#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jx9 s ASN 2 N 0.00 3.95 -0.26 6.43 2.20 -0.79 -3.10 114.94 123.37 1jx9 s ASN 2 Ca 0.00 -1.12 -0.25 0.00 -0.94 0.00 0.00 52.86 50.55 1jx9 s ASN 2 Cb 0.00 -0.43 0.09 0.00 -2.00 0.00 0.00 41.25 38.91 1jx9 s ASN 2 CO 0.00 -0.24 0.84 -0.32 -2.94 0.00 0.00 177.10 174.44 1jx9 s MET 3 N -3.67 0.72 -0.02 3.55 1.75 -0.31 0.05 119.30 121.37 1jx9 s MET 3 Ca 0.34 0.79 0.00 0.00 -1.25 0.00 0.00 55.69 55.57 1jx9 s MET 3 Cb 0.02 0.35 0.02 0.00 2.84 0.00 0.00 34.83 38.06 1jx9 s MET 3 CO 0.18 -0.10 0.00 1.67 -0.65 0.00 0.00 175.02 176.12 1jx9 s TRP 4 N 0.20 0.23 -0.18 4.11 -2.14 -0.54 -1.01 118.94 119.61 1jx9 s TRP 4 Ca 0.01 0.02 0.00 0.00 2.66 0.00 0.00 56.10 58.79 1jx9 s TRP 4 Cb -0.05 -0.33 0.01 0.00 -3.10 0.00 0.00 33.47 30.00 1jx9 s TRP 4 CO -0.01 -0.10 -0.17 0.08 -2.66 0.00 0.00 176.95 174.08 1jx9 s VAL 5 N 0.89 2.34 -0.26 -0.66 1.01 0.17 -1.62 120.40 122.26 1jx9 s VAL 5 Ca -0.09 -0.85 -0.07 0.00 0.00 0.00 0.00 61.98 60.98 1jx9 s VAL 5 Cb -0.12 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 1jx9 s VAL 5 CO -0.02 0.52 0.06 -0.63 0.00 0.00 0.00 175.10 175.03 1jx9 s ILE 6 N 1.22 4.02 0.85 2.22 1.01 -0.08 -0.45 121.20 129.99 1jx9 s ILE 6 Ca 0.03 -0.44 -0.09 0.00 0.00 0.00 0.00 60.65 60.15 1jx9 s ILE 6 Cb -0.14 -2.95 0.16 0.00 0.01 0.00 0.00 42.46 39.54 1jx9 s ILE 6 CO -0.09 0.24 1.17 -0.83 0.00 0.00 0.00 174.94 175.44 1jx9 s GLY 7 N 1.55 1.77 0.30 6.18 0.00 -0.23 -1.29 107.32 115.60 1jx9 s GLY 7 Ca 0.05 -1.43 0.06 0.00 0.00 0.00 0.00 44.72 43.39 1jx9 s GLY 7 CO 0.02 -0.76 1.66 1.70 0.00 0.00 0.00 173.10 175.72 1jx9 h LYS 8 N -1.12 0.26 0.00 2.90 3.64 -0.62 0.14 116.57 121.76 1jx9 h LYS 8 Ca -0.41 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1jx9 h LYS 8 Cb 1.25 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1jx9 h LYS 8 CO 0.40 0.17 0.00 0.66 -2.27 0.00 0.00 179.45 178.41 1jx9 h SER 9 N 0.27 0.00 0.00 4.20 4.64 -1.86 -3.15 113.55 117.64 1jx9 h SER 9 Ca 0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 1jx9 h SER 9 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1jx9 h SER 9 CO -0.63 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 175.62 1jx9 n LYS 10 N -2.65 -0.68 -3.33 4.77 5.02 0.23 -4.87 118.16 116.66 1jx9 n LYS 10 Ca -0.00 -0.37 -0.38 0.00 -2.02 0.00 0.00 58.31 55.54 1jx9 n LYS 10 Cb 0.17 -0.87 -0.06 0.00 -0.02 0.00 0.00 35.03 34.26 1jx9 n LYS 10 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1jx9 s ALA 11 N -0.01 3.56 -0.13 7.82 0.00 0.21 -1.09 121.76 132.12 1jx9 s ALA 11 Ca 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 51.96 51.84 1jx9 s ALA 11 Cb 0.00 -2.60 -0.03 0.00 0.00 0.00 0.00 23.12 20.50 1jx9 s ALA 11 CO 0.00 0.25 -0.05 -1.14 0.00 0.00 0.00 175.76 174.82 1jx9 s GLN 12 N -0.38 3.45 -1.84 0.00 2.00 0.75 -4.46 119.66 119.17 1jx9 s GLN 12 Ca 0.27 -0.53 0.00 0.00 -2.00 0.00 0.00 55.36 53.10 1jx9 s GLN 12 Cb -0.17 -2.82 0.00 0.00 0.80 0.00 0.00 33.01 30.82 1jx9 s GLN 12 CO 0.15 0.34 0.00 -0.25 -0.50 0.00 0.00 175.29 175.03 1jx9 n ASP 13 N 3.22 -5.76 -3.65 6.67 8.00 -1.26 -4.34 116.55 119.42 1jx9 n ASP 13 Ca -0.18 0.08 -0.00 0.00 0.71 0.00 0.00 54.79 55.41 1jx9 n ASP 13 Cb 0.53 -4.83 -0.00 0.00 -0.02 0.00 0.00 41.12 36.79 1jx9 n ASP 13 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jx9 s ALA 14 N -2.97 -2.03 -0.13 2.24 0.00 -1.26 -1.21 121.76 116.40 1jx9 s ALA 14 Ca 0.00 0.36 0.15 0.00 0.00 0.00 0.00 51.96 52.47 1jx9 s ALA 14 Cb 0.00 0.53 -0.22 0.00 0.00 0.00 0.00 23.12 23.44 1jx9 s ALA 14 CO 0.00 -1.06 0.14 1.63 0.00 0.00 0.00 175.76 176.46 1jx9 n LYS 15 N -0.55 1.14 -3.60 0.00 5.02 0.18 -4.69 118.16 115.66 1jx9 n LYS 15 Ca -0.06 -0.05 -0.16 0.00 -2.02 0.00 0.00 58.31 56.02 1jx9 n LYS 15 Cb 0.61 -1.42 -0.07 0.00 -0.02 0.00 0.00 35.03 34.14 1jx9 n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1jx9 s ALA 16 N -2.60 -1.48 -0.01 7.82 0.00 -1.20 -0.48 121.76 123.81 1jx9 s ALA 16 Ca -0.08 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.02 1jx9 s ALA 16 Cb 0.06 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.05 1jx9 s ALA 16 CO 0.68 -0.33 0.01 0.42 0.00 0.00 0.00 175.76 176.54 1jx9 s ILE 17 N -0.97 -0.00 -0.10 0.00 1.01 -0.41 -0.59 121.20 120.13 1jx9 s ILE 17 Ca -0.10 0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.64 1jx9 s ILE 17 Cb -0.02 -0.06 0.02 0.00 0.01 0.00 0.00 42.46 42.41 1jx9 s ILE 17 CO 0.07 0.04 -0.10 -0.32 0.00 0.00 0.00 174.94 174.63 1jx9 s MET 18 N 0.44 1.68 -0.15 2.79 1.75 -0.05 -0.90 119.30 124.86 1jx9 s MET 18 Ca -0.04 -0.34 -0.00 0.00 -1.25 0.00 0.00 55.69 54.06 1jx9 s MET 18 Cb -0.05 -1.59 0.03 0.00 2.84 0.00 0.00 34.83 36.06 1jx9 s MET 18 CO -0.01 -0.16 -0.09 0.08 -0.65 0.00 0.00 175.02 174.19 1jx9 s VAL 19 N 1.33 1.27 -0.07 10.11 1.01 -0.64 -1.08 120.40 132.33 1jx9 s VAL 19 Ca -0.02 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 61.41 1jx9 s VAL 19 Cb -0.14 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 1jx9 s VAL 19 CO -0.04 0.27 -0.22 0.21 0.00 0.00 0.00 175.10 175.31 1jx9 s ASN 20 N 1.58 3.29 -0.50 3.32 3.04 -0.49 -1.47 114.94 123.71 1jx9 s ASN 20 Ca 0.02 -0.46 0.05 0.00 0.04 0.00 0.00 52.86 52.52 1jx9 s ASN 20 Cb -0.14 -1.00 0.20 0.00 -1.54 0.00 0.00 41.25 38.77 1jx9 s ASN 20 CO -0.09 0.24 0.47 0.61 -3.04 0.00 0.00 177.10 175.29 1jx9 n GLY 21 N 3.02 3.05 3.77 1.21 0.00 0.11 -2.50 105.19 113.83 1jx9 n GLY 21 Ca -0.18 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.61 1jx9 n GLY 21 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jx9 s PRO 22 N -0.88 4.30 -0.33 1.61 0.04 -1.24 -1.88 135.00 136.62 1jx9 s PRO 22 Ca 0.33 2.29 0.03 0.00 0.04 0.00 0.00 61.00 63.68 1jx9 s PRO 22 Cb 0.07 -3.06 0.10 0.00 0.04 0.00 0.00 34.50 31.64 1jx9 s PRO 22 CO -0.15 -0.29 0.05 -0.65 0.04 0.00 0.00 177.00 176.00 1jx9 s GLN 23 N -1.51 1.36 -0.01 4.56 -0.21 -1.26 0.49 119.66 123.09 1jx9 s GLN 23 Ca 0.52 -1.68 0.02 0.00 0.02 0.00 0.00 55.36 54.24 1jx9 s GLN 23 Cb -0.41 -2.95 0.06 0.00 1.00 0.00 0.00 33.01 30.71 1jx9 s GLN 23 CO 0.52 -0.93 1.05 0.00 -2.12 0.00 0.00 175.29 173.81 1jx9 n ALA 24 N 4.38 2.04 0.00 6.09 0.00 -1.26 -4.57 120.51 127.19 1jx9 n ALA 24 Ca 0.02 -1.08 0.00 0.00 0.00 0.00 0.00 53.44 52.38 1jx9 n ALA 24 Cb 0.42 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.79 1jx9 n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jx9 n GLY 25 N -0.38 -3.72 3.26 0.00 0.00 -1.25 -4.85 105.19 98.25 1jx9 n GLY 25 Ca 0.02 -2.05 -0.32 0.00 0.00 0.00 0.00 46.02 43.67 1jx9 n GLY 25 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1jx9 s TRP 26 N -0.80 2.55 0.05 1.61 0.51 -1.26 -4.67 118.94 116.93 1jx9 s TRP 26 Ca 0.00 -0.86 0.01 0.00 -2.12 0.00 0.00 56.10 53.13 1jx9 s TRP 26 Cb 0.00 -1.68 -0.03 0.00 -0.81 0.00 0.00 33.47 30.95 1jx9 s TRP 26 CO 0.00 -0.30 -0.06 0.71 -0.51 0.00 0.00 176.95 176.79 1jx9 s TYR 27 N 0.12 0.62 -0.12 -1.98 2.02 -1.26 -0.98 117.35 115.77 1jx9 s TYR 27 Ca -0.11 -0.70 0.01 0.00 -0.37 0.00 0.00 57.07 55.90 1jx9 s TYR 27 Cb -0.16 -0.39 0.02 0.00 -0.40 0.00 0.00 41.96 41.03 1jx9 s TYR 27 CO 0.06 -0.17 -0.15 0.00 -1.57 0.00 0.00 175.55 173.73 1jx9 s ALA 28 N -2.35 1.70 1.24 3.71 0.00 0.37 -3.43 121.76 123.00 1jx9 s ALA 28 Ca -0.03 -0.75 -0.20 0.00 0.00 0.00 0.00 51.96 50.97 1jx9 s ALA 28 Cb -0.03 -0.88 0.30 0.00 0.00 0.00 0.00 23.12 22.51 1jx9 s ALA 28 CO -0.03 -0.15 1.11 -1.25 0.00 0.00 0.00 175.76 175.44 1jx9 s PRO 29 N 1.11 -1.52 0.35 0.00 0.04 -1.26 -4.32 135.00 129.40 1jx9 s PRO 29 Ca -0.04 -0.14 -0.25 0.00 0.04 0.00 0.00 61.00 60.60 1jx9 s PRO 29 Cb -0.14 -1.57 -0.13 0.00 0.04 0.00 0.00 34.50 32.70 1jx9 s PRO 29 CO -0.04 -3.90 0.83 0.00 0.04 0.00 0.00 177.00 173.94 1jx9 n ALA 30 N -4.88 -0.73 -0.14 8.56 0.00 -1.22 -4.90 120.51 117.21 1jx9 n ALA 30 Ca 0.14 0.29 -0.06 0.00 0.00 0.00 0.00 53.44 53.81 1jx9 n ALA 30 Cb 0.60 -1.93 0.12 0.00 0.00 0.00 0.00 19.45 18.24 1jx9 n ALA 30 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1jx9 h TYR 31 N 1.43 0.93 -1.61 0.00 3.20 -1.80 -3.45 116.97 115.68 1jx9 h TYR 31 Ca -0.40 -0.14 -0.52 0.00 3.14 0.00 0.00 58.73 60.81 1jx9 h TYR 31 Cb 1.37 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 39.33 1jx9 h TYR 31 CO 0.43 0.85 -0.44 0.95 -1.64 0.00 0.00 178.16 178.31 1jx9 s THR 32 N -4.99 2.67 -0.11 1.81 -4.23 -1.26 -2.66 115.64 106.87 1jx9 s THR 32 Ca -0.10 -1.49 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 1jx9 s THR 32 Cb 0.14 -3.01 0.02 0.00 1.34 0.00 0.00 72.50 70.99 1jx9 s THR 32 CO 0.82 -0.04 -0.09 -0.47 -0.54 0.00 0.00 174.62 174.30 1jx9 s TYR 33 N -2.49 1.55 0.04 3.99 5.04 0.18 -4.84 117.35 120.82 1jx9 s TYR 33 Ca 0.44 -0.74 -0.30 0.00 -2.44 0.00 0.00 57.07 54.03 1jx9 s TYR 33 Cb -0.01 -1.23 -0.05 0.00 0.35 0.00 0.00 41.96 41.01 1jx9 s TYR 33 CO 0.26 -0.47 1.24 0.20 -1.34 0.00 0.00 175.55 175.43 1jx9 s GLY 34 N 1.43 2.27 -0.11 8.97 0.00 -1.26 -0.77 107.32 117.85 1jx9 s GLY 34 Ca 0.00 0.84 -0.18 0.00 0.00 0.00 0.00 44.72 45.39 1jx9 s GLY 34 CO -0.06 2.14 0.46 -1.50 0.00 0.00 0.00 173.10 174.14 1jx9 s ILE 35 N 1.37 0.02 -0.06 0.90 1.10 -0.70 -4.99 121.20 118.84 1jx9 s ILE 35 Ca 0.59 -0.13 0.03 0.00 -0.51 0.00 0.00 60.65 60.63 1jx9 s ILE 35 Cb -0.30 -0.69 0.01 0.00 0.15 0.00 0.00 42.46 41.63 1jx9 s ILE 35 CO 0.28 -0.07 -0.13 -0.83 -2.11 0.00 0.00 174.94 172.08 1jx9 s GLY 36 N -0.39 0.78 -0.07 1.50 0.00 -1.26 -2.76 107.32 105.14 1jx9 s GLY 36 Ca -0.05 -0.45 0.04 0.00 0.00 0.00 0.00 44.72 44.26 1jx9 s GLY 36 CO 0.03 0.01 -0.19 1.08 0.00 0.00 0.00 173.10 174.03 1jx9 s LEU 37 N 0.49 1.93 -0.28 0.66 1.43 -0.73 -4.98 118.68 117.20 1jx9 s LEU 37 Ca -0.11 -0.42 -0.03 0.00 -1.03 0.00 0.00 54.13 52.53 1jx9 s LEU 37 Cb -0.14 -1.13 0.11 0.00 0.03 0.00 0.00 46.19 45.06 1jx9 s LEU 37 CO 0.03 0.14 0.17 -1.00 0.23 0.00 0.00 176.35 175.93 1jx9 s HIS 38 N 0.22 0.10 0.00 0.29 3.76 -1.26 -0.26 115.29 118.14 1jx9 s HIS 38 Ca -0.10 -0.64 0.00 0.00 -0.15 0.00 0.00 55.06 54.17 1jx9 s HIS 38 Cb -0.15 -0.76 0.00 0.00 1.11 0.00 0.00 32.58 32.78 1jx9 s HIS 38 CO 0.05 -0.83 0.00 0.41 -0.85 0.00 0.00 174.74 173.52 1jx9 n GLY 39 N 5.27 3.94 3.86 -2.22 0.00 0.41 -4.98 105.19 111.47 1jx9 n GLY 39 Ca -0.05 -1.62 -0.27 0.00 0.00 0.00 0.00 46.02 44.08 1jx9 n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jx9 n ALA 40 N -1.89 -1.66 -0.13 4.61 0.00 -1.26 -1.60 120.51 118.58 1jx9 n ALA 40 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1jx9 n ALA 40 Cb 0.00 -3.04 0.00 0.00 0.00 0.00 0.00 19.45 16.41 1jx9 n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jx9 n GLY 41 N -1.67 1.89 3.70 0.00 0.00 -1.26 -5.03 105.19 102.82 1jx9 n GLY 41 Ca -0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.61 1jx9 n GLY 41 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jx9 s TYR 42 N -2.84 2.97 -0.46 1.61 2.02 -0.62 -4.73 117.35 115.30 1jx9 s TYR 42 Ca 0.00 -0.06 0.05 0.00 -0.37 0.00 0.00 57.07 56.69 1jx9 s TYR 42 Cb 0.00 -1.48 0.19 0.00 -0.40 0.00 0.00 41.96 40.27 1jx9 s TYR 42 CO 0.00 0.50 0.76 0.34 -1.57 0.00 0.00 175.55 175.58 1jx9 s ASP 43 N -2.70 -1.29 0.17 2.29 2.15 -1.16 -0.44 116.67 115.69 1jx9 s ASP 43 Ca 0.27 -1.26 0.00 0.00 0.43 0.00 0.00 52.55 52.00 1jx9 s ASP 43 Cb -0.11 1.68 -0.04 0.00 -0.30 0.00 0.00 42.92 44.15 1jx9 s ASP 43 CO 0.20 -0.08 0.05 0.68 -0.17 0.00 0.00 175.17 175.85 1jx9 s VAL 44 N 1.19 0.39 -0.02 1.11 -7.23 0.64 -4.31 120.40 112.17 1jx9 s VAL 44 Ca 0.25 -1.96 -0.21 0.00 -1.81 0.00 0.00 61.98 58.25 1jx9 s VAL 44 Cb 0.01 -2.20 0.04 0.00 0.56 0.00 0.00 36.38 34.78 1jx9 s VAL 44 CO -0.07 -0.36 0.45 0.28 -0.31 0.00 0.00 175.10 175.09 1jx9 s THR 45 N -3.86 0.04 -5.00 5.32 -1.32 -1.03 -1.78 115.64 108.02 1jx9 s THR 45 Ca 0.27 -0.31 0.00 0.00 -1.21 0.00 0.00 61.69 60.44 1jx9 s THR 45 Cb 0.07 -0.78 0.00 0.00 -1.51 0.00 0.00 72.50 70.28 1jx9 s THR 45 CO 0.05 -0.17 0.00 0.61 -2.21 0.00 0.00 174.62 172.90 1jx9 n GLY 46 N 1.07 0.24 3.22 6.08 0.00 -1.11 -1.74 105.19 112.96 1jx9 n GLY 46 Ca -0.20 -1.32 -0.09 0.00 0.00 0.00 0.00 46.02 44.40 1jx9 n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jx9 s ASN 47 N -4.00 0.15 -0.14 1.61 2.20 -0.11 -1.71 114.94 112.94 1jx9 s ASN 47 Ca 0.00 -0.79 -0.20 0.00 -0.94 0.00 0.00 52.86 50.94 1jx9 s ASN 47 Cb 0.00 0.35 0.05 0.00 -2.00 0.00 0.00 41.25 39.65 1jx9 s ASN 47 CO 0.00 -0.76 0.51 0.28 -2.94 0.00 0.00 177.10 174.19 1jx9 s THR 48 N -3.91 0.01 0.24 0.54 -1.32 0.05 -2.56 115.64 108.68 1jx9 s THR 48 Ca 0.10 -0.08 -0.31 0.00 -1.21 0.00 0.00 61.69 60.19 1jx9 s THR 48 Cb 0.05 -0.75 -0.11 0.00 -1.51 0.00 0.00 72.50 70.18 1jx9 s THR 48 CO -0.07 -0.05 1.60 -2.84 -2.21 0.00 0.00 174.62 171.05 1jx9 s PRO 49 N -0.24 4.16 -1.59 7.08 0.02 -1.26 0.47 135.00 143.64 1jx9 s PRO 49 Ca -0.04 2.50 0.00 0.00 0.02 0.00 0.00 61.00 63.48 1jx9 s PRO 49 Cb -0.03 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.41 1jx9 s PRO 49 CO 0.03 -0.63 0.00 1.19 -0.33 0.00 0.00 177.00 177.26 1jx9 n PHE 50 N 3.08 -0.55 -3.80 6.54 3.72 -1.09 -2.20 117.46 123.16 1jx9 n PHE 50 Ca 0.11 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.28 1jx9 n PHE 50 Cb 0.37 -3.02 0.01 0.00 -0.94 0.00 0.00 39.48 35.91 1jx9 n PHE 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1jx9 n ALA 51 N -0.10 -1.96 -1.75 4.37 0.00 -1.09 -4.91 120.51 115.07 1jx9 n ALA 51 Ca -0.17 -0.18 -0.38 0.00 0.00 0.00 0.00 53.44 52.71 1jx9 n ALA 51 Cb 0.56 -1.97 0.05 0.00 0.00 0.00 0.00 19.45 18.09 1jx9 n ALA 51 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1jx9 s TYR 52 N -3.74 2.23 0.38 0.00 2.02 -0.93 -4.87 117.35 112.44 1jx9 s TYR 52 Ca 0.06 1.37 0.13 0.00 -0.37 0.00 0.00 57.07 58.25 1jx9 s TYR 52 Cb -0.03 -3.82 0.94 0.00 -0.40 0.00 0.00 41.96 38.65 1jx9 s TYR 52 CO 0.84 -3.00 1.84 -1.35 -1.57 0.00 0.00 175.55 172.31 1jx9 h PRO 53 N 1.36 0.54 -5.39 -1.71 0.11 -1.93 -3.38 132.00 121.60 1jx9 h PRO 53 Ca -0.51 -0.03 -0.60 0.00 0.11 0.00 0.00 66.00 64.96 1jx9 h PRO 53 Cb 1.31 -0.12 -0.12 0.00 0.11 0.00 0.00 31.00 32.18 1jx9 h PRO 53 CO 0.57 0.36 -0.22 0.20 -0.21 0.00 0.00 178.00 178.70 1jx9 s GLY 54 N -3.77 2.07 -0.16 -0.55 0.00 -1.26 -4.91 107.32 98.73 1jx9 s GLY 54 Ca -0.09 -0.56 -0.29 0.00 0.00 0.00 0.00 44.72 43.77 1jx9 s GLY 54 CO 0.79 0.80 1.50 1.08 0.00 0.00 0.00 173.10 177.26 1jx9 s LEU 55 N 1.32 4.11 0.35 0.66 1.02 -1.26 -4.85 118.68 120.03 1jx9 s LEU 55 Ca 0.18 1.79 0.17 0.00 0.02 0.00 0.00 54.13 56.29 1jx9 s LEU 55 Cb -0.15 -3.53 0.57 0.00 0.02 0.00 0.00 46.19 43.10 1jx9 s LEU 55 CO 0.08 -1.00 1.68 0.58 0.02 0.00 0.00 176.35 177.72 1jx9 h VAL 56 N 5.76 0.97 -3.22 -1.59 2.07 -1.91 -3.41 116.25 114.92 1jx9 h VAL 56 Ca -0.33 -1.69 -0.58 0.00 0.82 0.00 0.00 66.70 64.92 1jx9 h VAL 56 Cb 1.14 2.02 -0.40 0.00 -1.52 0.00 0.00 31.29 32.53 1jx9 h VAL 56 CO 0.98 0.42 -0.76 -0.36 0.02 0.00 0.00 177.57 177.87 1jx9 s PHE 57 N -3.53 1.74 -0.02 1.57 0.08 -1.06 -3.98 117.98 112.77 1jx9 s PHE 57 Ca 0.00 -1.67 -0.10 0.00 0.12 0.00 0.00 56.93 55.29 1jx9 s PHE 57 Cb 0.11 -1.66 0.03 0.00 -0.57 0.00 0.00 43.02 40.93 1jx9 s PHE 57 CO 0.70 -0.84 0.44 0.41 -0.10 0.00 0.00 175.22 175.83 1jx9 n GLY 58 N 4.84 0.36 3.58 4.36 0.00 -1.17 -0.93 105.19 116.22 1jx9 n GLY 58 Ca -0.03 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 45.01 1jx9 n GLY 58 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1jx9 s HIS 59 N -2.25 0.42 -0.07 1.61 -3.43 -0.71 -0.93 115.29 109.92 1jx9 s HIS 59 Ca 0.10 -0.78 0.14 0.00 -0.80 0.00 0.00 55.06 53.72 1jx9 s HIS 59 Cb -0.00 0.17 0.27 0.00 -1.43 0.00 0.00 32.58 31.59 1jx9 s HIS 59 CO -0.01 -1.01 1.13 0.27 -2.00 0.00 0.00 174.74 173.12 1jx9 n ASN 60 N -0.47 1.14 0.00 7.38 0.23 -0.52 -2.46 115.26 120.57 1jx9 n ASN 60 Ca -0.01 -2.63 0.00 0.00 -0.53 0.00 0.00 54.58 51.40 1jx9 n ASN 60 Cb 0.62 -0.35 0.00 0.00 -2.08 0.00 0.00 39.78 37.97 1jx9 n ASN 60 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1jx9 n GLY 61 N -0.40 2.98 0.54 4.83 0.00 -1.26 -4.63 105.19 107.24 1jx9 n GLY 61 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.07 1jx9 n GLY 61 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1jx9 n VAL 62 N -2.00 0.26 -4.38 1.61 0.31 -1.26 -4.82 118.33 108.06 1jx9 n VAL 62 Ca 0.00 -0.08 -0.19 0.00 -0.01 0.00 0.00 64.34 64.06 1jx9 n VAL 62 Cb 0.00 -1.22 -0.10 0.00 -0.91 0.00 0.00 33.84 31.60 1jx9 n VAL 62 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1jx9 s ILE 63 N -2.09 0.80 0.05 2.52 -4.36 -1.26 -1.21 121.20 115.65 1jx9 s ILE 63 Ca -0.07 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.30 1jx9 s ILE 63 Cb 0.02 -2.69 -0.03 0.00 1.25 0.00 0.00 42.46 41.01 1jx9 s ILE 63 CO 0.09 0.00 0.00 -0.94 0.24 0.00 0.00 174.94 174.34 1jx9 s SER 64 N -3.39 0.41 0.11 4.36 1.04 0.38 -1.43 113.70 115.18 1jx9 s SER 64 Ca 0.37 -0.91 -0.07 0.00 0.48 0.00 0.00 55.95 55.83 1jx9 s SER 64 Cb 0.08 0.21 -0.01 0.00 0.10 0.00 0.00 66.02 66.40 1jx9 s SER 64 CO 0.15 -0.60 0.17 -1.66 0.98 0.00 0.00 173.24 172.28 1jx9 s TRP 65 N -3.72 0.37 0.37 5.02 -2.14 -0.11 -2.29 118.94 116.44 1jx9 s TRP 65 Ca 0.05 -0.79 -0.16 0.00 2.66 0.00 0.00 56.10 57.85 1jx9 s TRP 65 Cb 0.06 -0.16 0.05 0.00 -3.10 0.00 0.00 33.47 30.33 1jx9 s TRP 65 CO -0.09 -0.58 0.80 0.20 -2.66 0.00 0.00 176.95 174.62 1jx9 s GLY 66 N -2.93 0.32 0.09 3.67 0.00 -0.88 -3.07 107.32 104.52 1jx9 s GLY 66 Ca 0.12 -0.69 -0.10 0.00 0.00 0.00 0.00 44.72 44.04 1jx9 s GLY 66 CO -0.06 -0.12 0.23 -0.56 0.00 0.00 0.00 173.10 172.59 1jx9 s SER 67 N -3.08 0.06 -0.08 1.64 0.01 -1.26 -1.22 113.70 109.77 1jx9 s SER 67 Ca 0.16 -0.58 -0.11 0.00 1.31 0.00 0.00 55.95 56.73 1jx9 s SER 67 Cb -0.05 0.36 0.02 0.00 0.21 0.00 0.00 66.02 66.56 1jx9 s SER 67 CO 0.11 -0.74 0.27 0.42 0.41 0.00 0.00 173.24 173.71 1jx9 s THR 68 N -3.77 0.02 0.28 1.44 -4.23 -0.81 -4.72 115.64 103.84 1jx9 s THR 68 Ca 0.04 -0.17 -0.30 0.00 -1.18 0.00 0.00 61.69 60.08 1jx9 s THR 68 Cb 0.04 -0.45 -0.13 0.00 1.34 0.00 0.00 72.50 73.30 1jx9 s THR 68 CO -0.11 -0.09 1.26 0.00 -0.54 0.00 0.00 174.62 175.14 1jx9 n ALA 69 N 2.43 0.71 0.11 3.99 0.00 -1.26 -0.49 120.51 125.99 1jx9 n ALA 69 Ca -0.16 0.40 -0.23 0.00 0.00 0.00 0.00 53.44 53.45 1jx9 n ALA 69 Cb 0.57 -2.19 -0.15 0.00 0.00 0.00 0.00 19.45 17.68 1jx9 n ALA 69 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1jx9 h GLY 70 N 3.12 0.51 -4.96 0.00 0.00 -1.19 -3.41 103.07 97.14 1jx9 h GLY 70 Ca -0.44 -1.31 -0.40 0.00 0.00 0.00 0.00 47.33 45.17 1jx9 h GLY 70 CO 0.68 1.15 -0.62 0.69 0.00 0.00 0.00 176.54 178.44 1jx9 n PHE 71 N -3.86 -2.07 -2.23 5.60 3.72 -1.25 -4.91 117.46 112.46 1jx9 n PHE 71 Ca -0.17 0.60 -0.26 0.00 -0.05 0.00 0.00 57.45 57.57 1jx9 n PHE 71 Cb 1.01 -4.23 0.06 0.00 -0.94 0.00 0.00 39.48 35.38 1jx9 n PHE 71 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1jx9 s GLY 72 N -2.82 1.65 -0.79 1.37 0.00 -1.26 -1.37 107.32 104.10 1jx9 s GLY 72 Ca 0.38 -0.80 -0.21 0.00 0.00 0.00 0.00 44.72 44.09 1jx9 s GLY 72 CO 0.47 -0.44 1.05 -0.35 0.00 0.00 0.00 173.10 173.83 1jx9 s ASP 73 N -4.44 6.38 -0.15 1.64 -1.08 -1.26 -4.24 116.67 113.52 1jx9 s ASP 73 Ca 0.58 -1.46 0.18 0.00 -0.52 0.00 0.00 52.55 51.33 1jx9 s ASP 73 Cb -0.11 -2.41 0.40 0.00 -1.46 0.00 0.00 42.92 39.34 1jx9 s ASP 73 CO 0.45 -1.28 1.28 -0.90 0.52 0.00 