 0.00 0.00 61.69 60.94 1jzf s THR 30 Cb -0.08 -1.79 -0.00 0.00 0.01 0.00 0.00 72.50 70.63 1jzf s THR 30 CO 0.00 0.56 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.71 1jzf s VAL 31 N 0.07 3.02 -0.43 3.82 1.01 -0.22 -1.04 120.40 126.64 1jzf s VAL 31 Ca -0.10 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.17 1jzf s VAL 31 Cb -0.16 -2.33 0.09 0.00 0.00 0.00 0.00 36.38 33.98 1jzf s VAL 31 CO 0.06 0.47 0.27 0.20 0.00 0.00 0.00 175.10 176.11 1jzf s ASN 32 N 1.16 5.60 -0.07 3.32 0.01 0.02 -1.73 114.94 123.26 1jzf s ASN 32 Ca 0.02 -1.69 -0.11 0.00 -0.71 0.00 0.00 52.86 50.37 1jzf s ASN 32 Cb -0.14 -1.97 -0.05 0.00 0.41 0.00 0.00 41.25 39.50 1jzf s ASN 32 CO -0.03 -0.58 0.28 -0.22 -1.51 0.00 0.00 177.10 175.03 1jzf s LEU 33 N 1.37 4.42 0.06 0.60 2.96 -0.06 -0.68 118.68 127.34 1jzf s LEU 33 Ca 0.04 0.71 -0.00 0.00 -0.22 0.00 0.00 54.13 54.65 1jzf s LEU 33 Cb -0.24 -2.33 -0.04 0.00 0.50 0.00 0.00 46.19 44.08 1jzf s LEU 33 CO 0.00 0.35 -0.04 -0.94 -1.32 0.00 0.00 176.35 174.41 1jzf s SER 34 N -0.95 0.60 -0.42 3.68 1.04 -0.57 -0.92 113.70 116.15 1jzf s SER 34 Ca 0.19 -0.95 0.03 0.00 0.48 0.00 0.00 55.95 55.70 1jzf s SER 34 Cb -0.14 0.17 0.12 0.00 0.10 0.00 0.00 66.02 66.26 1jzf s SER 34 CO 0.08 -0.54 0.17 -2.28 0.98 0.00 0.00 173.24 171.65 1jzf s HIS 35 N -3.59 2.85 -2.00 5.02 2.46 -0.96 -1.13 115.29 117.94 1jzf s HIS 35 Ca 0.06 -2.74 0.13 0.00 0.47 0.00 0.00 55.06 52.98 1jzf s HIS 35 Cb 0.05 -2.47 0.80 0.00 -0.13 0.00 0.00 32.58 30.84 1jzf s HIS 35 CO -0.08 -0.83 1.42 -0.35 -2.47 0.00 0.00 174.74 172.42 1jzf n PRO 36 N 3.81 0.87 -0.87 2.88 -0.04 -1.23 -1.74 135.00 138.67 1jzf n PRO 36 Ca 0.04 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.38 1jzf n PRO 36 Cb 0.37 -1.24 0.09 0.00 -0.04 0.00 0.00 33.50 32.67 1jzf n PRO 36 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1jzf n GLY 37 N 0.54 -1.17 0.02 0.55 0.00 -1.26 -4.91 105.19 98.96 1jzf n GLY 37 Ca 0.10 -1.71 0.02 0.00 0.00 0.00 0.00 46.02 44.44 1jzf n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jzf n ASN 38 N -3.35 2.39 -4.77 1.61 5.03 -1.26 -4.20 115.26 110.71 1jzf n ASN 38 Ca 0.07 0.00 -0.39 0.00 0.87 0.00 0.00 54.58 55.13 1jzf n ASN 38 Cb 0.25 1.27 -0.03 0.00 -1.02 0.00 0.00 39.78 40.25 1jzf n ASN 38 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1jzf s LEU 39 N -4.12 4.37 0.88 3.41 1.02 -1.26 -4.73 118.68 118.26 1jzf s LEU 39 Ca -0.05 2.28 -0.12 0.00 0.02 0.00 0.00 54.13 56.27 1jzf s LEU 39 Cb 0.06 -3.84 0.12 0.00 0.02 0.00 0.00 46.19 42.55 1jzf s LEU 39 CO 0.46 -0.38 1.09 -2.16 0.02 0.00 0.00 176.35 175.38 1jzf s PRO 40 N -1.90 1.35 0.51 1.29 0.04 -1.26 -1.72 135.00 133.31 1jzf s PRO 40 Ca 0.51 0.78 0.34 0.00 0.04 0.00 0.00 61.00 62.67 1jzf s PRO 40 Cb -0.30 -1.82 1.58 0.00 0.04 0.00 0.00 34.50 33.99 1jzf s PRO 40 CO 0.39 -2.16 2.01 1.57 0.04 0.00 0.00 177.00 178.84 1jzf h LYS 41 N -1.49 0.00 0.00 4.56 2.10 -1.83 -0.85 116.57 119.05 1jzf h LYS 41 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 1jzf h LYS 41 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 1jzf h LYS 41 CO 0.55 0.00 0.00 -2.95 -2.00 0.00 0.00 179.45 175.05 1jzf h ASN 42 N 0.00 0.00 0.00 7.07 -0.00 -1.94 -1.88 115.58 118.83 1jzf h ASN 42 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 56.30 56.27 1jzf h ASN 42 