#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jzn n ASN 2 N 0.00 0.84 -4.26 6.41 3.02 -1.26 -5.02 115.26 115.00 1jzn n ASN 2 Ca 0.00 0.14 -0.14 0.00 -0.03 0.00 0.00 54.58 54.55 1jzn n ASN 2 Cb 0.00 0.21 -0.10 0.00 -0.61 0.00 0.00 39.78 39.28 1jzn n ASN 2 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jzn s PRO 4 N -3.99 1.56 0.48 0.00 0.02 -1.26 -4.91 135.00 126.90 1jzn s PRO 4 Ca 0.30 0.84 0.14 0.00 0.02 0.00 0.00 61.00 62.31 1jzn s PRO 4 Cb 0.07 -1.84 1.15 0.00 0.02 0.00 0.00 34.50 33.90 1jzn s PRO 4 CO 0.08 -2.04 2.09 1.25 -0.33 0.00 0.00 177.00 178.06 1jzn h LEU 5 N -1.40 0.16 -0.01 -5.54 5.85 -2.03 -2.23 115.31 110.11 1jzn h LEU 5 Ca -0.48 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1jzn h LEU 5 Cb 1.27 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1jzn h LEU 5 CO 0.55 0.11 -0.00 -0.67 -0.34 0.00 0.00 178.44 178.09 1jzn n ASP 6 N -4.50 0.01 -4.52 1.25 2.03 -1.26 -4.85 116.55 104.72 1jzn n ASP 6 Ca 0.01 -0.93 -0.26 0.00 0.52 0.00 0.00 54.79 54.13 1jzn n ASP 6 Cb 0.16 -0.02 -0.10 0.00 -0.72 0.00 0.00 41.12 40.44 1jzn n ASP 6 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 1jzn s TRP 7 N -2.05 2.49 -0.34 -0.67 0.52 -0.84 -4.89 118.94 113.16 1jzn s TRP 7 Ca 0.46 -0.28 -0.16 0.00 0.02 0.00 0.00 56.10 56.15 1jzn s TRP 7 Cb 0.22 -1.19 -0.01 0.00 -1.15 0.00 0.00 33.47 31.33 1jzn s TRP 7 CO 0.38 0.54 0.38 -1.17 0.02 0.00 0.00 176.95 177.10 1jzn s LEU 8 N -2.93 4.44 0.03 2.99 2.96 0.67 -4.77 118.68 122.06 1jzn s LEU 8 Ca 0.25 -0.22 -0.29 0.00 -0.22 0.00 0.00 54.13 53.65 1jzn s LEU 8 Cb -0.08 -2.37 -0.04 0.00 0.50 0.00 0.00 46.19 44.20 1jzn s LEU 8 CO 0.14 -0.36 0.93 -2.84 -1.32 0.00 0.00 176.35 172.90 1jzn s PRO 9 N 2.06 4.58 -0.18 0.98 0.02 -1.26 -0.71 135.00 140.49 1jzn s PRO 9 Ca 0.13 1.35 -0.08 0.00 0.02 0.00 0.00 61.00 62.42 1jzn s PRO 9 Cb -0.16 -3.43 0.08 0.00 0.02 0.00 0.00 34.50 31.00 1jzn s PRO 9 CO 0.12 0.06 0.41 1.41 -0.33 0.00 0.00 177.00 178.66 1jzn s MET 10 N 0.64 0.35 -1.59 5.54 1.75 -0.32 -4.96 119.30 120.71 1jzn s MET 10 Ca 0.48 0.92 -0.03 0.00 -1.25 0.00 0.00 55.69 55.81 1jzn s MET 10 Cb -0.21 0.16 0.03 0.00 2.84 0.00 0.00 34.83 37.65 1jzn s MET 10 CO 0.27 -0.21 0.10 0.09 -0.65 0.00 0.00 175.02 174.62 1jzn n ASN 11 N 4.89 0.50 0.00 1.11 5.03 -1.26 -1.16 115.26 124.37 1jzn n ASN 11 Ca -0.15 -1.26 0.00 0.00 0.87 0.00 0.00 54.58 54.04 1jzn n ASN 11 Cb 0.52 -1.66 0.00 0.00 -1.02 0.00 0.00 39.78 37.62 1jzn n ASN 11 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1jzn n GLY 12 N -2.35 2.05 3.72 7.41 0.00 -1.26 -5.04 105.19 109.72 1jzn n GLY 12 Ca -0.27 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 1jzn n GLY 12 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzn s LEU 13 N 0.00 2.62 -0.05 0.99 1.43 -0.31 -4.92 118.68 118.44 1jzn s LEU 13 Ca 0.00 -1.46 0.06 0.00 -1.03 0.00 0.00 54.13 51.69 1jzn s LEU 13 Cb 0.00 -0.90 -0.01 0.00 0.03 0.00 0.00 46.19 45.31 1jzn s LEU 13 CO 0.00 -0.70 -0.22 0.00 0.23 0.00 0.00 176.35 175.66 1jzn s TYR 15 N -0.10 2.10 -0.12 0.00 1.51 0.11 0.04 117.35 120.90 1jzn s TYR 15 Ca -0.03 -0.40 -0.06 0.00 -1.01 0.00 0.00 57.07 55.57 1jzn s TYR 15 Cb -0.13 -1.24 0.05 0.00 -0.11 0.00 0.00 41.96 40.52 1jzn s TYR 15 CO 0.03 0.13 0.28 0.21 -1.11 0.00 0.00 175.55 175.09 1jzn s LYS 16 N -1.29 0.25 -0.06 -0.62 2.20 -0.86 -0.24 119.74 119.13 1jzn s LYS 16 Ca 0.10 0.57 -0.23 0.00 -0.36 0.00 0.00 55.97 56.06 1jzn s LYS 16 Cb -0.10 -0.08 -0.04 0.00 -1.51 0.00 0.00 37.83 36.11 1jzn s LYS 16 CO 0.02 -0.15 0.67 -1.50 -0.36 0.00 0.00 175.35 174.03 1jzn s ILE 17 N 1.20 5.04 -0.16 5.43 1.10 -1.26 -1.39 121.20 131.16 1jzn s ILE 17 Ca -0.09 1.39 -0.04 0.00 -0.51 0.00 0.00 60.65 61.41 1jzn s ILE 17 Cb -0.09 -4.01 -0.03 0.00 0.15 0.00 0.00 42.46 38.48 1jzn s ILE 17 CO -0.09 0.28 -0.04 -0.36 -2.11 0.00 0.00 174.94 172.62 1jzn s PHE 18 N 0.67 3.02 -1.01 3.50 0.40 0.79 -5.00 117.98 120.34 1jzn s PHE 18 Ca 0.36 -0.32 0.26 0.00 -0.60 0.00 0.00 56.93 56.63 1jzn s PHE 18 Cb -0.18 -1.96 0.75 0.00 0.51 0.00 0.00 43.02 42.14 1jzn s PHE 18 CO 0.17 -0.05 1.58 0.09 0.70 0.00 0.00 175.22 177.72 1jzn n ASN 19 N 3.56 0.34 -4.77 1.36 3.02 -1.26 -1.37 115.26 116.14 1jzn n ASN 19 Ca -0.17 -0.02 -0.40 0.00 -0.03 0.00 0.00 54.58 53.95 1jzn n ASN 19 Cb 0.52 0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.69 