0.00 175.17 175.24 1jx9 n ASP 74 N 7.25 3.08 -3.81 -0.34 5.75 -1.26 -4.73 116.55 122.49 1jx9 n ASP 74 Ca 0.09 -3.05 -0.18 0.00 -0.01 0.00 0.00 54.79 51.64 1jx9 n ASP 74 Cb 0.47 -0.48 -0.17 0.00 -1.03 0.00 0.00 41.12 39.91 1jx9 n ASP 74 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1jx9 s VAL 75 N -2.85 0.22 0.17 2.12 1.01 -1.26 -0.61 120.40 119.20 1jx9 s VAL 75 Ca 0.37 0.10 0.08 0.00 0.00 0.00 0.00 61.98 62.52 1jx9 s VAL 75 Cb 0.31 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 36.32 1jx9 s VAL 75 CO 0.06 0.17 -0.17 -1.81 0.00 0.00 0.00 175.10 173.36 1jx9 s ASP 76 N 1.23 2.53 -0.14 3.32 1.01 0.13 -4.94 116.67 119.82 1jx9 s ASP 76 Ca -0.07 -0.89 -0.02 0.00 0.71 0.00 0.00 52.55 52.28 1jx9 s ASP 76 Cb -0.13 -0.14 -0.02 0.00 1.01 0.00 0.00 42.92 43.64 1jx9 s ASP 76 CO -0.02 -0.09 -0.07 -0.63 0.21 0.00 0.00 175.17 174.57 1jx9 s ILE 77 N -2.29 3.56 -0.22 0.77 1.01 -1.26 0.10 121.20 122.88 1jx9 s ILE 77 Ca 0.16 -0.48 -0.08 0.00 0.00 0.00 0.00 60.65 60.25 1jx9 s ILE 77 Cb -0.04 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 1jx9 s ILE 77 CO 0.06 0.51 0.08 -0.36 0.00 0.00 0.00 174.94 175.23 1jx9 s PHE 78 N 0.34 3.18 -0.57 3.97 0.40 -0.13 -1.59 117.98 123.58 1jx9 s PHE 78 Ca -0.07 -0.10 -0.27 0.00 -0.60 0.00 0.00 56.93 55.90 1jx9 s PHE 78 Cb -0.15 -2.17 0.03 0.00 0.51 0.00 0.00 43.02 41.24 1jx9 s PHE 78 CO 0.04 -0.07 1.10 0.00 0.70 0.00 0.00 175.22 176.99 1jx9 s ALA 79 N 1.00 3.06 0.22 5.36 0.00 0.18 -1.39 121.76 130.19 1jx9 s ALA 79 Ca 0.04 -0.97 -0.25 0.00 0.00 0.00 0.00 51.96 50.78 1jx9 s ALA 79 Cb -0.14 -3.92 -0.09 0.00 0.00 0.00 0.00 23.12 18.97 1jx9 s ALA 79 CO 0.03 -2.55 0.83 -1.21 0.00 0.00 0.00 175.76 172.86 1jx9 s GLU 80 N 4.58 4.56 -0.28 0.00 0.41 0.12 0.00 118.70 128.09 1jx9 s GLU 80 Ca 0.38 1.20 -0.17 0.00 -0.41 0.00 0.00 54.97 55.97 1jx9 s GLU 80 Cb -0.09 -3.10 -0.03 0.00 -1.78 0.00 0.00 34.13 29.14 1jx9 s GLU 80 CO 0.23 0.47 0.46 0.50 -0.49 0.00 0.00 175.26 176.43 1jx9 s ARG 81 N -1.50 3.95 0.51 1.61 3.52 -1.26 -2.71 118.95 123.07 1jx9 s ARG 81 Ca 0.41 0.10 0.08 0.00 -0.13 0.00 0.00 55.73 56.19 1jx9 s ARG 81 Cb -0.21 -3.69 0.04 0.00 -1.56 0.00 0.00 34.95 29.52 1jx9 s ARG 81 CO 0.26 -0.38 0.55 -0.51 -0.81 0.00 0.00 175.30 174.40 1jx9 s LEU 82 N 2.23 3.11 -0.10 -0.88 1.43 0.66 -1.92 118.68 123.21 1jx9 s LEU 82 Ca 0.18 -0.90 -0.04 0.00 -1.03 0.00 0.00 54.13 52.34 1jx9 s LEU 82 Cb -0.16 -1.72 0.05 0.00 0.03 0.00 0.00 46.19 44.40 1jx9 s LEU 82 CO 0.10 -1.04 0.22 -0.55 0.23 0.00 0.00 176.35 175.31 1jx9 s SER 83 N -4.38 0.10 0.58 2.29 0.15 -1.26 -4.72 113.70 106.46 1jx9 s SER 83 Ca 0.49 0.47 0.28 0.00 0.70 0.00 0.00 55.95 57.89 1jx9 s SER 83 Cb -0.04 0.42 1.75 0.00 -1.71 0.00 0.00 66.02 66.44 1jx9 s SER 83 CO 0.30 -0.20 2.24 0.00 1.20 0.00 0.00 173.24 176.78 1jx9 h ALA 84 N 7.69 1.55 0.00 5.45 0.00 -1.98 -1.10 119.26 130.87 1jx9 h ALA 84 Ca -0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1jx9 h ALA 84 Cb 1.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1jx9 h ALA 84 CO 0.28 0.01 -0.40 0.39 0.00 0.00 0.00 179.25 179.53 1jx9 n GLU 85 N -3.90 0.04 -3.20 0.00 -0.58 -1.26 -4.31 120.64 107.43 1jx9 n GLU 85 Ca -0.03 0.01 -0.24 0.00 -0.42 0.00 0.00 57.16 56.49 1jx9 n GLU 85 Cb 0.09 -1.52 -0.06 0.00 -0.57 0.00 0.00 31.44 29.38 1jx9 n GLU 85 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1jx9 n LYS 86 N -1.58 1.65 -1.85 3.49 5.02 -0.42 -5.10 118.16 119.37 1jx9 n LYS 86 Ca 0.06 -3.90 -0.41 0.00 -2.02 0.00 0.00 58.31 52.04 1jx9 n LYS 86 Cb 0.35 -1.76 -0.01 0.00 -0.02 0.00 0.00 35.03 33.59 1jx9 n LYS 86 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1jx9 s PRO 87 N -2.20 4.15 0.00 1.97 0.04 -1.21 -1.54 135.00 136.21 1jx9 s PRO 87 Ca 0.40 2.51 0.00 0.00 0.04 0.00 0.00 61.00 63.95 1jx9 s PRO 87 Cb 0.23 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.77 1jx9 s PRO 87 CO -0.08 -0.50 0.00 0.41 0.04 0.00 0.00 177.00 176.87 1jx9 n GLY 88 N 0.89 0.76 3.43 0.56 0.00 -1.26 -5.05 105.19 104.52 1jx9 n GLY 88 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 1jx9 n GLY 88 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jx9 s TYR 89 N -2.79 2.03 -0.07 1.61 1.51 -0.59 -1.19 117.35 117.88 1jx9 s TYR 89 Ca 0.00 -0.55 -0.13 0.00 -1.01 0.00 0.00 57.07 55.38 1jx9 s TYR 89 Cb 0.00 -1.04 0.03 0.00 -0.11 0.00 0.00 41.96 40.84 1jx9 s TYR 89 CO 0.00 0.45 0.32 1.52 -1.11 0.00 0.00 175.55 176.73 1jx9 s TYR 90 N -2.82 -0.26 -0.09 2.71 -0.85 -0.40 -4.42 117.35 111.22 1jx9 s TYR 90 Ca 0.28 0.55 -0.30 0.00 -0.52 0.00 0.00 57.07 57.08 1jx9 s TYR 90 Cb 0.00 0.11 -0.02 0.00 0.38 0.00 0.00 41.96 42.42 1jx9 s TYR 90 CO 0.12 -0.29 1.19 -1.17 -1.52 0.00 0.00 175.55 173.89 1jx9 s LEU 91 N -0.62 4.24 -0.15 -3.49 2.96 -0.81 -0.38 118.68 120.43 1jx9 s LEU 91 Ca -0.07 1.74 -0.06 0.00 -0.22 0.00 0.00 54.13 55.52 1jx9 s LEU 91 Cb -0.04 -3.55 0.07 0.00 0.50 0.00 0.00 46.19 43.17 1jx9 s LEU 91 CO 0.02 -0.62 0.33 -2.28 -1.32 0.00 0.00 176.35 172.49 1jx9 s HIS 92 N 2.54 -0.56 -1.41 5.38 5.65 0.02 -4.28 115.29 122.64 1jx9 s HIS 92 Ca 0.54 1.17 -0.07 0.00 0.25 0.00 0.00 55.06 56.95 1jx9 s HIS 92 Cb -0.23 0.12 0.04 0.00 -1.18 0.00 0.00 32.58 31.33 1jx9 s HIS 92 CO 0.19 -0.38 0.90 0.09 -0.65 0.00 0.00 174.74 174.89 1jx9 n ASN 93 N 5.08 -3.43 0.00 9.88 3.02 0.16 -1.86 115.26 128.11 1jx9 n ASN 93 Ca -0.12 -0.76 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 1jx9 n ASN 93 Cb 0.51 -4.17 0.00 0.00 -0.61 0.00 0.00 39.78 35.51 1jx9 n ASN 93 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jx9 n GLY 94 N -1.65 0.38 3.07 7.41 0.00 -1.26 -5.01 105.19 108.12 1jx9 n GLY 94 Ca -0.11 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.72 1jx9 n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jx9 s LYS 95 N -0.67 0.78 -0.46 1.61 1.02 -0.78 -5.09 119.74 116.15 1jx9 s LYS 95 Ca 0.00 -0.52 -0.28 0.00 0.02 0.00 0.00 55.97 55.19 1jx9 s LYS 95 Cb 0.00 -0.74 0.00 0.00 -0.52 0.00 0.00 37.83 36.57 1jx9 s LYS 95 CO 0.00 0.19 1.53 -1.58 -0.92 0.00 0.00 175.35 174.57 1jx9 s TRP 96 N -0.57 2.18 0.01 3.18 0.52 -1.26 -0.80 118.94 122.20 1jx9 s TRP 96 Ca 0.01 0.61 -0.10 0.00 0.02 0.00 0.00 56.10 56.65 1jx9 s TRP 96 Cb -0.06 -4.28 -0.05 0.00 -1.15 0.00 0.00 33.47 27.93 1jx9 s TRP 96 CO 0.00 -2.20 0.33 0.08 0.02 0.00 0.00 176.95 175.18 1jx9 s VAL 97 N 6.27 5.19 -0.02 4.03 1.01 0.48 -4.83 120.40 132.53 1jx9 s VAL 97 Ca 0.63 0.44 -0.29 0.00 0.00 0.00 0.00 61.98 62.75 1jx9 s VAL 97 Cb -0.14 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1jx9 s VAL 97 CO 0.29 0.43 0.97 -0.75 0.00 0.00 0.00 175.10 176.04 1jx9 s LYS 98 N -1.53 4.53 0.55 2.72 2.20 -1.26 -1.27 119.74 125.68 1jx9 s LYS 98 Ca 0.27 1.38 -0.18 0.00 -0.36 0.00 0.00 55.97 57.07 1jx9 s LYS 98 Cb -0.14 -3.47 -0.05 0.00 -1.51 0.00 0.00 37.83 32.65 1jx9 s LYS 98 CO 0.14 -0.09 1.08 -1.64 -0.36 0.00 0.00 175.35 174.49 1jx9 s MET 99 N 1.18 3.41 0.33 4.03 -1.94 -0.33 -4.96 119.30 121.02 1jx9 s MET 99 Ca 0.50 1.42 -0.26 0.00 -1.71 0.00 0.00 55.69 55.64 1jx9 s MET 99 Cb -0.20 -2.03 -0.10 0.00 2.01 0.00 0.00 34.83 34.51 1jx9 s MET 99 CO 0.26 -0.76 0.96 -0.51 -0.01 0.00 0.00 175.02 174.95 1jx9 s LEU 100 N -4.00 4.31 0.05 -0.03 1.43 0.11 -4.90 118.68 115.65 1jx9 s LEU 100 Ca 0.68 1.86 -0.09 0.00 -1.03 0.00 0.00 54.13 55.55 1jx9 s LEU 100 Cb -0.19 -4.05 0.00 0.00 0.03 0.00 0.00 46.19 41.98 1jx9 s LEU 100 CO 0.29 -0.12 0.20 -0.94 0.23 0.00 0.00 176.35 176.00 1jx9 s SER 101 N -1.62 0.05 -0.03 2.29 1.04 -1.26 -1.05 113.70 113.11 1jx9 s SER 101 Ca 0.51 -0.44 -0.17 0.00 0.48 0.00 0.00 55.95 56.34 1jx9 s SER 101 Cb -0.19 0.30 0.03 0.00 0.10 0.00 0.00 66.02 66.27 1jx9 s SER 101 CO 0.24 -0.60 0.37 0.00 0.98 0.00 0.00 173.24 174.22 1jx9 s ARG 102 N -2.90 0.70 -0.07 4.02 1.70 -0.65 -4.99 118.95 116.76 1jx9 s ARG 102 Ca -0.02 -0.06 -0.11 0.00 -0.47 0.00 0.00 55.73 55.06 1jx9 s ARG 102 Cb 0.00 0.32 -0.05 0.00 -0.57 0.00 0.00 34.95 34.65 1jx9 s ARG 102 CO -0.06 -0.19 0.28 -1.21 -1.08 0.00 0.00 175.30 173.04 1jx9 s GLU 103 N -1.17 3.75 0.05 3.89 0.41 -1.26 -1.21 118.70 123.16 1jx9 s GLU 103 Ca -0.12 0.15 0.05 0.00 -0.41 0.00 0.00 54.97 54.64 1jx9 s GLU 103 Cb -0.04 -3.23 -0.02 0.00 -1.78 0.00 0.00 34.13 29.05 1jx9 s GLU 103 CO 0.05 0.68 -0.15 -1.21 -0.49 0.00 0.00 175.26 174.14 1jx9 s GLU 104 N -0.90 0.95 -0.17 1.61 0.41 -0.13 -4.98 118.70 115.48 1jx9 s GLU 104 Ca 0.19 -0.84 0.01 0.00 -0.41 0.00 0.00 54.97 53.92 1jx9 s GLU 104 Cb -0.14 -0.98 0.03 0.00 -1.78 0.00 0.00 34.13 31.26 1jx9 s GLU 104 CO 0.08 0.24 -0.14 0.99 -0.49 0.00 0.00 175.26 175.94 1jx9 s THR 105 N -0.96 1.68 -0.51 3.63 2.01 -1.26 -1.01 115.64 119.22 1jx9 s THR 105 Ca 0.01 -0.82 -0.24 0.00 0.31 0.00 0.00 61.69 60.95 1jx9 s THR 105 Cb -0.09 -1.63 0.03 0.00 0.01 0.00 0.00 72.50 70.83 1jx9 s THR 105 CO 0.02 0.36 0.92 -0.63 -0.69 0.00 0.00 174.62 174.60 1jx9 s ILE 106 N 1.42 4.45 0.16 1.82 -1.09 0.41 -4.89 121.20 123.49 1jx9 s ILE 106 Ca 0.03 0.44 -0.30 0.00 -2.23 0.00 0.00 60.65 58.59 1jx9 s ILE 106 Cb -0.14 -4.48 -0.07 0.00 -1.58 0.00 0.00 42.46 36.19 1jx9 s ILE 106 CO -0.10 -0.98 1.08 -0.89 -1.23 0.00 0.00 174.94 172.82 1jx9 s THR 107 N 3.80 3.99 -0.16 2.92 2.01 -1.26 -1.26 115.64 125.68 1jx9 s THR 107 Ca 0.32 1.70 0.00 0.00 0.31 0.00 0.00 61.69 64.03 1jx9 s THR 107 Cb -0.12 -4.08 0.02 0.00 0.01 0.00 0.00 72.50 68.33 1jx9 s THR 107 CO 0.22 0.28 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.60 1jx9 s VAL 108 N -0.16 1.63 0.13 3.82 1.01 -1.26 -4.98 120.40 120.58 1jx9 s VAL 108 Ca 0.49 -0.70 -0.33 0.00 0.00 0.00 0.00 61.98 61.44 1jx9 s VAL 108 Cb -0.28 -1.54 -0.12 0.00 0.00 0.00 0.00 36.38 34.44 1jx9 s VAL 108 CO 0.34 0.44 1.71 1.17 0.00 0.00 0.00 175.10 178.76 1jx9 n LYS 109 N 4.75 2.43 -1.77 2.72 3.00 -1.26 -0.71 118.16 127.33 1jx9 n LYS 109 Ca -0.17 0.88 -0.20 0.00 -0.00 0.00 0.00 58.31 58.82 1jx9 n LYS 109 Cb 0.50 -2.71 -0.07 0.00 0.00 0.00 0.00 35.03 32.75 1jx9 n LYS 109 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1jx9 n ASN 110 N 4.51 -5.26 -4.05 3.14 5.03 -1.26 -4.94 115.26 112.42 1jx9 n ASN 110 Ca 0.18 0.37 -0.13 0.00 0.87 0.00 0.00 54.58 55.87 1jx9 n ASN 110 Cb 0.32 -4.61 -0.10 0.00 -1.02 0.00 0.00 39.78 34.38 1jx9 n ASN 110 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1jx9 s GLY 111 N -2.51 1.55 -0.02 7.41 0.00 0.12 -5.13 107.32 108.73 1jx9 s GLY 111 Ca 0.00 -1.73 -0.24 0.00 0.00 0.00 0.00 44.72 42.75 1jx9 s GLY 111 CO 0.00 -1.38 0.71 1.62 0.00 0.00 0.00 173.10 174.05 1jx9 s GLN 112 N -4.03 4.44 0.69 2.90 0.74 -1.26 -4.44 119.66 118.69 1jx9 s GLN 112 Ca 0.39 0.93 -0.16 0.00 0.05 0.00 0.00 55.36 56.56 1jx9 s GLN 112 Cb 0.06 -3.40 0.02 0.00 1.10 0.00 0.00 33.01 30.78 1jx9 s GLN 112 CO 0.14 0.18 1.22 0.00 -0.55 0.00 0.00 175.29 176.28 1jx9 s ALA 113 N 0.38 2.24 -0.08 1.58 0.00 -1.26 -4.63 121.76 120.00 1jx9 s ALA 113 Ca 0.37 0.95 0.02 0.00 0.00 0.00 0.00 51.96 53.30 1jx9 s ALA 113 Cb -0.19 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.47 1jx9 s ALA 113 CO 0.20 -1.69 -0.13 -2.00 0.00 0.00 0.00 175.76 172.13 1jx9 s GLU 114 N -3.73 1.85 -0.10 0.00 2.12 -0.39 -4.95 118.70 113.50 1jx9 s GLU 114 Ca 0.76 -0.45 -0.01 0.00 0.36 0.00 0.00 54.97 55.63 1jx9 s GLU 114 Cb -0.31 -1.55 -0.03 0.00 0.26 0.00 0.00 34.13 32.50 1jx9 s GLU 114 CO 0.42 -0.01 -0.04 0.99 -0.54 0.00 0.00 175.26 176.08 1jx9 s THR 115 N 0.79 3.92 0.24 -1.70 2.01 -1.26 0.16 115.64 119.80 1jx9 s THR 115 Ca -0.12 -0.38 -0.16 0.00 0.31 0.00 0.00 61.69 61.35 1jx9 s THR 115 Cb -0.15 -2.65 0.01 0.00 0.01 0.00 0.00 72.50 69.71 1jx9 s THR 115 CO 0.02 0.57 0.54 0.72 -0.69 0.00 0.00 174.62 175.78 1jx9 s PHE 116 N -0.46 0.13 -0.03 4.92 -0.71 -0.18 -5.00 117.98 116.64 1jx9 s PHE 116 Ca 0.07 -0.51 0.03 0.00 -1.04 0.00 0.00 56.93 55.49 1jx9 s PHE 116 Cb -0.12 0.35 -0.03 0.00 -1.21 0.00 0.00 43.02 42.01 1jx9 s PHE 116 CO 0.02 -1.02 -0.12 0.99 -1.34 0.00 0.00 175.22 173.74 1jx9 s THR 117 N -3.96 3.22 -0.11 -4.49 2.01 -1.26 -0.95 115.64 110.09 1jx9 s THR 117 Ca 0.17 -0.74 -0.01 0.00 0.31 0.00 0.00 61.69 61.41 1jx9 s THR 117 Cb -0.02 -2.30 -0.03 0.00 0.01 0.00 0.00 72.50 70.16 1jx9 s THR 117 CO 0.06 0.54 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.77 1jx9 s VAL 118 N -0.80 3.71 0.06 3.82 1.01 -0.35 -4.96 120.40 122.88 1jx9 s VAL 118 Ca 0.13 -0.45 0.07 0.00 0.00 0.00 0.00 61.98 61.73 1jx9 s VAL 118 Cb -0.11 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.67 1jx9 s VAL 118 CO 0.02 0.55 -0.18 0.26 0.00 0.00 0.00 175.10 175.75 1jx9 s TRP 119 N -0.17 2.56 -0.02 5.22 0.52 -1.26 -1.64 118.94 124.15 1jx9 s TRP 119 Ca 0.02 -0.25 -0.05 0.00 0.02 0.00 0.00 56.10 55.84 1jx9 s TRP 119 Cb -0.13 -1.44 0.00 0.00 -1.15 0.00 0.00 33.47 30.76 1jx9 s TRP 119 CO 0.03 0.29 0.11 0.50 0.02 0.00 0.00 176.95 177.90 1jx9 s ARG 120 N -1.62 0.29 0.19 4.98 3.52 -0.22 0.20 118.95 126.30 1jx9 s ARG 120 Ca 0.16 -0.14 0.00 0.00 -0.13 0.00 0.00 55.73 55.62 1jx9 s ARG 120 Cb -0.11 0.12 0.00 0.00 -1.56 0.00 0.00 34.95 33.41 1jx9 s ARG 120 CO 0.07 -0.06 0.03 0.25 -0.81 0.00 0.00 175.30 174.78 1jx9 n THR 121 N 2.26 0.00 0.29 4.11 -2.24 -0.66 0.06 114.28 118.10 1jx9 n THR 121 Ca -0.18 -0.87 0.16 0.00 -2.27 0.00 0.00 64.05 60.89 1jx9 n THR 121 Cb 0.57 0.07 0.75 0.00 -2.10 0.00 0.00 70.33 69.63 1jx9 n THR 121 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1jx9 h VAL 122 N 0.99 0.00 0.00 2.28 2.07 -2.00 -2.70 116.25 116.89 1jx9 h VAL 122 Ca -0.15 -0.17 -0.18 0.00 0.82 0.00 0.00 66.70 67.03 1jx9 h VAL 122 Cb 0.47 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1jx9 h VAL 122 CO 0.25 0.00 -1.59 1.41 0.02 0.00 0.00 177.57 177.65 1jx9 n HIS 123 N -2.64 0.77 -0.82 1.57 8.25 -1.26 -5.09 115.22 116.00 1jx9 n HIS 123 Ca -0.01 0.26 0.00 0.00 -0.26 0.00 0.00 57.72 57.71 1jx9 n HIS 123 Cb 0.15 -1.02 0.00 0.00 1.12 0.00 0.00 29.99 30.24 1jx9 n HIS 123 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jx9 n GLY 124 N 1.43 -0.70 3.75 -1.41 0.00 -1.02 -3.40 105.19 103.84 1jx9 n GLY 124 Ca -0.12 -1.60 -0.37 0.00 0.00 0.00 0.00 46.02 43.92 1jx9 n GLY 124 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jx9 s ASN 125 N -1.60 5.41 0.03 1.61 0.01 -1.26 -1.65 114.94 117.49 1jx9 s ASN 125 Ca 0.00 2.55 -0.30 0.00 -0.71 0.00 0.00 52.86 54.40 1jx9 s ASN 125 Cb 0.00 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 39.00 1jx9 s ASN 125 CO 0.00 -1.46 0.95 -0.63 -1.51 0.00 0.00 177.10 174.46 1jx9 s ILE 126 N -1.44 4.77 0.54 0.60 -1.09 0.13 -2.15 121.20 122.55 1jx9 s ILE 126 Ca 0.72 2.02 -0.19 0.00 -2.23 0.00 0.00 60.65 60.97 1jx9 s ILE 126 Cb -0.35 -4.30 -0.06 0.00 -1.58 0.00 0.00 42.46 36.17 1jx9 s ILE 126 CO 0.40 0.22 1.09 -0.76 -1.23 0.00 0.00 174.94 174.66 1jx9 s LEU 127 N 0.67 3.72 0.04 2.97 1.43 -0.45 -4.77 118.68 122.29 1jx9 s LEU 127 Ca 0.49 2.04 -0.16 0.00 -1.03 0.00 0.00 54.13 55.48 1jx9 s LEU 127 Cb -0.22 -4.57 -0.26 0.00 0.03 0.00 0.00 46.19 41.18 1jx9 s LEU 127 CO 0.28 -1.12 1.12 -0.61 0.23 0.00 0.00 176.35 176.25 1jx9 h GLN 128 N 1.11 0.59 -7.35 1.70 5.75 -1.96 -3.44 115.11 111.51 1jx9 h GLN 128 Ca -0.49 -0.71 -0.46 0.00 -0.15 0.00 0.00 58.65 56.84 1jx9 h GLN 128 Cb 1.24 0.22 0.15 0.00 1.07 0.00 0.00 27.48 30.16 1jx9 h GLN 128 CO 0.57 1.30 0.22 0.95 -2.65 0.00 0.00 178.83 179.21 1jx9 s THR 129 N -3.11 2.29 -1.45 2.39 -4.23 -1.26 -4.25 115.64 106.02 1jx9 s THR 129 Ca -0.11 0.09 -0.09 0.00 -1.18 0.00 0.00 61.69 60.41 1jx9 s THR 129 Cb 0.05 -2.59 0.05 0.00 1.34 0.00 0.00 72.50 71.36 1jx9 s THR 129 CO 0.90 -0.12 0.73 0.47 -0.54 0.00 0.00 174.62 176.05 1jx9 n ASP 130 N -4.07 -5.03 -4.88 3.99 9.92 -1.26 -4.77 116.55 110.45 1jx9 n ASP 130 Ca 0.06 -0.48 -0.36 0.00 -0.53 0.00 0.00 54.79 53.48 1jx9 n ASP 130 Cb 0.56 -4.06 -0.06 0.00 -0.64 0.00 0.00 41.12 36.93 1jx9 n ASP 130 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1jx9 s GLN 131 N -6.11 3.54 0.37 -1.24 -0.21 -1.26 -4.62 119.66 110.12 1jx9 s GLN 131 Ca 0.46 -0.07 0.04 0.00 0.02 0.00 0.00 55.36 55.81 1jx9 s GLN 131 Cb -0.23 -3.15 -0.03 0.00 1.00 0.00 0.00 33.01 30.60 1jx9 s GLN 131 CO 0.57 0.72 0.13 0.99 -2.12 0.00 0.00 175.29 175.58 1jx9 s THR 132 N -1.14 0.60 0.42 -0.19 2.01 -0.66 -4.99 115.64 111.69 1jx9 s THR 132 Ca 0.21 -2.00 0.20 0.00 0.31 0.00 0.00 61.69 60.41 1jx9 s THR 132 Cb -0.13 -2.46 0.22 0.00 0.01 0.00 0.00 72.50 70.14 1jx9 s THR 132 CO 0.10 0.00 2.01 0.74 -0.69 0.00 0.00 174.62 176.78 1jx9 h THR 133 N 1.95 0.90 0.00 -0.82 2.02 -1.99 -3.20 112.91 111.77 1jx9 h THR 133 Ca -0.35 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.16 1jx9 h THR 133 Cb 1.26 1.38 0.00 0.00 -1.74 0.00 0.00 68.15 69.06 1jx9 h THR 133 CO 0.57 0.18 -0.67 0.00 0.37 0.00 0.00 175.52 175.96 1jx9 n GLN 134 N -4.00 2.69 -4.11 6.66 0.00 -1.26 -4.12 117.38 113.23 1jx9 n GLN 134 Ca -0.02 -0.01 -0.11 0.00 0.00 0.00 0.00 57.00 56.86 1jx9 n GLN 134 Cb 0.26 -1.10 -0.11 0.00 0.00 0.00 0.00 30.24 29.29 1jx9 n GLN 134 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1jx9 s THR 135 N -2.23 0.55 -0.17 -0.39 2.01 -1.21 -0.25 115.64 113.95 1jx9 s THR 135 Ca 0.04 -1.59 -0.28 0.00 0.31 0.00 0.00 61.69 60.17 1jx9 s THR 135 Cb 0.09 -1.23 0.08 0.00 0.01 0.00 0.00 72.50 71.45 1jx9 s THR 135 CO 0.51 -0.71 0.75 0.00 -0.69 0.00 0.00 174.62 174.48 1jx9 s ALA 136 N -2.82 -1.80 -0.06 7.40 0.00 -1.10 -1.65 121.76 121.72 1jx9 s ALA 136 Ca 0.03 1.69 -0.01 0.00 0.00 0.00 0.00 51.96 53.66 1jx9 s ALA 136 Cb -0.00 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 1jx9 s ALA 136 CO -0.04 -0.34 0.02 0.71 0.00 0.00 0.00 175.76 176.11 1jx9 s TYR 137 N -0.40 3.19 -0.08 0.00 2.02 -1.26 0.16 117.35 120.98 1jx9 s TYR 137 Ca -0.04 0.20 0.02 0.00 -0.37 0.00 0.00 57.07 56.88 1jx9 s TYR 137 Cb -0.03 -1.77 -0.02 0.00 -0.40 0.00 0.00 41.96 39.74 1jx9 s TYR 137 CO 0.04 0.50 -0.15 0.00 -1.57 0.00 0.00 175.55 174.37 1jx9 s ALA 138 N -0.97 2.60 -0.42 3.71 0.00 -0.48 -1.35 121.76 124.85 1jx9 s ALA 138 Ca 0.16 -0.95 -0.22 0.00 0.00 0.00 0.00 51.96 50.95 1jx9 s ALA 138 Cb -0.11 -1.04 0.02 0.00 0.00 0.00 0.00 23.12 21.98 1jx9 s ALA 138 CO 0.05 0.42 0.70 0.21 0.00 0.00 0.00 175.76 177.14 1jx9 s LYS 139 N -0.23 3.43 -0.33 0.00 2.20 -0.92 -0.96 119.74 122.94 1jx9 s LYS 139 Ca 0.01 -0.15 -0.11 0.00 -0.36 0.00 0.00 55.97 55.35 1jx9 s LYS 139 Cb -0.13 -3.91 -0.01 0.00 -1.51 0.00 0.00 37.83 32.27 1jx9 s LYS 139 CO 0.03 -0.98 0.19 0.45 -0.36 0.00 0.00 175.35 174.68 1jx9 s SER 140 N 1.99 5.76 -0.20 1.43 0.15 0.12 -4.02 113.70 118.93 1jx9 s SER 140 Ca 0.26 -0.53 -0.09 0.00 0.70 0.00 0.00 55.95 56.29 1jx9 s SER 140 Cb -0.13 -2.06 -0.05 0.00 -1.71 0.00 0.00 66.02 62.07 1jx9 s SER 140 CO 0.19 -0.23 0.11 -0.13 1.20 0.00 0.00 173.24 174.38 1jx9 s ARG 141 N 1.65 4.07 0.63 5.44 0.52 -1.26 -0.69 118.95 129.31 1jx9 s ARG 141 Ca 0.05 -0.29 0.40 0.00 -0.52 0.00 0.00 55.73 55.37 1jx9 s ARG 141 Cb -0.17 -3.36 2.13 0.00 0.52 0.00 0.00 34.95 34.07 1jx9 s ARG 141 CO 0.08 0.23 2.28 0.00 0.02 0.00 0.00 175.30 177.91 1jx9 h ALA 142 N 6.88 1.08 -0.01 2.13 0.00 -1.13 -1.63 119.26 126.58 1jx9 h ALA 142 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1jx9 h ALA 142 Cb 1.16 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1jx9 h ALA 142 CO 0.71 0.01 -0.03 -2.67 0.00 0.00 0.00 