#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 0.80 -4.15 6.41 3.02 -1.26 -4.99 115.26 115.09 1jzn n ASN 2 Ca 0.00 0.36 -0.10 0.00 -0.03 0.00 0.00 54.58 54.81 1jzn n ASN 2 Cb 0.00 0.04 -0.10 0.00 -0.61 0.00 0.00 39.78 39.11 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 -3.93 1.35 0.39 0.00 0.02 -1.26 -4.90 135.00 126.66 1jzn s PRO 4 Ca 0.15 1.24 0.15 0.00 0.02 0.00 0.00 61.00 62.57 1jzn s PRO 4 Cb 0.07 -1.79 1.00 0.00 0.02 0.00 0.00 34.50 33.80 1jzn s PRO 4 CO -0.03 -2.30 1.85 -0.07 -0.33 0.00 0.00 177.00 176.11 1jzn h LEU 5 N -1.62 0.49 -3.27 -5.54 4.07 -2.03 -2.26 115.31 105.16 1jzn h LEU 5 Ca -0.46 0.05 -0.13 0.00 0.08 0.00 0.00 57.88 57.42 1jzn h LEU 5 Cb 1.26 -0.04 -0.08 0.00 1.08 0.00 0.00 40.66 42.88 1jzn h LEU 5 CO 0.48 0.20 0.16 -0.90 -1.08 0.00 0.00 178.44 177.30 1jzn n ASP 6 N -4.55 4.52 -4.48 -0.43 5.75 -1.26 -4.90 116.55 111.21 1jzn n ASP 6 Ca 0.19 -2.93 -0.28 0.00 -0.01 0.00 0.00 54.79 51.76 1jzn n ASP 6 Cb 0.65 -0.69 -0.11 0.00 -1.03 0.00 0.00 41.12 39.93 1jzn n ASP 6 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 1jzn s TRP 7 N -2.53 2.46 -0.39 2.11 0.52 -0.85 -4.87 118.94 115.39 1jzn s TRP 7 Ca 0.45 -0.30 -0.17 0.00 0.02 0.00 0.00 56.10 56.11 1jzn s TRP 7 Cb 0.36 -1.26 0.01 0.00 -1.15 0.00 0.00 33.47 31.43 1jzn s TRP 7 CO 0.12 0.45 0.44 -1.17 0.02 0.00 0.00 176.95 176.81 1jzn s LEU 8 N -2.46 4.65 0.14 2.99 2.96 0.62 -4.83 118.68 122.75 1jzn s LEU 8 Ca 0.20 -0.44 -0.30 0.00 -0.22 0.00 0.00 54.13 53.37 1jzn s LEU 8 Cb -0.09 -2.43 -0.07 0.00 0.50 0.00 0.00 46.19 44.10 1jzn s LEU 8 CO 0.11 -0.52 1.02 -2.84 -1.32 0.00 0.00 176.35 172.80 1jzn s PRO 9 N 2.20 4.66 -0.26 0.98 0.02 -1.26 -0.65 135.00 140.69 1jzn s PRO 9 Ca 0.14 1.55 -0.07 0.00 0.02 0.00 0.00 61.00 62.64 1jzn s PRO 9 Cb -0.16 -3.34 0.12 0.00 0.02 0.00 0.00 34.50 31.14 1jzn s PRO 9 CO 0.13 0.16 0.54 1.41 -0.33 0.00 0.00 177.00 178.91 1jzn s MET 10 N -0.14 0.46 -1.56 5.54 1.75 0.10 -4.94 119.30 120.52 1jzn s MET 10 Ca 0.48 1.17 -0.09 0.00 -1.25 0.00 0.00 55.69 56.00 1jzn s MET 10 Cb -0.26 0.52 0.07 0.00 2.84 0.00 0.00 34.83 38.01 1jzn s MET 10 CO 0.32 -0.31 0.54 0.09 -0.65 0.00 0.00 175.02 175.00 1jzn n ASN 11 N 5.42 -1.53 0.00 1.11 3.02 -1.26 -1.74 115.26 120.28 1jzn n ASN 11 Ca -0.09 -1.04 0.00 0.00 -0.03 0.00 0.00 54.58 53.43 1jzn n ASN 11 Cb 0.50 -2.76 0.00 0.00 -0.61 0.00 0.00 39.78 36.91 1jzn n ASN 11 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jzn n GLY 12 N -1.78 1.70 3.71 7.41 0.00 -1.26 -5.04 105.19 109.93 1jzn n GLY 12 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 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 2.87 -0.07 0.99 1.43 -0.71 -4.87 118.68 118.32 1jzn s LEU 13 Ca 0.00 -1.29 0.05 0.00 -1.03 0.00 0.00 54.13 51.85 1jzn s LEU 13 Cb 0.00 -1.11 -0.00 0.00 0.03 0.00 0.00 46.19 45.11 1jzn s LEU 13 CO 0.00 -0.60 -0.21 0.00 0.23 0.00 0.00 176.35 175.76 1jzn s TYR 15 N 0.12 2.14 -0.18 0.00 1.51 0.18 -0.55 117.35 120.57 1jzn s TYR 15 Ca -0.09 -0.39 -0.14 0.00 -1.01 0.00 0.00 57.07 55.44 1jzn s TYR 15 Cb -0.15 -1.19 0.05 0.00 -0.11 0.00 0.00 41.96 40.57 1jzn s TYR 15 CO 0.05 0.26 0.45 0.21 -1.11 0.00 0.00 175.55 175.41 1jzn s LYS 16 N -1.84 0.50 -0.14 -0.62 2.20 -0.95 -0.28 119.74 118.61 1jzn s LYS 16 Ca 0.11 0.71 -0.17 0.00 -0.36 0.00 0.00 55.97 56.26 1jzn s LYS 16 Cb -0.10 0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.34 1jzn s LYS 16 CO 0.05 -0.10 0.41 0.96 -0.36 0.00 0.00 175.35 176.31 1jzn s ILE 17 N 0.66 5.23 -0.14 5.43 -4.36 -1.26 -1.05 121.20 125.71 1jzn s ILE 17 Ca -0.03 0.80 -0.03 0.00 -0.26 0.00 0.00 60.65 61.13 1jzn s ILE 17 Cb -0.05 -3.75 -0.02 0.00 1.25 0.00 0.00 42.46 39.89 1jzn s ILE 17 CO -0.04 0.34 -0.06 -0.36 0.24 0.00 0.00 174.94 175.06 1jzn s PHE 18 N 0.62 2.97 -0.55 1.37 0.40 0.11 -4.96 117.98 117.93 1jzn s PHE 18 Ca 0.22 -0.36 0.24 0.00 -0.60 0.00 0.00 56.93 56.44 1jzn s PHE 18 Cb -0.14 -1.91 0.42 0.00 0.51 0.00 0.00 43.02 41.89 1jzn s PHE 18 CO 0.08 -0.05 1.47 -0.91 0.70 0.00 0.00 175.22 176.51 1jzn h ASN 19 N 6.60 0.00 -3.22 1.36 2.35 -1.92 -1.26 115.58 119.50 1jzn h ASN 19 Ca -0.31 -0.07 -0.53 0.00 -0.55 0.00 0.00 56.30 54.85 1jzn h ASN 19 Cb 1.20 0.00 