1jzn n ASN 19 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1jzn s GLN 20 N -2.99 4.13 -0.10 3.52 -0.21 -1.26 -4.74 119.66 118.01 1jzn s GLN 20 Ca 0.12 2.33 -0.22 0.00 0.02 0.00 0.00 55.36 57.61 1jzn s GLN 20 Cb 0.18 -2.93 -0.04 0.00 1.00 0.00 0.00 33.01 31.23 1jzn s GLN 20 CO 0.64 -0.42 0.64 -0.51 -2.12 0.00 0.00 175.29 173.53 1jzn s LEU 21 N -2.12 4.28 0.13 2.90 1.43 -1.26 -4.31 118.68 119.74 1jzn s LEU 21 Ca 0.53 1.05 -0.12 0.00 -1.03 0.00 0.00 54.13 54.56 1jzn s LEU 21 Cb -0.42 -2.97 0.01 0.00 0.03 0.00 0.00 46.19 42.84 1jzn s LEU 21 CO 0.55 -0.12 0.32 -0.54 0.23 0.00 0.00 176.35 176.80 1jzn s LYS 22 N 0.94 1.06 0.89 1.70 1.02 -0.28 -4.83 119.74 120.25 1jzn s LYS 22 Ca 0.34 -0.92 -0.12 0.00 0.02 0.00 0.00 55.97 55.28 1jzn s LYS 22 Cb -0.17 0.41 0.12 0.00 -0.52 0.00 0.00 37.83 37.68 1jzn s LYS 22 CO 0.15 -0.39 1.10 0.95 -0.92 0.00 0.00 175.35 176.23 1jzn s THR 23 N -3.87 2.62 0.19 2.17 -4.23 -1.25 -1.65 115.64 109.62 1jzn s THR 23 Ca 0.08 0.20 -0.12 0.00 -1.18 0.00 0.00 61.69 60.67 1jzn s THR 23 Cb 0.03 -2.78 0.12 0.00 1.34 0.00 0.00 72.50 71.21 1jzn s THR 23 CO -0.07 -0.26 1.86 -0.25 -0.54 0.00 0.00 174.62 175.35 1jzn h TRP 24 N -1.48 0.84 -0.24 3.99 7.01 -1.17 -0.54 115.95 124.35 1jzn h TRP 24 Ca -0.50 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 60.51 1jzn h TRP 24 Cb 1.29 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 28.06 1jzn h TRP 24 CO 0.40 0.53 0.13 1.05 -2.79 0.00 0.00 178.44 177.76 1jzn h GLU 25 N 0.90 0.34 -0.05 2.65 4.11 -1.93 -0.43 114.58 120.16 1jzn h GLU 25 Ca 0.24 -0.04 -0.06 0.00 0.07 0.00 0.00 59.36 59.57 1jzn h GLU 25 Cb -0.09 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 1jzn h GLU 25 CO -0.05 0.32 -0.26 -0.44 0.07 0.00 0.00 179.01 178.65 1jzn h ASP 26 N 0.27 0.09 -0.07 3.06 3.32 -1.89 -1.43 116.42 119.77 1jzn h ASP 26 Ca 0.08 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.08 1jzn h ASP 26 Cb 0.08 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 1jzn h ASP 26 CO -0.01 0.35 -0.10 0.00 -1.72 0.00 0.00 179.24 177.76 1jzn h ALA 27 N 1.66 0.11 -0.34 3.45 0.00 -0.67 -0.33 119.26 123.13 1jzn h ALA 27 Ca 0.01 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.64 1jzn h ALA 27 Cb 0.50 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1jzn h ALA 27 CO 0.04 -0.05 0.15 1.49 0.00 0.00 0.00 179.25 180.88 1jzn h GLU 28 N -0.26 0.30 -0.30 0.00 4.57 -0.85 -1.56 114.58 116.48 1jzn h GLU 28 Ca 0.01 -0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 1jzn h GLU 28 Cb 0.64 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.14 1jzn h GLU 28 CO 0.02 0.20 -0.15 0.52 -1.18 0.00 0.00 179.01 178.43 1jzn h MET 29 N 0.31 0.52 -0.11 1.92 2.86 -1.27 -1.77 114.93 117.38 1jzn h MET 29 Ca 0.15 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1jzn h MET 29 Cb 0.09 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 1jzn h MET 29 CO -0.12 0.66 0.07 0.35 1.06 0.00 0.00 176.91 178.92 1jzn h PHE 30 N 0.48 0.15 -0.57 -0.22 3.04 -0.58 -0.80 116.94 118.45 1jzn h PHE 30 Ca 0.08 -0.00 0.04 0.00 3.98 0.00 0.00 57.97 62.07 1jzn h PHE 30 Cb 0.54 -0.05 -0.04 0.00 2.56 0.00 0.00 35.95 38.95 1jzn h PHE 30 CO 0.02 0.14 0.32 0.00 -2.02 0.00 0.00 178.31 176.77 1jzn h ARG 32 N 0.62 1.13 -0.01 0.00 3.08 -1.10 -2.17 114.38 115.94 1jzn h ARG 32 Ca 0.24 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1jzn h ARG 32 Cb 0.09 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 29.91 1jzn h ARG 32 CO -0.13 0.82 -0.04 1.63 -1.07 0.00 0.00 179.97 181.18 1jzn n LYS 33 N -4.42 1.27 -0.11 0.04 4.76 -0.32 -3.95 118.16 115.43 1jzn n LYS 33 Ca 0.08 -0.56 -0.10 0.00 -2.87 0.00 0.00 58.31 54.86 1jzn n LYS 33 Cb 0.08 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 31.75 1jzn n LYS 33 CO 0.00 0.00 0.00 -0.92 -1.37 0.00 0.00 177.40 175.11 1jzn h TYR 34 N 1.36 0.57 -1.84 2.13 5.03 -0.23 -3.47 116.97 120.52 1jzn h TYR 34 Ca 0.00 -0.08 0.14 0.00 2.58 0.00 0.00 58.73 61.37 1jzn h TYR 34 Cb 0.35 -0.15 -0.19 0.00 1.55 0.00 0.00 36.73 38.29 1jzn h TYR 34 CO 0.00 0.62 0.60 -1.59 -1.32 0.00 0.00 178.16 176.47 1jzn s LYS 35 N -5.15 0.60 0.30 1.82 -2.85 -1.25 -5.12 119.74 108.08 1jzn s LYS 35 Ca -0.13 -0.12 -0.30 0.00 -1.00 0.00 0.00 55.97 54.42 1jzn s LYS 35 Cb 0.09 0.28 -0.11 0.00 -2.06 0.00 0.00 37.83 36.03 1jzn s LYS 35 CO 