Cb 0.29 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.61 1jzf h ASN 42 CO 0.00 0.00 -1.11 0.52 -0.00 0.00 0.00 177.43 176.84 1jzf n VAL 43 N -2.37 0.11 -2.78 6.14 0.31 -1.02 -4.82 118.33 113.90 1jzf n VAL 43 Ca 0.05 -0.06 -0.03 0.00 -0.01 0.00 0.00 64.34 64.28 1jzf n VAL 43 Cb 0.41 -0.94 0.05 0.00 -0.91 0.00 0.00 33.84 32.45 1jzf n VAL 43 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 1jzf n MET 44 N -2.09 1.53 -2.33 5.55 0.00 -0.36 -5.03 117.12 114.40 1jzf n MET 44 Ca -0.03 -3.34 -0.39 0.00 -0.00 0.00 0.00 57.70 53.94 1jzf n MET 44 Cb 0.55 -1.42 -0.03 0.00 0.00 0.00 0.00 33.22 32.33 1jzf n MET 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1jzf s GLY 45 N -3.49 2.91 -0.01 -5.12 0.00 -0.70 -4.69 107.32 96.21 1jzf s GLY 45 Ca 0.26 0.97 0.03 0.00 0.00 0.00 0.00 44.72 45.98 1jzf s GLY 45 CO -0.02 1.51 -0.10 0.30 0.00 0.00 0.00 173.10 174.79 1jzf s HIS 46 N -1.36 0.91 0.09 1.90 3.76 -0.17 -4.63 115.29 115.79 1jzf s HIS 46 Ca 0.54 -0.19 0.01 0.00 -0.15 0.00 0.00 55.06 55.27 1jzf s HIS 46 Cb -0.31 -0.61 -0.04 0.00 1.11 0.00 0.00 32.58 32.73 1jzf s HIS 46 CO 0.40 -0.04 -0.06 0.54 -0.85 0.00 0.00 174.74 174.72 1jzf s ASN 47 N -0.09 1.05 -0.33 1.40 2.20 -1.26 -0.27 114.94 117.64 1jzf s ASN 47 Ca 0.01 -0.98 -0.02 0.00 -0.94 0.00 0.00 52.86 50.93 1jzf s ASN 47 Cb -0.05 0.10 0.06 0.00 -2.00 0.00 0.00 41.25 39.36 1jzf s ASN 47 CO -0.00 -0.46 0.05 0.86 -2.94 0.00 0.00 177.10 174.61 1jzf s TRP 48 N -3.51 3.33 -0.09 1.54 -0.00 -1.26 -3.80 118.94 115.15 1jzf s TRP 48 Ca 0.10 -1.93 0.02 0.00 -0.00 0.00 0.00 56.10 54.29 1jzf s TRP 48 Cb 0.05 -2.34 -0.02 0.00 -0.00 0.00 0.00 33.47 31.15 1jzf s TRP 48 CO -0.05 -0.83 -0.15 0.08 -0.00 0.00 0.00 176.95 176.00 1jzf s VAL 49 N 1.25 2.93 -0.08 5.86 1.01 0.01 -1.43 120.40 129.94 1jzf s VAL 49 Ca -0.02 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.25 1jzf s VAL 49 Cb -0.20 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 1jzf s VAL 49 CO -0.01 0.55 -0.14 -0.22 0.00 0.00 0.00 175.10 175.28 1jzf s LEU 50 N -0.08 2.72 0.31 3.92 2.96 -0.25 -1.02 118.68 127.24 1jzf s LEU 50 Ca -0.03 -0.25 -0.16 0.00 -0.22 0.00 0.00 54.13 53.47 1jzf s LEU 50 Cb -0.14 -1.57 0.03 0.00 0.50 0.00 0.00 46.19 45.00 1jzf s LEU 50 CO 0.04 0.27 0.68 -0.94 -1.32 0.00 0.00 176.35 175.08 1jzf s SER 51 N -0.29 -0.04 0.63 3.68 1.04 -0.80 -0.56 113.70 117.36 1jzf s SER 51 Ca 0.02 -0.92 -0.14 0.00 0.48 0.00 0.00 55.95 55.39 1jzf s SER 51 Cb -0.13 0.74 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 1jzf s SER 51 CO 0.03 -1.42 1.06 0.42 0.98 0.00 0.00 173.24 174.31 1jzf s THR 52 N -3.33 3.78 0.38 2.02 -4.23 -1.26 -0.66 115.64 112.34 1jzf s THR 52 Ca 0.16 0.76 0.08 0.00 -1.18 0.00 0.00 61.69 61.51 1jzf s THR 52 Cb -0.04 -3.33 0.29 0.00 1.34 0.00 0.00 72.50 70.76 1jzf s THR 52 CO 0.10 -0.58 1.98 0.00 -0.54 0.00 0.00 174.62 175.58 1jzf h ALA 53 N 0.04 1.76 -0.32 3.99 0.00 -1.12 -1.90 119.26 121.71 1jzf h ALA 53 Ca -0.46 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 1jzf h ALA 53 Cb 1.22 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 1jzf h ALA 53 CO 0.57 0.14 -0.09 0.00 0.00 0.00 0.00 179.25 179.86 1jzf h ALA 54 N 1.65 1.24 -0.00 0.00 0.00 -1.91 -3.08 119.26 117.15 1jzf h ALA 54 Ca 0.27 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1jzf