0.08 0.00 0.05 0.00 0.00 38.32 39.64 1jzn h ASN 19 CO 0.60 0.03 0.90 -1.10 -1.65 0.00 0.00 177.43 176.22 1jzn s GLN 20 N -3.19 4.13 0.01 0.81 1.11 -1.26 -4.66 119.66 116.60 1jzn s GLN 20 Ca 0.06 2.56 -0.29 0.00 0.01 0.00 0.00 55.36 57.71 1jzn s GLN 20 Cb 0.10 -3.04 -0.04 0.00 -1.01 0.00 0.00 33.01 29.03 1jzn s GLN 20 CO 0.69 -0.64 0.93 -0.51 0.01 0.00 0.00 175.29 175.76 1jzn s LEU 21 N -0.19 4.38 0.14 2.90 1.43 -1.26 -4.45 118.68 121.63 1jzn s LEU 21 Ca 0.65 1.60 -0.10 0.00 -1.03 0.00 0.00 54.13 55.24 1jzn s LEU 21 Cb -0.48 -3.48 0.00 0.00 0.03 0.00 0.00 46.19 42.26 1jzn s LEU 21 CO 0.45 -0.20 0.29 -0.54 0.23 0.00 0.00 176.35 176.58 1jzn s LYS 22 N 0.81 1.08 0.81 1.70 1.02 -0.73 -4.83 119.74 119.61 1jzn s LYS 22 Ca 0.49 -1.03 -0.11 0.00 0.02 0.00 0.00 55.97 55.33 1jzn s LYS 22 Cb -0.21 0.39 0.08 0.00 -0.52 0.00 0.00 37.83 37.57 1jzn s LYS 22 CO 0.27 -0.39 1.09 0.95 -0.92 0.00 0.00 175.35 176.34 1jzn s THR 23 N -3.91 3.09 0.18 2.17 -4.23 -1.26 -1.48 115.64 110.20 1jzn s THR 23 Ca 0.11 0.35 -0.14 0.00 -1.18 0.00 0.00 61.69 60.84 1jzn s THR 23 Cb 0.03 -2.98 0.07 0.00 1.34 0.00 0.00 72.50 70.96 1jzn s THR 23 CO -0.05 -0.46 1.75 -0.25 -0.54 0.00 0.00 174.62 175.07 1jzn h TRP 24 N -1.19 0.28 -0.82 3.99 7.01 -1.44 -0.26 115.95 123.52 1jzn h TRP 24 Ca -0.47 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 60.54 1jzn h TRP 24 Cb 1.26 -0.06 -0.04 0.00 -2.10 0.00 0.00 29.16 28.23 1jzn h TRP 24 CO 0.49 0.09 0.45 1.49 -2.79 0.00 0.00 178.44 178.17 1jzn h GLU 25 N 0.33 1.15 0.00 2.65 4.57 -1.92 -1.67 114.58 119.68 1jzn h GLU 25 Ca 0.22 -0.13 -0.09 0.00 -1.18 0.00 0.00 59.36 58.18 1jzn h GLU 25 Cb 0.22 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 1jzn h GLU 25 CO -0.23 0.84 -0.41 -0.44 -1.18 0.00 0.00 179.01 177.60 1jzn h ASP 26 N 1.14 0.00 -0.37 1.04 3.32 -1.81 -2.08 116.42 117.66 1jzn h ASP 26 Ca 0.29 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.23 1jzn h ASP 26 Cb 0.03 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1jzn h ASP 26 CO -0.05 0.41 -0.20 0.00 -1.72 0.00 0.00 179.24 177.68 1jzn h ALA 27 N 1.59 0.53 0.92 3.45 0.00 -0.65 -0.26 119.26 124.84 1jzn h ALA 27 Ca -0.00 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 1jzn h ALA 27 Cb 1.10 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.78 1jzn h ALA 27 CO 0.05 0.49 -0.44 1.49 0.00 0.00 0.00 179.25 180.84 1jzn h GLU 28 N 0.59 -1.19 0.00 0.00 4.22 -1.16 -1.73 114.58 115.31 1jzn h GLU 28 Ca 0.08 0.08 -0.01 0.00 0.08 0.00 0.00 59.36 59.59 1jzn h GLU 28 Cb 0.76 0.27 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 1jzn h GLU 28 CO 0.06 -0.79 -0.07 0.52 -2.18 0.00 0.00 179.01 176.54 1jzn h MET 29 N -1.30 0.00 0.10 1.92 2.86 -1.43 -1.31 114.93 115.77 1jzn h MET 29 Ca -0.13 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1jzn h MET 29 Cb 0.95 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.61 1jzn h MET 29 CO 0.21 0.07 -0.05 0.35 1.06 0.00 0.00 176.91 178.55 1jzn h PHE 30 N 0.00 -0.12 -0.48 -0.22 3.04 -0.80 -1.72 116.94 116.64 1jzn h PHE 30 Ca -0.00 -0.00 0.08 0.00 3.98 0.00 0.00 57.97 62.03 1jzn h PHE 30 Cb 0.17 0.04 -0.07 0.00 2.56 0.00 0.00 35.95 38.65 1jzn h PHE 30 CO 0.00 0.12 0.07 0.00 -2.02 0.00 0.00 178.31 176.48 1jzn h ARG 32 N 0.20 0.00 -0.02 0.00 3.08 -1.17 -1.68 114.38 114.79 1jzn h ARG 32 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1jzn h ARG 32 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1jzn h ARG 32 CO -0.34 0.03 -0.02 1.63 -1.07 0.00 0.00 179.97 180.20 1jzn n LYS 33 N -4.08 1.83 0.08 0.04 4.76 -0.19 -3.84 118.16 116.77 1jzn n LYS 33 Ca -0.03 -1.26 -0.08 0.00 -2.87 0.00 0.00 58.31 54.08 1jzn n LYS 33 Cb 0.11 -1.47 -0.05 0.00 -1.84 0.00 0.00 35.03 31.78 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 3.07 0.15 -1.23 2.13 5.03 -0.32 -3.47 116.97 122.33 1jzn h TYR 34 Ca 0.00 -0.09 0.16 0.00 2.58 0.00 0.00 58.73 61.38 1jzn h TYR 34 Cb 0.67 -0.01 -0.30 0.00 1.55 0.00 0.00 36.73 38.63 1jzn h TYR 34 CO 0.00 0.97 0.77 0.21 -1.32 0.00 0.00 178.16 178.79 1jzn s LYS 35 N -2.98 0.20 0.20 1.82 2.20 -1.25 -5.11 119.74 114.83 1jzn s LYS 35 Ca -0.01 0.19 -0.32 0.00 -0.36 0.00 0.00 55.97 55.47 1jzn s LYS 