0.76 -0.24 1.55 -2.14 0.10 0.00 0.00 175.35 175.37 1jzn s PRO 36 N -2.33 4.15 0.00 1.78 0.02 -1.26 -3.64 135.00 133.72 1jzn s PRO 36 Ca 0.04 2.52 0.00 0.00 0.02 0.00 0.00 61.00 63.58 1jzn s PRO 36 Cb -0.01 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.48 1jzn s PRO 36 CO -0.05 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.46 1jzn n GLY 37 N 1.92 1.31 3.22 0.52 0.00 -1.26 -4.75 105.19 106.15 1jzn n GLY 37 Ca 0.07 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.58 1jzn n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jzn s HIS 39 N -2.43 0.21 0.70 0.00 3.76 -0.38 -3.71 115.29 113.44 1jzn s HIS 39 Ca 0.09 -0.67 -0.15 0.00 -0.15 0.00 0.00 55.06 54.18 1jzn s HIS 39 Cb -0.03 0.50 0.02 0.00 1.11 0.00 0.00 32.58 34.18 1jzn s HIS 39 CO 0.02 -1.24 1.15 -0.51 -0.85 0.00 0.00 174.74 173.30 1jzn s LEU 40 N -3.03 3.33 0.39 0.89 1.43 -1.26 0.03 118.68 120.47 1jzn s LEU 40 Ca 0.18 2.15 -0.25 0.00 -1.03 0.00 0.00 54.13 55.18 1jzn s LEU 40 Cb -0.04 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.53 1jzn s LEU 40 CO 0.10 -1.97 1.16 0.00 0.23 0.00 0.00 176.35 175.88 1jzn s ALA 41 N -2.21 3.17 0.15 4.21 0.00 -0.20 -4.21 121.76 122.67 1jzn s ALA 41 Ca 0.70 0.96 0.08 0.00 0.00 0.00 0.00 51.96 53.70 1jzn s ALA 41 Cb -0.24 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 1jzn s ALA 41 CO 0.44 -0.50 -0.09 -1.54 0.00 0.00 0.00 175.76 174.07 1jzn s SER 42 N -1.13 4.34 0.00 0.00 1.04 -1.26 -0.66 113.70 116.03 1jzn s SER 42 Ca 0.56 -0.50 0.06 0.00 0.48 0.00 0.00 55.95 56.56 1jzn s SER 42 Cb -0.30 -0.78 -0.02 0.00 0.10 0.00 0.00 66.02 65.02 1jzn s SER 42 CO 0.38 0.13 -0.20 -0.36 0.98 0.00 0.00 173.24 174.17 1jzn s PHE 43 N -1.52 1.77 0.00 5.02 0.40 -1.26 -5.05 117.98 117.34 1jzn s PHE 43 Ca 0.24 -0.35 0.00 0.00 -0.60 0.00 0.00 56.93 56.22 1jzn s PHE 43 Cb -0.10 -1.12 0.00 0.00 0.51 0.00 0.00 43.02 42.32 1jzn s PHE 43 CO 0.15 0.01 0.10 0.72 0.70 0.00 0.00 175.22 176.90 1jzn n HIS 44 N 2.36 0.00 -3.58 0.36 8.25 -1.26 -4.59 115.22 116.76 1jzn n HIS 44 Ca -0.16 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.16 1jzn n HIS 44 Cb 0.53 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.59 1jzn n HIS 44 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1jzn s ARG 45 N -0.09 1.02 0.35 -0.41 1.70 -1.26 -4.68 118.95 115.57 1jzn s ARG 45 Ca 0.00 -0.20 0.04 0.00 -0.47 0.00 0.00 55.73 55.10 1jzn s ARG 45 Cb 0.00 0.47 0.68 0.00 -0.57 0.00 0.00 34.95 35.53 1jzn s ARG 45 CO 0.00 -0.36 1.96 -0.92 -1.08 0.00 0.00 175.30 174.89 1jzn h TYR 46 N 2.84 0.83 -0.81 5.89 3.20 -1.99 -1.97 116.97 124.96 1jzn h TYR 46 Ca -0.30 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.64 1jzn h TYR 46 Cb 1.21 -0.27 -0.06 0.00 1.54 0.00 0.00 36.73 39.15 1jzn h TYR 46 CO 0.37 0.45 0.50 0.78 -1.64 0.00 0.00 178.16 178.62 1jzn h GLY 47 N 0.83 1.20 1.00 1.82 0.00 -1.99 -1.57 103.07 104.37 1jzn h GLY 47 Ca 0.32 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 1jzn h GLY 47 CO -0.10 0.27 0.40 0.83 0.00 0.00 0.00 176.54 177.94 1jzn h GLU 48 N 0.93 0.96 -0.41 4.80 5.08 -1.78 0.16 114.58 124.33 1jzn h GLU 48 Ca 0.35 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1jzn h GLU 48 Cb 0.13 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1jzn h GLU 48 CO -0.16 0.70 0.25 0.77 -1.00 0.00 0.00 179.01 179.57 1jzn h SER 49 N 0.95 0.48 -0.32 1.42 0.02 -1.24 0.13 113.55 115.00 1jzn h SER 49 Ca 0.25 -0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 61.11 1jzn h SER 49 Cb 0.00 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1jzn h SER 49 CO -0.04 0.38 0.01 -0.07 -1.14 0.00 0.00 176.83 175.97 1jzn h LEU 50 N 0.54 0.54 -0.35 5.07 3.38 -0.96 0.36 115.31 123.89 1jzn h LEU 50 Ca 0.15 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 1jzn h LEU 50 Cb -0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1jzn h LEU 50 CO -0.03 0.71 0.06 -0.08 0.09 0.00 0.00 178.44 179.19 1jzn h GLU 51 N 0.36 0.57 -0.57 1.13 4.81 -0.52 -2.51 114.58 117.84 1jzn h GLU 51 Ca 0.09 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 1jzn h GLU 51 Cb 0.42 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1jzn h GLU 51 CO 0.01 0.64 0.19 0.82 -0.73 0.00 0.00 179.01 179.94 1jzn h ILE 52 N 0.41 1.23 -0.54 2.32 1.08 -0.72 -1.21 117.51 120.07 1jzn h ILE 52 Ca 0.11 -0.77 0.05 0.00 -0.39 0.00 