179.25 177.28 1jx9 n TRP 143 N -3.21 0.00 -1.64 0.00 4.27 -1.26 -4.82 117.44 110.78 1jx9 n TRP 143 Ca -0.02 0.00 -0.50 0.00 -3.89 0.00 0.00 57.50 53.08 1jx9 n TRP 143 Cb 0.12 -0.01 -0.05 0.00 -1.36 0.00 0.00 31.31 30.00 1jx9 n TRP 143 CO 0.00 0.00 0.00 -3.47 -2.29 0.00 0.00 177.69 171.93 1jx9 n ASP 144 N 0.08 2.38 0.00 -0.67 2.03 -0.61 -0.24 116.55 119.52 1jx9 n ASP 144 Ca 0.18 1.09 0.00 0.00 0.52 0.00 0.00 54.79 56.58 1jx9 n ASP 144 Cb 0.35 -1.28 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 1jx9 n ASP 144 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1jx9 n GLY 145 N 3.21 0.85 0.04 0.27 0.00 -1.26 -4.89 105.19 103.40 1jx9 n GLY 145 Ca 0.19 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.26 1jx9 n GLY 145 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jx9 n LYS 146 N -2.04 2.17 0.16 1.61 5.02 0.67 -4.78 118.16 120.97 1jx9 n LYS 146 Ca 0.00 -1.93 -0.14 0.00 -2.02 0.00 0.00 58.31 54.23 1jx9 n LYS 146 Cb 0.00 -1.19 -0.07 0.00 -0.02 0.00 0.00 35.03 33.75 1jx9 n LYS 146 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1jx9 h GLU 147 N 0.00 -0.41 -0.78 1.97 3.07 -1.91 -1.65 114.58 114.88 1jx9 h GLU 147 Ca 0.00 0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.87 1jx9 h GLU 147 Cb 0.73 0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 28.70 1jx9 h GLU 147 CO 0.00 -0.27 0.41 -0.07 -1.40 0.00 0.00 179.01 177.68 1jx9 h LEU 148 N -0.42 0.99 -1.74 1.33 -0.00 -1.95 -1.98 115.31 111.54 1jx9 h LEU 148 Ca -0.01 -0.11 0.03 0.00 -0.00 0.00 0.00 57.88 57.79 1jx9 h LEU 148 Cb 0.37 -0.25 -0.02 0.00 -0.00 0.00 0.00 40.66 40.76 1jx9 h LEU 148 CO -0.01 0.82 0.23 0.00 -0.00 0.00 0.00 178.44 179.48 1jx9 h ALA 149 N 1.21 1.90 -0.04 1.53 0.00 -1.79 -1.31 119.26 120.77 1jx9 h ALA 149 Ca 0.27 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.92 1jx9 h ALA 149 Cb 0.06 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1jx9 h ALA 149 CO -0.04 0.05 -0.94 0.77 0.00 0.00 0.00 179.25 179.08 1jx9 h SER 150 N 0.34 0.81 -0.41 0.00 0.02 -0.63 0.15 113.55 113.83 1jx9 h SER 150 Ca 0.14 -0.61 0.02 0.00 -0.84 0.00 0.00 61.79 60.50 1jx9 h SER 150 Cb 0.15 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.42 1jx9 h SER 150 CO -0.03 1.41 0.23 0.25 -1.14 0.00 0.00 176.83 177.55 1jx9 h LEU 151 N 0.38 0.36 -0.32 5.07 6.46 -0.64 -0.75 115.31 125.87 1jx9 h LEU 151 Ca -0.10 0.01 -0.19 0.00 -0.12 0.00 0.00 57.88 57.48 1jx9 h LEU 151 Cb 1.58 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 41.45 1jx9 h LEU 151 CO 0.18 0.26 -0.64 -0.07 -0.62 0.00 0.00 178.44 177.55 1jx9 h LEU 152 N 0.46 0.82 -1.38 2.25 3.38 -1.24 -2.21 115.31 117.39 1jx9 h LEU 152 Ca 0.17 -0.48 0.01 0.00 0.09 0.00 0.00 57.88 57.67 1jx9 h LEU 152 Cb 0.03 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1jx9 h LEU 152 CO -0.09 1.25 0.42 0.00 0.09 0.00 0.00 178.44 180.11 1jx9 h ALA 153 N 0.75 1.57 0.00 1.53 0.00 -0.49 0.38 119.26 123.00 1jx9 h ALA 153 Ca -0.01 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1jx9 h ALA 153 Cb 1.23 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1jx9 h ALA 153 CO 0.13 0.39 -0.38 2.35 0.00 0.00 0.00 179.25 181.74 1jx9 h TRP 154 N 0.84 0.00 0.04 0.00 2.91 -0.90 -2.02 115.95 116.81 1jx9 h TRP 154 Ca 0.24 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.26 1jx9 h TRP 154 Cb -0.06 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.59 1jx9 h TRP 154 CO -0.00 0.38 -0.02 1.15 -1.03 0.00 0.00 178.44 178.92 1jx9 h THR 155 N 0.00 0.67 -0.16 2.65 2.02 -0.36 -3.37 112.91 114.36 1jx9 h THR 155 Ca -0.00 -1.42 0.02 0.00 0.77 0.00 0.00 66.41 65.77 1jx9 h THR 155 Cb 0.78 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1jx9 h THR 155 CO 0.05 0.22 0.11 0.45 0.37 0.00 0.00 175.52 176.71 1jx9 h HIS 156 N -0.99 0.14 -0.04 3.16 3.86 -0.39 -1.81 115.15 119.08 1jx9 h HIS 156 Ca -0.01 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1jx9 h HIS 156 Cb 0.40 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 28.82 1jx9 h HIS 156 CO 0.10 0.08 0.05 -0.56 0.86 0.00 0.00 177.93 178.46 1jx9 h GLN 157 N 0.15 0.00 0.00 2.45 -0.00 -1.52 -1.28 115.11 114.90 1jx9 h GLN 157 Ca 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.71 1jx9 h GLN 157 Cb 0.08 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.56 1jx9 h GLN 157 CO -0.01 0.00 -0.01 0.52 -0.00 0.00 0.00 178.83 179.33 1jx9 h MET 158 N 0.00 0.00 -0.01 0.06 0.00 -1.51 -2.07 114.93 111.40 1jx9 h MET 158 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.72 1jx9 h MET 158 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 31.60 31.72 1jx9 h MET 158 CO -0.00 0.01 -0.08 1.63 0.00 0.00 0.00 176.91 178.48 1jx9 n LYS 159 N -3.14 1.31 -2.16 1.72 5.02 -0.48 -4.80 118.16 115.62 1jx9 n LYS 159 Ca -0.01 -0.70 -0.38 0.00 -2.02 0.00 0.00 58.31 55.19 1jx9 n LYS 159 Cb 0.19 -1.49 -0.00 0.00 -0.02 0.00 0.00 35.03 33.71 1jx9 n LYS 159 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1jx9 s ALA 160 N -2.17 3.06 0.00 7.82 0.00 -0.78 -4.95 121.76 124.73 1jx9 s ALA 160 Ca 0.34 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.36 1jx9 s ALA 160 Cb 0.21 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1jx9 s ALA 160 CO 0.40 -0.76 0.67 1.63 0.00 0.00 0.00 175.76 177.71 1jx9 n LYS 161 N -0.29 0.87 -3.68 0.00 4.76 -1.26 -4.64 118.16 113.92 1jx9 n LYS 161 Ca 0.06 -0.89 -0.06 0.00 -2.87 0.00 0.00 58.31 54.56 1jx9 n LYS 161 Cb 0.46 -0.92 -0.02 0.00 -1.84 0.00 0.00 35.03 32.72 1jx9 n LYS 161 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1jx9 s ASN 162 N -0.43 -0.26 0.42 4.39 2.20 -1.26 -4.89 114.94 115.11 1jx9 s ASN 162 Ca 0.00 -0.30 0.16 0.00 -0.94 0.00 0.00 52.86 51.78 1jx9 s ASN 162 Cb 0.00 0.50 1.04 0.00 -2.00 0.00 0.00 41.25 40.79 1jx9 s ASN 162 CO 0.00 -0.89 1.90 -0.25 -2.94 0.00 0.00 177.10 174.91 1jx9 h TRP 163 N 2.00 0.53 -0.07 1.54 2.91 -1.98 -0.97 115.95 119.91 1jx9 h TRP 163 Ca -0.24 0.02 -0.10 0.00 1.13 0.00 0.00 58.89 59.70 1jx9 h TRP 163 Cb 1.24 -0.17 0.00 0.00 -0.51 0.00 0.00 29.16 29.73 1jx9 h TRP 163 CO 0.35 0.18 -0.33 1.96 -1.03 0.00 0.00 178.44 179.57 1jx9 h GLN 164 N 0.44 0.34 -0.17 2.65 1.08 -1.98 -0.38 115.11 117.08 1jx9 h GLN 164 Ca 0.40 -0.28 -0.08 0.00 -1.45 0.00 0.00 58.65 57.24 1jx9 h GLN 164 Cb 0.92 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 28.40 1jx9 h GLN 164 CO -0.14 0.92 -0.25 0.93 -0.95 0.00 0.00 178.83 179.34 1jx9 h GLU 165 N -0.16 0.32 0.00 1.46 5.08 -1.86 -2.52 114.58 116.90 1jx9 h GLU 165 Ca -0.02 -0.11 -0.19 0.00 -1.00 0.00 0.00 59.36 58.04 1jx9 h GLU 165 Cb 0.99 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 30.23 1jx9 h GLU 165 CO 0.07 0.56 -0.74 2.35 -1.00 0.00 0.00 179.01 180.25 1jx9 h TRP 166 N 0.29 0.74 0.00 4.33 7.01 -1.15 -3.14 115.95 124.03 1jx9 h TRP 166 Ca 0.04 -0.40 -0.03 0.00 2.11 0.00 0.00 58.89 60.61 1jx9 h TRP 166 Cb 0.61 -0.08 -0.00 0.00 -2.10 0.00 0.00 29.16 27.58 1jx9 h TRP 166 CO 0.01 1.23 -0.15 1.79 -2.79 0.00 0.00 178.44 178.53 1jx9 h THR 167 N 0.04 0.49 -0.45 2.65 1.35 -1.04 -0.42 112.91 115.53 1jx9 h THR 167 Ca -0.09 -0.75 -0.01 0.00 -0.55 0.00 0.00 66.41 65.01 1jx9 h THR 167 Cb 1.43 1.52 -0.02 0.00 -1.73 0.00 0.00 68.15 69.35 1jx9 h THR 167 CO 0.14 0.15 0.25 1.56 -0.25 0.00 0.00 175.52 177.37 1jx9 h GLN 168 N 0.00 0.61 0.04 4.72 4.20 -1.40 -1.05 115.11 122.23 1jx9 h GLN 168 Ca -0.00 -0.05 -0.28 0.00 0.06 0.00 0.00 58.65 58.37 1jx9 h GLN 168 Cb 0.51 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 1jx9 h GLN 168 CO 0.02 0.45 -1.49 1.96 -0.67 0.00 0.00 178.83 179.10 1jx9 h GLN 169 N 0.62 0.09 -0.83 1.46 1.08 -1.19 -3.28 115.11 113.05 1jx9 h GLN 169 Ca 0.16 -0.16 0.04 0.00 -1.45 0.00 0.00 58.65 57.24 1jx9 h GLN 169 Cb 0.01 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.45 1jx9 h GLN 169 CO -0.03 0.85 0.55 0.00 -0.95 0.00 0.00 178.83 179.25 1jx9 h ALA 170 N 0.79 1.49 0.00 3.87 0.00 -0.80 0.62 119.26 125.24 1jx9 h ALA 170 Ca -0.21 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1jx9 h ALA 170 Cb 1.95 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1jx9 h ALA 170 CO 0.12 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.79 1jx9 h ALA 171 N 1.52 1.00 -0.00 0.00 0.00 -1.26 -2.53 119.26 117.98 1jx9 h ALA 171 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1jx9 h ALA 171 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1jx9 h ALA 171 CO -0.10 0.00 -0.89 1.63 0.00 0.00 0.00 179.25 179.89 1jx9 n LYS 172 N -2.84 0.29 -2.86 0.00 5.02 0.19 -4.84 118.16 113.12 1jx9 n LYS 172 Ca -0.02 -0.20 -0.42 0.00 -2.02 0.00 0.00 58.31 55.64 1jx9 n LYS 172 Cb 0.07 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.55 1jx9 n LYS 172 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1jx9 s GLN 173 N -2.88 3.85 0.01 1.97 -0.44 -0.95 -3.93 119.66 117.28 1jx9 s GLN 173 Ca 0.10 0.53 0.23 0.00 -2.50 0.00 0.00 55.36 53.72 1jx9 s GLN 173 Cb 0.16 -3.79 0.08 0.00 -1.64 0.00 0.00 33.01 27.82 1jx9 s GLN 173 CO 0.80 -0.88 1.10 0.00 0.50 0.00 0.00 175.29 176.82 1jx9 n ALA 174 N 6.59 4.12 -1.60 1.58 0.00 -1.26 -2.48 120.51 127.46 1jx9 n ALA 174 Ca 0.06 -0.48 -0.30 0.00 0.00 0.00 0.00 53.44 52.71 1jx9 n ALA 174 Cb 0.48 -0.92 0.08 0.00 0.00 0.00 0.00 19.45 19.08 1jx9 n ALA 174 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1jx9 s LEU 175 N -3.13 2.75 -1.07 0.00 1.43 -1.26 -0.55 118.68 116.85 1jx9 s LEU 175 Ca 0.08 1.35 -0.17 0.00 -1.03 0.00 0.00 54.13 54.36 1jx9 s LEU 175 Cb 0.16 -4.05 0.14 0.00 0.03 0.00 0.00 46.19 42.48 1jx9 s LEU 175 CO 0.80 -1.77 1.30 0.28 0.23 0.00 0.00 176.35 177.19 1jx9 s THR 176 N -3.16 4.77 -0.02 5.49 -1.32 -1.26 -3.00 115.64 117.14 1jx9 s THR 176 Ca 0.60 -1.98 0.03 0.00 -1.21 0.00 0.00 61.69 59.13 1jx9 s THR 176 Cb -0.14 -4.87 0.00 0.00 -1.51 0.00 0.00 72.50 65.98 1jx9 s THR 176 CO 0.54 -1.60 -0.09 -0.63 -2.21 0.00 0.00 174.62 170.62 1jx9 s ILE 177 N 2.45 0.81 -0.15 5.08 -1.09 -1.20 -0.67 121.20 126.42 1jx9 s ILE 177 Ca 0.39 -0.38 -0.29 0.00 -2.23 0.00 0.00 60.65 58.13 1jx9 s ILE 177 Cb -0.03 -0.71 -0.00 0.00 -1.58 0.00 0.00 42.46 40.13 1jx9 s ILE 177 CO -0.05 0.25 1.03 0.20 -1.23 0.00 0.00 174.94 175.14 1jx9 s ASN 178 N 0.12 7.18 0.01 3.58 0.01 0.35 -0.81 114.94 125.38 1jx9 s ASN 178 Ca -0.02 1.48 -0.00 0.00 -0.71 0.00 0.00 52.86 53.61 1jx9 s ASN 178 Cb -0.08 -2.55 -0.04 0.00 0.41 0.00 0.00 41.25 38.99 1jx9 s ASN 178 CO 0.00 -0.55 0.10 0.26 -1.51 0.00 0.00 177.10 175.41 1jx9 s TRP 179 N 2.52 3.33 0.05 2.20 0.52 0.42 -1.92 118.94 126.05 1jx9 s TRP 179 Ca 0.47 0.21 0.06 0.00 0.02 0.00 0.00 56.10 56.86 1jx9 s TRP 179 Cb -0.17 -1.74 -0.02 0.00 -1.15 0.00 0.00 33.47 30.39 1jx9 s TRP 179 CO 0.13 0.56 -0.16 0.71 0.02 0.00 0.00 176.95 178.22 1jx9 s TYR 180 N -1.26 1.36 0.14 -1.98 1.51 -0.36 -1.77 117.35 115.00 1jx9 s TYR 180 Ca 0.25 -0.38 0.08 0.00 -1.01 0.00 0.00 57.07 56.01 1jx9 s TYR 180 Cb -0.12 -0.79 -0.04 0.00 -0.11 0.00 0.00 41.96 40.90 1jx9 s TYR 180 CO 0.16 0.06 -0.19 -0.47 -1.11 0.00 0.00 175.55 174.01 1jx9 s TYR 181 N -0.96 1.78 0.01 2.71 6.14 -0.14 -2.08 117.35 124.80 1jx9 s TYR 181 Ca 0.02 -0.46 -0.29 0.00 0.64 0.00 0.00 57.07 56.98 1jx9 s TYR 181 Cb -0.09 -0.92 0.07 0.00 0.42 0.00 0.00 41.96 41.45 1jx9 s TYR 181 CO 0.02 0.28 0.66 0.00 0.64 0.00 0.00 175.55 177.15 1jx9 s ALA 182 N -1.81 -1.72 0.15 3.97 0.00 -0.97 -1.64 121.76 119.75 1jx9 s ALA 182 Ca 0.13 1.07 -0.07 0.00 0.00 0.00 0.00 51.96 53.09 1jx9 s ALA 182 Cb -0.07 0.27 -0.01 0.00 0.00 0.00 0.00 23.12 23.30 1jx9 s ALA 182 CO 0.06 -0.49 0.24 0.16 0.00 0.00 0.00 175.76 175.72 1jx9 s ASP 183 N -1.66 0.10 0.36 0.00 1.47 -0.60 -0.47 116.67 115.88 1jx9 s ASP 183 Ca -0.07 -0.92 0.22 0.00 1.18 0.00 0.00 52.55 52.95 1jx9 s ASP 183 Cb -0.00 0.40 1.19 0.00 -0.34 0.00 0.00 42.92 44.17 1jx9 s ASP 183 CO 0.03 -0.85 1.64 1.62 0.68 0.00 0.00 175.17 178.29 1jx9 h VAL 184 N 2.62 0.00 -0.02 2.11 3.04 -1.48 -0.81 116.25 121.71 1jx9 h VAL 184 Ca -0.32 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.37 1jx9 h VAL 184 Cb 1.22 0.48 0.00 0.00 -2.01 0.00 0.00 31.29 30.98 1jx9 h VAL 184 CO 0.51 0.00 -0.30 0.59 -1.01 0.00 0.00 177.57 177.36 1jx9 n ASN 185 N -2.30 1.85 0.00 3.17 3.02 -1.26 -4.37 115.26 115.37 1jx9 n ASN 185 Ca -0.01 -1.42 0.00 0.00 -0.03 0.00 0.00 54.58 53.12 1jx9 n ASN 185 Cb 0.11 0.26 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 1jx9 n ASN 185 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jx9 n GLY 186 N 1.36 0.66 3.79 7.41 0.00 -0.31 -4.95 105.19 113.15 1jx9 n GLY 186 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1jx9 n GLY 186 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jx9 s ASN 187 N -2.53 7.11 0.10 1.61 0.01 -1.25 -2.84 114.94 117.14 1jx9 s ASN 187 Ca 0.00 1.84 0.03 0.00 -0.71 0.00 0.00 52.86 54.02 1jx9 s ASN 187 Cb 0.00 -2.57 -0.04 0.00 0.41 0.00 0.00 41.25 39.05 1jx9 s ASN 187 CO 0.00 -0.23 -0.09 0.27 -1.51 0.00 0.00 177.10 175.54 1jx9 s ILE 188 N -1.77 0.85 0.21 0.60 -4.36 -1.26 -1.55 121.20 113.92 1jx9 s ILE 188 Ca 0.55 -1.71 -0.16 0.00 -0.26 0.00 0.00 60.65 59.07 1jx9 s ILE 188 Cb -0.17 -1.43 0.01 0.00 1.25 0.00 0.00 42.46 42.13 1jx9 s ILE 188 CO 0.22 -0.65 0.51 -0.83 0.24 0.00 0.00 174.94 174.42 1jx9 s GLY 189 N -2.61 0.13 -0.20 6.27 0.00 -0.65 -0.36 107.32 109.90 1jx9 s GLY 189 Ca 0.07 -0.48 -0.16 0.00 0.00 0.00 0.00 44.72 44.15 1jx9 s GLY 189 CO -0.01 -0.40 0.52 -0.47 0.00 0.00 0.00 173.10 172.74 1jx9 s TYR 190 N -3.93 -0.63 -0.03 1.90 5.04 -0.23 -0.97 117.35 118.49 1jx9 s TYR 190 Ca 0.14 1.46 -0.01 0.00 -2.44 0.00 0.00 57.07 56.22 1jx9 s TYR 190 Cb -0.01 0.26 0.03 0.00 0.35 0.00 0.00 41.96 42.59 1jx9 s TYR 190 CO 0.02 -0.32 0.05 0.08 -1.34 0.00 0.00 175.55 174.04 1jx9 s VAL 191 N 0.63 -0.08 -0.92 3.14 1.01 -0.73 -0.84 120.40 122.62 1jx9 s VAL 191 Ca -0.03 0.30 -0.22 0.00 0.00 0.00 0.00 61.98 62.04 1jx9 s VAL 191 Cb -0.05 -0.12 0.08 0.00 0.00 0.00 0.00 36.38 36.30 1jx9 s VAL 191 CO -0.04 0.13 1.25 -2.28 0.00 0.00 0.00 175.10 174.16 1jx9 s HIS 192 N 1.53 2.74 0.91 5.22 2.46 0.29 -0.44 115.29 128.01 1jx9 s HIS 192 Ca -0.03 -0.93 -0.14 0.00 0.47 0.00 0.00 55.06 54.42 1jx9 s HIS 192 Cb -0.13 -4.49 0.15 0.00 -0.13 0.00 0.00 32.58 27.98 1jx9 s HIS 192 CO -0.03 -1.75 1.20 0.95 -2.47 0.00 0.00 174.74 172.64 1jx9 s THR 193 N 4.09 1.97 0.00 0.89 -4.23 0.01 -4.30 115.64 114.06 1jx9 s THR 193 Ca 0.37 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.88 1jx9 s THR 193 Cb -0.05 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 70.91 1jx9 s THR 193 CO -0.05 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.64 1jx9 n GLY 194 N -2.92 3.63 3.72 3.99 0.00 -1.03 -3.27 105.19 109.31 1jx9 n GLY 194 Ca 0.10 -1.82 -0.39 0.00 0.00 0.00 0.00 46.02 43.91 1jx9 n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jx9 s ALA 195 N -2.67 3.42 -0.05 4.61 0.00 0.29 -4.90 121.76 122.47 1jx9 s ALA 195 Ca 0.00 -0.07 0.04 0.00 0.00 0.00 0.00 51.96 51.93 1jx9 s ALA 195 Cb 0.00 -2.78 0.00 0.00 0.00 0.00 0.00 23.12 20.34 1jx9 s ALA 195 CO 0.00 -0.06 -0.16 0.71 0.00 0.00 0.00 175.76 176.25 1jx9 s TYR 196 N 0.75 1.60 0.47 0.00 2.02 -1.26 -4.56 117.35 116.38 1jx9 s TYR 196 Ca 0.30 -0.48 -0.21 0.00 -0.37 0.00 0.00 57.07 56.31 1jx9 s TYR 196 Cb -0.16 -1.10 -0.08 0.00 -0.40 0.00 0.00 41.96 40.22 1jx9 s TYR 196 CO 0.13 -0.18 1.08 -1.25 -1.57 0.00 0.00 175.55 173.76 1jx9 s PRO 197 N 0.17 3.81 -0.67 -1.71 0.04 -1.26 -0.73 135.00 134.64 1jx9 s PRO 197 Ca -0.06 1.51 -0.17 0.00 0.04 0.00 0.00 61.00 62.32 1jx9 s PRO 197 Cb -0.12 -2.24 0.14 0.00 0.04 0.00 0.00 34.50 32.32 1jx9 s PRO 197 CO 0.02 -0.45 0.72 0.34 0.04 0.00 0.00 177.00 177.67 1jx9 s ASP 198 N -1.74 6.36 0.35 6.66 -1.08 0.34 -4.55 116.67 123.01 1jx9 s ASP 198 Ca 0.65 -1.87 -0.18 0.00 -0.52 0.00 0.00 52.55 50.64 1jx9 s ASP 198 Cb -0.21 -2.27 -0.10 0.00 -1.46 0.00 0.00 42.92 38.88 1jx9 s ASP 198 CO 0.25 -0.93 0.81 -0.13 0.52 0.00 0.00 175.17 175.70 1jx9 s ARG 199 N 1.86 4.12 0.85 4.34 0.52 -1.26 0.37 118.95 129.75 1jx9 s ARG 199 Ca 0.13 0.86 -0.11 0.00 -0.52 0.00 0.00 55.73 56.08 1jx9 s ARG 199 Cb -0.20 -2.40 0.11 0.00 0.52 0.00 0.00 34.95 32.97 1jx9 s ARG 199 CO 0.00 0.12 1.16 -0.65 0.02 0.00 0.00 175.30 175.96 1jx9 s GLN 200 N -2.92 1.46 0.20 3.54 -1.52 -1.26 -4.84 119.66 114.32 1jx9 s GLN 200 Ca 0.56 1.57 -0.30 0.00 -1.95 0.00 0.00 55.36 55.24 1jx9 s GLN 200 Cb -0.11 -1.77 -0.09 0.00 -0.22 0.00 0.00 33.01 30.82 1jx9 s GLN 200 CO 0.17 -2.31 1.36 0.45 -0.25 0.00 0.00 175.29 174.70 1jx9 s SER 201 N -2.57 6.82 0.00 5.90 0.15 -1.26 -2.37 113.70 120.37 1jx9 s SER 201 Ca 0.68 2.46 0.00 0.00 0.70 0.00 0.00 55.95 59.79 1jx9 s SER 201 Cb -0.24 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.46 1jx9 s SER 201 CO 0.54 -0.59 0.00 0.61 1.20 0.00 0.00 173.24 175.00 1jx9 n GLY 202 N 2.52 0.59 3.60 9.45 0.00 -1.26 -5.03 105.19 115.05 1jx9 n GLY 202 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1jx9 n GLY 202 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1jx9 s HIS 203 N -2.27 2.76 -0.46 1.61 5.04 -1.00 -4.99 115.29 115.98 1jx9 s HIS 203 Ca 0.00 0.72 -0.24 0.00 -1.54 0.00 0.00 55.06 54.00 1jx9 s HIS 203 Cb 0.00 -4.41 0.03 0.00 0.04 0.00 0.00 32.58 28.24 1jx9 s HIS 203 CO 0.00 -1.37 0.85 0.34 -2.34 0.00 0.00 174.74 172.22 1jx9 s ASP 204 N 2.66 6.43 0.00 9.88 -1.08 -1.26 -4.91 116.67 128.39 1jx9 s ASP 204 Ca 0.50 -0.07 0.13 0.00 -0.52 0.00 0.00 52.55 52.59 1jx9 s ASP 204 Cb -0.08 -2.41 0.75 0.00 -1.46 0.00 0.00 42.92 39.72 1jx9 s ASP 204 CO 0.32 -0.99 1.20 -0.81 0.52 0.00 0.00 175.17 175.41 1jx9 n PRO 205 N 6.94 0.58 0.00 4.34 -0.04 -1.26 -1.77 135.00 143.79 1jx9 n PRO 205 Ca 0.03 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.61 1jx9 n PRO 205 Cb 0.48 -1.34 0.15 0.00 -0.04 0.00 0.00 33.50 32.76 1jx9 n PRO 205 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1jx9 n ARG 206 N -0.84 0.94 -4.13 0.54 1.74 -1.26 -4.77 116.66 108.88 1jx9 n ARG 206 Ca 0.09 -0.70 -0.13 0.00 -0.77 0.00 0.00 57.85 56.35 1jx9 n ARG 206 Cb 0.04 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 29.89 1jx9 n ARG 206 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1jx9 s LEU 207 N -2.54 2.38 0.80 0.55 1.43 -0.73 -5.02 118.68 115.55 1jx9 s LEU 207 Ca 0.20 -0.77 -0.13 0.00 -1.03 0.00 0.00 54.13 52.40 1jx9 s LEU 207 Cb 0.18 -0.20 0.08 0.00 0.03 0.00 0.00 46.19 46.28 1jx9 s LEU 207 CO 0.57 -0.29 1.19 -2.84 0.23 0.00 0.00 176.35 175.21 1jx9 s PRO 208 N -2.61 1.73 0.12 1.29 0.02 -1.26 -4.80 135.00 129.48 1jx9 s PRO 208 Ca 0.01 1.69 0.08 0.00 0.02 0.00 0.00 61.00 62.81 1jx9 s PRO 208 Cb -0.03 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 32.66 1jx9 s PRO 208 CO -0.01 -2.13 -0.21 0.14 -0.33 0.00 0.00 177.00 174.46 1jx9 s VAL 209 N -2.22 1.78 0.37 3.83 -7.23 -0.62 -4.95 120.40 111.35 1jx9 s VAL 209 Ca 0.72 -1.63 -0.28 0.00 -1.81 0.00 0.00 61.98 58.98 1jx9 s VAL 209 Cb -0.27 -1.65 -0.11 0.00 0.56 0.00 0.00 36.38 34.91 1jx9 s VAL 209 CO 0.50 -0.10 1.39 -2.65 -0.31 0.00 0.00 175.10 173.93 1jx9 n PRO 210 N 0.92 2.38 -0.57 4.82 -0.02 -1.26 0.48 135.00 141.74 1jx9 n PRO 210 Ca -0.18 0.83 0.07 0.00 -2.02 0.00 0.00 63.50 62.20 1jx9 n PRO 210 Cb 0.54 -2.51 0.30 0.00 -0.02 0.00 0.00 33.50 31.81 1jx9 n PRO 210 