35 Cb 0.10 0.10 -0.13 0.00 -1.51 0.00 0.00 37.83 36.39 1jzn s LYS 35 CO 0.82 -0.03 1.64 -2.30 -0.36 0.00 0.00 175.35 175.12 1jzn n PRO 36 N 1.55 2.49 0.00 4.03 -0.02 -1.26 -2.52 135.00 139.27 1jzn n PRO 36 Ca -0.10 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1jzn n PRO 36 Cb 0.57 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 1jzn n PRO 36 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jzn n GLY 37 N 3.45 0.19 3.89 -1.23 0.00 -1.26 -4.87 105.19 105.36 1jzn n GLY 37 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.97 0.05 0.47 0.00 3.76 -0.40 -3.78 115.29 112.41 1jzn s HIS 39 Ca 0.52 -0.50 -0.23 0.00 -0.15 0.00 0.00 55.06 54.69 1jzn s HIS 39 Cb -0.11 0.56 -0.07 0.00 1.11 0.00 0.00 32.58 34.07 1jzn s HIS 39 CO 0.49 -1.22 1.22 -0.51 -0.85 0.00 0.00 174.74 173.86 1jzn s LEU 40 N -2.98 4.01 0.57 0.89 1.43 -1.26 -0.06 118.68 121.27 1jzn s LEU 40 Ca 0.15 2.43 -0.20 0.00 -1.03 0.00 0.00 54.13 55.48 1jzn s LEU 40 Cb -0.04 -4.21 -0.05 0.00 0.03 0.00 0.00 46.19 41.91 1jzn s LEU 40 CO 0.09 -1.03 1.04 0.00 0.23 0.00 0.00 176.35 176.67 1jzn n ALA 41 N -0.52 0.41 -2.44 4.21 0.00 -0.31 -4.00 120.51 117.86 1jzn n ALA 41 Ca 0.07 0.05 -0.27 0.00 0.00 0.00 0.00 53.44 53.30 1jzn n ALA 41 Cb 0.47 -2.15 -0.13 0.00 0.00 0.00 0.00 19.45 17.64 1jzn n ALA 41 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1jzn s SER 42 N -1.13 2.93 0.05 0.00 1.04 -1.26 -0.67 113.70 114.66 1jzn s SER 42 Ca 0.74 -0.67 0.08 0.00 0.48 0.00 0.00 55.95 56.58 1jzn s SER 42 Cb -0.43 -0.20 -0.03 0.00 0.10 0.00 0.00 66.02 65.45 1jzn s SER 42 CO 0.48 0.15 -0.23 -0.36 0.98 0.00 0.00 173.24 174.27 1jzn s PHE 43 N -1.02 2.43 0.00 5.02 0.40 -1.26 -5.02 117.98 118.53 1jzn s PHE 43 Ca 0.10 -0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.09 1jzn s PHE 43 Cb -0.10 -1.41 0.00 0.00 0.51 0.00 0.00 43.02 42.02 1jzn s PHE 43 CO 0.04 0.20 0.24 0.72 0.70 0.00 0.00 175.22 177.12 1jzn n HIS 44 N 1.60 0.00 -3.57 0.36 8.25 -1.26 -4.62 115.22 115.98 1jzn n HIS 44 Ca -0.17 -0.01 -0.12 0.00 -0.26 0.00 0.00 57.72 57.17 1jzn n HIS 44 Cb 0.52 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.58 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 -0.02 0.65 0.33 -0.41 1.70 -1.26 -4.76 118.95 115.19 1jzn s ARG 45 Ca 0.00 0.17 0.11 0.00 -0.47 0.00 0.00 55.73 55.54 1jzn s ARG 45 Cb 0.00 0.31 0.93 0.00 -0.57 0.00 0.00 34.95 35.62 1jzn s ARG 45 CO 0.00 -0.20 1.73 -0.92 -1.08 0.00 0.00 175.30 174.83 1jzn h TYR 46 N 2.65 0.95 -0.69 5.89 3.20 -1.99 -0.76 116.97 126.22 1jzn h TYR 46 Ca -0.20 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.66 1jzn h TYR 46 Cb 1.16 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 39.13 1jzn h TYR 46 CO 0.30 0.06 0.24 0.78 -1.64 0.00 0.00 178.16 177.90 1jzn h GLY 47 N 0.54 1.12 0.95 1.82 0.00 -1.99 -2.51 103.07 103.00 1jzn h GLY 47 Ca 0.64 -0.62 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 1jzn h GLY 47 CO -0.45 0.59 0.14 0.83 0.00 0.00 0.00 176.54 177.64 1jzn h GLU 48 N 1.02 0.65 -0.50 4.80 5.08 -1.56 -0.21 114.58 123.86 1jzn h GLU 48 Ca 0.23 -0.14 0.08 0.00 -1.00 0.00 0.00 59.36 58.53 1jzn h GLU 48 Cb 0.24 -0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.33 1jzn h GLU 48 CO -0.01 0.64 0.13 0.77 -1.00 0.00 0.00 179.01 179.53 1jzn h SER 49 N 0.54 0.06 -0.41 1.42 0.02 -1.32 0.23 113.55 114.09 1jzn h SER 49 Ca 0.14 0.08 -0.10 0.00 -0.84 0.00 0.00 61.79 61.07 1jzn h SER 49 Cb 0.25 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 1jzn h SER 49 CO -0.01 0.06 -0.11 -0.07 -1.14 0.00 0.00 176.83 175.56 1jzn h LEU 50 N 0.28 0.81 0.14 5.07 3.38 -1.20 0.14 115.31 123.94 1jzn h LEU 50 Ca 0.25 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1jzn h LEU 50 Cb 0.32 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1jzn h LEU 50 CO -0.30 1.00 -0.07 -0.08 0.09 0.00 0.00 178.44 179.07 1jzn h GLU 51 N 0.62 -0.19 -0.35 1.13 4.57 -0.59 -2.23 114.58 117.54 1jzn h GLU 51 Ca 0.10 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.32 1jzn h GLU 51 Cb 0.65 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.25 1jzn h GLU 51 CO 0.04 0.07 0.18 0.82 -1.18 0.00 0.00 179.01 178.95 1jzn h ILE 52 N -0.43 1.00 -0.74 