h ALA 54 Cb 0.25 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1jzf h ALA 54 CO -0.08 0.50 -0.45 -0.25 0.00 0.00 0.00 179.25 178.97 1jzf n ASP 55 N -4.21 0.54 0.01 0.00 8.00 -0.76 -4.52 116.55 115.61 1jzf n ASP 55 Ca 0.01 -0.30 -0.11 0.00 0.71 0.00 0.00 54.79 55.10 1jzf n ASP 55 Cb 0.31 0.20 -0.05 0.00 -0.02 0.00 0.00 41.12 41.56 1jzf n ASP 55 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 1jzf h MET 56 N 0.14 -0.43 -0.92 -1.24 4.05 -1.36 -1.79 114.93 113.39 1jzf h MET 56 Ca 0.00 0.03 0.13 0.00 -0.28 0.00 0.00 59.70 59.58 1jzf h MET 56 Cb 0.50 0.10 -0.09 0.00 -0.80 0.00 0.00 31.60 31.31 1jzf h MET 56 CO 0.00 -0.28 0.54 0.37 0.23 0.00 0.00 176.91 177.77 1jzf h GLN 57 N -0.44 0.80 -0.32 0.39 5.75 -1.80 -0.56 115.11 118.93 1jzf h GLN 57 Ca 0.08 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.46 1jzf h GLN 57 Cb 0.58 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.94 1jzf h GLN 57 CO -0.35 0.53 -0.08 0.78 -2.65 0.00 0.00 178.83 177.06 1jzf h GLY 58 N 0.83 0.67 0.99 2.39 0.00 -1.76 -1.16 103.07 105.03 1jzf h GLY 58 Ca 0.47 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 47.22 1jzf h GLY 58 CO -0.30 0.51 0.26 -2.08 0.00 0.00 0.00 176.54 174.93 1jzf h VAL 59 N 0.39 1.22 -0.21 4.60 2.07 -0.74 -1.84 116.25 121.75 1jzf h VAL 59 Ca 0.08 -0.65 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 1jzf h VAL 59 Cb 0.58 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1jzf h VAL 59 CO 0.03 0.26 -0.02 0.58 0.02 0.00 0.00 177.57 178.44 1jzf h VAL 60 N 0.81 1.27 0.43 2.57 2.07 -1.07 -0.04 116.25 122.29 1jzf h VAL 60 Ca 0.20 -0.95 -0.02 0.00 0.82 0.00 0.00 66.70 66.75 1jzf h VAL 60 Cb 0.16 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1jzf h VAL 60 CO -0.02 0.29 -0.26 0.74 0.02 0.00 0.00 177.57 178.34 1jzf h THR 61 N 0.13 0.46 0.00 2.57 2.02 -1.12 -1.84 112.91 115.12 1jzf h THR 61 Ca 0.06 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.15 1jzf h THR 61 Cb 0.45 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 1jzf h THR 61 CO 0.02 0.00 -0.40 0.44 0.37 0.00 0.00 175.52 175.95 1jzf h ASP 62 N -0.66 0.00 -0.55 4.18 3.32 -1.40 -3.06 116.42 118.24 1jzf h ASP 62 Ca -0.05 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 1jzf h ASP 62 Cb 0.54 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 1jzf h ASP 62 CO 0.05 0.40 0.19 1.23 -1.72 0.00 0.00 179.24 179.38 1jzf h GLY 63 N 1.33 0.92 1.62 2.75 0.00 -0.69 -2.91 103.07 106.10 1jzf h GLY 63 Ca -0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 47.33 46.73 1jzf h GLY 63 CO 0.05 0.50 -0.10 1.98 0.00 0.00 0.00 176.54 178.97 1jzf h MET 64 N 0.77 0.46 0.00 4.80 1.85 -1.24 -2.30 114.93 119.28 1jzf h MET 64 Ca 0.18 -0.12 0.00 0.00 -0.61 0.00 0.00 59.70 59.15 1jzf h MET 64 Cb 0.26 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 32.23 1jzf h MET 64 CO -0.01 0.57 0.00 0.00 -0.40 0.00 0.00 176.91 177.07 1jzf n ALA 65 N -2.48 2.30 0.07 0.39 0.00 -1.13 -3.64 120.51 116.03 1jzf n ALA 65 Ca 0.01 -0.11 -0.05 0.00 0.00 0.00 0.00 53.44 53.28 1jzf n ALA 65 Cb 0.30 -1.44 -0.10 0.00 0.00 0.00 0.00 19.45 18.21 1jzf n ALA 65 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1jzf h SER 66 N 0.00 0.00 -4.81 0.00 0.02 -1.22 -3.51 113.55 104.03 1jzf h SER 66 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1jzf