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jx9 n GLY 211 N 0.61 2.35 0.04 -1.23 0.00 0.10 -4.38 105.19 102.69 1jx9 n GLY 211 Ca 0.03 -0.70 0.11 0.00 0.00 0.00 0.00 46.02 45.47 1jx9 n GLY 211 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jx9 n THR 212 N 0.76 0.55 0.00 2.61 -2.24 -1.26 -4.70 114.28 109.99 1jx9 n THR 212 Ca 0.21 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 62.04 1jx9 n THR 212 Cb 0.82 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 1jx9 n THR 212 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jx9 n GLY 213 N 0.78 4.16 0.31 3.38 0.00 -1.26 -0.67 105.19 111.88 1jx9 n GLY 213 Ca 0.05 -0.85 0.21 0.00 0.00 0.00 0.00 46.02 45.43 1jx9 n GLY 213 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1jx9 h LYS 214 N 0.00 0.00 -0.06 1.61 3.64 -1.91 -2.69 116.57 117.16 1jx9 h LYS 214 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1jx9 h LYS 214 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1jx9 h LYS 214 CO 0.00 0.00 0.00 0.91 -2.27 0.00 0.00 179.45 178.09 1jx9 n TRP 215 N -2.93 0.06 -1.56 1.91 7.02 -1.26 -5.00 117.44 115.68 1jx9 n TRP 215 Ca -0.03 -0.07 -0.39 0.00 -1.02 0.00 0.00 57.50 55.99 1jx9 n TRP 215 Cb 0.07 -0.00 0.03 0.00 -2.42 0.00 0.00 31.31 28.99 1jx9 n TRP 215 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1jx9 n ASP 216 N 0.55 0.30 -4.74 -0.99 9.92 -1.02 -4.70 116.55 115.87 1jx9 n ASP 216 Ca 0.07 0.85 -0.37 0.00 -0.53 0.00 0.00 54.79 54.81 1jx9 n ASP 216 Cb 0.28 -1.30 0.05 0.00 -0.64 0.00 0.00 41.12 39.50 1jx9 n ASP 216 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 1jx9 s TRP 217 N -1.50 2.22 -0.39 1.24 0.51 -1.26 -4.59 118.94 115.17 1jx9 s TRP 217 Ca 0.70 1.47 0.26 0.00 -2.12 0.00 0.00 56.10 56.40 1jx9 s TRP 217 Cb -0.47 -3.66 0.66 0.00 -0.81 0.00 0.00 33.47 29.19 1jx9 s TRP 217 CO 0.52 -2.72 1.72 0.87 -0.51 0.00 0.00 176.95 176.84 1jx9 h LYS 218 N 0.89 0.00 0.00 4.98 1.57 -0.41 -3.49 116.57 120.11 1jx9 h LYS 218 Ca -0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1jx9 h LYS 218 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 1jx9 h LYS 218 CO 0.55 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.84 1jx9 n GLY 219 N 0.87 0.05 3.45 3.86 0.00 -1.24 -4.98 105.19 107.19 1jx9 n GLY 219 Ca 0.04 -1.13 -0.31 0.00 0.00 0.00 0.00 46.02 44.61 1jx9 n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jx9 s LEU 220 N 0.00 2.58 0.66 0.99 1.43 -1.26 -0.50 118.68 122.57 1jx9 s LEU 220 Ca 0.00 -0.40 -0.18 0.00 -1.03 0.00 0.00 54.13 52.52 1jx9 s LEU 220 Cb 0.00 -1.51 -0.00 0.00 0.03 0.00 0.00 46.19 44.71 1jx9 s LEU 220 CO 0.00 0.27 1.28 -0.76 0.23 0.00 0.00 176.35 177.37 1jx9 s LEU 221 N -1.28 3.53 0.60 1.79 1.43 0.09 -4.73 118.68 120.11 1jx9 s LEU 221 Ca 0.14 2.58 -0.09 0.00 -1.03 0.00 0.00 54.13 55.72 1jx9 s LEU 221 Cb -0.10 -4.61 -0.02 0.00 0.03 0.00 0.00 46.19 41.48 1jx9 s LEU 221 CO 0.04 -2.05 0.97 -2.16 0.23 0.00 0.00 176.35 173.38 1jx9 s PRO 222 N -3.47 3.32 0.49 1.29 0.05 -1.26 -4.68 135.00 130.74 1jx9 s PRO 222 Ca 0.81 0.45 0.25 0.00 0.05 0.00 0.00 61.00 62.55 1jx9 s PRO 222 Cb -0.36 -2.16 1.30 0.00 0.05 0.00 0.00 34.50 33.33 1jx9 s PRO 222 CO 0.40 -0.61 1.90 0.35 0.05 0.00 0.00 177.00 179.10 1jx9 h PHE 223 N -0.25 0.21 -1.01 0.56 3.57 -1.95 0.10 116.94 118.18 1jx9 h PHE 223 Ca -0.45 0.01 0.24 0.00 3.53 0.00 0.00 57.97 61.30 1jx9 h PHE 223 Cb 1.22 -0.06 -0.11 0.00 2.79 0.00 0.00 35.95 39.78 1jx9 h PHE 223 CO 0.58 0.06 0.62 1.49 -2.23 0.00 0.00 178.31 178.83 1jx9 h GLU 224 N 0.16 0.54 -0.04 1.11 4.57 -2.03 -0.91 114.58 117.99 1jx9 h GLU 224 Ca 0.40 -0.03 -0.10 0.00 -1.18 0.00 0.00 59.36 58.44 1jx9 h GLU 224 Cb 1.33 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.78 1jx9 h GLU 224 CO -0.07 0.36 -0.46 0.52 -1.18 0.00 0.00 179.01 178.19 1jx9 h MET 225 N 0.56 0.10 -6.42 1.92 2.86 -1.16 -3.45 114.93 109.35 1jx9 h MET 225 Ca 0.62 -0.05 -0.57 0.00 -2.06 0.00 0.00 59.70 57.64 1jx9 h MET 225 Cb 1.25 0.00 0.04 0.00 0.06 0.00 0.00 31.60 32.95 1jx9 h MET 225 CO -0.42 0.54 1.04 0.09 1.06 0.00 0.00 176.91 179.22 1jx9 n ASN 226 N -3.99 3.63 -4.63 1.22 4.13 -0.35 -4.90 115.26 110.37 1jx9 n ASN 226 Ca -0.02 1.00 -0.49 0.00 1.68 0.00 0.00 54.58 56.75 1jx9 n ASN 226 Cb 0.49 -1.46 -0.05 0.00 -1.54 0.00 0.00 39.78 37.22 1jx9 n ASN 226 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1jx9 n PRO 227 N 5.58 1.65 -3.59 3.52 -0.02 -1.26 -4.81 135.00 136.07 1jx9 n PRO 227 Ca 0.19 0.60 -0.13 0.00 -2.02 0.00 0.00 63.50 62.14 1jx9 n PRO 227 Cb 0.33 -2.30 -0.05 0.00 -0.02 0.00 0.00 33.50 31.46 1jx9 n PRO 227 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1jx9 s LYS 228 N 0.67 1.03 -0.12 -0.52 -2.85 -1.26 -0.54 119.74 116.14 1jx9 s LYS 228 Ca 0.81 -0.30 -0.12 0.00 -1.00 0.00 0.00 55.97 55.36 1jx9 s LYS 228 Cb -0.81 0.47 0.03 0.00 -2.06 0.00 0.00 37.83 35.45 1jx9 s LYS 228 CO 0.42 -0.37 0.33 0.54 0.10 0.00 0.00 175.35 176.37 1jx9 s VAL 229 N -2.61 0.00 -0.12 1.79 0.11 -0.02 -4.99 120.40 114.56 1jx9 s VAL 229 Ca -0.04 -0.04 0.02 0.00 -2.93 0.00 0.00 61.98 58.99 1jx9 s VAL 229 Cb -0.00 -0.48 0.01 0.00 -1.53 0.00 0.00 36.38 34.37 1jx9 s VAL 229 CO -0.03 -0.02 -0.19 -0.47 -3.33 0.00 0.00 175.10 171.06 1jx9 s TYR 230 N 0.05 2.32 -1.16 1.54 5.04 -1.26 -1.07 117.35 122.80 1jx9 s TYR 230 Ca -0.01 -1.12 -0.15 0.00 -2.44 0.00 0.00 57.07 53.34 1jx9 s TYR 230 Cb -0.03 -1.61 -0.02 0.00 0.35 0.00 0.00 41.96 40.65 1jx9 s TYR 230 CO 0.01 -0.53 0.78 0.09 -1.34 0.00 0.00 175.55 174.55 1jx9 n ASN 231 N 4.10 -4.72 -4.70 4.32 3.02 0.51 -4.91 115.26 112.88 1jx9 n ASN 231 Ca -0.19 -0.96 -0.38 0.00 -0.03 0.00 0.00 54.58 53.02 1jx9 n ASN 231 Cb 0.51 -3.67 0.06 0.00 -0.61 0.00 0.00 39.78 36.07 1jx9 n ASN 231 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1jx9 n PRO 232 N -4.08 1.20 -0.16 3.52 -0.04 -1.26 -4.86 135.00 129.31 1jx9 n PRO 232 Ca -0.13 0.46 0.16 0.00 -0.04 0.00 0.00 63.50 63.96 1jx9 n PRO 232 Cb 0.61 -2.43 0.52 0.00 -0.04 0.00 0.00 33.50 32.16 1jx9 n PRO 232 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1jx9 h GLN 233 N 0.75 0.36 0.00 0.54 4.20 -1.94 -1.33 115.11 117.70 1jx9 h GLN 233 Ca -0.50 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.18 1jx9 h GLN 233 Cb 1.34 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 29.03 1jx9 h GLN 233 CO 0.53 0.24 -0.05 0.66 -0.67 0.00 0.00 178.83 179.55 1jx9 h SER 234 N 0.37 0.00 0.00 1.46 4.64 -2.02 -3.46 113.55 114.54 1jx9 h SER 234 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1jx9 h SER 234 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1jx9 h SER 234 CO -0.11 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.50 1jx9 n GLY 235 N -0.85 0.62 3.34 -0.77 0.00 -0.50 -4.93 105.19 102.10 1jx9 n GLY 235 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 1jx9 n GLY 235 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1jx9 s TYR 236 N -2.39 -0.22 -0.12 1.61 -0.85 -1.26 -1.07 117.35 113.04 1jx9 s TYR 236 Ca 0.00 -0.09 -0.02 0.00 -0.52 0.00 0.00 57.07 56.44 1jx9 s TYR 236 Cb 0.00 0.30 0.04 0.00 0.38 0.00 0.00 41.96 42.68 1jx9 s TYR 236 CO 0.00 -0.73 0.02 0.42 -1.52 0.00 0.00 175.55 173.74 1jx9 s ILE 237 N -3.81 0.37 0.00 -3.49 1.01 0.40 -4.85 121.20 110.83 1jx9 s ILE 237 Ca 0.03 -0.14 0.06 0.00 0.00 0.00 0.00 60.65 60.60 1jx9 s ILE 237 Cb 0.01 -0.71 -0.02 0.00 0.01 0.00 0.00 42.46 41.76 1jx9 s ILE 237 CO -0.11 0.03 -0.20 0.00 0.00 0.00 0.00 174.94 174.66 1jx9 s ALA 238 N 1.95 1.65 -0.12 9.38 0.00 -1.26 0.44 121.76 133.81 1jx9 s ALA 238 Ca 0.03 -0.91 -0.16 0.00 0.00 0.00 0.00 51.96 50.92 1jx9 s ALA 238 Cb -0.14 -0.38 0.04 0.00 0.00 0.00 0.00 23.12 22.63 1jx9 s ALA 238 CO -0.07 0.39 0.42 1.21 0.00 0.00 0.00 175.76 177.71 1jx9 s ASN 239 N -0.70 -0.40 -0.34 0.00 3.84 -0.18 -5.00 114.94 112.16 1jx9 s ASN 239 Ca 0.07 0.68 0.15 0.00 0.21 0.00 0.00 52.86 53.98 1jx9 s ASN 239 Cb -0.08 0.73 0.43 0.00 -0.55 0.00 0.00 41.25 41.78 1jx9 s ASN 239 CO 0.00 -0.24 1.02 1.87 -2.79 0.00 0.00 177.10 176.96 1jx9 n TRP 240 N 2.39 0.26 -1.28 0.43 -0.00 -1.26 -1.16 117.44 116.82 1jx9 n TRP 240 Ca -0.15 -2.69 -0.10 0.00 -0.00 0.00 0.00 57.50 54.56 1jx9 n TRP 240 Cb 0.57 0.06 -0.04 0.00 -0.00 0.00 0.00 31.31 31.89 1jx9 n TRP 240 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1jx9 n ASN 241 N -0.13 -4.66 -4.21 5.87 5.03 -1.18 -4.74 115.26 111.24 1jx9 n ASN 241 Ca 0.08 0.24 -0.29 0.00 0.87 0.00 0.00 54.58 55.48 1jx9 n ASN 241 Cb 0.81 -3.01 0.18 0.00 -1.02 0.00 0.00 39.78 36.73 1jx9 n ASN 241 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1jx9 s ASN 242 N -2.64 3.29 0.27 6.41 4.22 -1.26 -4.96 114.94 120.28 1jx9 s ASN 242 Ca 0.00 0.15 -0.30 0.00 -2.14 0.00 0.00 52.86 50.57 1jx9 s ASN 242 Cb 0.00 -0.24 -0.11 0.00 1.28 0.00 0.00 41.25 42.18 1jx9 s ASN 242 CO 0.00 -2.61 1.62 -0.55 -2.04 0.00 0.00 177.10 173.53 1jx9 s SER 243 N -4.87 6.37 0.24 3.54 0.15 -1.26 -4.92 113.70 112.95 1jx9 s SER 243 Ca 0.73 2.93 -0.04 0.00 0.70 0.00 0.00 55.95 60.27 1jx9 s SER 243 Cb -0.04 -2.63 0.26 0.00 -1.71 0.00 0.00 66.02 61.91 1jx9 s SER 243 CO 0.52 -0.93 1.75 -0.65 1.20 0.00 0.00 173.24 175.13 1jx9 h PRO 244 N 5.32 0.92 -1.85 5.44 0.11 -1.92 -3.47 132.00 136.55 1jx9 h PRO 244 Ca -0.46 -0.23 -0.01 0.00 0.11 0.00 0.00 66.00 65.41 1jx9 h PRO 244 Cb 1.22 -0.12 -0.20 0.00 0.11 0.00 0.00 31.00 32.01 1jx9 h PRO 244 CO 0.83 0.87 0.31 -1.14 -0.21 0.00 0.00 178.00 178.67 1jx9 s GLN 245 N -5.12 0.90 0.23 1.05 0.74 -1.26 -4.97 119.66 111.22 1jx9 s GLN 245 Ca -0.10 0.22 -0.32 0.00 0.05 0.00 0.00 55.36 55.21 1jx9 s GLN 245 Cb 0.15 0.42 -0.13 0.00 1.10 0.00 0.00 33.01 34.55 1jx9 s GLN 245 CO 0.82 -0.28 1.54 1.17 -0.55 0.00 0.00 175.29 177.99 1jx9 n LYS 246 N 0.86 2.32 -0.97 1.67 4.81 -1.26 -1.64 118.16 123.95 1jx9 n LYS 246 Ca -0.16 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 1jx9 n LYS 246 Cb 0.57 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 33.05 1jx9 n LYS 246 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1jx9 n ASP 247 N 2.71 -1.25 -4.66 3.14 8.00 -1.26 -5.01 116.55 118.21 1jx9 n ASP 247 Ca 0.13 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.22 1jx9 n ASP 247 Cb 0.32 -0.46 -0.05 0.00 -0.02 0.00 0.00 41.12 40.91 1jx9 n ASP 247 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1jx9 s TYR 248 N -3.02 3.38 0.25 1.24 5.04 -0.65 -5.02 117.35 118.57 1jx9 s TYR 248 Ca 0.00 1.09 -0.29 0.00 -2.44 0.00 0.00 57.07 55.43 1jx9 s TYR 248 Cb 0.00 -2.92 -0.09 0.00 0.35 0.00 0.00 41.96 39.29 1jx9 s TYR 248 CO 0.00 -0.23 0.93 -1.25 -1.34 0.00 0.00 175.55 173.66 1jx9 s PRO 249 N 2.14 4.79 0.96 4.97 0.04 -1.26 -4.86 135.00 141.78 1jx9 s PRO 249 Ca 0.34 1.44 -0.15 0.00 0.04 0.00 0.00 61.00 62.67 1jx9 s PRO 249 Cb -0.16 -3.20 0.18 0.00 0.04 0.00 0.00 34.50 31.36 1jx9 s PRO 249 CO 0.11 0.48 1.23 0.00 0.04 0.00 0.00 177.00 178.86 1jx9 s ALA 250 N -1.25 1.99 0.54 8.56 0.00 -1.26 -3.99 121.76 126.34 1jx9 s ALA 250 Ca 0.42 -0.93 -0.20 0.00 0.00 0.00 0.00 51.96 51.25 1jx9 s ALA 250 Cb -0.25 -2.88 -0.07 0.00 0.00 0.00 0.00 23.12 19.93 1jx9 s ALA 250 CO 0.30 -2.43 0.98 0.45 0.00 0.00 0.00 175.76 175.06 1jx9 n SER 251 N -3.83 0.94 0.00 0.00 2.88 -0.47 -3.98 113.62 109.16 1jx9 n SER 251 Ca 0.12 0.88 0.12 0.00 -1.33 0.00 0.00 58.87 58.66 1jx9 n SER 251 Cb 0.60 -1.38 0.62 0.00 -0.75 0.00 0.00 64.21 63.30 1jx9 n SER 251 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1jx9 n ASP 252 N -0.30 0.00 -4.69 -3.46 5.68 -1.26 -4.86 116.55 107.66 1jx9 n ASP 252 Ca 0.12 -0.21 -0.58 0.00 -0.50 0.00 0.00 54.79 53.61 1jx9 n ASP 252 Cb 0.45 -0.22 -0.07 0.00 -1.14 0.00 0.00 41.12 40.13 1jx9 n ASP 252 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1jx9 n LEU 253 N -1.22 2.04 0.21 -2.12 4.77 -1.26 -4.83 117.00 114.59 1jx9 n LEU 253 Ca 0.13 1.10 0.11 0.00 -0.03 0.00 0.00 56.01 57.32 1jx9 n LEU 253 Cb 0.16 -1.11 0.68 0.00 -2.33 0.00 0.00 43.42 40.83 1jx9 n LEU 253 CO 0.17 -0.63 1.10 2.19 -1.33 0.00 0.00 177.39 178.89 1jx9 h PHE 254 N 6.37 0.00 -0.24 -1.77 -5.15 -1.99 -0.86 116.94 113.30 1jx9 h PHE 254 Ca -0.46 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.31 1jx9 h PHE 254 Cb 1.33 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.50 1jx9 h PHE 254 CO 0.72 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 177.03 1jx9 n ALA 255 N -2.53 2.48 -3.45 12.09 0.00 -1.26 -4.84 120.51 123.00 1jx9 n ALA 255 Ca -0.01 -0.48 -0.29 0.00 0.00 0.00 0.00 53.44 52.66 1jx9 n ALA 255 Cb 0.19 -1.02 -0.17 0.00 0.00 0.00 0.00 19.45 18.45 1jx9 n ALA 255 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1jx9 s PHE 256 N -1.68 2.11 -0.02 0.00 2.19 -0.33 -4.54 117.98 115.71 1jx9 s PHE 256 Ca 0.22 -0.90 -0.07 0.00 0.33 0.00 0.00 56.93 56.51 1jx9 s PHE 256 Cb 0.12 -1.47 0.01 0.00 -1.31 0.00 0.00 43.02 40.37 1jx9 s PHE 256 CO 0.16 -0.41 0.14 -0.51 1.83 0.00 0.00 175.22 176.43 1jx9 s LEU 257 N 0.65 1.50 -0.37 6.12 1.43 -1.26 -4.75 118.68 122.00 1jx9 s LEU 257 Ca -0.13 -0.04 -0.03 0.00 -1.03 0.00 0.00 54.13 52.89 1jx9 s LEU 257 Cb -0.16 0.64 0.08 0.00 0.03 0.00 0.00 46.19 46.77 1jx9 s LEU 257 CO 0.04 -0.27 0.13 0.26 0.23 0.00 0.00 176.35 176.73 1jx9 s TRP 258 N -0.93 3.43 0.08 0.29 0.51 -1.26 -5.02 118.94 116.04 1jx9 s TRP 258 Ca -0.10 -2.08 0.02 0.00 -2.12 0.00 0.00 56.10 51.82 1jx9 s TRP 258 Cb -0.06 -2.74 -0.01 0.00 -0.81 0.00 0.00 33.47 29.86 1jx9 s TRP 258 CO 0.01 -0.88 0.06 0.41 -0.51 0.00 0.00 176.95 176.04 1jx9 n GLY 259 N 4.64 3.81 0.40 0.98 0.00 -1.26 -5.02 105.19 108.75 1jx9 n GLY 259 Ca -0.07 -1.76 0.19 0.00 0.00 0.00 0.00 46.02 44.38 1jx9 n GLY 259 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1jx9 h GLY 260 N 0.44 0.54 -7.16 -0.02 0.00 -1.98 -3.34 103.07 91.55 1jx9 h GLY 260 Ca -0.06 -0.13 -0.65 0.00 0.00 0.00 0.00 47.33 46.50 1jx9 h GLY 260 CO 0.08 0.02 0.20 0.00 0.00 0.00 0.00 176.54 176.84 1jx9 s ALA 261 N -5.29 3.32 -0.08 3.60 0.00 -1.26 -5.01 121.76 117.05 1jx9 s ALA 261 Ca -0.07 -1.25 -0.05 0.00 0.00 0.00 0.00 51.96 50.59 1jx9 s ALA 261 Cb 0.21 -3.38 0.03 0.00 0.00 0.00 0.00 23.12 19.99 1jx9 s ALA 261 CO 0.77 -1.90 0.19 0.34 0.00 0.00 0.00 175.76 175.15 1jx9 s ASP 262 N 2.20 -0.18 0.60 0.00 -1.08 -1.26 -4.93 116.67 112.02 1jx9 s ASP 262 Ca 0.24 0.38 0.39 0.00 -0.52 0.00 0.00 52.55 53.04 1jx9 s ASP 262 Cb -0.14 0.31 2.04 0.00 -1.46 0.00 0.00 42.92 43.67 1jx9 s ASP 262 CO 0.19 -0.12 2.20 0.08 0.52 0.00 0.00 175.17 178.04 1jx9 h ARG 263 N 6.72 0.00 0.00 4.34 0.11 -1.92 -2.56 114.38 121.08 1jx9 h ARG 263 Ca -0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.72 1jx9 h ARG 263 Cb 1.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.25 1jx9 h ARG 263 CO 0.40 0.00 0.00 -0.24 0.10 0.00 0.00 179.97 180.23 1jx9 h VAL 264 N 0.00 0.00 0.00 0.08 3.04 -1.96 -1.95 116.25 115.46 1jx9 h VAL 264 Ca 0.00 -0.24 -0.03 0.00 -1.01 0.00 0.00 66.70 65.42 1jx9 h VAL 264 Cb 0.12 1.12 -0.00 0.00 -2.01 0.00 0.00 31.29 30.52 1jx9 h VAL 264 CO 0.00 0.00 -0.13 0.74 -1.01 0.00 0.00 177.57 177.17 1jx9 h THR 265 N 0.00 0.78 -0.19 3.17 2.02 -1.87 -0.79 112.91 116.03 1jx9 h THR 265 Ca 0.00 -0.49 -0.03 0.00 0.77 0.00 0.00 66.41 66.66 1jx9 h THR 265 Cb 0.26 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 1jx9 h THR 265 CO 0.00 0.12 -0.03 -0.33 0.37 0.00 0.00 175.52 175.65 1jx9 h GLU 266 N 0.00 0.27 0.07 6.66 4.39 -1.57 -1.08 114.58 123.33 1jx9 h GLU 266 Ca -0.00 -0.05 -0.17 0.00 0.34 0.00 0.00 59.36 59.48 1jx9 h GLU 266 Cb 0.28 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1jx9 h GLU 266 CO 0.02 0.33 -0.85 0.82 -1.16 0.00 0.00 179.01 178.16 1jx9 h ILE 267 N 0.27 1.34 -0.76 3.13 2.04 -1.34 -3.26 117.51 118.93 1jx9 h ILE 267 Ca 0.06 -2.38 0.14 0.00 1.00 0.00 0.00 64.86 63.68 1jx9 h ILE 267 Cb 0.24 2.94 -0.09 0.00 -0.74 0.00 0.00 36.82 39.16 1jx9 h ILE 267 CO 0.01 0.61 0.33 0.44 0.00 0.00 0.00 178.15 179.54 1jx9 h ASP 268 N -0.63 0.35 -0.27 1.72 3.32 -1.27 -1.55 116.42 118.08 1jx9 h ASP 268 Ca -0.19 0.10 0.03 0.00 0.02 0.00 0.00 57.03 56.99 1jx9 h ASP 268 Cb 1.44 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 41.02 1jx9 h ASP 268 CO 0.02 0.15 0.09 -0.09 -1.72 0.00 0.00 179.24 177.69 1jx9 h ARG 269 N 0.50 0.21 0.00 3.56 2.43 -1.32 -1.06 114.38 118.70 1jx9 h ARG 269 Ca 0.41 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.48 1jx9 h ARG 269 Cb 0.60 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1jx9 h ARG 269 CO -0.38 0.14 -0.45 -0.07 -1.51 0.00 0.00 179.97 177.70 1jx9 h LEU 270 N 0.22 0.00 -0.22 3.80 3.38 -1.37 -0.29 115.31 120.83 1jx9 h LEU 270 Ca 0.12 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.89 1jx9 h LEU 270 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1jx9 h LEU 270 CO -0.12 0.45 -0.92 -0.07 0.09 0.00 0.00 178.44 177.87 1jx9 h LEU 271 N 0.00 0.23 0.00 1.67 3.38 -1.00 -3.25 115.31 116.34 1jx9 h LEU 271 Ca -0.00 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.70 1jx9 h LEU 271 Cb 0.86 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1jx9 h LEU 271 CO 0.06 1.03 -0.97 -0.33 0.09 0.00 0.00 178.44 178.32 1jx9 h GLU 272 N 0.09 0.00 -0.62 1.13 5.08 -1.09 -3.35 114.58 115.82 1jx9 h GLU 272 Ca -0.05 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.42 1jx9 h GLU 272 Cb 1.57 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.74 1jx9 h GLU 272 CO 0.14 0.16 0.20 0.37 -1.00 0.00 0.00 179.01 178.87 1jx9 h GLN 273 N 0.00 0.34 -5.42 2.33 4.15 -1.08 -3.39 115.11 112.04 1jx9 h GLN 273 Ca -0.06 -0.02 -0.65 0.00 0.77 0.00 0.00 58.65 58.70 1jx9 h GLN 273 Cb 1.24 -0.08 -0.22 0.00 0.21 0.00 0.00 27.48 28.64 1jx9 h GLN 273 CO 0.02 0.23 -0.68 0.15 -1.93 0.00 0.00 178.83 176.62 1jx9 s LYS 274 N -6.09 3.51 0.17 1.69 1.02 -1.25 -5.02 119.74 113.77 1jx9 s LYS 274 Ca -0.13 -0.54 -0.14 0.00 0.02 0.00 0.00 55.97 55.18 1jx9 s LYS 274 Cb 0.18 -2.84 0.13 0.00 -0.52 0.00 0.00 37.83 34.77 1jx9 s LYS 274 CO 0.74 0.31 1.75 -1.35 -0.92 0.00 0.00 175.35 175.88 1jx9 h PRO 275 N 6.47 0.33 -5.54 -1.68 0.11 -1.83 -3.42 132.00 126.44 1jx9 h PRO 275 Ca -0.33 -0.02 -0.45 0.00 0.11 0.00 0.00 66.00 65.31 1jx9 h PRO 275 Cb 1.19 -0.08 -0.22 0.00 0.11 0.00 0.00 31.00 32.01 1jx9 h PRO 275 CO 0.61 0.22 -0.79 1.03 -0.21 0.00 0.00 178.00 178.86 1jx9 s ARG 276 N -6.14 0.90 0.06 1.05 0.52 -1.26 -4.61 118.95 109.47 1jx9 s ARG 276 Ca -0.13 -0.99 0.08 0.00 -0.52 0.00 0.00 55.73 54.17 1jx9 s ARG 276 Cb 0.14 -0.97 -0.03 0.00 0.52 0.00 0.00 34.95 34.61 1jx9 s ARG 276 CO 0.72 0.22 -0.22 -0.51 0.02 0.00 0.00 175.30 175.53 1jx9 s LEU 277 N -1.74 2.21 0.65 2.53 1.02 -0.25 -4.85 118.68 118.25 1jx9 s LEU 277 Ca 0.00 -0.59 -0.02 0.00 0.02 0.00 0.00 54.13 53.55 1jx9 s LEU 277 Cb -0.10 -1.01 0.07 0.00 0.02 0.00 0.00 46.19 45.17 1jx9 s LEU 277 CO 0.03 0.15 0.91 0.42 0.02 0.00 0.00 176.35 177.88 1jx9 s THR 278 N -0.90 2.41 0.17 5.49 -4.23 -1.26 -0.18 115.64 117.13 1jx9 s THR 278 Ca 0.08 -0.52 -0.14 0.00 -1.18 0.00 0.00 61.69 59.93 1jx9 s THR 278 Cb -0.09 -2.88 0.07 0.00 1.34 0.00 0.00 72.50 70.93 1jx9 s THR 278 CO 0.03 0.00 1.75 0.00 -0.54 0.00 0.00 174.62 175.85 1jx9 h ALA 279 N -0.31 0.52 -0.48 3.99 0.00 -1.94 0.14 119.26 121.18 1jx9 h ALA 279 Ca -0.41 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 1jx9 h ALA 279 Cb 1.29 