2.32 1.08 -0.55 -1.28 117.51 118.90 1jzn h ILE 52 Ca -0.02 -0.13 0.11 0.00 -0.39 0.00 0.00 64.86 64.43 1jzn h ILE 52 Cb 0.34 0.59 -0.08 0.00 -3.07 0.00 0.00 36.82 34.61 1jzn h ILE 52 CO 0.03 0.07 0.36 0.00 -0.69 0.00 0.00 178.15 177.92 1jzn h ALA 53 N 1.17 1.03 -0.36 1.87 0.00 -0.66 -0.88 119.26 121.43 1jzn h ALA 53 Ca 0.14 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 1jzn h ALA 53 Cb 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1jzn h ALA 53 CO -0.09 -0.06 -0.29 1.49 0.00 0.00 0.00 179.25 180.30 1jzn h GLU 54 N 0.59 0.83 0.09 0.00 4.81 -1.02 -2.33 114.58 117.57 1jzn h GLU 54 Ca 0.37 -0.41 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1jzn h GLU 54 Cb 0.43 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.81 1jzn h GLU 54 CO -0.30 1.05 -0.07 -0.92 -0.73 0.00 0.00 179.01 178.05 1jzn h TYR 55 N 0.63 -0.18 -0.41 0.92 5.03 -0.60 -2.00 116.97 120.36 1jzn h TYR 55 Ca 0.07 -0.00 0.02 0.00 2.58 0.00 0.00 58.73 61.40 1jzn h TYR 55 Cb 0.86 0.07 -0.03 0.00 1.55 0.00 0.00 36.73 39.18 1jzn h TYR 55 CO 0.06 -0.11 0.23 0.82 -1.32 0.00 0.00 178.16 177.85 1jzn h ILE 56 N -0.17 1.02 0.00 1.81 2.04 -1.19 0.15 117.51 121.18 1jzn h ILE 56 Ca -0.00 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 1jzn h ILE 56 Cb 0.15 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1jzn h ILE 56 CO -0.00 0.09 -0.02 0.28 0.00 0.00 0.00 178.15 178.49 1jzn h SER 57 N 0.47 0.00 0.23 1.72 0.02 -1.23 -0.60 113.55 114.16 1jzn h SER 57 Ca 0.17 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.77 1jzn h SER 57 Cb 0.03 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.53 1jzn h SER 57 CO -0.09 0.02 -1.97 0.47 -1.14 0.00 0.00 176.83 174.12 1jzn n ASP 58 N -3.68 1.51 -0.09 3.07 8.00 -0.67 -4.67 116.55 120.02 1jzn n ASP 58 Ca -0.03 0.23 0.07 0.00 0.71 0.00 0.00 54.79 55.78 1jzn n ASP 58 Cb 0.11 -0.40 -0.07 0.00 -0.02 0.00 0.00 41.12 40.74 1jzn n ASP 58 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1jzn n TYR 59 N -3.25 0.00 -1.48 1.24 4.02 0.44 -5.03 117.16 113.09 1jzn n TYR 59 Ca -0.28 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.31 1jzn n TYR 59 Cb 1.05 0.00 0.21 0.00 -0.02 0.00 0.00 39.34 40.58 1jzn n TYR 59 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 176.86 172.47 1jzn s HIS 60 N -2.29 1.12 -0.19 -0.72 -3.43 -0.26 -5.03 115.29 104.48 1jzn s HIS 60 Ca 0.07 0.45 -0.04 0.00 -0.80 0.00 0.00 55.06 54.75 1jzn s HIS 60 Cb 0.12 -3.74 0.06 0.00 -1.43 0.00 0.00 32.58 27.59 1jzn s HIS 60 CO 0.57 -3.23 0.06 0.15 -2.00 0.00 0.00 174.74 170.28 1jzn s LYS 61 N -5.61 0.45 0.00 -0.38 1.02 -1.26 -5.05 119.74 108.91 1jzn s LYS 61 Ca 0.72 -0.33 0.00 0.00 0.02 0.00 0.00 55.97 56.38 1jzn s LYS 61 Cb -0.08 -2.00 0.00 0.00 -0.52 0.00 0.00 37.83 35.24 1jzn s LYS 61 CO 0.54 -0.67 0.00 0.41 -0.92 0.00 0.00 175.35 174.72 1jzn n GLY 62 N 5.12 -0.31 1.23 -3.33 0.00 -1.26 -4.81 105.19 101.84 1jzn n GLY 62 Ca -0.08 -2.23 0.03 0.00 0.00 0.00 0.00 46.02 43.74 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 0.00 1.01 -2.14 1.61 1.13 -1.26 -5.09 117.38 112.63 1jzn n GLN 63 Ca 0.00 -2.79 -0.33 0.00 -1.94 0.00 0.00 57.00 51.94 1jzn n GLN 63 Cb 0.00 -0.93 0.00 0.00 0.11 0.00 0.00 30.24 29.42 1jzn n GLN 63 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1jzn s GLU 64 N -1.84 3.42 0.69 -1.09 0.41 -1.26 -4.86 118.70 114.17 1jzn s GLU 64 Ca 0.36 1.23 -0.11 0.00 -0.41 0.00 0.00 54.97 56.04 1jzn s GLU 64 Cb 0.38 -2.05 0.01 0.00 -1.78 0.00 0.00 34.13 30.69 1jzn s GLU 64 CO -0.11 -0.73 1.06 -0.80 -0.49 0.00 0.00 175.26 174.19 1jzn s ASN 65 N -2.64 5.49 -0.12 -0.19 0.01 -1.26 -4.65 114.94 111.58 1jzn s ASN 65 Ca 0.64 1.41 0.02 0.00 -0.71 0.00 0.00 52.86 54.23 1jzn s ASN 65 Cb -0.16 -2.30 0.01 0.00 0.41 0.00 0.00 41.25 39.21 1jzn s ASN 65 CO 0.34 -1.35 -0.20 -0.69 -1.51 0.00 0.00 177.10 173.69 1jzn s VAL 66 N -3.16 1.85 0.21 1.60 1.01 -0.76 -1.57 120.40 119.56 1jzn s VAL 66 Ca 0.58 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 1jzn s VAL 66 Cb -0.13 -1.64 -0.09 0.00 0.00 0.00 0.00 36.38 34.52 1jzn s VAL 66 CO 0.54 0.51 1.24 0.26 0.00 0.00 0.00 175.10 177.65 1jzn s TRP 67 N 0.81 3.35 0.41 5.22 0.23 -0.23 0.15 118.94 