h SER 66 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1jzf h SER 66 CO 0.00 0.92 0.00 0.61 -1.14 0.00 0.00 176.83 177.22 1jzf n GLY 67 N 1.33 0.97 0.27 -3.77 0.00 -1.24 -4.43 105.19 98.33 1jzf n GLY 67 Ca 0.00 -1.87 -0.07 0.00 0.00 0.00 0.00 46.02 44.08 1jzf n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jzf h LEU 68 N 0.00 0.85 -1.40 0.99 5.85 -1.93 -0.47 115.31 119.20 1jzf h LEU 68 Ca 0.00 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1jzf h LEU 68 Cb 0.00 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.81 1jzf h LEU 68 CO 0.00 0.79 0.00 -2.24 -0.34 0.00 0.00 178.44 176.65 1jzf h ASP 69 N 0.87 0.00 -0.46 1.25 2.03 -2.02 -0.20 116.42 117.89 1jzf h ASP 69 Ca 0.21 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 1jzf h ASP 69 Cb 0.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.70 1jzf h ASP 69 CO -0.02 0.00 0.00 0.29 -1.03 0.00 0.00 179.24 178.48 1jzf n LYS 70 N -2.36 2.94 -2.21 4.15 4.76 -1.03 -4.95 118.16 119.45 1jzf n LYS 70 Ca -0.01 -2.35 -0.21 0.00 -2.87 0.00 0.00 58.31 52.87 1jzf n LYS 70 Cb 0.10 -1.46 -0.03 0.00 -1.84 0.00 0.00 35.03 31.80 1jzf n LYS 70 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1jzf n ASP 71 N 0.74 -5.77 -3.85 4.39 9.92 -0.09 -2.43 116.55 119.47 1jzf n ASP 71 Ca 0.17 0.10 -0.26 0.00 -0.53 0.00 0.00 54.79 54.27 1jzf n ASP 71 Cb 0.56 -4.84 0.02 0.00 -0.64 0.00 0.00 41.12 36.22 1jzf n ASP 71 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1jzf n TYR 72 N -3.66 -2.02 -3.88 1.24 4.01 -0.21 -4.83 117.16 107.81 1jzf n TYR 72 Ca -0.24 0.85 -0.12 0.00 -0.16 0.00 0.00 57.90 58.23 1jzf n TYR 72 Cb 0.68 -4.05 -0.14 0.00 -0.31 0.00 0.00 39.34 35.52 1jzf n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1jzf s LEU 73 N -6.99 2.00 -0.07 7.72 1.43 -1.02 -4.23 118.68 117.52 1jzf s LEU 73 Ca 0.30 -0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 53.10 1jzf s LEU 73 Cb -0.15 -0.00 -0.04 0.00 0.03 0.00 0.00 46.19 46.02 1jzf s LEU 73 CO 0.84 -0.00 1.43 -0.75 0.23 0.00 0.00 176.35 178.09 1jzf s LYS 74 N -0.03 4.24 -0.05 1.70 2.20 -1.26 -4.82 119.74 121.72 1jzf s LYS 74 Ca -0.00 1.93 -0.38 0.00 -0.36 0.00 0.00 55.97 57.16 1jzf s LYS 74 Cb -0.00 -3.75 -0.16 0.00 -1.51 0.00 0.00 37.83 32.40 1jzf s LYS 74 CO -0.00 -0.69 1.49 -2.30 -0.36 0.00 0.00 175.35 173.49 1jzf n PRO 75 N 6.27 1.15 -1.98 4.03 -0.02 -1.26 -1.55 135.00 141.65 1jzf n PRO 75 Ca 0.14 0.42 -0.18 0.00 -2.02 0.00 0.00 63.50 61.86 1jzf n PRO 75 Cb 0.44 -2.08 -0.04 0.00 -0.02 0.00 0.00 33.50 31.80 1jzf n PRO 75 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1jzf n ASP 76 N 3.59 -5.30 -4.59 2.55 10.43 -1.26 -4.90 116.55 117.07 1jzf n ASP 76 Ca 0.21 0.20 -0.42 0.00 2.57 0.00 0.00 54.79 57.36 1jzf n ASP 76 Cb 0.17 -4.39 -0.03 0.00 1.84 0.00 0.00 41.12 38.70 1jzf n ASP 76 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1jzf s ASP 77 N -2.46 5.25 0.30 -2.24 -1.08 -0.59 -4.82 116.67 111.02 1jzf s ASP 77 Ca 0.00 1.73 0.24 0.00 -0.52 0.00 0.00 52.55 53.99 1jzf s ASP 77 Cb 0.00 -2.51 1.09 0.00 -1.46 0.00 0.00 42.92 40.04 1jzf s ASP 77 CO 0.00 -2.14 1.71 -1.54 0.52 0.00 0.00 175.17 173.72 1jzf n SER 78 N 12.53 0.67 0.24 -0.34 3.41 -1.26 -2.20 113.62 126.67 1jzf n SER 78 Ca 0.31 0.71 0.15 0.00 -0.26 0.00 0.00 58.87 59.78 1jzf n SER 78 Cb 0.47 -0.84 