0.00 64.86 63.85 1jzn h ILE 52 Cb 0.34 0.67 -0.05 0.00 -3.07 0.00 0.00 36.82 34.71 1jzn h ILE 52 CO 0.01 0.29 0.27 0.00 -0.69 0.00 0.00 178.15 178.03 1jzn h ALA 53 N 1.05 0.70 -0.32 1.87 0.00 -0.80 -0.17 119.26 121.59 1jzn h ALA 53 Ca 0.19 0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.96 1jzn h ALA 53 Cb 0.26 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1jzn h ALA 53 CO -0.01 -0.08 -0.44 1.49 0.00 0.00 0.00 179.25 180.21 1jzn h GLU 54 N 0.52 0.87 -0.30 0.00 4.81 -1.33 -2.36 114.58 116.79 1jzn h GLU 54 Ca 0.24 -0.50 0.03 0.00 -0.13 0.00 0.00 59.36 59.00 1jzn h GLU 54 Cb 0.17 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1jzn h GLU 54 CO -0.18 1.14 0.12 -0.92 -0.73 0.00 0.00 179.01 178.45 1jzn h TYR 55 N 0.65 0.23 -0.60 0.92 -0.00 -0.81 -1.30 116.97 116.05 1jzn h TYR 55 Ca 0.04 0.01 -0.04 0.00 -0.00 0.00 0.00 58.73 58.74 1jzn h TYR 55 Cb 1.04 -0.06 -0.03 0.00 -0.00 0.00 0.00 36.73 37.69 1jzn h TYR 55 CO 0.07 0.11 0.20 0.82 -0.00 0.00 0.00 178.16 179.37 1jzn h ILE 56 N 0.27 1.24 -1.00 1.81 2.04 -1.00 -0.23 117.51 120.64 1jzn h ILE 56 Ca 0.13 -0.80 0.06 0.00 1.00 0.00 0.00 64.86 65.25 1jzn h ILE 56 Cb 0.08 0.62 -0.07 0.00 -0.74 0.00 0.00 36.82 36.71 1jzn h ILE 56 CO -0.12 0.31 0.65 0.28 0.00 0.00 0.00 178.15 179.27 1jzn h SER 57 N 0.86 1.05 0.13 1.72 0.02 -1.16 0.67 113.55 116.84 1jzn h SER 57 Ca 0.20 0.01 -0.24 0.00 -0.84 0.00 0.00 61.79 60.91 1jzn h SER 57 Cb 0.27 -0.22 0.01 0.00 0.14 0.00 0.00 62.40 62.60 1jzn h SER 57 CO -0.01 0.67 -0.97 0.44 -1.14 0.00 0.00 176.83 175.82 1jzn h ASP 58 N 1.19 0.75 -0.23 3.07 3.32 -0.78 -3.36 116.42 120.38 1jzn h ASP 58 Ca 0.43 -0.59 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1jzn h ASP 58 Cb 0.14 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.47 1jzn h ASP 58 CO -0.17 1.39 0.00 -1.22 -1.72 0.00 0.00 179.24 177.52 1jzn n TYR 59 N -3.82 0.29 -3.66 4.55 4.02 -0.14 -4.84 117.16 113.56 1jzn n TYR 59 Ca -0.09 -0.22 -0.29 0.00 -0.01 0.00 0.00 57.90 57.29 1jzn n TYR 59 Cb 0.85 -0.01 -0.15 0.00 -0.02 0.00 0.00 39.34 40.01 1jzn n TYR 59 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1jzn s HIS 60 N -1.15 1.03 0.41 -0.72 5.65 0.23 -5.00 115.29 115.73 1jzn s HIS 60 Ca 0.24 -1.23 -0.02 0.00 0.25 0.00 0.00 55.06 54.30 1jzn s HIS 60 Cb 0.14 -1.27 -0.03 0.00 -1.18 0.00 0.00 32.58 30.24 1jzn s HIS 60 CO 0.20 -0.81 0.65 0.15 -0.65 0.00 0.00 174.74 174.29 1jzn s LYS 61 N 1.85 3.51 0.00 2.88 -0.14 -1.26 -4.49 119.74 122.10 1jzn s LYS 61 Ca 0.08 -0.10 0.00 0.00 -1.36 0.00 0.00 55.97 54.59 1jzn s LYS 61 Cb -0.17 -2.54 0.00 0.00 -1.68 0.00 0.00 37.83 33.45 1jzn s LYS 61 CO -0.26 -0.01 0.00 0.41 -0.76 0.00 0.00 175.35 174.73 1jzn n GLY 62 N -1.99 1.22 1.28 -3.33 0.00 -1.26 -4.78 105.19 96.34 1jzn n GLY 62 Ca -0.02 -2.11 0.11 0.00 0.00 0.00 0.00 46.02 44.00 1jzn n GLY 62 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1jzn n GLN 63 N 0.39 2.69 -2.29 1.61 6.02 -1.26 -5.00 117.38 119.54 1jzn n GLN 63 Ca 0.00 -2.57 -0.39 0.00 -0.01 0.00 0.00 57.00 54.04 1jzn n GLN 63 Cb 0.00 -1.54 -0.02 0.00 1.02 0.00 0.00 30.24 29.69 1jzn n GLN 63 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1jzn s GLU 64 N -1.09 4.13 0.79 -1.09 0.41 -1.26 -4.73 118.70 115.86 1jzn s GLU 64 Ca 0.46 1.87 -0.11 0.00 -0.41 0.00 0.00 54.97 56.78 1jzn s GLU 64 Cb 0.24 -2.75 0.07 0.00 -1.78 0.00 0.00 34.13 29.91 1jzn s GLU 64 CO 0.32 -0.26 1.15 -0.80 -0.49 0.00 0.00 175.26 175.18 1jzn s ASN 65 N -1.05 4.63 -0.09 -0.19 0.01 -1.26 -4.62 114.94 112.37 1jzn s ASN 65 Ca 0.55 0.77 0.02 0.00 -0.71 0.00 0.00 52.86 53.49 1jzn s ASN 65 Cb -0.32 -1.31 0.01 0.00 0.41 0.00 0.00 41.25 40.05 1jzn s ASN 65 CO 0.40 -1.81 -0.14 -0.69 -1.51 0.00 0.00 177.10 173.35 1jzn s VAL 66 N -3.51 1.34 0.33 1.60 1.01 -0.91 -1.02 120.40 119.23 1jzn s VAL 66 Ca 0.61 -0.56 -0.28 0.00 0.00 0.00 0.00 61.98 61.76 1jzn s VAL 66 Cb -0.11 -1.23 -0.09 0.00 0.00 0.00 0.00 36.38 34.95 1jzn s VAL 66 CO 0.49 0.41 1.15 0.26 0.00 0.00 0.00 175.10 177.41 1jzn s TRP 67 N 0.93 3.32 0.36 5.22 0.23 0.75 0.26 118.94 130.00 1jzn s TRP 67 Ca -0.09 1.60 0.03 0.00 -2.03 0.00 0.00 56.10 55.62 1jzn s TRP 67 Cb -0.15 -3.38 -0.04 0.00 0.03 0.00 0.00 33.47 29.93 1jzn s TRP 67 CO -0.00 -1.01 0.10 0.96 0.96 0.00 0.00 176.95 177.96 1jzn s ILE 68 N -1.27 0.83 -1.60 2.03 -4.36 -0.95 -2.17 121.20 113.71 1jzn s ILE 68 Ca 0.50 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.89 1jzn s ILE 68 Cb -0.32 -2.56 0.00 0.00 1.25 0.00 0.00 42.46 40.83 1jzn s ILE 68 CO 0.42 0.00 0.72 0.61 0.24 0.00 0.00 174.94 176.92 1jzn n GLY 69 N -0.77 0.01 3.79 6.27 0.00 0.16 -4.60 105.19 110.04 1jzn n GLY 69 Ca -0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 1jzn n GLY 69 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1jzn s LEU 70 N -0.60 4.38 0.09 0.99 2.96 -1.26 -1.41 118.68 123.84 1jzn s LEU 70 Ca 0.00 0.84 -0.21 0.00 -0.22 0.00 0.00 54.13 54.54 1jzn s LEU 70 Cb 0.00 -2.57 0.05 0.00 0.50 0.00 0.00 46.19 44.17 1jzn s LEU 70 CO 0.00 0.21 0.51 0.00 -1.32 0.00 0.00 176.35 175.74 1jzn s ARG 71 N -0.39 1.10 -0.99 1.98 3.03 -0.81 -1.82 118.95 121.05 1jzn s ARG 71 Ca 0.23 -0.41 -0.05 0.00 2.03 0.00 0.00 55.73 57.52 1jzn s ARG 71 Cb -0.16 0.50 0.25 0.00 -1.03 0.00 0.00 34.95 34.51 1jzn s ARG 71 CO 0.11 -0.43 0.92 0.34 -1.13 0.00 0.00 175.30 175.11 1jzn s ASP 72 N -2.37 6.58 0.24 -2.89 2.15 0.30 -1.43 116.67 119.26 1jzn s ASP 72 Ca -0.02 -3.66 -0.05 0.00 0.43 0.00 0.00 52.55 49.25 1jzn s ASP 72 Cb -0.00 -2.04 0.25 0.00 -0.30 0.00 0.00 42.92 40.83 1jzn s ASP 72 CO -0.07 -0.23 1.83 0.50 -0.17 0.00 0.00 175.17 177.03 1jzn h LYS 73 N 6.32 1.13 -0.00 4.34 3.64 -1.85 -2.33 116.57 127.82 1jzn h LYS 73 Ca 0.17 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1jzn h LYS 73 Cb 0.84 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1jzn h LYS 73 CO 0.92 0.89 -0.08 1.63 -2.27 0.00 0.00 179.45 180.54 1jzn n LYS 74 N -4.30 0.36 -1.93 1.90 5.02 -1.26 -4.93 118.16 113.01 1jzn n LYS 74 Ca 0.07 -0.07 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 1jzn n LYS 74 Cb 0.16 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 1jzn n LYS 74 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1jzn n LYS 75 N -1.26 -1.35 -1.96 1.97 5.02 -0.88 -4.90 118.16 114.81 1jzn n LYS 75 Ca 0.12 1.01 -0.06 0.00 -2.02 0.00 0.00 58.31 57.35 1jzn n LYS 75 Cb 0.28 -5.39 0.06 0.00 -0.02 0.00 0.00 35.03 29.97 1jzn n LYS 75 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1jzn n ASP 76 N -1.18 2.61 -2.02 4.39 5.75 -1.26 -4.94 116.55 119.89 1jzn n ASP 76 Ca -0.20 -2.91 -0.14 0.00 -0.01 0.00 0.00 54.79 51.53 1jzn n ASP 76 Cb 0.63 -0.41 0.02 0.00 -1.03 0.00 0.00 41.12 40.33 1jzn n ASP 76 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1jzn n PHE 77 N -0.54 -1.27 -3.57 2.11 3.01 -1.26 -4.98 117.46 110.96 1jzn n PHE 77 Ca 0.21 0.34 -0.40 0.00 1.01 0.00 0.00 57.45 58.62 1jzn n PHE 77 Cb 0.90 -3.25 -0.06 0.00 -0.01 0.00 0.00 39.48 37.05 1jzn n PHE 77 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1jzn s SER 78 N -2.83 5.89 -0.18 4.37 0.01 -1.26 -5.06 113.70 114.64 1jzn s SER 78 Ca 0.20 -2.97 -0.27 0.00 1.31 0.00 0.00 55.95 54.22 1jzn s SER 78 Cb -0.09 -1.99 -0.01 0.00 0.21 0.00 0.00 66.02 64.15 1jzn s SER 78 CO 0.25 -0.40 0.94 0.26 0.41 0.00 0.00 173.24 174.69 1jzn s TRP 79 N -0.24 3.41 0.11 2.43 0.52 -1.26 -4.14 118.94 119.77 1jzn s TRP 79 Ca 0.19 1.39 0.08 0.00 0.02 0.00 0.00 56.10 57.78 1jzn s TRP 79 Cb -0.15 -3.14 -0.04 0.00 -1.15 0.00 0.00 33.47 29.00 1jzn s TRP 79 CO -0.06 -0.32 -0.19 -1.21 0.02 0.00 0.00 176.95 175.18 1jzn s GLU 80 N 2.49 1.10 0.05 4.98 2.02 -0.51 -4.83 118.70 124.01 1jzn s GLU 80 Ca 0.42 -1.19 -0.15 0.00 0.02 0.00 0.00 54.97 54.07 1jzn s GLU 80 Cb -0.16 -1.26 -0.06 0.00 0.10 0.00 0.00 34.13 32.75 1jzn s GLU 80 CO 0.11 0.28 0.47 -1.58 0.02 0.00 0.00 175.26 174.56 1jzn s TRP 81 N -1.45 3.71 0.47 1.61 0.52 -1.26 -1.93 118.94 120.61 1jzn s TRP 81 Ca 0.07 1.05 0.31 0.00 0.02 0.00 0.00 56.10 57.55 1jzn s TRP 81 Cb -0.09 -2.34 1.68 0.00 -1.15 0.00 0.00 33.47 31.58 1jzn s TRP 81 CO 0.04 0.58 2.16 1.79 0.02 0.00 0.00 176.95 181.54 1jzn h THR 82 N 3.42 0.44 -0.20 2.01 1.35 -1.55 -1.79 112.91 116.59 1jzn h THR 82 Ca -0.50 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 1jzn h THR 82 Cb 1.21 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 1jzn h THR 82 CO 0.63 0.06 0.00 -0.90 -0.25 0.00 0.00 175.52 175.06 1jzn n ASP 83 N -3.58 1.17 -0.27 5.36 5.75 -1.26 -4.89 116.55 118.83 1jzn n ASP 83 Ca -0.02 -1.93 -0.03 0.00 -0.01 0.00 0.00 54.79 52.79 1jzn n ASP 83 Cb 0.18 -0.14 -0.01 0.00 -1.03 0.00 0.00 41.12 40.12 1jzn n ASP 83 