128.88 1jzn s TRP 67 Ca -0.09 1.37 0.04 0.00 -2.03 0.00 0.00 56.10 55.40 1jzn s TRP 67 Cb -0.16 -3.50 -0.05 0.00 0.03 0.00 0.00 33.47 29.80 1jzn s TRP 67 CO -0.00 -1.44 0.05 0.96 0.96 0.00 0.00 176.95 177.48 1jzn s ILE 68 N -0.15 1.23 -2.00 2.03 -4.36 -0.63 -2.57 121.20 114.75 1jzn s ILE 68 Ca 0.53 -2.00 0.11 0.00 -0.26 0.00 0.00 60.65 59.03 1jzn s ILE 68 Cb -0.34 -2.59 0.31 0.00 1.25 0.00 0.00 42.46 41.09 1jzn s ILE 68 CO 0.39 0.00 1.11 0.61 0.24 0.00 0.00 174.94 177.29 1jzn n GLY 69 N -0.94 -0.57 3.72 6.27 0.00 0.16 -4.62 105.19 109.21 1jzn n GLY 69 Ca -0.08 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.60 4.32 -0.08 0.99 2.96 -1.26 -1.59 118.68 122.43 1jzn s LEU 70 Ca 0.16 1.18 -0.18 0.00 -0.22 0.00 0.00 54.13 55.08 1jzn s LEU 70 Cb 0.07 -3.06 0.04 0.00 0.50 0.00 0.00 46.19 43.74 1jzn s LEU 70 CO 0.13 -0.10 0.42 -0.60 -1.32 0.00 0.00 176.35 174.88 1jzn s ARG 71 N 0.72 0.68 -1.00 1.98 3.52 -0.86 -1.56 118.95 122.42 1jzn s ARG 71 Ca 0.37 0.18 -0.12 0.00 -0.13 0.00 0.00 55.73 56.03 1jzn s ARG 71 Cb -0.18 0.31 0.24 0.00 -1.56 0.00 0.00 34.95 33.77 1jzn s ARG 71 CO 0.18 -0.16 1.00 0.34 -0.81 0.00 0.00 175.30 175.85 1jzn s ASP 72 N -0.72 7.06 0.07 -2.12 2.15 -0.04 -1.89 116.67 121.18 1jzn s ASP 72 Ca -0.08 -3.14 -0.28 0.00 0.43 0.00 0.00 52.55 49.48 1jzn s ASP 72 Cb -0.04 -2.23 -0.17 0.00 -0.30 0.00 0.00 42.92 40.18 1jzn s ASP 72 CO 0.04 -0.46 1.61 0.50 -0.17 0.00 0.00 175.17 176.69 1jzn h LYS 73 N 7.23 -0.44 0.00 4.34 3.64 -1.82 -2.96 116.57 126.55 1jzn h LYS 73 Ca 0.16 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1jzn h LYS 73 Cb 0.95 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1jzn h LYS 73 CO 0.93 -0.26 0.00 1.63 -2.27 0.00 0.00 179.45 179.48 1jzn n LYS 74 N -5.26 0.17 -1.18 1.90 5.02 -1.26 -4.86 118.16 112.70 1jzn n LYS 74 Ca -0.10 0.42 -0.06 0.00 -2.02 0.00 0.00 58.31 56.55 1jzn n LYS 74 Cb 0.22 -1.84 -0.03 0.00 -0.02 0.00 0.00 35.03 33.36 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 -2.17 -0.84 -0.99 1.97 5.02 -1.12 -4.87 118.16 115.16 1jzn n LYS 75 Ca 0.02 0.61 -0.09 0.00 -2.02 0.00 0.00 58.31 56.83 1jzn n LYS 75 Cb 0.21 -4.47 0.17 0.00 -0.02 0.00 0.00 35.03 30.93 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 -0.02 3.07 -1.45 4.39 5.75 -1.26 -4.92 116.55 122.10 1jzn n ASP 76 Ca -0.06 -3.79 -0.16 0.00 -0.01 0.00 0.00 54.79 50.77 1jzn n ASP 76 Cb 0.30 -0.63 -0.04 0.00 -1.03 0.00 0.00 41.12 39.72 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 -1.07 -0.32 -3.30 2.11 3.01 -1.26 -4.96 117.46 111.68 1jzn n PHE 77 Ca 0.37 0.00 -0.47 0.00 1.01 0.00 0.00 57.45 58.36 1jzn n PHE 77 Cb 1.02 -2.96 -0.02 0.00 -0.01 0.00 0.00 39.48 37.52 1jzn n PHE 77 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1jzn s SER 78 N -2.61 6.72 0.01 4.37 1.04 -1.26 -5.03 113.70 116.94 1jzn s SER 78 Ca 0.00 -2.58 -0.30 0.00 0.48 0.00 0.00 55.95 53.55 1jzn s SER 78 Cb 0.00 -2.23 -0.05 0.00 0.10 0.00 0.00 66.02 63.85 1jzn s SER 78 CO 0.00 -0.63 1.23 0.26 0.98 0.00 0.00 173.24 175.08 1jzn s TRP 79 N 0.46 3.26 0.06 5.02 0.52 -1.26 -4.15 118.94 122.84 1jzn s TRP 79 Ca 0.18 1.19 0.05 0.00 0.02 0.00 0.00 56.10 57.54 1jzn s TRP 79 Cb -0.11 -3.46 -0.03 0.00 -1.15 0.00 0.00 33.47 28.72 1jzn s TRP 79 CO -0.08 -1.48 -0.14 -1.21 0.02 0.00 0.00 176.95 174.06 1jzn s GLU 80 N 1.68 0.86 0.13 4.98 2.02 -0.79 -4.84 118.70 122.74 1jzn s GLU 80 Ca 0.58 -0.86 -0.16 0.00 0.02 0.00 0.00 54.97 54.55 1jzn s GLU 80 Cb -0.28 -0.87 -0.07 0.00 0.10 0.00 0.00 34.13 33.01 1jzn s GLU 80 CO 0.26 0.20 0.56 -1.58 0.02 0.00 0.00 175.26 174.72 1jzn s TRP 81 N -1.08 3.67 0.39 1.61 0.52 -1.26 -2.04 118.94 120.74 1jzn s TRP 81 Ca -0.01 1.13 0.25 0.00 0.02 0.00 0.00 56.10 57.49 1jzn s TRP 81 Cb -0.09 -2.41 1.30 0.00 -1.15 0.00 0.00 33.47 31.12 1jzn s TRP 81 CO 0.02 0.47 2.02 1.79 0.02 0.00 0.00 176.95 181.27 1jzn h THR 82 N 3.03 0.67 -0.09 2.01 1.35 -1.60 -2.11 112.91 116.17 1jzn h THR 82 Ca -0.49 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 64.71 1jzn h THR 82 Cb 1.20 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 1jzn h THR 82 CO 0.65 0.15 0.00 -0.90 -0.25 0.00 0.00 175.52 175.17 1jzn n ASP 83 N -3.71 0.88 -1.17 5.36 