0.42 0.00 -0.26 0.00 0.00 64.21 64.01 1jzf n SER 78 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1jzf h ARG 79 N 0.00 0.00 -5.99 4.33 3.08 -1.97 -3.43 114.38 110.40 1jzf h ARG 79 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1jzf h ARG 79 Cb 0.23 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.21 1jzf h ARG 79 CO 0.00 0.00 0.65 0.08 -1.07 0.00 0.00 179.97 179.63 1jzf s VAL 80 N -3.42 4.75 -0.04 2.04 1.01 -0.93 -4.47 120.40 119.33 1jzf s VAL 80 Ca 0.04 1.86 -0.20 0.00 0.00 0.00 0.00 61.98 63.68 1jzf s VAL 80 Cb 0.07 -4.24 -0.31 0.00 0.00 0.00 0.00 36.38 31.90 1jzf s VAL 80 CO 0.60 -0.12 0.86 0.40 0.00 0.00 0.00 175.10 176.84 1jzf h ILE 81 N 5.40 1.41 -2.81 2.22 2.04 -1.11 -3.49 117.51 121.18 1jzf h ILE 81 Ca -0.22 -2.54 0.00 0.00 1.00 0.00 0.00 64.86 63.10 1jzf h ILE 81 Cb 1.08 3.12 -0.13 0.00 -0.74 0.00 0.00 36.82 40.15 1jzf h ILE 81 CO 0.93 0.73 0.26 0.00 0.00 0.00 0.00 178.15 180.07 1jzf s ALA 82 N -2.46 -1.65 -0.12 1.87 0.00 -1.24 -5.03 121.76 113.14 1jzf s ALA 82 Ca -0.14 0.64 -0.30 0.00 0.00 0.00 0.00 51.96 52.15 1jzf s ALA 82 Cb 0.02 0.75 0.11 0.00 0.00 0.00 0.00 23.12 23.99 1jzf s ALA 82 CO 0.84 -0.73 0.90 -3.38 0.00 0.00 0.00 175.76 173.39 1jzf s HIS 83 N -3.49 -0.45 0.65 0.00 -3.43 -1.26 -1.09 115.29 106.23 1jzf s HIS 83 Ca 0.01 0.75 0.02 0.00 -0.80 0.00 0.00 55.06 55.04 1jzf s HIS 83 Cb -0.01 0.44 0.10 0.00 -1.43 0.00 0.00 32.58 31.68 1jzf s HIS 83 CO -0.11 -0.43 0.90 0.95 -2.00 0.00 0.00 174.74 174.05 1jzf s THR 84 N -1.23 2.26 0.62 -5.38 -4.23 -0.51 -4.85 115.64 102.32 1jzf s THR 84 Ca -0.04 -0.70 -0.05 0.00 -1.18 0.00 0.00 61.69 59.72 1jzf s THR 84 Cb -0.00 -2.56 0.03 0.00 1.34 0.00 0.00 72.50 71.30 1jzf s THR 84 CO 0.03 0.00 0.92 -1.59 -0.54 0.00 0.00 174.62 173.45 1jzf s LYS 85 N -4.96 2.63 -0.08 3.99 -2.85 -1.26 -4.51 119.74 112.71 1jzf s LYS 85 Ca 0.63 -0.18 -0.30 0.00 -1.00 0.00 0.00 55.97 55.13 1jzf s LYS 85 Cb -0.06 -2.27 -0.02 0.00 -2.06 0.00 0.00 37.83 33.42 1jzf s LYS 85 CO 0.42 -0.88 1.11 -1.17 0.10 0.00 0.00 175.35 174.93 1jzf s LEU 86 N -5.05 4.26 0.20 2.77 2.96 -1.26 -4.44 118.68 118.12 1jzf s LEU 86 Ca 0.56 1.68 0.10 0.00 -0.22 0.00 0.00 54.13 56.26 1jzf s LEU 86 Cb -0.11 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 1jzf s LEU 86 CO 0.44 -0.52 -0.21 0.27 -1.32 0.00 0.00 176.35 175.01 1jzf s ILE 87 N 2.12 2.15 0.03 6.68 -4.36 0.62 -4.87 121.20 123.56 1jzf s ILE 87 Ca 0.52 -2.07 0.00 0.00 -0.26 0.00 0.00 60.65 58.84 1jzf s ILE 87 Cb -0.22 -2.05 0.00 0.00 1.25 0.00 0.00 42.46 41.44 1jzf s ILE 87 CO 0.20 -0.27 0.00 0.61 0.24 0.00 0.00 174.94 175.72 1jzf n GLY 88 N 0.07 4.00 3.56 6.27 0.00 -1.26 -1.00 105.19 116.83 1jzf n GLY 88 Ca -0.11 -2.21 -0.53 0.00 0.00 0.00 0.00 46.02 43.17 1jzf n GLY 88 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1jzf n SER 89 N -1.16 1.06 0.00 1.61 2.88 -0.70 -1.71 113.62 115.60 1jzf n SER 89 Ca -0.01 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.67 1jzf n SER 89 Cb 0.03 -1.13 0.00 0.00 -0.75 0.00 0.00 64.21 62.37 1jzf n SER 89 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jzf n GLY 90 N 2.13 1.22 3.97 0.46 0.00 -0.71 -4.99 105.19 107.27 1jzf n GLY 90 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 1jzf n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jzf s GLU 91 