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 1jx9 h ALA 279 CO 0.51 -0.25 -0.10 -0.44 0.00 0.00 0.00 179.25 178.97 1jx9 h ASP 280 N 0.31 0.87 -0.45 0.00 3.32 -1.96 -0.09 116.42 118.42 1jx9 h ASP 280 Ca 0.21 -0.27 -0.07 0.00 0.02 0.00 0.00 57.03 56.92 1jx9 h ASP 280 Cb 0.21 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1jx9 h ASP 280 CO -0.22 0.99 0.02 1.56 -1.72 0.00 0.00 179.24 179.88 1jx9 h GLN 281 N 0.79 0.77 -0.85 3.56 4.20 -1.82 -0.53 115.11 121.23 1jx9 h GLN 281 Ca 0.13 -0.23 0.04 0.00 0.06 0.00 0.00 58.65 58.65 1jx9 h GLN 281 Cb 0.62 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.27 1jx9 h GLN 281 CO 0.04 0.82 0.56 0.00 -0.67 0.00 0.00 178.83 179.58 1jx9 h ALA 282 N 0.92 1.51 -0.29 3.87 0.00 -0.45 -1.77 119.26 123.05 1jx9 h ALA 282 Ca 0.13 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 1jx9 h ALA 282 Cb 0.46 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1jx9 h ALA 282 CO 0.02 0.40 -0.48 2.35 0.00 0.00 0.00 179.25 181.54 1jx9 h TRP 283 N 1.02 0.96 0.00 0.00 2.91 -0.79 -2.99 115.95 117.06 1jx9 h TRP 283 Ca 0.35 -0.31 -0.00 0.00 1.13 0.00 0.00 58.89 60.05 1jx9 h TRP 283 Cb 0.09 -0.19 -0.00 0.00 -0.51 0.00 0.00 29.16 28.55 1jx9 h TRP 283 CO -0.00 1.10 -0.01 -0.44 -1.03 0.00 0.00 178.44 178.06 1jx9 h ASP 284 N 0.62 0.00 -0.01 2.65 3.45 -0.21 0.04 116.42 122.96 1jx9 h ASP 284 Ca 0.03 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.49 1jx9 h ASP 284 Cb 1.05 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.82 1jx9 h ASP 284 CO 0.10 0.01 0.02 0.58 -1.57 0.00 0.00 179.24 178.38 1jx9 h VAL 285 N 0.00 0.27 0.42 -1.35 2.07 -1.32 -1.98 116.25 114.35 1jx9 h VAL 285 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1jx9 h VAL 285 Cb 0.03 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1jx9 h VAL 285 CO 0.00 0.00 -0.20 0.40 0.02 0.00 0.00 177.57 177.79 1jx9 h ILE 286 N 0.00 0.45 -0.62 4.57 2.04 -1.15 -1.39 117.51 121.42 1jx9 h ILE 286 Ca 0.00 -0.55 0.09 0.00 1.00 0.00 0.00 64.86 65.41 1jx9 h ILE 286 Cb 0.05 0.66 -0.07 0.00 -0.74 0.00 0.00 36.82 36.72 1jx9 h ILE 286 CO -0.00 0.08 0.25 -0.09 0.00 0.00 0.00 178.15 178.39 1jx9 h ARG 287 N -0.93 0.43 0.23 2.37 2.43 -1.58 0.10 114.38 117.43 1jx9 h ARG 287 Ca -0.06 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1jx9 h ARG 287 Cb 0.56 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1jx9 h ARG 287 CO 0.09 0.29 -0.11 1.96 -1.51 0.00 0.00 179.97 180.69 1jx9 h GLN 288 N 0.44 -0.30 -0.54 0.20 1.08 -1.40 -2.87 115.11 111.73 1jx9 h GLN 288 Ca 0.31 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.53 1jx9 h GLN 288 Cb 0.36 0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.84 1jx9 h GLN 288 CO -0.29 -0.00 0.34 1.79 -0.95 0.00 0.00 178.83 179.71 1jx9 h THR 289 N -0.59 1.15 0.00 -0.54 1.35 -1.14 -1.63 112.91 111.51 1jx9 h THR 289 Ca -0.03 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 1jx9 h THR 289 Cb 0.43 0.37 0.00 0.00 -1.73 0.00 0.00 68.15 67.22 1jx9 h THR 289 CO 0.05 0.15 0.00 0.77 -0.25 0.00 0.00 175.52 176.24 1jx9 h SER 290 N 0.74 0.00 -0.01 5.36 4.64 -0.74 -2.71 113.55 120.84 1jx9 h SER 290 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1jx9 h SER 290 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1jx9 h SER 290 CO -0.04 0.00 -0.23 0.54 -0.87 0.00 0.00 176.83 176.23 1jx9 n ARG 291 N -2.61 1.91 -2.47 4.77 1.74 -0.69 -1.23 116.66 118.07 1jx9 n ARG 291 Ca 0.00 -0.68 -0.43 0.00 -0.77 0.00 0.00 57.85 55.97 1jx9 n ARG 291 Cb 0.20 -1.14 -0.02 0.00 -1.02 0.00 0.00 32.46 30.48 1jx9 n ARG 291 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1jx9 s GLN 292 N -1.48 4.17 0.18 5.56 2.00 -0.72 -0.76 119.66 128.61 1jx9 s GLN 292 Ca 0.10 1.51 -0.31 0.00 -2.00 0.00 0.00 55.36 54.66 1jx9 s GLN 292 Cb 0.09 -3.76 -0.09 0.00 0.80 0.00 0.00 33.01 30.05 1jx9 s GLN 292 CO 0.29 -0.78 1.43 0.34 -0.50 0.00 0.00 175.29 176.07 1jx9 s ASP 293 N 1.98 6.73 0.13 6.67 -1.08 0.88 -4.91 116.67 127.07 1jx9 s ASP 293 Ca 0.53 2.51 0.24 0.00 -0.52 0.00 0.00 52.55 55.30 1jx9 s ASP 293 Cb -0.19 -2.60 0.30 0.00 -1.46 0.00 0.00 42.92 38.96 1jx9 s ASP 293 CO 0.15 -0.69 1.28 -0.07 0.52 0.00 0.00 175.17 176.36 1jx9 h LEU 294 N 6.05 0.00 0.00 -1.34 3.38 -1.94 -3.37 115.31 118.08 1jx9 h LEU 294 Ca -0.44 -0.20 -0.28 0.00 0.09 0.00 0.00 57.88 57.05 1jx9 h LEU 294 Cb 1.21 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.91 1jx9 h LEU 294 CO 0.84 0.10 -1.79 0.59 0.09 0.00 0.00 178.44 178.27 1jx9 n ASN 295 N -2.16 0.69 -0.12 -0.43 3.02 -1.26 -4.47 115.26 110.53 1jx9 n ASN 295 Ca 0.03 0.33 -0.07 0.00 -0.03 0.00 0.00 54.58 54.83 1jx9 n ASN 295 Cb 0.45 0.21 -0.01 0.00 -0.61 0.00 0.00 39.78 39.82 1jx9 n ASN 295 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1jx9 h LEU 296 N 0.00 -1.05 -1.92 3.41 5.85 -1.99 -0.46 115.31 119.15 1jx9 h LEU 296 Ca -0.31 0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 1jx9 h LEU 296 Cb 1.97 0.50 -0.00 0.00 0.37 0.00 0.00 40.66 43.49 1jx9 h LEU 296 CO 0.06 -0.31 -0.06 -0.09 -0.34 0.00 0.00 178.44 177.70 1jx9 h ARG 297 N -0.24 0.00 0.13 1.25 2.43 -1.82 -0.29 114.38 115.85 1jx9 h ARG 297 Ca 0.18 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 59.07 1jx9 h ARG 297 Cb 0.53 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1jx9 h ARG 297 CO -0.54 0.06 -1.24 -0.07 -1.51 0.00 0.00 179.97 176.66 1jx9 h LEU 298 N 0.00 0.55 0.00 3.80 3.38 -1.34 -3.39 115.31 118.31 1jx9 h LEU 298 Ca -0.00 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.41 1jx9 h LEU 298 Cb 0.11 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1jx9 h LEU 298 CO 0.01 1.42 -0.45 0.49 0.09 0.00 0.00 178.44 180.00 1jx9 n PHE 299 N -3.61 0.00 -0.12 1.13 3.72 -0.70 -4.67 117.46 113.20 1jx9 n PHE 299 Ca -0.10 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.26 1jx9 n PHE 299 Cb 1.01 -0.01 0.03 0.00 -0.94 0.00 0.00 39.48 39.56 1jx9 n PHE 299 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1jx9 h LEU 300 N 0.00 -0.20 -0.73 4.37 5.85 -1.24 -0.66 115.31 122.70 1jx9 h LEU 300 Ca 0.00 0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.91 1jx9 h LEU 300 Cb 0.20 0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.34 1jx9 h LEU 300 CO 0.00 -0.06 0.37 -0.65 -0.34 0.00 0.00 178.44 177.76 1jx9 h PRO 301 N 0.09 0.61 -0.66 5.25 0.11 -1.83 0.46 132.00 136.03 1jx9 h PRO 301 Ca 0.20 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.22 1jx9 h PRO 301 Cb 0.29 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.23 1jx9 h PRO 301 CO -0.35 0.41 0.20 1.15 -0.21 0.00 0.00 178.00 179.20 1jx9 h THR 302 N 0.63 1.24 -0.42 -1.15 2.02 -1.67 -0.72 112.91 112.84 1jx9 h THR 302 Ca 0.36 -0.85 -0.08 0.00 0.77 0.00 0.00 66.41 66.60 1jx9 h THR 302 Cb 0.36 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 1jx9 h THR 302 CO -0.26 0.33 -0.06 -0.07 0.37 0.00 0.00 175.52 175.82 1jx9 h LEU 303 N 0.97 0.79 -0.46 2.58 3.38 -0.37 -1.90 115.31 120.30 1jx9 h LEU 303 Ca 0.22 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1jx9 h LEU 303 Cb 0.28 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1jx9 h LEU 303 CO -0.01 0.94 0.15 1.56 0.09 0.00 0.00 178.44 181.17 1jx9 h GLN 304 N 0.62 0.70 -0.47 1.13 4.20 -0.61 -2.23 115.11 118.46 1jx9 h GLN 304 Ca 0.11 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.67 1jx9 h GLN 304 Cb 0.58 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 1jx9 h GLN 304 CO 0.03 0.67 0.29 0.00 -0.67 0.00 0.00 178.83 179.15 1jx9 h ALA 305 N 1.00 0.59 -0.18 3.87 0.00 -1.04 0.14 119.26 123.64 1jx9 h ALA 305 Ca 0.15 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1jx9 h ALA 305 Cb 0.26 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1jx9 h ALA 305 CO -0.01 0.07 -0.15 0.00 0.00 0.00 0.00 179.25 179.17 1jx9 h ALA 306 N 1.14 1.40 -0.02 0.00 0.00 -1.20 -3.11 119.26 117.47 1jx9 h ALA 306 Ca 0.17 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1jx9 h ALA 306 Cb -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1jx9 h ALA 306 CO -0.03 0.41 -0.17 0.25 0.00 0.00 0.00 179.25 179.71 1jx9 n THR 307 N -4.23 0.00 0.31 0.00 -2.24 -0.85 -4.54 114.28 102.73 1jx9 n THR 307 Ca -0.00 -0.41 0.18 0.00 -2.27 0.00 0.00 64.05 61.55 1jx9 n THR 307 Cb 0.30 1.37 1.03 0.00 -2.10 0.00 0.00 70.33 70.93 1jx9 n THR 307 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1jx9 h SER 308 N 3.45 0.00 -0.26 3.42 4.64 -0.65 -2.47 113.55 121.68 1jx9 h SER 308 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jx9 h SER 308 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1jx9 h SER 308 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1jx9 n GLY 309 N -1.23 1.35 3.87 -0.77 0.00 -1.26 -5.00 105.19 102.15 1jx9 n GLY 309 Ca -0.03 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 1jx9 n GLY 309 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jx9 s LEU 310 N -1.39 3.49 0.51 0.99 1.43 -0.93 -5.05 118.68 117.73 1jx9 s LEU 310 Ca 0.30 1.35 -0.18 0.00 -1.03 0.00 0.00 54.13 54.57 1jx9 s LEU 310 Cb 0.18 -4.33 -0.08 0.00 0.03 0.00 0.00 46.19 42.00 1jx9 s LEU 310 CO 0.26 -0.68 1.00 0.42 0.23 0.00 0.00 176.35 177.58 1jx9 s THR 311 N -2.84 4.23 0.14 5.49 -4.23 -1.26 -4.94 115.64 112.23 1jx9 s THR 311 Ca 0.54 1.18 -0.12 0.00 -1.18 0.00 0.00 61.69 62.12 1jx9 s THR 311 Cb -0.10 -3.58 0.13 0.00 1.34 0.00 0.00 72.50 70.28 1jx9 s THR 311 CO 0.43 -0.50 1.00 1.67 -0.54 0.00 0.00 174.62 176.67 1jx9 n GLN 312 N -1.38 -0.17 0.00 3.99 -0.06 -1.26 -0.93 117.38 117.58 1jx9 n GLN 312 Ca 0.08 0.99 0.09 0.00 -2.00 0.00 0.00 57.00 56.15 1jx9 n GLN 312 Cb 0.54 -1.46 0.44 0.00 -4.06 0.00 0.00 30.24 25.69 1jx9 n GLN 312 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 1jx9 n SER 313 N -4.93 0.00 -4.65 1.69 3.41 -1.26 -4.68 113.62 103.20 1jx9 n SER 313 Ca 0.06 0.10 -0.42 0.00 -0.26 0.00 0.00 58.87 58.35 1jx9 n SER 313 Cb 0.25 -0.32 -0.03 0.00 -0.26 0.00 0.00 64.21 63.85 1jx9 n SER 313 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1jx9 s ASP 314 N -2.64 6.45 0.39 4.04 -1.08 -0.10 -4.89 116.67 118.85 1jx9 s ASP 314 Ca 0.16 2.17 0.07 0.00 -0.52 0.00 0.00 52.55 54.43 1jx9 s ASP 314 Cb 0.12 -2.53 0.79 0.00 -1.46 0.00 0.00 42.92 39.84 1jx9 s ASP 314 CO 0.28 -1.12 1.99 1.55 0.52 0.00 0.00 175.17 178.39 1jx9 h PRO 315 N 10.51 0.47 -0.92 4.34 0.13 -1.89 0.11 132.00 144.74 1jx9 h PRO 315 Ca -0.40 -0.06 0.06 0.00 -0.87 0.00 0.00 66.00 64.73 1jx9 h PRO 315 Cb 1.19 -0.09 -0.06 0.00 0.13 0.00 0.00 31.00 32.17 1jx9 h PRO 315 CO 0.96 0.40 0.60 0.00 -0.23 0.00 0.00 178.00 179.73 1jx9 h ARG 316 N 0.47 1.04 -0.37 0.86 3.08 -1.90 -1.21 114.38 116.36 1jx9 h ARG 316 Ca 0.12 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 1jx9 h ARG 316 Cb 0.12 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1jx9 h ARG 316 CO -0.01 0.69 0.15 -0.09 -1.07 0.00 0.00 179.97 179.64 1jx9 h ARG 317 N 1.07 0.55 0.00 0.04 9.65 -1.34 -2.66 114.38 121.68 1jx9 h ARG 317 Ca 0.39 -0.09 -0.09 0.00 -1.10 0.00 0.00 59.98 59.08 1jx9 h ARG 317 Cb 0.16 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.63 1jx9 h ARG 317 CO -0.14 0.52 -0.44 -0.56 2.80 0.00 0.00 179.97 182.15 1jx9 h GLN 318 N 0.45 0.00 -0.34 0.20 3.07 -0.80 0.28 115.11 117.98 1jx9 h GLN 318 Ca 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.84 1jx9 h GLN 318 Cb 0.17 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.72 1jx9 h GLN 318 CO -0.01 0.44 0.13 -0.07 0.09 0.00 0.00 178.83 179.41 1jx9 h LEU 319 N 0.00 0.47 -0.60 0.06 3.38 -1.08 -0.82 115.31 116.71 1jx9 h LEU 319 Ca -0.00 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.68 1jx9 h LEU 319 Cb 0.79 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1jx9 h LEU 319 CO 0.06 0.52 -0.13 0.58 0.09 0.00 0.00 178.44 179.56 1jx9 h VAL 320 N 0.39 1.27 -0.66 1.22 2.07 -1.11 -2.55 116.25 116.88 1jx9 h VAL 320 Ca 0.11 -1.27 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 1jx9 h VAL 320 Cb 0.20 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1jx9 h VAL 320 CO -0.01 0.44 0.38 -0.33 0.02 0.00 0.00 177.57 178.08 1jx9 h GLU 321 N 0.86 0.91 -0.99 1.57 5.08 -0.78 0.06 114.58 121.30 1jx9 h GLU 321 Ca 0.13 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1jx9 h GLU 321 Cb 0.68 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.69 1jx9 h GLU 321 CO 0.05 0.65 0.66 1.15 -1.00 0.00 0.00 179.01 180.52 1jx9 h THR 322 N 0.92 1.23 -0.18 1.13 2.02 -0.89 -2.55 112.91 114.58 1jx9 h THR 322 Ca 0.24 -0.45 -0.21 0.00 0.77 0.00 0.00 66.41 66.76 1jx9 h THR 322 Cb -0.00 -0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.21 1jx9 h THR 322 CO -0.04 0.24 -0.70 -0.07 0.37 0.00 0.00 175.52 175.32 1jx9 h LEU 323 N 1.32 0.88 -0.93 2.58 3.38 -0.67 -3.21 115.31 118.65 1jx9 h LEU 323 Ca 0.38 -0.54 0.05 0.00 0.09 0.00 0.00 57.88 57.85 1jx9 h LEU 323 Cb -0.10 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.33 1jx9 h LEU 323 CO -0.09 1.33 0.60 0.74 0.09 0.00 0.00 178.44 181.10 1jx9 h THR 324 N 0.54 1.11 0.00 0.22 2.02 -0.79 -1.69 112.91 114.32 1jx9 h THR 324 Ca -0.03 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.76 1jx9 h THR 324 Cb 1.31 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1jx9 h THR 324 CO 0.14 0.21 0.00 0.54 0.37 0.00 0.00 175.52 176.78 1jx9 n ARG 325 N -4.53 0.08 -3.59 6.66 1.74 -0.99 -4.82 116.66 111.21 1jx9 n ARG 325 Ca 0.13 0.11 -0.37 0.00 -0.77 0.00 0.00 57.85 56.96 1jx9 n ARG 325 Cb 0.14 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.02 1jx9 n ARG 325 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 1jx9 s TRP 326 N -2.90 3.66 -1.78 -1.55 -0.00 -0.64 -4.98 118.94 110.76 1jx9 s TRP 326 Ca 0.13 0.85 0.27 0.00 -0.00 0.00 0.00 56.10 57.34 1jx9 s TRP 326 Cb 0.15 -2.19 0.80 0.00 -0.00 0.00 0.00 33.47 32.23 1jx9 s TRP 326 CO 0.39 0.61 1.60 -0.40 -0.00 0.00 0.00 176.95 179.15 1jx9 n ASP 327 N 1.49 1.01 0.00 5.86 5.68 -1.26 -4.93 116.55 124.40 1jx9 n ASP 327 Ca -0.13 -0.89 0.00 0.00 -0.50 0.00 0.00 54.79 53.27 1jx9 n ASP 327 Cb 0.53 0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.62 1jx9 n ASP 327 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jx9 n GLY 328 N 1.33 0.73 3.50 6.12 0.00 -1.26 -4.87 105.19 110.73 1jx9 n GLY 328 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 1jx9 n GLY 328 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jx9 s ILE 329 N -2.95 4.33 0.36 -0.61 -1.09 -1.26 -0.09 121.20 119.89 1jx9 s ILE 329 Ca 0.00 0.02 -0.27 0.00 -2.23 0.00 0.00 60.65 58.17 1jx9 s ILE 329 Cb 0.00 -4.61 -0.09 0.00 -1.58 0.00 0.00 42.46 36.18 1jx9 s ILE 329 CO 0.00 -1.28 1.16 0.20 -1.23 0.00 0.00 174.94 173.78 1jx9 s ASN 330 N 3.22 6.79 0.03 3.58 0.01 0.06 -4.99 114.94 123.64 1jx9 s ASN 330 Ca 0.27 2.34 0.02 0.00 -0.71 0.00 0.00 52.86 54.78 1jx9 s ASN 330 Cb -0.14 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 38.88 1jx9 s ASN 330 CO 0.15 -0.49 -0.07 -0.76 -1.51 0.00 0.00 177.10 174.42 1jx9 s LEU 331 N -2.13 2.21 0.30 0.60 1.43 -1.26 -4.86 118.68 114.97 1jx9 s LEU 331 Ca 0.53 -0.47 -0.25 0.00 -1.03 0.00 0.00 54.13 52.91 1jx9 s LEU 331 Cb -0.31 -0.16 -0.09 0.00 0.03 0.00 0.00 46.19 45.65 1jx9 s LEU 331 CO 0.40 -0.17 0.90 -0.76 0.23 0.00 0.00 176.35 176.95 1jx9 s LEU 332 N -1.33 4.36 0.94 1.79 1.43 -1.26 -0.45 118.68 124.15 1jx9 s LEU 332 Ca -0.08 1.76 -0.12 0.00 -1.03 0.00 0.00 54.13 54.65 1jx9 s LEU 332 Cb -0.09 -3.90 0.15 0.00 0.03 0.00 0.00 46.19 42.38 1jx9 s LEU 332 CO 0.00 -0.03 1.12 0.20 0.23 0.00 0.00 176.35 177.87 1jx9 s ASN 333 N -1.60 3.25 0.48 2.29 0.01 0.63 -4.68 114.94 115.33 1jx9 s ASN 333 Ca 0.48 1.04 0.21 0.00 -0.71 0.00 0.00 52.86 53.88 1jx9 s ASN 333 Cb -0.19 -1.65 1.24 0.00 0.41 0.00 0.00 41.25 41.07 1jx9 s ASN 333 CO 0.24 -2.72 1.96 0.44 -1.51 0.00 0.00 177.10 175.50 1jx9 h ASP 334 N -1.62 0.17 0.21 -1.22 3.32 -1.97 -0.62 116.42 114.70 1jx9 h ASP 334 Ca -0.52 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1jx9 h ASP 334 Cb 1.33 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1jx9 h ASP 334 CO 0.61 0.09 0.00 -0.90 -1.72 0.00 0.00 179.24 177.32 1jx9 n ASP 335 N -4.42 0.21 -0.83 6.45 5.68 -1.26 -4.87 116.55 117.51 1jx9 n ASP 335 Ca 0.12 0.58 -0.11 0.00 -0.50 0.00 0.00 54.79 54.88 1jx9 n ASP 335 Cb 0.57 -0.61 -0.05 0.00 -1.14 0.00 0.00 41.12 39.89 1jx9 n ASP 335 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jx9 n GLY 336 N -0.90 1.17 0.00 6.12 0.00 -0.24 -4.80 105.19 106.53 1jx9 n GLY 336 Ca 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1jx9 n GLY 336 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1jx9 n LYS 337 N -2.13 3.63 -4.32 1.61 2.85 -1.26 -4.86 118.16 113.68 1jx9 n LYS 337 Ca -0.11 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 56.91 1jx9 n LYS 337 Cb 0.42 -0.60 -0.08 0.00 -0.65 0.00 0.00 35.03 34.12 1jx9 n LYS 337 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1jx9 s THR 338 N -0.64 3.23 0.24 0.58 -4.23 -1.26 -0.92 115.64 112.64 1jx9 s THR 338 Ca 0.00 -1.93 -0.14 0.00 -1.18 0.00 0.00 61.69 58.44 1jx9 s THR 338 Cb 0.00 -2.69 -0.08 0.00 1.34 0.00 0.00 72.50 71.07 1jx9 s THR 338 CO 0.00 -0.32 0.64 0.26 -0.54 0.00 0.00 174.62 174.66 1jx9 s TRP 339 N -2.20 3.49 0.33 3.99 0.51 -0.01 -0.27 118.94 124.77 1jx9 s TRP 339 Ca 0.30 1.11 0.00 0.00 -2.12 0.00 0.00 56.10 55.39 1jx9 s TRP 339 Cb -0.07 -2.43 0.54 0.00 -0.81 0.00 0.00 33.47 30.70 1jx9 s TRP 339 CO 0.18 0.26 1.99 1.96 -0.51 0.00 0.00 176.95 180.83 1jx9 h GLN 340 N 2.84 0.94 -6.72 4.98 4.20 -1.03 -3.39 115.11 116.93 1jx9 h GLN 340 Ca -0.48 -0.06 -0.69 0.00 0.06 0.00 0.00 58.65 57.48 1jx9 h GLN 340 Cb 1.18 -0.21 -0.26 0.00 0.30 0.00 0.00 27.48 28.49 1jx9 h GLN 340 CO 0.66 0.63 -0.87 -0.65 -0.67 0.00 0.00 178.83 177.94 1jx9 s GLN 341 N -5.79 1.83 -0.02 1.46 -1.52 -1.26 -5.00 119.66 109.37 1jx9 s GLN 341 Ca -0.11 -1.10 0.08 0.00 -1.95 0.00 0.00 55.36 52.28 1jx9 s GLN 341 Cb 0.18 -2.01 0.24 0.00 -0.22 0.00 0.00 33.01 31.20 1jx9 s GLN 341 CO 0.78 0.51 1.15 -0.35 -0.25 0.00 0.00 175.29 177.13 1jx9 n PRO 342 N 1.71 1.75 -0.13 2.91 -0.04 -1.26 -4.55 135.00 135.39 1jx9 n PRO 342 Ca -0.17 -0.98 -0.04 0.00 -0.04 0.00 0.00 63.50 62.27 1jx9 n PRO 342 Cb 0.52 -1.31 0.04 0.00 -0.04 0.00 0.00 33.50 32.71 1jx9 n PRO 342 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1jx9 h GLY 343 N 5.29 0.44 1.56 0.55 0.00 -1.95 -1.90 103.07 107.05 1jx9 h GLY 343 Ca 0.00 0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.31 1jx9 h GLY 343 CO 0.03 -0.11 -0.08 1.76 0.00 0.00 0.00 176.54 178.14 1jx9 h SER 344 N 0.11 0.52 -0.52 0.19 0.02 -1.98 -0.30 113.55 111.60 1jx9 h SER 344 Ca 0.22 -0.12 -0.11 0.00 -0.84 0.00 0.00 61.79 60.93 1jx9 h SER 344 Cb 0.31 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1jx9 h SER 344 CO -0.36 0.64 -0.10 0.00 -1.14 0.00 0.00 176.83 175.87 1jx9 h ALA 345 N 1.42 0.80 0.24 3.77 0.00 -1.73 0.83 119.26 124.59 1jx9 h ALA 345 Ca 0.10 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1jx9 h ALA 345 Cb 0.45 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1jx9 h ALA 345 CO 0.02 0.67 -0.12 0.82 0.00 0.00 0.00 179.25 180.64 1jx9 h ILE 346 N 0.90 0.77 -0.96 0.00 2.04 -0.72 -0.90 117.51 118.63 1jx9 h ILE 346 Ca 0.14 -0.05 0.01 0.00 1.00 0.00 0.00 64.86 65.96 1jx9 h ILE 