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1jzn n ARG 84 N 0.11 -1.35 -1.58 0.11 1.74 -0.67 -5.00 116.66 110.03 1jzn n ARG 84 Ca 0.09 0.51 -0.29 0.00 -0.77 0.00 0.00 57.85 57.39 1jzn n ARG 84 Cb 0.20 -4.61 0.12 0.00 -1.02 0.00 0.00 32.46 27.15 1jzn n ARG 84 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1jzn s SER 85 N -2.19 3.79 0.39 0.55 1.04 -1.26 -4.98 113.70 111.03 1jzn s SER 85 Ca 0.00 1.00 -0.25 0.00 0.48 0.00 0.00 55.95 57.18 1jzn s SER 85 Cb 0.00 -1.60 -0.09 0.00 0.10 0.00 0.00 66.02 64.43 1jzn s SER 85 CO 0.00 -2.38 1.13 0.00 0.98 0.00 0.00 173.24 172.98 1jzn n THR 87 N 0.16 4.45 0.28 0.00 -1.04 -1.26 -4.66 114.28 112.21 1jzn n THR 87 Ca 0.04 -4.94 0.09 0.00 -2.04 0.00 0.00 64.05 57.20 1jzn n THR 87 Cb 0.47 -2.44 0.15 0.00 -1.82 0.00 0.00 70.33 66.70 1jzn n THR 87 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1jzn n ASP 88 N 4.20 2.95 -3.69 8.00 3.85 -1.26 -4.95 116.55 125.64 1jzn n ASP 88 Ca 0.33 -1.86 -0.11 0.00 -0.71 0.00 0.00 54.79 52.44 1jzn n ASP 88 Cb 0.40 -0.17 -0.10 0.00 -1.35 0.00 0.00 41.12 39.90 1jzn n ASP 88 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.20 175.72 1jzn s TYR 89 N -1.27 -0.65 0.02 2.11 5.04 -1.26 -5.01 117.35 116.33 1jzn s TYR 89 Ca 0.28 1.42 0.01 0.00 -2.44 0.00 0.00 57.07 56.34 1jzn s TYR 89 Cb 0.17 0.29 -0.02 0.00 0.35 0.00 0.00 41.96 42.76 1jzn s TYR 89 CO 0.24 -0.34 -0.04 -0.51 -1.34 0.00 0.00 175.55 173.55 1jzn s LEU 90 N 1.06 2.16 -0.42 6.97 1.43 -1.26 -4.85 118.68 123.77 1jzn s LEU 90 Ca -0.06 -0.36 0.08 0.00 -1.03 0.00 0.00 54.13 52.75 1jzn s LEU 90 Cb -0.06 -0.06 0.26 0.00 0.03 0.00 0.00 46.19 46.35 1jzn s LEU 90 CO -0.09 -0.16 0.68 1.07 0.23 0.00 0.00 176.35 178.08 1jzn n THR 91 N 2.04 -0.41 -2.26 5.49 5.66 -1.26 -5.10 114.28 118.45 1jzn n THR 91 Ca -0.20 -3.14 -0.37 0.00 -3.05 0.00 0.00 64.05 57.30 1jzn n THR 91 Cb 0.56 -0.60 -0.01 0.00 -1.55 0.00 0.00 70.33 68.74 1jzn n THR 91 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 175.07 172.28 1jzn s TRP 92 N -0.60 2.82 0.91 1.09 0.52 -1.26 -1.34 118.94 121.08 1jzn s TRP 92 Ca 0.34 1.54 -0.13 0.00 0.02 0.00 0.00 56.10 57.87 1jzn s TRP 92 Cb 0.21 -3.36 0.14 0.00 -1.15 0.00 0.00 33.47 29.31 1jzn s TRP 92 CO -0.15 -1.53 1.15 0.34 0.02 0.00 0.00 176.95 176.78 1jzn s ASP 93 N -1.46 3.55 0.01 2.95 2.15 0.91 -4.61 116.67 120.17 1jzn s ASP 93 Ca 0.66 0.90 -0.36 0.00 0.43 0.00 0.00 52.55 54.18 1jzn s ASP 93 Cb -0.27 -1.44 -0.15 0.00 -0.30 0.00 0.00 42.92 40.76 1jzn s ASP 93 CO 0.33 -2.52 1.55 1.17 -0.17 0.00 0.00 175.17 175.53 1jzn n LYS 94 N -3.73 1.51 -2.23 4.34 4.81 -1.26 -1.72 118.16 119.88 1jzn n LYS 94 Ca 0.07 0.55 -0.19 0.00 -0.87 0.00 0.00 58.31 57.87 1jzn n LYS 94 Cb 0.59 -2.25 -0.02 0.00 0.02 0.00 0.00 35.03 33.37 1jzn n LYS 94 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1jzn n ASN 95 N 3.83 -5.46 -4.40 3.14 5.03 -1.26 -5.01 115.26 111.13 1jzn n ASN 95 Ca 0.20 0.06 -0.26 0.00 0.87 0.00 0.00 54.58 55.46 1jzn n ASN 95 Cb 0.21 -4.53 -0.12 0.00 -1.02 0.00 0.00 39.78 34.33 1jzn n ASN 95 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1jzn s GLN 96 N -4.73 1.44 0.38 3.52 -1.52 -0.70 -4.23 119.66 113.82 1jzn s GLN 96 Ca 0.00 -1.48 -0.18 0.00 -1.95 0.00 0.00 55.36 51.75 1jzn s GLN 96 Cb 0.00 -1.72 -0.10 0.00 -0.22 0.00 0.00 33.01 30.97 1jzn s GLN 96 CO 0.00 0.37 0.85 -1.25 -0.25 0.00 0.00 175.29 175.01 1jzn s PRO 97 N -2.64 4.13 0.00 2.91 0.04 -1.26 -4.63 135.00 133.55 1jzn s PRO 97 Ca 0.19 0.92 0.00 0.00 0.04 0.00 0.00 61.00 62.14 1jzn s PRO 97 Cb -0.08 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.15 1jzn s PRO 97 CO 0.09 0.07 0.36 -0.40 0.04 0.00 0.00 177.00 177.16 1jzn n ASP 98 N -0.47 0.71 -4.16 6.66 5.75 -1.26 -5.01 116.55 118.77 1jzn n ASP 98 Ca 0.05 -1.04 -0.31 0.00 -0.01 0.00 0.00 54.79 53.48 1jzn n ASP 98 Cb 0.53 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.58 1jzn n ASP 98 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1jzn n HIS 99 N -0.02 -1.53 -1.66 2.11 8.25 -1.26 -4.74 115.22 116.38 1jzn n HIS 99 Ca 0.00 0.72 -0.56 0.00 -0.26 0.00 0.00 57.72 57.62 1jzn n HIS 99 Cb 0.10 -3.15 -0.07 0.00 1.12 0.00 0.00 29.99 27.99 1jzn n HIS 99 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1jzn n TYR 100 N -4.42 1.76 -2.06 4.41 -0.00 -1.26 -0.68 117.16 114.91 1jzn n TYR 100 Ca -0.19 0.64 -0.10 0.00 -0.00 0.00 0.00 57.90 58.25 1jzn n TYR 100 Cb 0.62 -2.38 -0.02 0.00 -0.00 0.00 0.00 39.34 37.57 1jzn n TYR 100 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 1jzn n GLN 101 N 4.01 -1.96 -4.02 2.98 6.02 -1.26 -2.31 117.38 120.83 1jzn n GLN 101 Ca 0.23 0.54 -0.31 0.00 -0.01 0.00 0.00 57.00 57.46 1jzn n GLN 101 Cb 0.14 -4.99 -0.00 0.00 1.02 0.00 0.00 30.24 26.41 1jzn n GLN 101 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1jzn n ASN 102 N -1.22 -3.10 0.00 1.08 3.02 0.15 -4.85 115.26 110.34 1jzn n ASN 102 Ca -0.12 -0.91 0.00 0.00 -0.03 0.00 0.00 54.58 53.52 1jzn n ASN 102 Cb 0.51 -3.33 0.00 0.00 -0.61 0.00 0.00 39.78 36.34 1jzn n ASN 102 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1jzn n LYS 103 N -4.49 0.15 -3.81 3.52 2.85 -0.98 -5.04 118.16 110.37 1jzn n LYS 103 Ca -0.04 -0.41 -0.37 0.00 -1.05 0.00 0.00 58.31 56.44 1jzn n LYS 103 Cb 0.56 -0.66 -0.13 0.00 -0.65 0.00 0.00 35.03 34.14 1jzn n LYS 103 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1jzn s GLU 104 N -0.12 2.50 0.00 -1.58 2.02 -1.25 -4.11 118.70 116.16 1jzn s GLU 104 Ca 0.00 -1.27 0.00 0.00 0.02 0.00 0.00 54.97 53.72 1jzn s GLU 104 Cb 0.00 -3.37 0.00 0.00 0.10 0.00 0.00 34.13 30.86 1jzn s GLU 104 CO 0.00 -0.69 0.20 1.19 0.02 0.00 0.00 175.26 175.99 1jzn n PHE 105 N 4.73 0.00 -4.42 1.61 3.01 -1.07 -4.58 117.46 116.74 1jzn n PHE 105 Ca -0.12 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.04 1jzn n PHE 105 Cb 0.44 0.00 -0.12 0.00 -0.01 0.00 0.00 39.48 39.79 1jzn n PHE 105 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1jzn s VAL 107 N -1.07 4.54 0.16 0.00 1.01 -0.76 0.80 120.40 125.09 1jzn s VAL 107 Ca 0.16 -0.14 0.10 0.00 0.00 0.00 0.00 61.98 62.10 1jzn s VAL 107 Cb -0.10 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 1jzn s VAL 107 CO 0.08 0.52 -0.21 -1.83 0.00 0.00 0.00 175.10 173.66 1jzn s GLU 108 N -0.12 1.34 -0.04 2.72 -1.05 -0.22 -2.25 118.70 119.08 1jzn s GLU 108 Ca 0.06 -1.41 -0.24 0.00 -0.15 0.00 0.00 54.97 53.23 1jzn s GLU 108 Cb -0.12 -1.54 -0.04 0.00 -0.44 0.00 0.00 34.13 31.99 1jzn s GLU 108 CO 0.02 0.33 0.73 -0.51 0.95 0.00 0.00 175.26 176.77 1jzn s LEU 109 N -2.52 4.35 -0.34 1.83 1.43 0.14 -1.44 118.68 122.14 1jzn s LEU 109 Ca 0.16 1.27 -0.25 0.00 -1.03 0.00 0.00 54.13 54.28 1jzn s LEU 109 Cb -0.07 -3.14 0.01 0.00 0.03 0.00 0.00 46.19 43.02 1jzn s LEU 109 CO 0.07 -0.09 0.89 -0.69 0.23 0.00 0.00 176.35 176.76 1jzn s VAL 110 N 0.59 4.66 0.25 -1.59 1.01 -0.21 -2.14 120.40 122.97 1jzn s VAL 110 Ca 0.38 1.25 -0.04 0.00 0.00 0.00 0.00 61.98 63.57 1jzn s VAL 110 Cb -0.19 -4.27 0.22 0.00 0.00 0.00 0.00 36.38 32.14 1jzn s VAL 110 CO 0.20 -0.41 1.75 -1.28 0.00 0.00 0.00 175.10 175.36 1jzn h SER 111 N 8.28 0.42 0.21 3.32 0.87 -1.85 -1.11 113.55 123.70 1jzn h SER 111 Ca -0.23 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.42 1jzn h SER 111 Cb 1.08 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1jzn h SER 111 CO 0.95 0.19 0.00 -0.07 -0.53 0.00 0.00 176.83 177.37 1jzn h LEU 112 N 0.55 0.00 -3.00 2.23 3.38 -1.93 -0.47 115.31 116.08 1jzn h LEU 112 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 1jzn h LEU 112 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1jzn h LEU 112 CO -0.35 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.53 1jzn n THR 113 N -2.61 1.53 -1.69 0.22 -2.24 -0.50 -4.92 114.28 104.07 1jzn n THR 113 Ca -0.01 -1.14 -0.07 0.00 -2.27 0.00 0.00 64.05 60.56 1jzn n THR 113 Cb 0.10 0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.58 1jzn n THR 113 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jzn n GLY 114 N 1.27 0.49 2.34 3.38 0.00 -0.18 -3.21 105.19 109.28 1jzn n GLY 114 Ca 0.25 -0.64 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 1jzn n GLY 114 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1jzn n TYR 115 N -3.42 -0.32 -0.02 1.61 4.02 -0.72 -4.66 117.16 113.65 1jzn n TYR 115 Ca -0.08 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.61 1jzn n TYR 115 Cb 0.41 -2.73 -0.14 0.00 -0.02 0.00 0.00 39.34 36.86 1jzn n TYR 115 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1jzn n ARG 116 N -2.47 0.74 -4.17 -0.72 1.74 -1.20 -4.34 116.66 106.23 1jzn n ARG 116 Ca -0.15 0.24 -0.24 0.00 -0.77 0.00 0.00 57.85 56.93 1jzn n ARG 116 Cb 0.54 -1.67 -0.06 0.00 -1.02 0.00 0.00 32.46 30.24 