5.75 -1.26 -4.91 116.55 117.48 1jzn n ASP 83 Ca -0.02 -1.58 -0.14 0.00 -0.01 0.00 0.00 54.79 53.05 1jzn n ASP 83 Cb 0.27 -0.06 -0.05 0.00 -1.03 0.00 0.00 41.12 40.26 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 -0.20 -0.99 -2.80 0.11 1.74 -0.79 -5.02 116.66 108.71 1jzn n ARG 84 Ca 0.15 0.91 -0.29 0.00 -0.77 0.00 0.00 57.85 57.85 1jzn n ARG 84 Cb 0.20 -5.04 -0.02 0.00 -1.02 0.00 0.00 32.46 26.58 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 -2.75 6.41 0.58 0.55 1.04 -1.26 -5.01 113.70 113.26 1jzn s SER 85 Ca 0.00 1.02 -0.20 0.00 0.48 0.00 0.00 55.95 57.25 1jzn s SER 85 Cb 0.00 -2.28 -0.04 0.00 0.10 0.00 0.00 66.02 63.80 1jzn s SER 85 CO 0.00 -0.46 1.26 0.00 0.98 0.00 0.00 173.24 175.02 1jzn n THR 87 N -1.42 4.40 -0.44 0.00 -1.04 -1.26 -4.72 114.28 109.81 1jzn n THR 87 Ca 0.13 -4.95 0.10 0.00 -2.04 0.00 0.00 64.05 57.29 1jzn n THR 87 Cb 0.48 -2.48 0.32 0.00 -1.82 0.00 0.00 70.33 66.82 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 4.46 4.08 -3.66 8.00 3.85 -1.26 -4.94 116.55 127.09 1jzn n ASP 88 Ca 0.33 -2.14 -0.14 0.00 -0.71 0.00 0.00 54.79 52.12 1jzn n ASP 88 Cb 0.41 -0.49 -0.08 0.00 -1.35 0.00 0.00 41.12 39.61 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 -0.59 -0.10 2.11 5.04 -1.26 -4.99 117.35 116.29 1jzn s TYR 89 Ca 0.47 1.34 -0.15 0.00 -2.44 0.00 0.00 57.07 56.29 1jzn s TYR 89 Cb 0.26 0.24 0.03 0.00 0.35 0.00 0.00 41.96 42.85 1jzn s TYR 89 CO 0.29 -0.37 0.38 -0.51 -1.34 0.00 0.00 175.55 173.99 1jzn s LEU 90 N -0.15 0.57 -0.42 6.97 1.43 -1.26 -4.90 118.68 120.93 1jzn s LEU 90 Ca -0.04 0.54 0.08 0.00 -1.03 0.00 0.00 54.13 53.69 1jzn s LEU 90 Cb -0.03 1.37 0.28 0.00 0.03 0.00 0.00 46.19 47.84 1jzn s LEU 90 CO 0.03 -0.27 0.72 1.07 0.23 0.00 0.00 176.35 178.13 1jzn n THR 91 N 2.22 -0.34 -2.16 5.49 5.66 -1.26 -5.12 114.28 118.77 1jzn n THR 91 Ca -0.16 -3.28 -0.35 0.00 -3.05 0.00 0.00 64.05 57.20 1jzn n THR 91 Cb 0.57 -0.40 0.01 0.00 -1.55 0.00 0.00 70.33 68.97 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 -0.87 2.56 1.09 1.09 0.52 -1.26 -1.21 118.94 120.86 1jzn s TRP 92 Ca 0.34 1.53 -0.18 0.00 0.02 0.00 0.00 56.10 57.81 1jzn s TRP 92 Cb 0.24 -3.37 0.26 0.00 -1.15 0.00 0.00 33.47 29.45 1jzn s TRP 92 CO -0.13 -1.83 1.25 -3.47 0.02 0.00 0.00 176.95 172.79 1jzn n ASP 93 N -1.41 -0.78 -4.68 2.95 2.03 0.67 -4.58 116.55 110.75 1jzn n ASP 93 Ca 0.12 -1.36 -0.45 0.00 0.52 0.00 0.00 54.79 53.62 1jzn n ASP 93 Cb 0.50 -1.03 -0.04 0.00 -0.72 0.00 0.00 41.12 39.84 1jzn n ASP 93 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1jzn n LYS 94 N -4.27 2.52 -2.24 -0.67 4.81 -1.26 -2.53 118.16 114.52 1jzn n LYS 94 Ca 0.16 0.92 -0.13 0.00 -0.87 0.00 0.00 58.31 58.40 1jzn n LYS 94 Cb 0.59 -2.80 -0.01 0.00 0.02 0.00 0.00 35.03 32.84 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 6.11 -3.97 -4.40 3.14 5.03 -1.26 -5.03 115.26 114.88 1jzn n ASN 95 Ca 0.20 -0.01 -0.24 0.00 0.87 0.00 0.00 54.58 55.40 1jzn n ASN 95 Cb 0.34 -3.17 -0.11 0.00 -1.02 0.00 0.00 39.78 35.82 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 -4.63 1.45 0.36 3.52 -1.52 -1.05 -4.19 119.66 113.61 1jzn s GLN 96 Ca 0.00 -1.54 -0.16 0.00 -1.95 0.00 0.00 55.36 51.71 1jzn s GLN 96 Cb 0.00 -1.59 -0.09 0.00 -0.22 0.00 0.00 33.01 31.11 1jzn s GLN 96 CO 0.00 0.32 0.80 -1.25 -0.25 0.00 0.00 175.29 174.91 1jzn s PRO 97 N -2.98 4.02 0.00 2.91 0.04 -1.26 -4.72 135.00 133.02 1jzn s PRO 97 Ca 0.21 0.76 0.00 0.00 0.04 0.00 0.00 61.00 62.01 1jzn s PRO 97 Cb -0.06 -2.36 0.00 0.00 0.04 0.00 0.00 34.50 32.13 1jzn s PRO 97 CO 0.10 0.07 0.77 -0.40 0.04 0.00 0.00 177.00 177.58 1jzn n ASP 98 N -0.59 1.54 -2.58 6.66 5.68 -1.26 -4.99 116.55 121.02 1jzn n ASP 98 Ca 0.04 -1.53 -0.05 0.00 -0.50 0.00 0.00 54.79 52.75 1jzn n ASP 98 Cb 0.53 -0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1jzn n ASP 98 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1jzn n HIS 99 N -0.25 -1.82 -1.18 2.11 8.25 -1.26 -4.68 115.22 116.38 1jzn n HIS 99 Ca 0.00 0.04 -0.46 0.00 -0.26 0.00 0.00 57.72 57.03 1jzn n HIS 99 Cb 0.14 -1.52 -0.07 0.00 1.12 0.00 0.00 29.99 29.66 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 -2.81 0.81 -2.11 4.41 4.19 -1.26 