346 Cb 0.66 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 1jx9 h ILE 346 CO 0.05 0.01 0.62 -0.07 0.00 0.00 0.00 178.15 178.76 1jx9 h LEU 347 N -0.35 1.12 0.19 1.44 3.38 -0.96 -1.28 115.31 118.85 1jx9 h LEU 347 Ca -0.03 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1jx9 h LEU 347 Cb 0.27 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1jx9 h LEU 347 CO 0.05 0.82 -0.09 -1.13 0.09 0.00 0.00 178.44 178.19 1jx9 h ASN 348 N 1.31 -0.21 0.20 -0.43 -1.24 -0.53 0.27 115.58 114.96 1jx9 h ASN 348 Ca 0.35 -0.02 -0.01 0.00 0.71 0.00 0.00 56.30 57.33 1jx9 h ASN 348 Cb -0.13 0.06 0.00 0.00 0.73 0.00 0.00 38.32 38.98 1jx9 h ASN 348 CO -0.07 -0.12 -0.10 0.58 -1.29 0.00 0.00 177.43 176.43 1jx9 h VAL 349 N -0.29 0.85 -0.10 2.57 2.07 -0.92 -0.26 116.25 120.17 1jx9 h VAL 349 Ca -0.03 -0.23 0.04 0.00 0.82 0.00 0.00 66.70 67.30 1jx9 h VAL 349 Cb 0.22 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 1jx9 h VAL 349 CO 0.04 0.05 -0.18 -0.25 0.02 0.00 0.00 177.57 177.25 1jx9 h TRP 350 N -0.39 -0.48 -0.68 1.57 7.01 -1.22 -1.24 115.95 120.52 1jx9 h TRP 350 Ca -0.03 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 60.99 1jx9 h TRP 350 Cb 0.30 0.23 -0.03 0.00 -2.10 0.00 0.00 29.16 27.55 1jx9 h TRP 350 CO -0.03 -0.26 0.41 1.25 -2.79 0.00 0.00 178.44 177.02 1jx9 h LEU 351 N -0.24 0.83 -0.99 0.65 5.85 -0.39 0.23 115.31 121.24 1jx9 h LEU 351 Ca 0.09 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1jx9 h LEU 351 Cb 0.37 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.14 1jx9 h LEU 351 CO -0.25 0.65 0.65 0.74 -0.34 0.00 0.00 178.44 179.90 1jx9 h THR 352 N 0.93 1.20 -0.46 1.05 2.02 -0.51 -1.11 112.91 116.03 1jx9 h THR 352 Ca 0.25 -0.44 -0.12 0.00 0.77 0.00 0.00 66.41 66.87 1jx9 h THR 352 Cb -0.02 -0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.17 1jx9 h THR 352 CO -0.05 0.23 -0.17 -1.28 0.37 0.00 0.00 175.52 174.63 1jx9 h SER 353 N 1.29 0.94 -0.20 4.18 0.87 -0.30 -2.62 113.55 117.71 1jx9 h SER 353 Ca 0.39 -0.38 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1jx9 h SER 353 Cb -0.05 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.64 1jx9 h SER 353 CO -0.11 1.11 0.12 0.24 -0.53 0.00 0.00 176.83 177.66 1jx9 h MET 354 N 0.77 0.26 -0.61 2.24 2.07 -0.20 -1.00 114.93 118.46 1jx9 h MET 354 Ca 0.11 -0.02 -0.00 0.00 -2.07 0.00 0.00 59.70 57.71 1jx9 h MET 354 Cb 0.73 -0.06 -0.03 0.00 -1.87 0.00 0.00 31.60 30.38 1jx9 h MET 354 CO 0.06 0.21 0.37 -0.07 1.07 0.00 0.00 176.91 178.55 1jx9 h LEU 355 N 0.24 0.73 -0.91 1.22 3.38 -1.20 0.15 115.31 118.91 1jx9 h LEU 355 Ca 0.07 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.02 1jx9 h LEU 355 Cb 0.02 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 1jx9 h LEU 355 CO -0.01 0.57 0.59 0.50 0.09 0.00 0.00 178.44 180.18 1jx9 h LYS 356 N 0.82 1.12 0.00 1.13 3.64 -1.17 -0.87 116.57 121.25 1jx9 h LYS 356 Ca 0.22 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.39 1jx9 h LYS 356 Cb -0.03 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.52 1jx9 h LYS 356 CO -0.04 0.74 -0.65 0.00 -2.27 0.00 0.00 179.45 177.23 1jx9 h ARG 357 N 1.16 0.00 0.00 1.90 3.08 0.01 -3.14 114.38 117.38 1jx9 h ARG 357 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.41 1jx9 h ARG 357 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1jx9 h ARG 357 CO -0.12 0.65 0.00 0.25 -1.07 0.00 0.00 179.97 179.68 1jx9 n THR 358 N -3.64 0.00 -0.10 2.04 -2.24 0.40 -4.57 114.28 106.17 1jx9 n THR 358 Ca -0.01 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.72 1jx9 n THR 358 Cb 0.67 -0.27 0.01 0.00 -2.10 0.00 0.00 70.33 68.64 1jx9 n THR 358 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1jx9 h VAL 359 N 0.00 0.67 -0.62 2.28 2.07 -1.72 -1.32 116.25 117.61 1jx9 h VAL 359 Ca 0.00 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.52 1jx9 h VAL 359 Cb 0.00 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 1jx9 h VAL 359 CO 0.00 0.00 0.41 0.58 0.02 0.00 0.00 177.57 178.58 1jx9 h VAL 360 N 0.02 1.16 0.00 2.57 2.07 -1.37 -1.84 116.25 118.86 1jx9 h VAL 360 Ca 0.17 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.32 1jx9 h VAL 360 Cb 0.25 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1jx9 h VAL 360 CO -0.35 0.15 -0.38 0.00 0.02 0.00 0.00 177.57 177.01 1jx9 h ALA 361 N 1.62 1.26 -0.01 1.67 0.00 -1.21 -3.06 119.26 119.52 1jx9 h ALA 361 Ca 0.23 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1jx9 h ALA 361 Cb -0.10 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1jx9 h ALA 361 CO -0.05 0.48 -0.44 0.00 0.00 0.00 0.00 179.25 179.24 1jx9 n ALA 362 N -2.42 3.46 -2.86 0.00 0.00 -0.72 -4.87 120.51 113.11 1jx9 n ALA 362 Ca -0.02 -0.43 -0.34 0.00 0.00 0.00 0.00 53.44 52.65 1jx9 n ALA 362 Cb 0.44 -1.06 -0.10 0.00 0.00 0.00 0.00 19.45 18.73 1jx9 n ALA 362 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1jx9 s VAL 363 N -2.72 4.51 0.44 0.00 1.01 -1.03 -5.07 120.40 117.53 1jx9 s VAL 363 Ca 0.17 -0.13 -0.25 0.00 0.00 0.00 0.00 61.98 61.77 1jx9 s VAL 363 Cb 0.18 -3.02 -0.08 0.00 0.00 0.00 0.00 36.38 33.46 1jx9 s VAL 363 CO 0.62 0.47 1.37 -2.16 0.00 0.00 0.00 175.10 175.41 1jx9 s PRO 364 N 0.37 3.76 0.59 2.72 0.04 -1.26 -4.20 135.00 137.02 1jx9 s PRO 364 Ca 0.01 2.30 -0.17 0.00 0.04 0.00 0.00 61.00 63.17 1jx9 s PRO 364 Cb -0.13 -2.67 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 1jx9 s PRO 364 CO 0.01 -0.71 1.11 -1.64 0.04 0.00 0.00 177.00 175.80 1jx9 s MET 365 N -2.40 3.19 -0.06 4.56 -1.94 -1.26 -1.56 119.30 119.83 1jx9 s MET 365 Ca 0.60 1.46 0.10 0.00 -1.71 0.00 0.00 55.69 56.14 1jx9 s MET 365 Cb -0.41 -2.00 0.39 0.00 2.01 0.00 0.00 34.83 34.83 1jx9 s MET 365 CO 0.53 -0.95 1.24 -0.35 -0.01 0.00 0.00 175.02 175.48 1jx9 n PRO 366 N -1.77 2.45 0.22 2.03 -0.04 -1.26 -4.87 135.00 131.77 1jx9 n PRO 366 Ca 0.11 -1.55 0.16 0.00 -0.04 0.00 0.00 63.50 62.17 1jx9 n PRO 366 Cb 0.52 -1.58 0.71 0.00 -0.04 0.00 0.00 33.50 33.11 1jx9 n PRO 366 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1jx9 h PHE 367 N 2.26 0.00 -0.12 0.54 0.04 -1.61 -2.61 116.94 115.43 1jx9 h PHE 367 Ca 0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 1jx9 h PHE 367 Cb 0.87 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.02 1jx9 h PHE 367 CO 0.41 0.00 -0.06 0.38 -0.60 0.00 0.00 178.31 178.44 1jx9 h ASP 368 N 0.00 0.16 -0.23 2.17 2.03 -1.67 -1.31 116.42 117.58 1jx9 h ASP 368 Ca 0.00 -0.02 0.07 0.00 -0.73 0.00 0.00 57.03 56.34 1jx9 h ASP 368 Cb 0.28 -0.04 -0.01 0.00 -0.83 0.00 0.00 39.33 38.73 1jx9 h ASP 368 CO 0.00 0.26 0.18 0.11 -1.03 0.00 0.00 179.24 178.76 1jx9 h LYS 369 N 0.18 0.00 0.00 4.15 1.79 -1.80 -1.71 116.57 119.18 1jx9 h LYS 369 Ca 0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 1jx9 h LYS 369 Cb 0.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.88 1jx9 h LYS 369 CO 0.01 0.00 0.00 0.91 -1.08 0.00 0.00 179.45 179.29 1jx9 n TRP 370 N -4.25 0.31 -0.66 -1.35 8.01 -0.49 -2.97 117.44 116.04 1jx9 n TRP 370 Ca 0.02 0.13 0.04 0.00 -1.31 0.00 0.00 57.50 56.39 1jx9 n TRP 370 Cb 0.33 -0.72 0.06 0.00 -2.01 0.00 0.00 31.31 28.97 1jx9 n TRP 370 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1jx9 n TYR 371 N -1.80 0.00 0.01 -5.99 4.01 -0.64 -4.67 117.16 108.08 1jx9 n TYR 371 Ca 0.02 -0.63 -0.00 0.00 -0.16 0.00 0.00 57.90 57.13 1jx9 n TYR 371 Cb 0.14 -0.09 -0.10 0.00 -0.31 0.00 0.00 39.34 38.98 1jx9 n TYR 371 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1jx9 n SER 372 N -0.81 0.67 -4.70 7.72 3.41 -1.16 -4.44 113.62 114.31 1jx9 n SER 372 Ca 0.07 0.29 -0.43 0.00 -0.26 0.00 0.00 58.87 58.53 1jx9 n SER 372 Cb 0.46 0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 64.82 1jx9 n SER 372 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jx9 n ALA 373 N -2.43 2.32 0.17 7.33 0.00 -1.26 -4.86 120.51 121.78 1jx9 n ALA 373 Ca -0.12 0.42 0.07 0.00 0.00 0.00 0.00 53.44 53.81 1jx9 n ALA 373 Cb 0.85 -2.46 0.09 0.00 0.00 0.00 0.00 19.45 17.93 1jx9 n ALA 373 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1jx9 h SER 374 N 6.42 0.00 0.00 0.00 4.64 -1.92 -3.42 113.55 119.27 1jx9 h SER 374 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1jx9 h SER 374 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1jx9 h SER 374 CO 0.93 0.25 0.00 0.61 -0.87 0.00 0.00 176.83 177.75 1jx9 n GLY 375 N 1.17 0.60 0.43 -0.77 0.00 -1.26 -4.35 105.19 101.01 1jx9 n GLY 375 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.14 1jx9 n GLY 375 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1jx9 n TYR 376 N -2.01 0.00 -1.66 1.61 4.02 -1.26 -4.65 117.16 113.21 1jx9 n TYR 376 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.44 1jx9 n TYR 376 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.29 1jx9 n TYR 376 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1jx9 n GLU 377 N -0.07 1.97 -3.80 -0.72 4.71 -1.26 -4.96 120.64 116.51 1jx9 n GLU 377 Ca 0.08 0.70 -0.04 0.00 -0.01 0.00 0.00 57.16 57.89 1jx9 n GLU 377 Cb 0.40 -2.36 -0.01 0.00 -1.01 0.00 0.00 31.44 28.46 1jx9 n GLU 377 CO 0.00 0.00 0.00 -0.08 0.09 0.00 0.00 177.13 177.14 1jx9 s THR 378 N 0.05 0.00 0.56 2.62 -1.32 -1.26 -4.88 115.64 111.41 1jx9 s THR 378 Ca 0.70 -0.75 0.04 0.00 -1.21 0.00 0.00 61.69 60.47 1jx9 s THR 378 Cb -0.67 -2.16 0.04 0.00 -1.51 0.00 0.00 72.50 68.19 1jx9 s THR 378 CO 0.48 0.00 0.33 0.42 -2.21 0.00 0.00 174.62 173.64 1jx9 s THR 379 N -3.21 1.40 0.24 5.08 -4.23 -1.26 -4.99 115.64 108.66 1jx9 s THR 379 Ca 0.13 -1.60 -0.06 0.00 -1.18 0.00 0.00 61.69 58.98 1jx9 s THR 379 Cb -0.03 -2.00 0.23 0.00 1.34 0.00 0.00 72.50 72.05 1jx9 s THR 379 CO 0.04 0.00 1.67 -0.61 -0.54 0.00 0.00 174.62 175.18 1jx9 h GLN 380 N 0.81 0.20 0.00 3.99 4.15 -2.02 0.28 115.11 122.52 1jx9 h GLN 380 Ca -0.38 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.03 1jx9 h GLN 380 Cb 1.31 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.96 1jx9 h GLN 380 CO 0.60 0.13 0.00 -0.25 -1.93 0.00 0.00 178.83 177.38 1jx9 n ASP 381 N -5.21 0.00 0.00 -0.69 8.00 -1.26 -4.75 116.55 112.63 1jx9 n ASP 381 Ca 0.13 -0.69 0.00 0.00 0.71 0.00 0.00 54.79 54.94 1jx9 n ASP 381 Cb 0.44 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 1jx9 n ASP 381 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jx9 n GLY 382 N 0.43 -1.33 3.62 0.44 0.00 0.09 -3.21 105.19 105.22 1jx9 n GLY 382 Ca 0.17 -1.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.21 1jx9 n GLY 382 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1jx9 n PRO 383 N -1.57 1.13 0.00 1.61 -0.02 -1.26 -4.45 135.00 130.44 1jx9 n PRO 383 Ca 0.00 0.42 0.13 0.00 -2.02 0.00 0.00 63.50 62.03 1jx9 n PRO 383 Cb 0.00 -2.13 0.46 0.00 -0.02 0.00 0.00 33.50 31.81 1jx9 n PRO 383 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1jx9 n THR 384 N -1.20 0.00 -1.19 3.45 -2.24 -1.26 -4.73 114.28 107.11 1jx9 n THR 384 Ca 0.11 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1jx9 n THR 384 Cb 0.44 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1jx9 n THR 384 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jx9 n GLY 385 N 1.27 3.43 3.83 3.38 0.00 -1.26 -3.96 105.19 111.89 1jx9 n GLY 385 Ca 0.15 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 1jx9 n GLY 385 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jx9 s SER 386 N 1.95 5.92 -0.00 1.61 1.04 -1.26 -4.94 113.70 118.02 1jx9 s SER 386 Ca 0.00 1.61 -0.12 0.00 0.48 0.00 0.00 55.95 57.93 1jx9 s SER 386 Cb 0.00 -2.50 -0.05 0.00 0.10 0.00 0.00 66.02 63.56 1jx9 s SER 386 CO 0.00 -1.08 0.35 -0.76 0.98 0.00 0.00 173.24 172.74 1jx9 s LEU 387 N -4.91 4.43 0.18 2.42 1.02 -1.26 -5.09 118.68 115.47 1jx9 s LEU 387 Ca 0.59 0.82 -0.02 0.00 0.02 0.00 0.00 54.13 55.54 1jx9 s LEU 387 Cb -0.13 -2.59 -0.04 0.00 0.02 0.00 0.00 46.19 43.45 1jx9 s LEU 387 CO 0.45 0.30 0.14 0.21 0.02 0.00 0.00 176.35 177.48 1jx9 s ASN 388 N -1.26 0.17 -0.01 2.29 3.84 -1.26 -5.07 114.94 113.63 1jx9 s ASN 388 Ca 0.25 -1.30 -0.30 0.00 0.21 0.00 0.00 52.86 51.72 1jx9 s ASN 388 Cb -0.15 0.38 -0.03 0.00 -0.55 0.00 0.00 41.25 40.89 1jx9 s ASN 388 CO 0.13 -0.83 1.08 -0.63 -2.79 0.00 0.00 177.10 174.05 1jx9 s ILE 389 N -4.12 4.55 0.77 -5.21 1.01 -1.26 -4.79 121.20 112.15 1jx9 s ILE 389 Ca 0.34 1.83 -0.12 0.00 0.00 0.00 0.00 60.65 62.70 1jx9 s ILE 389 Cb 0.06 -4.17 0.06 0.00 0.01 0.00 0.00 42.46 38.42 1jx9 s ILE 389 CO 0.09 0.09 1.11 -0.94 0.00 0.00 0.00 174.94 175.29 1jx9 s SER 390 N 1.12 4.36 0.30 3.58 1.04 -1.26 -4.81 113.70 118.03 1jx9 s SER 390 Ca 0.54 1.96 -0.01 0.00 0.48 0.00 0.00 55.95 58.91 1jx9 s SER 390 Cb -0.23 -2.54 0.46 0.00 0.10 0.00 0.00 66.02 63.81 1jx9 s SER 390 CO 0.25 -2.14 1.96 1.62 0.98 0.00 0.00 173.24 175.92 1jx9 h VAL 391 N -0.92 1.21 -0.48 5.02 3.04 -1.86 -0.53 116.25 121.73 1jx9 h VAL 391 Ca -0.44 -0.41 -0.04 0.00 -1.01 0.00 0.00 66.70 64.80 1jx9 h VAL 391 Cb 1.25 0.08 -0.02 0.00 -2.01 0.00 0.00 31.29 30.58 1jx9 h VAL 391 CO 0.50 0.21 0.14 1.23 -1.01 0.00 0.00 177.57 178.64 1jx9 h GLY 392 N 1.07 0.80 1.19 3.17 0.00 -1.81 -1.89 103.07 105.60 1jx9 h GLY 392 Ca 0.28 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 47.11 1jx9 h GLY 392 CO -0.06 0.45 0.35 0.00 0.00 0.00 0.00 176.54 177.28 1jx9 h ALA 393 N 1.00 1.23 -0.21 3.60 0.00 -1.61 0.11 119.26 123.39 1jx9 h ALA 393 Ca 0.15 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1jx9 h ALA 393 Cb 0.28 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1jx9 h ALA 393 CO -0.00 0.59 -0.36 0.87 0.00 0.00 0.00 179.25 180.34 1jx9 h LYS 394 N 1.04 0.46 -0.23 0.00 1.57 -0.87 0.15 116.57 118.69 1jx9 h LYS 394 Ca 0.25 -0.21 -0.11 0.00 -1.87 0.00 0.00 60.65 58.72 1jx9 h LYS 394 Cb 0.11 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 1jx9 h LYS 394 CO -0.03 0.76 -0.27 0.82 -0.57 0.00 0.00 179.45 180.15 1jx9 h ILE 395 N 0.38 1.32 -0.71 1.86 2.04 -0.75 -2.89 117.51 118.77 1jx9 h ILE 395 Ca 0.04 -1.46 -0.00 0.00 1.00 0.00 0.00 64.86 64.44 1jx9 h ILE 395 Cb 0.82 1.74 -0.03 0.00 -0.74 0.00 0.00 36.82 38.60 1jx9 h ILE 395 CO 0.07 0.45 0.44 0.25 0.00 0.00 0.00 178.15 179.36 1jx9 h LEU 396 N 0.28 0.84 -1.26 1.44 5.85 -0.50 -1.76 115.31 120.20 1jx9 h LEU 396 Ca 0.03 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.73 1jx9 h LEU 396 Cb 0.84 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.62 1jx9 h LEU 396 CO 0.07 0.64 0.51 0.22 -0.34 0.00 0.00 178.44 179.54 1jx9 h TYR 397 N 0.98 0.95 -0.20 1.25 3.20 -0.50 -1.38 116.97 121.26 1jx9 h TYR 397 Ca 0.26 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 62.01 1jx9 h TYR 397 Cb -0.06 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 37.89 1jx9 h TYR 397 CO 0.00 0.57 -0.45 0.93 -1.64 0.00 0.00 178.16 177.57 1jx9 h GLU 398 N 1.00 0.49 -0.51 1.82 4.39 -1.15 -2.61 114.58 118.02 1jx9 h GLU 398 Ca 0.29 -0.27 -0.05 0.00 0.34 0.00 0.00 59.36 59.67 1jx9 h GLU 398 Cb -0.04 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1jx9 h GLU 398 CO -0.07 0.85 0.11 0.00 -1.16 0.00 0.00 179.01 178.73 1jx9 h ALA 399 N 1.11 0.67 0.00 3.43 0.00 -1.10 -2.37 119.26 121.00 1jx9 h ALA 399 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1jx9 h ALA 399 Cb 0.95 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1jx9 h ALA 399 CO 0.08 0.38 0.00 1.33 0.00 0.00 0.00 179.25 181.04 1jx9 n VAL 400 N -4.43 0.72 0.76 0.00 0.24 -0.61 -2.09 118.33 112.91 1jx9 n VAL 400 Ca 0.01 -0.03 0.13 0.00 -2.04 0.00 0.00 64.34 62.41 1jx9 n VAL 400 Cb 0.24 -0.88 0.50 0.00 -1.47 0.00 0.00 33.84 32.22 1jx9 n VAL 400 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jx9 n GLN 401 N -2.29 0.12 0.00 7.34 1.13 -0.90 -4.97 117.38 117.81 1jx9 n GLN 401 Ca 0.04 0.14 0.00 0.00 -1.94 0.00 0.00 57.00 55.24 1jx9 n GLN 401 Cb 0.33 -1.65 0.00 0.00 0.11 0.00 0.00 30.24 29.03 1jx9 n GLN 401 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1jx9 n GLY 402 N 1.15 3.46 0.05 1.08 0.00 -0.89 -1.43 105.19 108.61 1jx9 n GLY 402 Ca 0.06 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.07 1jx9 n GLY 402 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jx9 n ASP 403 N 4.33 0.26 0.07 1.61 10.43 -1.26 -2.19 116.55 129.80 1jx9 n ASP 403 Ca 0.00 0.56 0.11 0.00 2.57 0.00 0.00 54.79 58.03 1jx9 n ASP 403 Cb 0.00 -0.62 0.44 0.00 1.84 0.00 0.00 41.12 42.79 1jx9 n ASP 403 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1jx9 n LYS 404 N -1.78 0.13 -3.20 -1.24 5.02 -0.51 -4.71 118.16 111.86 1jx9 n LYS 404 Ca 0.03 0.28 -0.39 0.00 -2.02 0.00 0.00 58.31 56.22 1jx9 n LYS 404 Cb 0.22 -1.71 -0.06 0.00 -0.02 0.00 0.00 35.03 33.46 1jx9 n LYS 404 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1jx9 s SER 405 N -3.80 6.94 0.00 4.39 0.15 -0.93 -4.95 113.70 115.49 1jx9 s SER 405 Ca 0.07 1.12 0.26 0.00 0.70 0.00 0.00 55.95 58.11 1jx9 s SER 405 Cb 0.11 -2.36 1.23 0.00 -1.71 0.00 0.00 66.02 63.29 1jx9 s SER 405 CO 0.41 0.06 1.87 -0.81 1.20 0.00 0.00 173.24 175.97 1jx9 n PRO 406 N 2.98 0.20 -3.04 5.44 -0.04 -1.26 -4.74 135.00 134.55 1jx9 n PRO 406 Ca -0.06 0.05 -0.42 0.00 -0.04 0.00 0.00 63.50 63.02 1jx9 n PRO 406 Cb 0.51 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.41 1jx9 n PRO 406 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1jx9 s ILE 407 N -2.78 4.81 0.18 0.52 -1.09 -1.26 -5.02 121.20 116.56 1jx9 s ILE 407 Ca 0.19 0.69 -0.33 0.00 -2.23 0.00 0.00 60.65 58.98 1jx9 s ILE 407 Cb 0.17 -4.15 -0.13 0.00 -1.58 0.00 0.00 42.46 36.78 1jx9 s ILE 407 CO 0.44 -0.39 1.69 -2.65 -1.23 0.00 0.00 174.94 172.79 1jx9 n PRO 408 N 6.25 2.57 -2.65 2.79 -0.02 -1.26 -4.86 135.00 137.82 1jx9 n PRO 408 Ca 0.01 0.93 -0.43 0.00 -2.02 0.00 0.00 63.50 61.98 1jx9 n PRO 408 Cb 0.48 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.21 1jx9 n PRO 408 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1jx9 n GLN 409 N 3.98 3.56 -0.30 -0.52 1.13 -1.26 -4.79 117.38 119.18 1jx9 n GLN 409 Ca 0.17 -3.74 0.02 0.00 -1.94 0.00 0.00 57.00 51.51 1jx9 n GLN 409 Cb 0.33 -2.94 0.09 0.00 0.11 0.00 0.00 30.24 27.83 1jx9 n GLN 409 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1jx9 h ALA 410 N 6.32 0.47 -3.93 -1.58 0.00 -2.05 -3.36 119.26 115.13 1jx9 h ALA 410 Ca 0.35 0.31 -0.68 0.00 0.00 0.00 0.00 54.91 54.89 1jx9 h ALA 410 Cb 0.73 0.70 -0.21 0.00 0.00 0.00 0.00 17.79 19.00 1jx9 h ALA 410 CO 1.44 -0.45 -0.79 0.14 0.00 0.00 0.00 179.25 179.60 1jx9 s VAL 411 N -6.20 2.93 -0.65 0.00 -7.23 -1.26 -5.08 120.40 102.91 1jx9 s VAL 411 Ca -0.15 -1.08 -0.27 0.00 -1.81 0.00 0.00 61.98 58.67 1jx9 s VAL 411 Cb 0.23 -2.23 0.03 0.00 0.56 0.00 0.00 36.38 34.97 1jx9 s VAL 411 CO 0.75 0.37 1.21 -0.62 -0.31 0.00 0.00 175.10 176.50 1jx9 s ASP 412 N -1.36 6.30 0.62 4.85 2.15 -1.26 -4.90 116.67 123.07 1jx9 s ASP 412 Ca 0.15 -0.22 0.32 0.00 0.43 0.00 0.00 52.55 53.22 1jx9 s ASP 412 Cb -0.11 -2.54 1.77 0.00 -0.30 0.00 0.00 42.92 41.74 1jx9 s ASP 412 CO 0.05 -1.63 2.08 -0.07 -0.17 0.00 0.00 175.17 175.43 1jx9 h LEU 413 N 12.34 0.00 -1.02 -1.34 3.38 -1.93 0.48 115.31 127.23 1jx9 h LEU 413 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1jx9 h LEU 413 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1jx9 h LEU 413 CO 1.22 0.00 0.00 0.49 0.09 0.00 0.00 178.44 180.24 1jx9 n PHE 414 N -3.43 0.03 -4.06 1.13 3.72 -1.26 -4.25 