N -0.16 2.86 0.02 1.61 2.02 -0.70 -4.94 118.70 119.40 1jzf s GLU 91 Ca 0.00 -0.75 -0.22 0.00 0.02 0.00 0.00 54.97 54.02 1jzf s GLU 91 Cb 0.00 -2.59 0.05 0.00 0.10 0.00 0.00 34.13 31.68 1jzf s GLU 91 CO 0.00 -0.38 0.49 -1.59 0.02 0.00 0.00 175.26 173.79 1jzf s LYS 92 N -4.55 0.95 -0.14 1.61 -2.85 -1.26 -2.26 119.74 111.23 1jzf s LYS 92 Ca 0.52 -0.18 -0.27 0.00 -1.00 0.00 0.00 55.97 55.04 1jzf s LYS 92 Cb -0.10 0.43 0.07 0.00 -2.06 0.00 0.00 37.83 36.17 1jzf s LYS 92 CO 0.37 -0.32 0.67 0.34 0.10 0.00 0.00 175.35 176.50 1jzf s ASP 93 N -1.76 -0.67 0.17 0.03 2.15 -0.10 -5.00 116.67 111.49 1jzf s ASP 93 Ca -0.07 0.99 0.10 0.00 0.43 0.00 0.00 52.55 54.00 1jzf s ASP 93 Cb -0.01 0.92 -0.04 0.00 -0.30 0.00 0.00 42.92 43.49 1jzf s ASP 93 CO 0.01 -0.44 -0.21 -0.44 -0.17 0.00 0.00 175.17 173.92 1jzf s SER 94 N -0.50 2.99 -0.04 -0.34 0.01 -1.26 -0.88 113.70 113.69 1jzf s SER 94 Ca -0.06 -0.83 -0.01 0.00 1.31 0.00 0.00 55.95 56.35 1jzf s SER 94 Cb -0.02 -0.20 0.03 0.00 0.21 0.00 0.00 66.02 66.04 1jzf s SER 94 CO 0.06 0.05 0.08 0.54 0.41 0.00 0.00 173.24 174.37 1jzf s VAL 95 N -1.73 -0.04 -0.07 3.43 0.11 -0.71 -4.91 120.40 116.49 1jzf s VAL 95 Ca 0.16 0.16 0.05 0.00 -2.93 0.00 0.00 61.98 59.43 1jzf s VAL 95 Cb -0.07 -0.14 -0.01 0.00 -1.53 0.00 0.00 36.38 34.62 1jzf s VAL 95 CO 0.08 0.07 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.79 1jzf s THR 96 N 0.92 2.25 0.06 5.04 2.01 -1.26 -1.05 115.64 123.60 1jzf s THR 96 Ca -0.07 -0.99 0.00 0.00 0.31 0.00 0.00 61.69 60.94 1jzf s THR 96 Cb -0.10 -1.84 -0.03 0.00 0.01 0.00 0.00 72.50 70.54 1jzf s THR 96 CO -0.04 0.57 -0.05 0.72 -0.69 0.00 0.00 174.62 175.13 1jzf s PHE 97 N -0.12 0.59 0.10 4.92 -0.71 -0.68 -4.96 117.98 117.12 1jzf s PHE 97 Ca -0.04 -0.82 -0.31 0.00 -1.04 0.00 0.00 56.93 54.72 1jzf s PHE 97 Cb -0.14 -0.39 -0.07 0.00 -1.21 0.00 0.00 43.02 41.22 1jzf s PHE 97 CO 0.04 -0.23 1.23 0.34 -1.34 0.00 0.00 175.22 175.26 1jzf s ASP 98 N -2.44 7.04 0.60 1.98 3.68 -1.26 -1.37 116.67 124.90 1jzf s ASP 98 Ca 0.01 2.11 0.38 0.00 2.13 0.00 0.00 52.55 57.18 1jzf s ASP 98 Cb 0.01 -2.59 1.83 0.00 -1.45 0.00 0.00 42.92 40.72 1jzf s ASP 98 CO -0.05 -0.48 2.16 0.58 0.13 0.00 0.00 175.17 177.51 1jzf h VAL 99 N 4.30 0.07 0.00 1.11 2.07 -1.21 -1.65 116.25 120.95 1jzf h VAL 99 Ca -0.42 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1jzf h VAL 99 Cb 1.21 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 1jzf h VAL 99 CO 0.81 0.02 0.00 -1.54 0.02 0.00 0.00 177.57 176.87 1jzf n SER 100 N -3.16 0.00 -0.09 0.57 3.41 -1.26 -1.20 113.62 111.89 1jzf n SER 100 Ca -0.01 0.32 0.15 0.00 -0.26 0.00 0.00 58.87 59.07 1jzf n SER 100 Cb 0.20 -0.40 0.80 0.00 -0.26 0.00 0.00 64.21 64.54 1jzf n SER 100 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1jzf n LYS 101 N -1.40 0.93 -4.44 4.33 5.02 -0.62 -4.81 118.16 117.17 1jzf n LYS 101 Ca 0.05 -0.18 -0.25 0.00 -2.02 0.00 0.00 58.31 55.91 1jzf n LYS 101 Cb 0.14 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.55 1jzf n LYS 101 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1jzf s LEU 102 N -2.19 2.60 0.03 -0.35 1.43 -0.34 -5.11 118.68 114.76 1jzf s LEU 102 Ca 0.40 -0.94 -0.01 0.00 -1.03 0.00 0.00 54.13 52.55 1jzf s LEU 102 Cb 0.21 -1.18 -0.03 0.00 0.03 0.00 0.00 46.19 45.22 1jzf s LEU 102 CO 0.40 0.06 -0.02 -1.59 0.23 0.00 0.00 176.35 175.43 1jzf s LYS 103 N -3.26 0.44 0.40 1.70 -2.85 -1.26 -5.03 119.74 109.88 1jzf s LYS 103 Ca 0.27 -0.84 -0.25 0.00 -1.00 0.00 0.00 55.97 54.16 1jzf s LYS 103 Cb -0.06 0.15 -0.08 0.00 -2.06 0.00 0.00 37.83 35.78 1jzf s LYS 103 CO 0.14 -0.08 1.13 -1.21 0.10 0.00 0.00 175.35 175.43 1jzf s GLU 104 N -2.43 4.06 0.00 1.78 2.02 -1.26 -3.60 118.70 119.27 1jzf s GLU 104 Ca -0.07 1.72 0.00 0.00 0.02 0.00 0.00 54.97 56.64 1jzf s GLU 104 Cb -0.03 -2.61 0.00 0.00 0.10 0.00 0.00 34.13 31.59 1jzf s GLU 104 CO -0.05 -0.28 0.00 0.41 0.02 0.00 0.00 175.26 175.37 1jzf n GLY 105 N 0.53 0.57 3.07 -1.39 0.00 -1.26 -5.04 105.19 101.68 1jzf n GLY 105 Ca 0.05 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 1jzf n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jzf s GLU 106 N -0.51 1.62 -0.07 1.61 2.12 -1.24 -5.13 118.70 117.10 1jzf s GLU 106 Ca 0.00 -0.49 -0.21 0.00 0.36 0.00 0.00 54.97 54.63 1jzf s GLU 106 Cb 0.00 -1.39 -0.04 0.00 0.26 0.00 0.00 34.13 32.96 1jzf s GLU 106 CO 0.00 0.15 0.59 -0.65 -0.54 0.00 0.00 175.26 174.81 1jzf s GLN 107 N 0.27 4.38 0.25 4.30 -0.21 -1.26 -4.74 119.66 122.64 1jzf s GLN 107 Ca -0.07 0.68 0.09 0.00 0.02 0.00 0.00 55.36 56.08 1jzf s GLN 107 Cb -0.12 -3.42 -0.04 0.00 1.00 0.00 0.00 33.01 30.42 1jzf s GLN 107 CO 0.02 0.16 0.00 0.71 -2.12 0.00 0.00 175.29 174.07 1jzf s TYR 108 N 0.54 2.74 -0.02 0.91 2.02 -0.89 -0.60 117.35 122.05 1jzf s TYR 108 Ca 0.32 -0.20 0.01 0.00 -0.37 0.00 0.00 57.07 56.83 1jzf s TYR 108 Cb -0.17 -1.24 0.01 0.00 -0.40 0.00 0.00 41.96 40.16 1jzf s TYR 108 CO 0.15 0.59 -0.05 -1.64 -1.57 0.00 0.00 175.55 173.03 1jzf s MET 109 N -3.53 0.53 0.06 -0.62 -1.94 0.16 -1.53 119.30 112.43 1jzf s MET 109 Ca 0.31 -0.15 0.04 0.00 -1.71 0.00 0.00 55.69 54.17 1jzf s MET 109 Cb -0.07 -0.54 -0.04 0.00 2.01 0.00 0.00 34.83 36.19 1jzf s MET 109 CO 0.20 0.05 -0.03 -0.59 -0.01 0.00 0.00 175.02 174.64 1jzf s PHE 110 N 0.22 2.95 0.07 -0.03 -0.71 -0.14 -1.90 117.98 118.45 1jzf s PHE 110 Ca -0.02 -0.03 -0.27 0.00 -1.04 0.00 0.00 56.93 55.57 1jzf s PHE 110 Cb -0.06 -1.56 0.09 0.00 -1.21 0.00 0.00 43.02 40.27 1jzf s PHE 110 CO -0.00 0.45 1.00 -0.59 -1.34 0.00 0.00 175.22 174.73 1jzf s PHE 111 N -1.20 -0.18 -0.14 3.49 -0.71 -0.19 -1.10 117.98 117.95 1jzf s PHE 111 Ca 0.22 -0.04 -0.08 0.00 -1.04 0.00 0.00 56.93 56.00 1jzf s PHE 111 Cb -0.11 0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 42.24 1jzf s PHE 111 CO 0.14 -0.64 0.13 0.00 -1.34 0.00 0.00 175.22 173.51 1jzf n THR 113 N 2.49 0.56 -1.97 0.00 -2.24 -1.26 -3.35 114.28 108.50 1jzf n THR 113 Ca -0.19 -0.74 -0.41 0.00 -2.27 0.00 0.00 64.05 60.45 1jzf n THR 113 Cb 0.54 0.79 -0.02 0.00 -2.10 0.00 0.00 70.33 69.54 1jzf n THR 113 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1jzf s PHE 114 N -1.44 2.93 -0.48 4.78 2.19 -1.26 -4.37 117.98 120.33 1jzf s PHE 114 Ca 0.40 1.10 -0.44 0.00 0.33 0.00 0.00 56.93 58.31 1jzf s PHE 114 Cb 0.22 -3.85 -0.19 0.00 -1.31 0.00 0.00 43.02 37.89 1jzf s PHE 114 CO 0.31 -2.66 1.68 -2.30 1.83 0.00 0.00 175.22 174.07 1jzf n PRO 115 N 1.73 0.00 0.00 10.12 -0.02 -1.26 -1.24 135.00 144.33 1jzf n PRO 115 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 1jzf n PRO 115 Cb 0.40 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 1jzf