1jzn n ARG 116 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1jzn s LEU 117 N -6.91 3.56 0.17 0.55 1.43 -1.26 -4.96 118.68 111.26 1jzn s LEU 117 Ca -0.24 -0.36 0.04 0.00 -1.03 0.00 0.00 54.13 52.54 1jzn s LEU 117 Cb 0.07 -2.13 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 1jzn s LEU 117 CO 0.74 0.01 0.20 0.26 0.23 0.00 0.00 176.35 177.79 1jzn s TRP 118 N -2.04 3.27 -0.02 0.29 0.51 -0.45 -1.04 118.94 119.45 1jzn s TRP 118 Ca 0.31 0.02 -0.01 0.00 -2.12 0.00 0.00 56.10 54.30 1jzn s TRP 118 Cb -0.08 -1.55 0.01 0.00 -0.81 0.00 0.00 33.47 31.04 1jzn s TRP 118 CO 0.22 0.51 0.05 1.21 -0.51 0.00 0.00 176.95 178.44 1jzn s ASN 119 N -3.25 -0.02 0.03 2.95 2.47 -0.52 -0.06 114.94 116.53 1jzn s ASN 119 Ca 0.32 0.09 -0.27 0.00 0.42 0.00 0.00 52.86 53.43 1jzn s ASN 119 Cb -0.10 0.06 -0.05 0.00 -1.45 0.00 0.00 41.25 39.71 1jzn s ASN 119 CO 0.25 -0.05 0.84 1.51 -3.72 0.00 0.00 177.10 175.93 1jzn s ASP 120 N 0.38 7.26 0.17 -4.21 -4.77 -1.26 -1.06 116.67 113.18 1jzn s ASP 120 Ca -0.03 1.51 0.00 0.00 -3.30 0.00 0.00 52.55 50.73 1jzn s ASP 120 Cb -0.04 -2.50 -0.04 0.00 -1.09 0.00 0.00 42.92 39.24 1jzn s ASP 120 CO -0.01 -0.09 0.05 -1.58 0.70 0.00 0.00 175.17 174.24 1jzn s GLN 121 N 0.36 1.10 0.03 2.11 2.00 0.24 -4.88 119.66 120.61 1jzn s GLN 121 Ca 0.43 -1.54 -0.30 0.00 -2.00 0.00 0.00 55.36 51.95 1jzn s GLN 121 Cb -0.21 -0.03 -0.08 0.00 0.80 0.00 0.00 33.01 33.49 1jzn s GLN 121 CO 0.24 -0.23 1.90 0.08 -0.50 0.00 0.00 175.29 176.79 1jzn s VAL 122 N -3.86 3.08 0.56 1.34 1.01 -1.26 -2.60 120.40 118.66 1jzn s VAL 122 Ca 0.28 0.15 0.26 0.00 0.00 0.00 0.00 61.98 62.66 1jzn s VAL 122 Cb 0.07 -3.10 0.37 0.00 0.00 0.00 0.00 36.38 33.73 1jzn s VAL 122 CO 0.05 -0.01 2.03 0.00 0.00 0.00 0.00 175.10 177.17 1jzn n GLU 124 N -4.12 0.92 -2.13 0.00 -0.58 -1.26 -0.86 120.64 112.60 1jzn n GLU 124 Ca 0.06 -0.09 -0.37 0.00 -0.42 0.00 0.00 57.16 56.34 1jzn n GLU 124 Cb 0.49 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.87 1jzn n GLU 124 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1jzn s SER 125 N -2.15 5.83 -0.32 1.62 0.01 -0.34 -4.71 113.70 113.63 1jzn s SER 125 Ca 0.42 2.39 -0.18 0.00 1.31 0.00 0.00 55.95 59.90 1jzn s SER 125 Cb 0.21 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.83 1jzn s SER 125 CO 0.39 -1.16 0.50 -0.54 0.41 0.00 0.00 173.24 172.84 1jzn s LYS 126 N -2.88 3.76 0.32 12.44 -0.14 -1.26 -3.88 119.74 128.10 1jzn s LYS 126 Ca 0.68 -0.04 0.04 0.00 -1.36 0.00 0.00 55.97 55.30 1jzn s LYS 126 Cb -0.31 -3.76 -0.06 0.00 -1.68 0.00 0.00 37.83 32.02 1jzn s LYS 126 CO 0.36 -0.54 0.03 -0.51 -0.76 0.00 0.00 175.35 173.93 1jzn s ASP 127 N 1.70 2.53 0.90 2.83 1.11 -0.66 -4.74 116.67 120.35 1jzn s ASP 127 Ca 0.19 -1.34 -0.13 0.00 0.18 0.00 0.00 52.55 51.45 1jzn s ASP 127 Cb -0.16 -0.12 0.17 0.00 1.07 0.00 0.00 42.92 43.88 1jzn s ASP 127 CO 0.12 -0.54 1.25 0.00 1.18 0.00 0.00 175.17 177.18 1jzn s ALA 128 N -3.21 2.50 -0.01 5.23 0.00 -0.19 -1.13 121.76 124.95 1jzn s ALA 128 Ca 0.35 -1.17 -0.18 0.00 0.00 0.00 0.00 51.96 50.96 1jzn s ALA 128 Cb 0.08 -2.71 0.03 0.00 0.00 0.00 0.00 23.12 20.52 1jzn s ALA 128 CO 0.15 -2.17 0.38 -0.59 0.00 0.00 0.00 175.76 173.53 1jzn s PHE 129 N -3.73 -0.27 -0.31 0.00 -0.71 -0.47 -0.18 117.98 112.30 1jzn s PHE 129 Ca 0.71 0.41 -0.09 0.00 -1.04 0.00 0.00 56.93 56.92 1jzn s PHE 129 Cb -0.05 0.16 0.00 0.00 -1.21 0.00 0.00 43.02 41.92 1jzn s PHE 129 CO 0.51 -0.45 0.13 -1.17 -1.34 0.00 0.00 175.22 172.90 1jzn s LEU 130 N -1.37 4.07 0.32 -1.99 2.96 -0.92 -0.15 118.68 121.60 1jzn s LEU 130 Ca -0.12 -0.65 -0.02 0.00 -0.22 0.00 0.00 54.13 53.12 1jzn s LEU 130 Cb -0.04 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1jzn s LEU 130 CO 0.05 -0.21 0.54 0.00 -1.32 0.00 0.00 176.35 175.40 1jzn s GLN 132 N -3.98 0.57 0.11 0.00 0.74 0.10 -2.03 119.66 115.18 1jzn s GLN 132 Ca 0.41 0.02 0.01 0.00 0.05 0.00 0.00 55.36 55.85 1jzn s GLN 132 Cb -0.10 -0.74 -0.04 0.00 1.10 0.00 0.00 33.01 33.23 1jzn s GLN 132 CO 0.34 -0.16 -0.02 0.00 -0.55 0.00 0.00 175.29 174.89 1jzn s LYS 134 N -3.91 3.04 0.00 0.00 1.02 -0.99 -0.33 119.74 118.57 1jzn s LYS 134 Ca 0.15 -0.39 0.00 0.00 0.02 0.00 0.00 55.97 55.75 1jzn s LYS 134 Cb 0.06 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 34.55 1jzn s LYS 134 CO -0.03 0.69 0.45 1.19 -0.92 0.00 0.00 175.35 176.73