117.46 109.34 1jx9 n PHE 414 Ca 0.00 -0.02 -0.43 0.00 -0.05 0.00 0.00 57.45 56.96 1jx9 n PHE 414 Cb 0.33 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.88 1jx9 n PHE 414 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1jx9 n ALA 415 N 0.23 -2.44 0.00 4.37 0.00 0.17 -0.85 120.51 122.00 1jx9 n ALA 415 Ca 0.19 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 53.08 1jx9 n ALA 415 Cb 0.36 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.56 1jx9 n ALA 415 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jx9 n GLY 416 N -2.01 2.45 3.78 0.00 0.00 -1.26 -4.98 105.19 103.16 1jx9 n GLY 416 Ca -0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1jx9 n GLY 416 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jx9 s LYS 417 N 0.00 4.63 0.34 1.61 1.02 -0.02 -5.00 119.74 122.32 1jx9 s LYS 417 Ca 0.00 1.30 -0.28 0.00 0.02 0.00 0.00 55.97 57.01 1jx9 s LYS 417 Cb 0.00 -3.00 -0.12 0.00 -0.52 0.00 0.00 37.83 34.19 1jx9 s LYS 417 CO 0.00 0.40 1.38 -2.30 -0.92 0.00 0.00 175.35 173.91 1jx9 n PRO 418 N 0.97 2.35 -0.36 -1.68 -0.02 -1.26 -4.86 135.00 130.14 1jx9 n PRO 418 Ca -0.01 0.82 -0.02 0.00 -2.02 0.00 0.00 63.50 62.28 1jx9 n PRO 418 Cb 0.49 -2.48 0.11 0.00 -0.02 0.00 0.00 33.50 31.61 1jx9 n PRO 418 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1jx9 h GLN 419 N 2.93 1.26 -0.38 -0.52 4.20 -1.94 -2.52 115.11 118.13 1jx9 h GLN 419 Ca -0.48 -0.08 0.06 0.00 0.06 0.00 0.00 58.65 58.22 1jx9 h GLN 419 Cb 1.26 -0.28 -0.06 0.00 0.30 0.00 0.00 27.48 28.71 1jx9 h GLN 419 CO 0.65 0.83 0.04 0.37 -0.67 0.00 0.00 178.83 180.05 1jx9 h GLN 420 N 1.29 0.14 -0.58 1.46 4.15 -1.96 0.25 115.11 119.87 1jx9 h GLN 420 Ca 0.37 -0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.82 1jx9 h GLN 420 Cb -0.10 -0.03 -0.05 0.00 0.21 0.00 0.00 27.48 27.51 1jx9 h GLN 420 CO -0.09 0.10 0.32 1.49 -1.93 0.00 0.00 178.83 178.71 1jx9 h GLU 421 N 0.15 0.60 -0.17 1.69 4.81 -1.83 0.31 114.58 120.14 1jx9 h GLU 421 Ca 0.18 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.23 1jx9 h GLU 421 Cb 0.24 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1jx9 h GLU 421 CO -0.28 0.39 -0.53 0.28 -0.73 0.00 0.00 179.01 178.15 1jx9 h VAL 422 N 0.61 1.33 -0.52 0.32 2.07 -1.20 0.13 116.25 118.98 1jx9 h VAL 422 Ca 0.25 -1.78 -0.11 0.00 0.82 0.00 0.00 66.70 65.89 1jx9 h VAL 422 Cb 0.11 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1jx9 h VAL 422 CO -0.15 0.55 -0.09 0.58 0.02 0.00 0.00 177.57 178.48 1jx9 h VAL 423 N 0.38 1.26 -0.25 2.57 2.07 -0.35 -2.16 116.25 119.77 1jx9 h VAL 423 Ca 0.01 -1.23 -0.05 0.00 0.82 0.00 0.00 66.70 66.25 1jx9 h VAL 423 Cb 1.05 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1jx9 h VAL 423 CO 0.10 0.43 -0.05 -0.07 0.02 0.00 0.00 177.57 177.99 1jx9 h LEU 424 N 0.87 0.48 -0.97 2.57 3.38 -0.12 -1.13 115.31 120.39 1jx9 h LEU 424 Ca 0.14 -0.36 0.09 0.00 0.09 0.00 0.00 57.88 57.84 1jx9 h LEU 424 Cb 0.64 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 1jx9 h LEU 424 CO 0.04 0.73 0.61 0.00 0.09 0.00 0.00 178.44 179.91 1jx9 h ALA 425 N 0.77 1.40 -0.46 1.53 0.00 -0.64 0.11 119.26 121.97 1jx9 h ALA 425 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1jx9 h ALA 425 Cb 0.52 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1jx9 h ALA 425 CO 0.02 0.29 -0.17 0.00 0.00 0.00 0.00 179.25 179.40 1jx9 h ALA 426 N 1.49 0.82 -0.37 0.00 0.00 -1.23 -1.39 119.26 118.57 1jx9 h ALA 426 Ca 0.45 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1jx9 h ALA 426 Cb 0.33 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1jx9 h ALA 426 CO -0.22 0.65 -0.00 -0.07 0.00 0.00 0.00 179.25 179.60 1jx9 h LEU 427 N 0.79 0.55 -0.32 0.00 3.38 0.11 -0.24 115.31 119.59 1jx9 h LEU 427 Ca 0.12 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1jx9 h LEU 427 Cb 0.71 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1jx9 h LEU 427 CO 0.05 0.63 0.10 -0.08 0.09 0.00 0.00 178.44 179.23 1jx9 h GLU 428 N 0.56 0.50 -0.59 1.13 4.81 -0.46 -0.28 114.58 120.25 1jx9 h GLU 428 Ca 0.12 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1jx9 h GLU 428 Cb 0.36 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.63 1jx9 h GLU 428 CO 0.01 0.55 0.36 -0.44 -0.73 0.00 0.00 179.01 178.76 1jx9 h ASP 429 N 0.37 0.58 -0.41 1.04 3.32 -0.95 -0.79 116.42 119.57 1jx9 h ASP 429 Ca 0.10 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 1jx9 h ASP 429 Cb 0.26 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1jx9 h ASP 429 CO -0.00 0.41 0.25 0.74 -1.72 0.00 0.00 179.24 178.92 1jx9 h THR 430 N 0.71 1.13 -0.48 0.35 2.02 -0.67 -1.21 112.91 114.76 1jx9 h THR 430 Ca 0.24 -0.29 -0.07 0.00 0.77 0.00 0.00 66.41 67.05 1jx9 h THR 430 Cb 0.02 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 1jx9 h THR 430 CO -0.10 0.13 0.02 -0.25 0.37 0.00 0.00 175.52 175.69 1jx9 h TRP 431 N 0.55 0.91 0.09 3.16 2.91 -0.57 0.07 115.95 123.08 1jx9 h TRP 431 Ca 0.15 -0.15 -0.00 0.00 1.13 0.00 0.00 58.89 60.01 1jx9 h TRP 431 Cb -0.01 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 28.40 1jx9 h TRP 431 CO -0.04 0.86 -0.04 0.93 -1.03 0.00 0.00 178.44 179.12 1jx9 h GLU 432 N 0.70 -0.12 0.21 2.65 4.39 -1.02 -0.40 114.58 120.99 1jx9 h GLU 432 Ca 0.14 0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.86 1jx9 h GLU 432 Cb 0.49 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.13 1jx9 h GLU 432 CO 0.02 -0.03 -0.28 1.15 -1.16 0.00 0.00 179.01 178.71 1jx9 h THR 433 N -0.17 0.40 0.04 1.13 2.02 -1.02 -1.06 112.91 114.25 1jx9 h THR 433 Ca -0.01 0.00 -0.28 0.00 0.77 0.00 0.00 66.41 66.89 1jx9 h THR 433 Cb 0.14 0.40 0.02 0.00 -1.74 0.00 0.00 68.15 66.97 1jx9 h THR 433 CO 0.02 0.00 -1.10 -0.07 0.37 0.00 0.00 175.52 174.74 1jx9 h LEU 434 N -0.55 0.90 -1.33 2.58 3.38 -0.97 -2.75 115.31 116.58 1jx9 h LEU 434 Ca 0.01 -0.77 -0.03 0.00 0.09 0.00 0.00 57.88 57.18 1jx9 h LEU 434 Cb 0.53 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1jx9 h LEU 434 CO -0.10 1.56 0.11 0.77 0.09 0.00 0.00 178.44 180.87 1jx9 h SER 435 N 0.34 0.52 0.09 -0.43 4.64 -1.09 0.56 113.55 118.19 1jx9 h SER 435 Ca -0.15 -0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 61.02 1jx9 h SER 435 Cb 1.76 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.70 1jx9 h SER 435 CO 0.21 0.51 -0.29 0.50 -0.87 0.00 0.00 176.83 176.90 1jx9 h LYS 436 N 0.56 0.31 0.09 4.77 3.64 -1.15 -0.12 116.57 124.67 1jx9 h LYS 436 Ca 0.13 -0.11 -0.25 0.00 -1.27 0.00 0.00 60.65 59.15 1jx9 h LYS 436 Cb 0.19 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1jx9 h LYS 436 CO -0.01 0.57 -1.27 -0.09 -2.27 0.00 0.00 179.45 176.39 1jx9 h ARG 437 N 0.27 0.19 -0.01 1.90 2.43 -0.89 -3.40 114.38 114.87 1jx9 h ARG 437 Ca 0.04 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1jx9 h ARG 437 Cb 0.65 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1jx9 h ARG 437 CO 0.05 1.16 -0.58 0.66 -1.51 0.00 0.00 179.97 179.74 1jx9 n TYR 438 N -4.05 0.00 0.00 2.20 4.01 0.18 -5.10 117.16 114.40 1jx9 n TYR 438 Ca -0.25 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.49 1jx9 n TYR 438 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.86 1jx9 n TYR 438 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1jx9 n GLY 439 N 1.30 0.52 1.05 2.72 0.00 -0.06 -4.70 105.19 106.03 1jx9 n GLY 439 Ca 0.05 -2.01 0.10 0.00 0.00 0.00 0.00 46.02 44.16 1jx9 n GLY 439 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jx9 n ASN 440 N -0.19 3.07 -4.20 1.61 3.02 -1.26 -4.27 115.26 113.05 1jx9 n ASN 440 Ca 0.00 -1.98 -0.41 0.00 -0.03 0.00 0.00 54.58 52.16 1jx9 n ASN 440 Cb 0.00 -0.36 -0.06 0.00 -0.61 0.00 0.00 39.78 38.75 1jx9 n ASN 440 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1jx9 s ASN 441 N -1.09 5.90 0.39 6.41 2.47 -1.26 -4.92 114.94 122.83 1jx9 s ASN 441 Ca 0.39 -2.73 0.15 0.00 0.42 0.00 0.00 52.86 51.09 1jx9 s ASN 441 Cb 0.20 -2.01 1.01 0.00 -1.45 0.00 0.00 41.25 39.00 1jx9 s ASN 441 CO 0.27 -0.47 1.82 0.58 -3.72 0.00 0.00 177.10 175.58 1jx9 h VAL 442 N 5.12 0.65 0.00 -5.21 2.07 -1.94 -1.03 116.25 115.92 1jx9 h VAL 442 Ca 0.02 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1jx9 h VAL 442 Cb 1.00 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1jx9 h VAL 442 CO 0.74 0.09 0.00 0.77 0.02 0.00 0.00 177.57 179.19 1jx9 h SER 443 N 0.49 0.00 -0.21 0.57 4.64 -1.98 -2.02 113.55 115.03 1jx9 h SER 443 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1jx9 h SER 443 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1jx9 h SER 443 CO -0.25 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.25 1jx9 n ASN 444 N -2.97 3.57 -4.68 4.97 2.04 -0.39 -4.99 115.26 112.82 1jx9 n ASN 444 Ca -0.01 -3.01 -0.43 0.00 -0.44 0.00 0.00 54.58 50.69 1jx9 n ASN 444 Cb 0.18 -0.52 -0.02 0.00 -2.53 0.00 0.00 39.78 36.88 1jx9 n ASN 444 CO 0.00 0.00 0.00 0.26 -0.44 0.00 0.00 177.26 177.08 1jx9 s TRP 445 N -2.80 2.98 -0.57 -2.53 0.52 -0.76 -4.99 118.94 110.79 1jx9 s TRP 445 Ca 0.40 1.06 0.00 0.00 0.02 0.00 0.00 56.10 57.58 1jx9 s TRP 445 Cb 0.33 -3.49 0.15 0.00 -1.15 0.00 0.00 33.47 29.30 1jx9 s TRP 445 CO 0.08 -1.67 0.35 0.15 0.02 0.00 0.00 176.95 175.88 1jx9 s LYS 446 N 2.79 2.28 0.55 4.98 1.02 -1.26 -4.65 119.74 125.46 1jx9 s LYS 446 Ca 0.57 -2.56 -0.12 0.00 0.02 0.00 0.00 55.97 53.88 1jx9 s LYS 446 Cb -0.24 -3.54 -0.05 0.00 -0.52 0.00 0.00 37.83 33.48 1jx9 s LYS 446 CO 0.20 -1.14 0.96 0.95 -0.92 0.00 0.00 175.35 175.40 1jx9 s THR 447 N -0.14 4.70 0.17 2.17 -4.23 -1.26 -4.87 115.64 112.18 1jx9 s THR 447 Ca 0.17 0.84 -0.30 0.00 -1.18 0.00 0.00 61.69 61.22 1jx9 s THR 447 Cb -0.23 -3.82 -0.08 0.00 1.34 0.00 0.00 72.50 69.71 1jx9 s THR 447 CO -0.02 -0.93 1.23 -2.84 -0.54 0.00 0.00 174.62 171.52 1jx9 s PRO 448 N -4.72 4.45 0.54 3.99 0.02 -1.26 -0.83 135.00 137.19 1jx9 s PRO 448 Ca 0.55 1.91 -0.05 0.00 0.02 0.00 0.00 61.00 63.42 1jx9 s PRO 448 Cb -0.11 -3.24 -0.01 0.00 0.02 0.00 0.00 34.50 31.16 1jx9 s PRO 448 CO 0.45 -0.16 0.84 0.00 -0.33 0.00 0.00 177.00 177.80 1jx9 s ALA 449 N 0.15 3.36 0.21 -1.55 0.00 -0.10 -4.63 121.76 119.21 1jx9 s ALA 449 Ca 0.55 -0.61 -0.20 0.00 0.00 0.00 0.00 51.96 51.69 1jx9 s ALA 449 Cb -0.33 -2.59 -0.08 0.00 0.00 0.00 0.00 23.12 20.12 1jx9 s ALA 449 CO 0.36 -0.58 0.72 -1.64 0.00 0.00 0.00 175.76 174.62 1jx9 s MET 450 N -4.87 4.28 0.54 0.00 -1.94 -1.26 -4.93 119.30 111.13 1jx9 s MET 450 Ca 0.51 0.89 0.05 0.00 -1.71 0.00 0.00 55.69 55.43 1jx9 s MET 450 Cb -0.10 -2.94 0.05 0.00 2.01 0.00 0.00 34.83 33.85 1jx9 s MET 450 CO 0.45 0.43 0.42 0.00 -0.01 0.00 0.00 175.02 176.30 1jx9 n ALA 451 N 0.87 0.84 -2.92 3.03 0.00 -1.26 -0.92 120.51 120.16 1jx9 n ALA 451 Ca -0.03 -2.16 -0.18 0.00 0.00 0.00 0.00 53.44 51.07 1jx9 n ALA 451 Cb 0.51 0.88 -0.15 0.00 0.00 0.00 0.00 19.45 20.69 1jx9 n ALA 451 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1jx9 s LEU 452 N 0.00 1.86 -0.09 0.00 0.20 -0.26 -4.10 118.68 116.30 1jx9 s LEU 452 Ca 0.32 -0.14 0.02 0.00 0.69 0.00 0.00 54.13 55.02 1jx9 s LEU 452 Cb -0.03 -0.41 0.01 0.00 -0.43 0.00 0.00 46.19 45.34 1jx9 s LEU 452 CO 0.20 0.06 -0.14 -0.89 -0.29 0.00 0.00 176.35 175.29 1jx9 s THR 453 N 0.07 1.35 -0.62 3.68 2.01 -1.20 -1.22 115.64 119.71 1jx9 s THR 453 Ca -0.01 -0.58 -0.22 0.00 0.31 0.00 0.00 61.69 61.20 1jx9 s THR 453 Cb -0.06 -1.23 0.07 0.00 0.01 0.00 0.00 72.50 71.29 1jx9 s THR 453 CO -0.00 0.41 0.89 -0.36 -0.69 0.00 0.00 174.62 174.87 1jx9 s PHE 454 N 0.80 2.77 0.42 4.92 0.40 0.23 -4.37 117.98 123.15 1jx9 s PHE 454 Ca -0.11 -0.52 -0.21 0.00 -0.60 0.00 0.00 56.93 55.48 1jx9 s PHE 454 Cb -0.16 -4.15 -0.11 0.00 0.51 0.00 0.00 43.02 39.11 1jx9 s PHE 454 CO 0.02 -1.50 0.95 1.03 0.70 0.00 0.00 175.22 176.42 1jx9 s ARG 455 N 3.73 4.26 0.01 0.44 0.52 -0.16 -1.24 118.95 126.51 1jx9 s ARG 455 Ca 0.21 1.14 0.27 0.00 -0.52 0.00 0.00 55.73 56.83 1jx9 s ARG 455 Cb -0.17 -2.23 0.91 0.00 0.52 0.00 0.00 34.95 33.98 1jx9 s ARG 455 CO 0.11 -0.01 1.70 0.00 0.02 0.00 0.00 175.30 177.13 1jx9 n ALA 456 N -0.55 2.82 -2.81 2.13 0.00 -1.26 -0.48 120.51 120.37 1jx9 n ALA 456 Ca 0.07 -0.20 -0.36 0.00 0.00 0.00 0.00 53.44 52.94 1jx9 n ALA 456 Cb 0.54 -1.32 -0.07 0.00 0.00 0.00 0.00 19.45 18.60 1jx9 n ALA 456 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1jx9 s ASN 457 N -3.09 6.37 1.14 0.00 0.01 -1.26 -0.32 114.94 117.78 1jx9 s ASN 457 Ca 0.12 0.43 -0.19 0.00 -0.71 0.00 0.00 52.86 52.52 1jx9 s ASN 457 Cb 0.18 -2.09 0.26 0.00 0.41 0.00 0.00 41.25 40.02 1jx9 s ASN 457 CO 0.60 0.33 1.18 0.54 -1.51 0.00 0.00 177.10 178.24 1jx9 s ASN 458 N -0.60 1.51 0.61 -1.22 2.20 0.48 -4.74 114.94 113.18 1jx9 s ASN 458 Ca 0.14 0.50 0.32 0.00 -0.94 0.00 0.00 52.86 52.87 1jx9 s ASN 458 Cb -0.12 -0.66 1.80 0.00 -2.00 0.00 0.00 41.25 40.27 1jx9 s ASN 458 CO 0.03 -3.75 2.13 2.19 -2.94 0.00 0.00 177.10 174.76 1jx9 h PHE 459 N -2.33 0.00 0.00 1.54 -5.15 -1.88 0.36 116.94 109.47 1jx9 h PHE 459 Ca -0.44 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.33 1jx9 h PHE 459 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.44 1jx9 h PHE 459 CO -1.94 0.00 0.00 0.74 -2.00 0.00 0.00 178.31 175.11 1jx9 h PHE 460 N 0.00 0.00 0.00 6.09 -1.00 -1.99 -3.45 116.94 116.59 1jx9 h PHE 460 Ca 0.05 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.83 1jx9 h PHE 460 Cb 0.40 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.96 1jx9 h PHE 460 CO 0.00 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.11 1jx9 n GLY 461 N 0.10 0.77 3.63 -1.45 0.00 0.13 -5.06 105.19 103.31 1jx9 n GLY 461 Ca 0.02 -0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 1jx9 n GLY 461 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jx9 s VAL 462 N -2.00 5.08 0.10 1.61 1.01 -1.25 -4.83 120.40 120.12 1jx9 s VAL 462 Ca 0.00 0.08 -0.36 0.00 0.00 0.00 0.00 61.98 61.70 1jx9 s VAL 462 Cb 0.00 -3.34 -0.15 0.00 0.00 0.00 0.00 36.38 32.88 1jx9 s VAL 462 CO 0.00 0.39 1.47 -2.65 0.00 0.00 0.00 175.10 174.31 1jx9 n PRO 463 N 4.08 1.61 -0.04 2.72 -0.02 -1.26 -0.39 135.00 141.70 1jx9 n PRO 463 Ca -0.16 0.58 0.02 0.00 -2.02 0.00 0.00 63.50 61.93 1jx9 n PRO 463 Cb 0.52 -2.29 0.03 0.00 -0.02 0.00 0.00 33.50 31.75 1jx9 n PRO 463 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jx9 n GLN 464 N 3.13 2.17 -3.67 -0.52 10.64 0.56 -4.81 117.38 124.89 1jx9 n GLN 464 Ca 0.18 -1.65 -0.00 0.00 -1.83 0.00 0.00 57.00 53.70 1jx9 n GLN 464 Cb 0.23 -1.06 -0.01 0.00 -0.86 0.00 0.00 30.24 28.55 1jx9 n GLN 464 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1jx9 s ALA 465 N -1.33 -2.04 0.54 2.61 0.00 -1.07 -4.60 121.76 115.87 1jx9 s ALA 465 Ca 0.08 0.48 -0.17 0.00 0.00 0.00 0.00 51.96 52.35 1jx9 s ALA 465 Cb 0.07 0.46 -0.06 0.00 0.00 0.00 0.00 23.12 23.59 1jx9 s ALA 465 CO 0.01 -1.05 1.03 0.00 0.00 0.00 0.00 175.76 175.74 1jx9 s ALA 466 N -2.70 2.86 0.25 0.00 0.00 -1.26 -4.81 121.76 116.10 1jx9 s ALA 466 Ca 0.14 0.41 -0.03 0.00 0.00 0.00 0.00 51.96 52.47 1jx9 s ALA 466 Cb 0.03 -3.21 0.45 0.00 0.00 0.00 0.00 23.12 20.39 1jx9 s ALA 466 CO -0.02 -0.49 1.77 0.00 0.00 0.00 0.00 175.76 177.02 1jx9 h ALA 467 N 0.94 1.15 0.00 0.00 0.00 -2.01 0.52 119.26 119.86 1jx9 h ALA 467 Ca -0.48 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1jx9 h ALA 467 Cb 1.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1jx9 h ALA 467 CO 0.59 -0.07 0.00 -0.85 0.00 0.00 0.00 179.25 178.91 1jx9 n GLU 468 N -4.87 0.09 0.00 0.00 0.28 -1.26 -1.48 120.64 113.40 1jx9 n GLU 468 Ca 0.15 0.53 0.15 0.00 -0.16 0.00 0.00 57.16 57.83 1jx9 n GLU 468 Cb 0.37 -1.77 0.78 0.00 1.43 0.00 0.00 31.44 32.25 1jx9 n GLU 468 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1jx9 n GLU 469 N -1.96 0.80 -1.82 3.44 1.02 0.17 -4.87 120.64 117.43 1jx9 n GLU 469 Ca -0.00 -0.13 -0.41 0.00 -0.02 0.00 0.00 57.16 56.60 1jx9 n GLU 469 Cb 0.06 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 29.97 1jx9 n GLU 469 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1jx9 s THR 470 N -2.28 2.17 0.22 2.62 2.01 -0.55 -4.86 115.64 114.96 1jx9 s THR 470 Ca 0.37 0.14 0.07 0.00 0.31 0.00 0.00 61.69 62.59 1jx9 s THR 470 Cb 0.21 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.59 1jx9 s THR 470 CO 0.42 0.02 0.08 -0.13 -0.69 0.00 0.00 174.62 174.32 1jx9 s ARG 471 N -0.45 2.61 0.03 4.92 1.81 -0.37 -4.97 118.95 122.53 1jx9 s ARG 471 Ca 0.63 -1.12 0.04 0.00 -1.72 0.00 0.00 55.73 53.55 1jx9 s ARG 471 Cb -0.47 -2.42 -0.02 0.00 -0.45 0.00 0.00 34.95 31.59 1jx9 s ARG 471 CO 0.47 0.42 -0.12 -1.01 -0.68 0.00 0.00 175.30 174.38 1jx9 s HIS 472 N -1.99 1.08 -0.06 -0.53 3.76 -1.26 -0.60 115.29 115.69 1jx9 s HIS 472 Ca 0.30 -0.35 0.00 0.00 -0.15 0.00 0.00 55.06 54.87 1jx9 s HIS 472 Cb -0.08 -0.64 0.02 0.00 1.11 0.00 0.00 32.58 32.99 1jx9 s HIS 472 CO 0.21 0.01 -0.04 -1.14 -0.85 0.00 0.00 174.74 172.94 1jx9 s GLN 473 N -1.09 0.85 0.17 1.40 0.74 -0.36 -4.99 119.66 116.38 1jx9 s GLN 473 Ca 0.00 -0.08 -0.14 0.00 0.05 0.00 0.00 55.36 55.19 1jx9 s GLN 473 Cb -0.08 -0.93 0.10 0.00 1.10 0.00 0.00 33.01 33.20 1jx9 s GLN 473 CO 0.01 -0.14 1.78 0.00 -0.55 0.00 0.00 175.29 176.39 1jx9 h ALA 474 N 7.50 0.57 -2.29 1.58 0.00 -1.91 -0.68 119.26 124.05 1jx9 h ALA 474 Ca -0.33 0.02 -0.65 0.00 0.00 0.00 0.00 54.91 53.95 1jx9 h ALA 474 Cb 1.15 -0.07 -0.15 0.00 0.00 0.00 0.00 17.79 18.71 1jx9 h ALA 474 CO 0.42 -0.12 0.06 -2.00 0.00 0.00 0.00 179.25 177.61 1jx9 s GLU 475 N -6.14 3.43 0.36 0.00 2.12 -1.26 -4.01 118.70 113.19 1jx9 s GLU 475 Ca -0.13 -0.27 -0.28 0.00 0.36 0.00 0.00 54.97 54.65 1jx9 s GLU 475 Cb 0.13 -3.89 -0.11 0.00 0.26 0.00 0.00 34.13 30.52 1jx9 s GLU 475 CO 0.73 -0.86 1.41 -0.47 -0.54 0.00 0.00 175.26 175.54 1jx9 s TYR 476 N 2.64 2.76 -0.14 5.30 5.04 -0.10 -4.54 117.35 128.31 1jx9 s TYR 476 Ca 0.21 1.27 -0.01 0.00 -2.44 0.00 0.00 57.07 56.10 1jx9 s TYR 476 Cb -0.15 -3.89 0.04 0.00 0.35 0.00 0.00 41.96 38.32 1jx9 s TYR 476 CO 0.16 -2.56 -0.02 -0.65 -1.34 0.00 0.00 175.55 171.15 1jx9 s GLN 477 N -2.00 1.01 -1.19 4.97 -0.21 -1.26 -4.91 119.66 116.07 1jx9 s GLN 477 Ca 0.52 -0.30 -0.18 0.00 0.02 0.00 0.00 55.36 55.41 1jx9 s GLN 477 Cb -0.44 -1.72 -0.03 0.00 1.00 0.00 0.00 33.01 31.83 1jx9 s GLN 477 CO 0.59 -0.44 2.00 -1.71 -2.12 0.00 0.00 175.29 173.61 1jx9 n ASN 478 N 5.00 3.59 -3.70 5.90 5.15 -0.37 -4.82 115.26 126.02 1jx9 n ASN 478 Ca -0.10 -2.79 -0.16 0.00 -0.60 0.00 0.00 54.58 50.94 1jx9 n ASN 478 Cb 0.48 -1.53 -0.08 0.00 -0.53 0.00 0.00 39.78 38.12 1jx9 n ASN 478 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1jx9 s ARG 479 N 4.42 1.55 0.48 1.20 1.70 -1.26 -3.70 118.95 123.34 1jx9 s ARG 479 Ca 0.55 -1.81 -0.24 0.00 -0.47 0.00 0.00 55.73 53.76 1jx9 s ARG 479 Cb 0.10 0.32 -0.07 0.00 -0.57 0.00 0.00 34.95 34.73 1jx9 s ARG 479 CO 0.04 -0.56 1.34 0.20 -1.08 0.00 0.00 175.30 175.24 1jx9 s GLY 480 N -3.26 2.89 0.31 3.88 0.00 -1.26 -4.82 107.32 105.07 1jx9 s GLY 480 Ca 0.38 1.30 0.03 0.00 0.00 0.00 0.00 44.72 46.43 1jx9 s GLY 480 CO 0.20 1.85 1.88 -0.84 0.00 0.00 0.00 173.10 176.19 1jx9 h THR 481 N 1.91 0.96 -3.65 0.90 2.02 -0.23 -3.40 112.91 111.42 1jx9 h THR 481 Ca -0.50 -0.32 -0.37 0.00 0.77 0.00 0.00 66.41 65.99 1jx9 h THR 481 Cb 1.27 -0.05 -0.18 0.00 -1.74 0.00 0.00 68.15 67.46 1jx9 h THR 481 CO 0.60 0.17 -0.74 -1.83 0.37 0.00 0.00 