n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jzf n GLY 116 N 4.74 3.03 0.32 -1.23 0.00 -1.26 -4.90 105.19 105.89 1jzf n GLY 116 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1jzf n GLY 116 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1jzf h HIS 117 N 0.00 0.80 0.00 1.61 3.86 -1.45 -2.90 115.15 117.07 1jzf h HIS 117 Ca 0.00 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1jzf h HIS 117 Cb 0.00 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.22 1jzf h HIS 117 CO 0.00 0.58 0.00 -1.13 0.86 0.00 0.00 177.93 178.24 1jzf n SER 118 N -4.37 0.08 -0.05 2.45 3.41 -1.21 0.03 113.62 113.96 1jzf n SER 118 Ca 0.05 0.54 0.03 0.00 -0.26 0.00 0.00 58.87 59.23 1jzf n SER 118 Cb 0.12 -0.55 0.37 0.00 -0.26 0.00 0.00 64.21 63.89 1jzf n SER 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jzf h ALA 119 N 2.05 1.63 0.00 7.33 0.00 -1.86 -3.33 119.26 125.07 1jzf h ALA 119 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1jzf h ALA 119 Cb 0.03 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1jzf h ALA 119 CO 0.00 0.34 -0.95 1.28 0.00 0.00 0.00 179.25 179.92 1jzf n LEU 120 N -4.45 1.81 -4.37 0.00 4.32 -0.67 -4.91 117.00 108.74 1jzf n LEU 120 Ca 0.04 0.00 -0.43 0.00 -0.02 0.00 0.00 56.01 55.60 1jzf n LEU 120 Cb 0.07 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.87 1jzf n LEU 120 CO 0.36 0.30 1.81 0.23 -1.22 0.00 0.00 177.39 178.87 1jzf n MET 121 N -2.26 3.28 -3.47 3.23 2.81 0.11 -4.76 117.12 116.06 1jzf n MET 121 Ca 0.00 -3.48 -0.13 0.00 -1.81 0.00 0.00 57.70 52.28 1jzf n MET 121 Cb 0.47 -3.23 -0.03 0.00 -0.71 0.00 0.00 33.22 29.73 1jzf n MET 121 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 1jzf s LYS 122 N 2.59 1.21 0.16 0.03 -2.85 -1.26 -2.12 119.74 117.50 1jzf s LYS 122 Ca 0.47 -0.37 -0.24 0.00 -1.00 0.00 0.00 55.97 54.83 1jzf s LYS 122 Cb 0.03 0.56 0.07 0.00 -2.06 0.00 0.00 37.83 36.43 1jzf s LYS 122 CO 0.02 -0.50 1.01 0.20 0.10 0.00 0.00 175.35 176.18 1jzf s GLY 123 N -2.47 -0.11 0.23 0.59 0.00 -0.26 -4.83 107.32 100.47 1jzf s GLY 123 Ca -0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 44.72 44.66 1jzf s GLY 123 CO -0.09 0.86 0.46 -0.51 0.00 0.00 0.00 173.10 173.82 1jzf s THR 124 N -2.81 5.12 -0.03 0.90 -4.23 -0.71 -0.97 115.64 112.92 1jzf s THR 124 Ca 0.16 -0.13 -0.00 0.00 -1.18 0.00 0.00 61.69 60.54 1jzf s THR 124 Cb -0.01 -3.72 0.03 0.00 1.34 0.00 0.00 72.50 70.14 1jzf s THR 124 CO 0.03 -0.20 0.03 -0.22 -0.54 0.00 0.00 174.62 173.72 1jzf s LEU 125 N -3.31 0.91 0.02 4.79 0.20 -0.58 -0.36 118.68 120.35 1jzf s LEU 125 Ca 0.41 0.03 0.01 0.00 0.69 0.00 0.00 54.13 55.28 1jzf s LEU 125 Cb -0.11 -0.11 -0.02 0.00 -0.43 0.00 0.00 46.19 45.52 1jzf s LEU 125 CO 0.29 -0.15 -0.06 -0.89 -0.29 0.00 0.00 176.35 175.25 1jzf s THR 126 N 1.28 0.37 -0.30 3.68 2.01 -0.69 -2.09 115.64 119.91 1jzf s THR 126 Ca -0.06 -0.74 -0.17 0.00 0.31 0.00 0.00 61.69 61.03 1jzf s THR 126 Cb -0.13 -0.42 -0.02 0.00 0.01 0.00 0.00 72.50 71.94 1jzf s THR 126 CO -0.03 -0.25 0.46 -0.22 -0.69 0.00 0.00 174.62 173.89 1jzf s LEU 127 N -1.06 4.17 0.00 4.42 2.96 -1.26 -0.63 118.68 127.28 1jzf s LEU 127 Ca -0.07 0.21 0.00 0.00 -0.22 0.00 0.00 54.13 54.05 1jzf s LEU 127 Cb -0.07 -2.54 0.00 0.00 0.50 0.00 0.00 46.19 44.08 1jzf s LEU 127 CO -0.00 -0.33 0.26 0.29 -1.32 0.00 0.00 176.35 175.26