0.89 117.16 121.27 1jzn n TYR 100 Ca -0.03 0.81 -0.13 0.00 3.31 0.00 0.00 57.90 61.85 1jzn n TYR 100 Cb 0.53 -1.59 -0.02 0.00 0.49 0.00 0.00 39.34 38.75 1jzn n TYR 100 CO 0.00 0.00 0.00 1.04 0.91 0.00 0.00 176.86 178.81 1jzn n GLN 101 N 1.85 -1.89 -4.36 2.98 6.02 -1.26 -2.29 117.38 118.43 1jzn n GLN 101 Ca 0.18 0.70 -0.37 0.00 -0.01 0.00 0.00 57.00 57.50 1jzn n GLN 101 Cb 0.02 -5.20 -0.07 0.00 1.02 0.00 0.00 30.24 26.01 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 -1.43 -1.34 -0.38 1.08 3.02 0.26 -4.79 115.26 111.68 1jzn n ASN 102 Ca -0.15 -1.18 0.01 0.00 -0.03 0.00 0.00 54.58 53.22 1jzn n ASN 102 Cb 0.57 -2.01 0.01 0.00 -0.61 0.00 0.00 39.78 37.74 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 -4.30 0.11 -4.02 3.52 2.85 -0.97 -5.04 118.16 110.32 1jzn n LYS 103 Ca -0.04 -1.01 -0.31 0.00 -1.05 0.00 0.00 58.31 55.90 1jzn n LYS 103 Cb 0.54 -0.56 -0.15 0.00 -0.65 0.00 0.00 35.03 34.21 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 -0.17 2.07 -0.01 -1.58 2.02 -1.25 -4.12 118.70 115.65 1jzn s GLU 104 Ca 0.02 -1.06 0.14 0.00 0.02 0.00 0.00 54.97 54.09 1jzn s GLU 104 Cb 0.02 -2.64 0.24 0.00 0.10 0.00 0.00 34.13 31.84 1jzn s GLU 104 CO 0.00 -0.51 1.10 1.19 0.02 0.00 0.00 175.26 177.06 1jzn n PHE 105 N 4.59 0.00 -4.06 1.61 3.01 -1.17 -4.53 117.46 116.92 1jzn n PHE 105 Ca -0.14 -0.31 -0.15 0.00 1.01 0.00 0.00 57.45 57.85 1jzn n PHE 105 Cb 0.45 -0.11 -0.15 0.00 -0.01 0.00 0.00 39.48 39.66 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 0.15 5.48 0.12 0.00 1.01 -0.60 0.14 120.40 126.70 1jzn s VAL 107 Ca -0.01 0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.23 1jzn s VAL 107 Cb -0.04 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1jzn s VAL 107 CO -0.00 0.57 -0.14 -1.83 0.00 0.00 0.00 175.10 173.70 1jzn s GLU 108 N -0.67 1.00 0.13 2.72 -1.05 -0.68 -1.61 118.70 118.53 1jzn s GLU 108 Ca 0.13 -1.22 -0.27 0.00 -0.15 0.00 0.00 54.97 53.47 1jzn s GLU 108 Cb -0.12 -0.87 -0.07 0.00 -0.44 0.00 0.00 34.13 32.63 1jzn s GLU 108 CO 0.03 0.17 0.83 -0.51 0.95 0.00 0.00 175.26 176.73 1jzn s LEU 109 N -2.41 4.55 -0.23 1.83 1.43 0.40 -2.19 118.68 122.05 1jzn s LEU 109 Ca 0.08 1.67 -0.22 0.00 -1.03 0.00 0.00 54.13 54.63 1jzn s LEU 109 Cb -0.05 -3.38 -0.02 0.00 0.03 0.00 0.00 46.19 42.77 1jzn s LEU 109 CO 0.03 0.10 0.68 -0.69 0.23 0.00 0.00 176.35 176.70 1jzn s VAL 110 N -0.64 4.96 0.27 -1.59 1.01 -0.12 -1.83 120.40 122.45 1jzn s VAL 110 Ca 0.39 1.27 -0.04 0.00 0.00 0.00 0.00 61.98 63.60 1jzn s VAL 110 Cb -0.23 -3.99 0.20 0.00 0.00 0.00 0.00 36.38 32.36 1jzn s VAL 110 CO 0.27 0.03 1.87 -1.28 0.00 0.00 0.00 175.10 175.98 1jzn h SER 111 N 7.71 0.96 0.51 3.32 0.87 -1.89 -0.20 113.55 124.83 1jzn h SER 111 Ca -0.27 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 1jzn h SER 111 Cb 1.12 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 1jzn h SER 111 CO 0.80 0.81 0.00 0.18 -0.53 0.00 0.00 176.83 178.08 1jzn n LEU 112 N -4.33 0.57 -1.60 2.23 4.77 -1.26 -1.27 117.00 116.11 1jzn n LEU 112 Ca 0.07 0.67 0.09 0.00 -0.03 0.00 0.00 56.01 56.81 1jzn n LEU 112 Cb 0.13 -0.63 0.36 0.00 -2.33 0.00 0.00 43.42 40.95 1jzn n LEU 112 CO 0.39 -0.63 0.82 0.35 -1.33 0.00 0.00 177.39 176.99 1jzn n THR 113 N -2.16 2.05 -1.71 -5.08 -2.24 -0.94 -4.90 114.28 99.30 1jzn n THR 113 Ca 0.01 -1.28 -0.10 0.00 -2.27 0.00 0.00 64.05 60.41 1jzn n THR 113 Cb 0.17 0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.40 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 0.92 0.60 2.26 3.38 0.00 -0.40 -3.02 105.19 108.93 1jzn n GLY 114 Ca 0.26 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 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 -3.31 -0.39 -0.10 1.61 4.02 -0.13 -4.72 117.16 114.15 1jzn n TYR 115 Ca -0.11 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.62 1jzn n TYR 115 Cb 0.45 -2.53 -0.13 0.00 -0.02 0.00 0.00 39.34 37.11 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 -2.30 0.67 -3.93 -0.72 1.74 -1.17 -4.38 116.66 106.58 1jzn n ARG 116 Ca -0.13 0.14 -0.25 0.00 -0.77 0.00 0.00 57.85 56.83 1jzn n ARG 116 Cb 0.54 -1.56 -0.03 0.00 -1.02 0.00 0.00 32.46 30.39 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 -6.34 4.33 0.28 0.55 1.43 -1.26 -4.96 118.68 112.71 1jzn s LEU 117 Ca -0.27 0.16 0.06 0.00 -1.03 0.00 0.00 54.13 53.05 1jzn s LEU 117 Cb 0.08 -2.91 -0.02 0.00 0.03 0.00 0.00 46.19 43.36 1jzn s LEU 117 CO 0.68 0.01 0.35 0.26 0.23 0.00 0.00 176.35 177.89 1jzn s TRP 118 N -1.81 3.22 -0.25 0.29 0.51 -0.35 -0.95 118.94 119.61 1jzn s TRP 118 Ca 0.35 -0.13 -0.15 0.00 -2.12 0.00 0.00 56.10 54.04 1jzn s TRP 118 Cb -0.11 -1.68 0.07 0.00 -0.81 0.00 0.00 33.47 30.95 1jzn s TRP 118 CO 0.29 0.30 0.62 1.21 -0.51 0.00 0.00 176.95 178.86 1jzn s ASN 119 N -4.01 -0.82 0.10 2.95 2.47 -0.93 -0.24 114.94 114.46 1jzn s ASN 119 Ca 0.38 1.35 -0.30 0.00 0.42 0.00 0.00 52.86 54.71 1jzn s ASN 119 Cb -0.09 1.25 -0.06 0.00 -1.45 0.00 0.00 41.25 40.90 1jzn s ASN 119 CO 0.28 -0.23 1.04 1.51 -3.72 0.00 0.00 177.10 175.99 1jzn s ASP 120 N 1.39 7.34 0.21 -4.21 -4.77 -1.26 -1.69 116.67 113.69 1jzn s ASP 120 Ca -0.08 1.88 0.00 0.00 -3.30 0.00 0.00 52.55 51.05 1jzn s ASP 120 Cb -0.06 -2.59 -0.05 0.00 -1.09 0.00 0.00 42.92 39.14 1jzn s ASP 120 CO -0.15 -0.21 0.08 -1.58 0.70 0.00 0.00 175.17 174.01 1jzn s GLN 121 N 0.29 1.25 -0.01 2.11 2.00 0.38 -4.86 119.66 120.82 1jzn s GLN 121 Ca 0.51 -1.65 -0.30 0.00 -2.00 0.00 0.00 55.36 51.91 1jzn s GLN 121 Cb -0.25 -0.07 -0.07 0.00 0.80 0.00 0.00 33.01 33.42 1jzn s GLN 121 CO 0.31 -0.29 1.80 0.08 -0.50 0.00 0.00 175.29 176.68 1jzn s VAL 122 N -3.88 3.32 0.60 1.34 1.01 -1.26 -2.64 120.40 118.89 1jzn s VAL 122 Ca 0.34 0.39 0.33 0.00 0.00 0.00 0.00 61.98 63.05 1jzn s VAL 122 Cb 0.07 -3.25 0.37 0.00 0.00 0.00 0.00 36.38 33.57 1jzn s VAL 122 CO 0.10 -0.03 2.28 0.00 0.00 0.00 0.00 175.10 177.45 1jzn n GLU 124 N -3.66 0.45 -2.05 0.00 -0.58 -1.26 -1.64 120.64 111.89 1jzn n GLU 124 Ca -0.03 -0.19 -0.32 0.00 -0.42 0.00 0.00 57.16 56.20 1jzn n GLU 124 Cb 0.08 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.46 1jzn n GLU 124 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1jzn s SER 125 N -2.68 6.13 -0.04 1.62 0.15 -0.50 -4.76 113.70 113.62 1jzn s SER 125 Ca 0.22 1.60 -0.02 0.00 0.70 0.00 0.00 55.95 58.44 1jzn s SER 125 Cb 0.19 -2.50 -0.04 0.00 -1.71 0.00 0.00 66.02 61.96 1jzn s SER 125 CO 0.54 -0.93 0.11 -0.54 1.20 0.00 0.00 173.24 173.62 1jzn s LYS 126 N -4.51 3.22 0.24 5.44 1.02 -1.26 -3.96 119.74 119.93 1jzn s LYS 126 Ca 0.59 -0.36 -0.08 0.00 0.02 0.00 0.00 55.97 56.13 1jzn s LYS 126 Cb -0.12 -2.98 -0.02 0.00 -0.52 0.00 0.00 37.83 34.20 1jzn s LYS 126 CO 0.42 0.69 0.36 -0.51 -0.92 0.00 0.00 175.35 175.39 1jzn s ASP 127 N -1.54 0.06 0.96 2.83 1.01 -0.55 -4.80 116.67 114.64 1jzn s ASP 127 Ca 0.21 -1.13 -0.14 0.00 0.71 0.00 0.00 52.55 52.21 1jzn s ASP 127 Cb -0.12 0.52 0.17 0.00 1.01 0.00 0.00 42.92 44.50 1jzn s ASP 127 CO 0.12 -1.05 1.17 0.00 0.21 0.00 0.00 175.17 175.62 1jzn s ALA 128 N -4.00 1.73 0.07 5.23 0.00 -0.61 -1.77 121.76 122.41 1jzn s ALA 128 Ca 0.29 -0.72 -0.15 0.00 0.00 0.00 0.00 51.96 51.38 1jzn s ALA 128 Cb 0.02 -2.96 0.03 0.00 0.00 0.00 0.00 23.12 20.21 1jzn s ALA 128 CO 0.11 -2.48 0.34 -0.59 0.00 0.00 0.00 175.76 173.15 1jzn s PHE 129 N -3.37 -0.15 -0.34 0.00 -0.71 -0.47 -1.07 117.98 111.88 1jzn s PHE 129 Ca 0.67 -0.03 -0.05 0.00 -1.04 0.00 0.00 56.93 56.48 1jzn s PHE 129 Cb -0.12 0.15 0.05 0.00 -1.21 0.00 0.00 43.02 41.90 1jzn s PHE 129 CO 0.53 -0.57 0.09 -1.17 -1.34 0.00 0.00 175.22 172.76 1jzn s LEU 130 N -2.29 4.31 0.41 -1.99 0.20 -1.06 0.05 118.68 118.30 1jzn s LEU 130 Ca -0.02 -1.29 -0.04 0.00 0.69 0.00 0.00 54.13 53.47 1jzn s LEU 130 Cb 0.00 -1.82 -0.04 0.00 -0.43 0.00 0.00 46.19 43.91 1jzn s LEU 130 CO -0.06 -0.34 0.68 0.00 -0.29 0.00 0.00 176.35 176.34 1jzn s GLN 132 N -4.39 0.30 0.18 0.00 0.74 0.91 -2.23 119.66 115.17 1jzn s GLN 132 Ca 0.45 0.11 0.00 0.00 0.05 0.00 0.00 55.36 55.98 1jzn s GLN 132 Cb -0.10 -0.56 -0.04 0.00 1.10 0.00 0.00 33.01 33.41 1jzn s GLN 132 CO 0.39 -0.18 0.06 0.00 -0.55 0.00 0.00 175.29 175.01 1jzn s LYS 134 N -4.02 2.98 0.00 0.00 3.01 -1.26 -0.94 119.74 119.51 1jzn s LYS 134 Ca 0.29 -0.85 0.11 0.00 -1.01 0.00 0.00 55.97 54.51 1jzn s LYS 134 Cb 0.07 -2.29 0.09 0.00 -1.01 0.00 0.00 37.83 34.68 1jzn s LYS 134 CO 0.07 0.13 0.84 1.19 0.51 0.00 0.00 175.35 178.08