175.52 174.08 1jx9 s GLU 482 N -5.86 0.93 -0.04 6.66 4.04 -1.25 -4.71 118.70 118.47 1jx9 s GLU 482 Ca -0.11 -1.20 0.03 0.00 0.04 0.00 0.00 54.97 53.73 1jx9 s GLU 482 Cb 0.21 -0.72 0.00 0.00 0.02 0.00 0.00 34.13 33.65 1jx9 s GLU 482 CO 0.80 0.13 -0.12 -0.80 -1.84 0.00 0.00 175.26 173.42 1jx9 s ASN 483 N -2.45 1.63 0.01 0.83 -0.87 -1.26 -3.65 114.94 109.18 1jx9 s ASN 483 Ca 0.07 -0.26 0.02 0.00 -1.57 0.00 0.00 52.86 51.12 1jx9 s ASN 483 Cb -0.04 -0.55 -0.01 0.00 -0.02 0.00 0.00 41.25 40.63 1jx9 s ASN 483 CO 0.02 0.08 -0.07 1.51 -2.57 0.00 0.00 177.10 176.06 1jx9 s ASP 484 N 0.31 0.79 -0.04 -1.22 -4.77 -1.04 -2.47 116.67 108.24 1jx9 s ASP 484 Ca -0.07 -0.26 0.02 0.00 -3.30 0.00 0.00 52.55 48.94 1jx9 s ASP 484 Cb -0.12 -0.04 0.01 0.00 -1.09 0.00 0.00 42.92 41.68 1jx9 s ASP 484 CO 0.02 -0.01 -0.09 -0.32 0.70 0.00 0.00 175.17 175.46 1jx9 s MET 485 N -0.63 1.11 -0.10 2.11 1.75 -0.37 -1.40 119.30 121.77 1jx9 s MET 485 Ca -0.01 -0.31 0.03 0.00 -1.25 0.00 0.00 55.69 54.15 1jx9 s MET 485 Cb -0.05 -1.01 -0.00 0.00 2.84 0.00 0.00 34.83 36.61 1jx9 s MET 485 CO 0.00 0.08 -0.22 0.42 -0.65 0.00 0.00 175.02 174.65 1jx9 s ILE 486 N 0.37 2.29 -0.22 10.11 1.09 -0.24 -1.42 121.20 133.19 1jx9 s ILE 486 Ca -0.06 -0.94 -0.00 0.00 -1.10 0.00 0.00 60.65 58.54 1jx9 s ILE 486 Cb -0.11 -1.89 0.02 0.00 -1.06 0.00 0.00 42.46 39.42 1jx9 s ILE 486 CO 0.01 0.55 -0.13 -0.69 -0.10 0.00 0.00 174.94 174.59 1jx9 s VAL 487 N 0.26 2.50 -0.01 2.92 1.01 0.86 -0.87 120.40 127.06 1jx9 s VAL 487 Ca -0.15 -0.99 -0.16 0.00 0.00 0.00 0.00 61.98 60.68 1jx9 s VAL 487 Cb -0.17 -2.19 -0.06 0.00 0.00 0.00 0.00 36.38 33.97 1jx9 s VAL 487 CO 0.07 0.35 0.43 -0.36 0.00 0.00 0.00 175.10 175.59 1jx9 s PHE 488 N 1.30 3.70 -1.30 5.22 0.08 0.24 -1.07 117.98 126.16 1jx9 s PHE 488 Ca 0.02 1.00 -0.14 0.00 0.12 0.00 0.00 56.93 57.92 1jx9 s PHE 488 Cb -0.15 -2.34 0.01 0.00 -0.57 0.00 0.00 43.02 39.96 1jx9 s PHE 488 CO -0.08 0.57 0.54 0.43 -0.10 0.00 0.00 175.22 176.58 1jx9 n SER 489 N 2.10 -2.56 -4.70 1.36 7.64 -0.11 -0.65 113.62 116.69 1jx9 n SER 489 Ca -0.13 -1.10 -0.42 0.00 1.01 0.00 0.00 58.87 58.23 1jx9 n SER 489 Cb 0.52 -2.70 -0.03 0.00 -1.01 0.00 0.00 64.21 60.99 1jx9 n SER 489 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1jx9 s PRO 490 N -6.65 4.26 0.17 1.43 0.04 -1.26 -3.69 135.00 129.29 1jx9 s PRO 490 Ca 0.26 2.17 0.21 0.00 0.04 0.00 0.00 61.00 63.68 1jx9 s PRO 490 Cb -0.11 -3.41 0.86 0.00 0.04 0.00 0.00 34.50 31.87 1jx9 s PRO 490 CO 0.91 -0.59 1.63 0.25 0.04 0.00 0.00 177.00 179.24 1jx9 n THR 491 N 4.36 0.88 -0.40 1.26 -2.24 -0.35 -3.00 114.28 114.78 1jx9 n THR 491 Ca 0.14 0.23 0.10 0.00 -2.27 0.00 0.00 64.05 62.24 1jx9 n THR 491 Cb 0.41 -1.09 0.29 0.00 -2.10 0.00 0.00 70.33 67.85 1jx9 n THR 491 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1jx9 n THR 492 N -1.99 1.21 -4.42 4.28 -2.24 -1.26 -4.98 114.28 104.89 1jx9 n THR 492 Ca 0.03 -1.07 -0.21 0.00 -2.27 0.00 0.00 64.05 60.53 1jx9 n THR 492 Cb 0.21 0.40 -0.10 0.00 -2.10 0.00 0.00 70.33 68.75 1jx9 n THR 492 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1jx9 s SER 493 N -1.01 2.99 0.00 3.42 0.15 -1.16 -5.01 113.70 113.07 1jx9 s SER 493 Ca 0.44 -1.08 0.27 0.00 0.70 0.00 0.00 55.95 56.28 1jx9 s SER 493 Cb 0.25 -0.21 0.84 0.00 -1.71 0.00 0.00 66.02 65.19 1jx9 s SER 493 CO 0.27 -0.16 1.62 -0.90 1.20 0.00 0.00 173.24 175.28 1jx9 n ASP 494 N -0.53 1.33 -4.77 5.45 5.75 -1.26 -4.84 116.55 117.68 1jx9 n ASP 494 Ca -0.06 -1.22 -0.30 0.00 -0.01 0.00 0.00 54.79 53.20 1jx9 n ASP 494 Cb 0.61 0.08 -0.07 0.00 -1.03 0.00 0.00 41.12 40.72 1jx9 n ASP 494 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1jx9 s ARG 495 N -2.26 2.87 0.00 0.11 1.81 -1.26 -4.99 118.95 115.22 1jx9 s ARG 495 Ca 0.30 -0.70 0.26 0.00 -1.72 0.00 0.00 55.73 53.88 1jx9 s ARG 495 Cb 0.20 -2.72 1.55 0.00 -0.45 0.00 0.00 34.95 33.53 1jx9 s ARG 495 CO 0.43 0.56 1.95 -2.30 -0.68 0.00 0.00 175.30 175.27 1jx9 n PRO 496 N 0.46 0.93 -3.62 3.54 -0.02 -1.26 -4.45 135.00 130.56 1jx9 n PRO 496 Ca -0.09 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.26 1jx9 n PRO 496 Cb 0.52 -1.44 -0.07 0.00 -0.02 0.00 0.00 33.50 32.49 1jx9 n PRO 496 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1jx9 s VAL 497 N -2.00 0.00 0.09 -1.45 0.11 -1.26 -0.94 120.40 114.95 1jx9 s VAL 497 Ca 0.39 0.00 0.08 0.00 -2.93 0.00 0.00 61.98 59.51 1jx9 s VAL 497 Cb 0.18 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 34.00 1jx9 s VAL 497 CO 0.30 0.00 -0.20 -0.76 -3.33 0.00 0.00 175.10 171.11 1jx9 s LEU 498 N 0.24 2.28 -0.05 2.54 1.43 -0.23 -4.99 118.68 119.90 1jx9 s LEU 498 Ca -0.00 -0.65 -0.12 0.00 -1.03 0.00 0.00 54.13 52.33 1jx9 s LEU 498 Cb -0.05 -0.83 0.02 0.00 0.03 0.00 0.00 46.19 45.36 1jx9 s LEU 498 CO 0.01 0.05 0.28 0.00 0.23 0.00 0.00 176.35 176.91 1jx9 s ALA 499 N -1.12 -0.69 0.05 4.21 0.00 -1.26 -0.10 121.76 122.84 1jx9 s ALA 499 Ca 0.05 0.43 -0.02 0.00 0.00 0.00 0.00 51.96 52.43 1jx9 s ALA 499 Cb -0.10 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 1jx9 s ALA 499 CO 0.04 -0.21 -0.01 -1.58 0.00 0.00 0.00 175.76 174.00 1jx9 s TRP 500 N -0.80 0.44 0.39 0.00 0.51 -0.50 0.24 118.94 119.23 1jx9 s TRP 500 Ca -0.09 -0.93 -0.15 0.00 -2.12 0.00 0.00 56.10 52.81 1jx9 s TRP 500 Cb -0.04 -0.33 0.06 0.00 -0.81 0.00 0.00 33.47 32.34 1jx9 s TRP 500 CO 0.02 -0.36 0.79 0.16 -0.51 0.00 0.00 176.95 177.06 1jx9 s ASP 501 N -2.67 0.02 -0.17 2.95 -4.77 -0.42 -1.23 116.67 110.38 1jx9 s ASP 501 Ca 0.03 -1.18 -0.07 0.00 -3.30 0.00 0.00 52.55 48.03 1jx9 s ASP 501 Cb 0.05 0.86 0.07 0.00 -1.09 0.00 0.00 42.92 42.81 1jx9 s ASP 501 CO -0.09 -1.72 0.36 0.54 0.70 0.00 0.00 175.17 174.97 1jx9 s VAL 502 N -2.20 -0.37 -0.42 2.11 0.11 -1.03 -1.58 120.40 117.02 1jx9 s VAL 502 Ca 0.16 0.17 0.03 0.00 -2.93 0.00 0.00 61.98 59.41 1jx9 s VAL 502 Cb -0.05 -0.57 0.12 0.00 -1.53 0.00 0.00 36.38 34.34 1jx9 s VAL 502 CO 0.12 0.07 0.16 -0.69 -3.33 0.00 0.00 175.10 171.43 1jx9 s VAL 503 N 2.11 2.14 -0.02 2.04 1.01 -1.26 -3.98 120.40 122.44 1jx9 s VAL 503 Ca -0.04 -2.65 -0.02 0.00 0.00 0.00 0.00 61.98 59.27 1jx9 s VAL 503 Cb -0.11 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1jx9 s VAL 503 CO -0.11 -0.72 0.11 0.00 0.00 0.00 0.00 175.10 174.38 1jx9 s ALA 504 N 0.44 3.71 0.32 5.51 0.00 -1.26 -1.95 121.76 128.53 1jx9 s ALA 504 Ca 0.14 -0.81 0.08 0.00 0.00 0.00 0.00 51.96 51.37 1jx9 s ALA 504 Cb -0.22 -1.71 0.55 0.00 0.00 0.00 0.00 23.12 21.74 1jx9 s ALA 504 CO -0.06 0.69 1.75 -1.35 0.00 0.00 0.00 175.76 176.80 1jx9 h PRO 505 N 4.19 0.20 -1.87 0.00 0.11 -1.86 -3.38 132.00 129.39 1jx9 h PRO 505 Ca -0.50 -0.08 0.30 0.00 0.11 0.00 0.00 66.00 65.83 1jx9 h PRO 505 Cb 1.19 -0.01 -0.09 0.00 0.11 0.00 0.00 31.00 32.20 1jx9 h PRO 505 CO 0.63 0.54 0.80 0.20 -0.21 0.00 0.00 178.00 179.96 1jx9 s GLY 506 N -4.21 -0.24 0.36 -0.55 0.00 -0.82 -1.07 107.32 100.80 1jx9 s GLY 506 Ca -0.04 0.30 0.06 0.00 0.00 0.00 0.00 44.72 45.04 1jx9 s GLY 506 CO 0.76 2.29 1.93 -1.61 0.00 0.00 0.00 173.10 176.47 1jx9 h GLN 507 N 2.00 0.47 -6.32 2.90 5.75 -1.65 -3.41 115.11 114.85 1jx9 h GLN 507 Ca -0.27 -0.08 -0.67 0.00 -0.15 0.00 0.00 58.65 57.48 1jx9 h GLN 507 Cb 1.20 -0.08 -0.16 0.00 1.07 0.00 0.00 27.48 29.52 1jx9 h GLN 507 CO 0.30 0.47 -0.70 0.45 -2.65 0.00 0.00 178.83 176.71 1jx9 s SER 508 N -6.76 4.71 -0.08 -0.69 0.15 -0.68 -4.88 113.70 105.47 1jx9 s SER 508 Ca -0.07 -0.17 0.12 0.00 0.70 0.00 0.00 55.95 56.53 1jx9 s SER 508 Cb 0.16 -1.09 0.34 0.00 -1.71 0.00 0.00 66.02 63.72 1jx9 s SER 508 CO 0.75 0.25 1.27 0.61 1.20 0.00 0.00 173.24 177.32 1jx9 n GLY 509 N 1.26 3.51 3.74 9.45 0.00 -1.26 -4.15 105.19 117.73 1jx9 n GLY 509 Ca -0.14 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 1jx9 n GLY 509 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1jx9 s PHE 510 N -1.88 3.77 -0.07 1.61 5.36 -1.26 -4.98 117.98 120.53 1jx9 s PHE 510 Ca 0.28 1.76 -0.00 0.00 -0.96 0.00 0.00 56.93 58.01 1jx9 s PHE 510 Cb 0.20 -3.11 0.02 0.00 -0.34 0.00 0.00 43.02 39.80 1jx9 s PHE 510 CO 0.10 -0.00 -0.03 0.42 -1.46 0.00 0.00 175.22 174.24 1jx9 s ILE 511 N -0.29 0.57 0.79 3.12 1.01 -1.26 -1.74 121.20 123.40 1jx9 s ILE 511 Ca 0.47 -0.04 -0.14 0.00 0.00 0.00 0.00 60.65 60.94 1jx9 s ILE 511 Cb -0.26 -0.65 0.07 0.00 0.01 0.00 0.00 42.46 41.63 1jx9 s ILE 511 CO 0.32 0.27 1.20 0.00 0.00 0.00 0.00 174.94 176.74 1jx9 s ALA 512 N 1.57 1.90 0.41 9.38 0.00 0.02 -4.83 121.76 130.21 1jx9 s ALA 512 Ca -0.00 0.84 0.20 0.00 0.00 0.00 0.00 51.96 52.99 1jx9 s ALA 512 Cb -0.13 -3.48 1.14 0.00 0.00 0.00 0.00 23.12 20.64 1jx9 s ALA 512 CO -0.04 -2.20 1.78 -1.35 0.00 0.00 0.00 175.76 173.95 1jx9 h PRO 513 N -0.78 0.35 0.00 0.00 0.11 -2.01 0.42 132.00 130.09 1jx9 h PRO 513 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1jx9 h PRO 513 Cb 1.29 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1jx9 h PRO 513 CO 0.47 0.23 0.00 -0.40 -0.21 0.00 0.00 178.00 178.09 1jx9 n ASP 514 N -4.59 0.00 0.00 -2.05 5.68 -1.26 -4.87 116.55 109.46 1jx9 n ASP 514 Ca 0.25 -1.03 0.00 0.00 -0.50 0.00 0.00 54.79 53.51 1jx9 n ASP 514 Cb 0.90 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.88 1jx9 n ASP 514 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jx9 n GLY 515 N 0.89 0.79 3.66 6.12 0.00 0.15 -5.03 105.19 111.78 1jx9 n GLY 515 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 1jx9 n GLY 515 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jx9 s THR 516 N -2.17 4.44 0.25 2.61 2.01 -1.25 -4.77 115.64 116.76 1jx9 s THR 516 Ca 0.00 1.74 -0.29 0.00 0.31 0.00 0.00 61.69 63.45 1jx9 s THR 516 Cb 0.00 -4.12 -0.09 0.00 0.01 0.00 0.00 72.50 68.30 1jx9 s THR 516 CO 0.00 -0.14 0.92 -0.69 -0.69 0.00 0.00 174.62 174.02 1jx9 s VAL 517 N 3.23 4.14 0.78 3.82 1.01 -1.26 -0.80 120.40 131.32 1jx9 s VAL 517 Ca 0.51 1.98 -0.15 0.00 0.00 0.00 0.00 61.98 64.32 1jx9 s VAL 517 Cb -0.19 -4.24 0.04 0.00 0.00 0.00 0.00 36.38 31.99 1jx9 s VAL 517 CO 0.12 0.43 1.01 -0.67 0.00 0.00 0.00 175.10 175.99 1jx9 n ASP 518 N 1.31 0.44 0.15 3.32 2.03 -0.71 -4.90 116.55 118.19 1jx9 n ASP 518 Ca -0.02 0.60 0.05 0.00 0.52 0.00 0.00 54.79 55.95 1jx9 n ASP 518 Cb 0.48 -1.43 0.52 0.00 -0.72 0.00 0.00 41.12 39.97 1jx9 n ASP 518 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 1jx9 h LYS 519 N -0.65 0.22 -0.90 -0.67 2.10 -1.95 -2.23 116.57 112.50 1jx9 h LYS 519 Ca -0.46 -0.02 -0.55 0.00 -2.00 0.00 0.00 60.65 57.62 1jx9 h LYS 519 Cb 1.31 -0.05 -0.29 0.00 -0.90 0.00 0.00 32.23 32.31 1jx9 h LYS 519 CO 0.45 0.20 0.53 0.72 -2.00 0.00 0.00 179.45 179.35 1jx9 n HIS 520 N -4.46 2.87 0.08 0.07 8.25 -1.26 -4.52 115.22 116.24 1jx9 n HIS 520 Ca -0.01 -2.36 -0.11 0.00 -0.26 0.00 0.00 57.72 54.98 1jx9 n HIS 520 Cb 0.12 -1.06 -0.13 0.00 1.12 0.00 0.00 29.99 30.04 1jx9 n HIS 520 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1jx9 h TYR 521 N 1.53 0.22 0.00 4.41 3.20 -1.56 -1.73 116.97 123.04 1jx9 h TYR 521 Ca 0.55 -0.16 -0.04 0.00 3.14 0.00 0.00 58.73 62.22 1jx9 h TYR 521 Cb 1.73 -0.01 -0.08 0.00 1.54 0.00 0.00 36.73 39.91 1jx9 h TYR 521 CO 1.40 1.13 -0.45 -0.85 -1.64 0.00 0.00 178.16 177.75 1jx9 n GLU 522 N -3.42 0.00 0.00 1.82 0.28 -1.26 -3.75 120.64 114.31 1jx9 n GLU 522 Ca -0.04 -0.92 0.09 0.00 -0.16 0.00 0.00 57.16 56.12 1jx9 n GLU 522 Cb 0.98 -0.19 0.51 0.00 1.43 0.00 0.00 31.44 34.17 1jx9 n GLU 522 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1jx9 n ASP 523 N 0.09 0.00 0.00 -1.84 5.75 -1.18 -3.10 116.55 116.27 1jx9 n ASP 523 Ca -0.02 -1.46 0.00 0.00 -0.01 0.00 0.00 54.79 53.31 1jx9 n ASP 523 Cb 0.73 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.82 1jx9 n ASP 523 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jx9 n GLN 524 N -0.77 2.50 -0.03 0.11 6.02 -0.23 -4.77 117.38 120.20 1jx9 n GLN 524 Ca 0.13 -1.37 -0.14 0.00 -0.01 0.00 0.00 57.00 55.61 1jx9 n GLN 524 Cb 0.06 -1.00 -0.10 0.00 1.02 0.00 0.00 30.24 30.22 1jx9 n GLN 524 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1jx9 h LEU 525 N 0.00 0.14 -0.29 1.08 5.85 -1.46 -1.84 115.31 118.79 1jx9 h LEU 525 Ca 0.00 -0.67 -0.14 0.00 0.84 0.00 0.00 57.88 57.91 1jx9 h LEU 525 Cb 0.44 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 1jx9 h LEU 525 CO 0.00 0.79 -0.39 0.11 -0.34 0.00 0.00 178.44 178.61 1jx9 h LYS 526 N -0.50 0.77 -0.93 1.25 1.79 -1.87 -2.43 116.57 114.65 1jx9 h LYS 526 Ca -0.01 -0.44 0.16 0.00 -2.18 0.00 0.00 60.65 58.18 1jx9 h LYS 526 Cb 0.79 0.03 -0.10 0.00 -1.58 0.00 0.00 32.23 31.38 1jx9 h LYS 526 CO 0.02 1.07 0.53 1.98 -1.08 0.00 0.00 179.45 181.97 1jx9 h MET 527 N 0.52 0.71 -0.17 3.15 4.05 -1.86 -0.74 114.93 120.60 1jx9 h MET 527 Ca 0.03 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 1jx9 h MET 527 Cb 0.98 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.61 1jx9 h MET 527 CO 0.09 0.47 0.06 -0.92 0.23 0.00 0.00 176.91 176.84 1jx9 h TYR 528 N 0.74 0.26 -0.86 1.39 3.20 -1.05 0.19 116.97 120.82 1jx9 h TYR 528 Ca 0.51 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.48 1jx9 h TYR 528 Cb 0.70 -0.08 -0.08 0.00 1.54 0.00 0.00 36.73 38.81 1jx9 h TYR 528 CO -0.05 0.34 0.49 1.49 -1.64 0.00 0.00 178.16 178.78 1jx9 h GLU 529 N 0.10 0.73 -0.64 1.82 4.81 -0.70 -2.61 114.58 118.10 1jx9 h GLU 529 Ca 0.05 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1jx9 h GLU 529 Cb 0.19 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1jx9 h GLU 529 CO -0.00 0.48 0.00 0.27 -0.73 0.00 0.00 179.01 179.03 1jx9 n ASN 530 N -4.78 4.93 -1.70 1.04 0.23 -0.62 -4.90 115.26 109.47 1jx9 n ASN 530 Ca 0.16 -2.72 -0.15 0.00 -0.53 0.00 0.00 54.58 51.34 1jx9 n ASN 530 Cb 0.36 -0.64 -0.01 0.00 -2.08 0.00 0.00 39.78 37.41 1jx9 n ASN 530 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1jx9 n PHE 531 N 0.63 -0.67 -1.66 -2.53 3.72 -0.98 -5.02 117.46 110.95 1jx9 n PHE 531 Ca 0.24 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.43 1jx9 n PHE 531 Cb 1.02 -3.14 0.14 0.00 -0.94 0.00 0.00 39.48 36.55 1jx9 n PHE 531 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1jx9 n GLY 532 N -1.02 -1.35 3.55 1.37 0.00 0.64 -5.04 105.19 103.34 1jx9 n GLY 532 Ca -0.18 -1.70 -0.08 0.00 0.00 0.00 0.00 46.02 44.05 1jx9 n GLY 532 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1jx9 s ARG 533 N -5.02 0.65 0.14 1.61 1.70 -1.26 -4.69 118.95 112.08 1jx9 s ARG 533 Ca 0.53 -0.11 0.09 0.00 -0.47 0.00 0.00 55.73 55.77 1jx9 s ARG 533 Cb -0.01 0.30 -0.04 0.00 -0.57 0.00 0.00 34.95 34.63 1jx9 s ARG 533 CO 0.37 -0.26 -0.22 -1.59 -1.08 0.00 0.00 175.30 172.52 1jx9 s LYS 534 N -2.29 1.28 0.36 3.89 0.00 -0.61 -4.92 119.74 117.45 1jx9 s LYS 534 Ca 0.03 -1.32 -0.28 0.00 0.00 0.00 0.00 55.97 54.41 1jx9 s LYS 534 Cb -0.01 -1.56 -0.10 0.00 0.00 0.00 0.00 37.83 36.17 1jx9 s LYS 534 CO -0.05 0.35 1.34 -1.12 0.00 0.00 0.00 175.35 175.87 1jx9 s SER 535 N -2.24 6.58 -0.24 0.03 0.01 -1.26 -1.31 113.70 115.27 1jx9 s SER 535 Ca 0.12 2.75 -0.09 0.00 1.31 0.00 0.00 55.95 60.05 1jx9 s SER 535 Cb -0.09 -2.65 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 1jx9 s SER 535 CO 0.06 -0.67 0.12 -0.76 0.41 0.00 0.00 173.24 172.40 1jx9 s LEU 536 N -2.00 3.82 0.16 2.44 1.43 0.14 -4.85 118.68 119.82 1jx9 s LEU 536 Ca 0.51 -0.02 -0.10 0.00 -1.03 0.00 0.00 54.13 53.49 1jx9 s LEU 536 Cb -0.41 -2.02 -0.07 0.00 0.03 0.00 0.00 46.19 43.72 1jx9 s LEU 536 CO 0.54 0.03 0.48 0.26 0.23 0.00 0.00 176.35 177.89 1jx9 s TRP 537 N 1.26 3.52 0.14 0.29 0.52 -1.26 -4.40 118.94 119.00 1jx9 s TRP 537 Ca 0.06 0.85 0.00 0.00 0.02 0.00 0.00 56.10 57.03 1jx9 s TRP 537 Cb -0.14 -2.22 0.00 0.00 -1.15 0.00 0.00 33.47 29.96 1jx9 s TRP 537 CO 0.05 0.40 0.00 -0.11 0.02 0.00 0.00 176.95 177.31 1jx9 n LEU 538 N 0.39 0.66 -4.70 2.99 7.94 -1.26 -4.76 117.00 118.25 1jx9 n LEU 538 Ca -0.04 0.21 -0.34 0.00 -1.11 0.00 0.00 56.01 54.74 1jx9 n LEU 538 Cb 0.52 -0.11 0.12 0.00 0.53 0.00 0.00 43.42 44.48 1jx9 n LEU 538 CO 0.44 -0.74 0.78 0.42 -1.11 0.00 0.00 177.39 177.18 1jx9 s THR 539 N -1.87 2.14 0.19 1.96 -4.23 -1.26 -4.78 115.64 107.78 1jx9 s THR 539 Ca 0.00 0.06 -0.12 0.00 -1.18 0.00 0.00 61.69 60.45 1jx9 s THR 539 Cb 0.00 -2.51 0.10 0.00 1.34 0.00 0.00 72.50 71.43 1jx9 s THR 539 CO 0.00 -0.04 1.78 0.11 -0.54 0.00 0.00 174.62 175.93 1jx9 h LYS 540 N -0.76 0.49 -0.82 3.99 1.57 -1.99 -1.54 116.57 117.51 1jx9 h LYS 540 Ca -0.46 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1jx9 h LYS 540 Cb 1.29 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.45 1jx9 h LYS 540 CO 0.47 0.33 0.52 0.37 -0.57 0.00 0.00 179.45 180.57 1jx9 h GLN 541 N 0.51 1.10 -0.13 3.15 4.15 -1.98 0.31 115.11 122.22 1jx9 h GLN 541 Ca 0.25 -0.08 -0.02 0.00 0.77 0.00 0.00 58.65 59.57 1jx9 h GLN 541 Cb 0.18 -0.24 -0.00 0.00 0.21 0.00 0.00 27.48 27.63 1jx9 h GLN 541 CO -0.19 0.75 0.01 -0.44 -1.93 0.00 0.00 178.83 177.04 1jx9 h ASP 542 N 1.12 0.21 -0.09 -0.69 5.19 -1.77 0.38 116.42 120.77 1jx9 h ASP 542 Ca 0.30 -0.27 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1jx9 h ASP 542 Cb -0.08 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.37 1jx9 h ASP 542 CO -0.06 0.43 0.05 0.58 -3.12 0.00 0.00 179.24 177.12 1jx9 h VAL 543 N -0.02 1.01 -0.64 -1.35 2.07 -1.07 -1.96 116.25 114.28 1jx9 h VAL 543 Ca 0.04 -0.04 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1jx9 h VAL 543 Cb 0.32 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 1jx9 h VAL 543 CO 0.00 0.02 0.39 -0.08 0.02 0.00 0.00 177.57 177.93 1jx9 h GLU 544 N 0.11 0.75 0.00 1.57 4.57 -0.35 -0.59 114.58 120.64 1jx9 h GLU 544 Ca 0.03 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1jx9 h GLU 544 Cb -0.01 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.42 1jx9 h GLU 544 CO -0.01 0.49 0.00 0.00 -1.18 0.00 0.00 179.01 178.31 1jx9 h ALA 545 N 1.28 1.00 -0.07 2.92 0.00 -0.51 -2.73 119.26 121.14 1jx9 h ALA 545 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1jx9 h ALA 545 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1jx9 h ALA 545 CO -0.11 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.86 1jx9 n HIS 546 N -2.80 0.17 -1.73 0.00 8.25 -0.76 -5.04 115.22 113.30 1jx9 n HIS 546 Ca 0.00 -0.71 -0.39 0.00 -0.26 0.00 0.00 57.72 56.36 1jx9 n HIS 546 Cb 0.24 -0.11 0.03 0.00 1.12 0.00 0.00 29.99 31.27 1jx9 n HIS 546 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1jx9 n LYS 547 N -0.69 1.78 -0.00 -0.41 4.81 -0.30 -4.93 118.16 118.41 1jx9 n LYS 547 Ca 0.09 0.65 -0.01 0.00 -0.87 0.00 0.00 58.31 58.18 1jx9 n LYS 547 Cb 0.48 -2.53 -0.01 0.00 0.02 0.00 0.00 35.03 32.99 1jx9 n LYS 547 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1jx9 n GLU 548 N -0.71 1.85 -3.88 1.64 2.13 -1.26 -5.09 120.64 115.33 1jx9 n GLU 548 Ca 0.09 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.83 1jx9 n GLU 548 Cb 0.43 -1.02 -0.04 0.00 0.27 0.00 0.00 31.44 31.08 1jx9 n GLU 548 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1jx9 s SER 549 N -3.63 -0.19 -0.01 4.31 1.04 -1.26 -5.18 113.70 108.79 1jx9 s SER 549 Ca -0.01 -0.70 -0.23 0.00 0.48 0.00 0.00 55.95 55.49 1jx9 s SER 549 Cb 0.00 0.61 0.05 0.00 0.10 0.00 0.00 66.02 66.78 1jx9 s SER 549 CO 0.03 -1.15 0.50 -1.58 0.98 0.00 0.00 173.24 172.02 1jx9 s GLN 550 N -3.94 0.91 -0.24 4.02 0.74 -1.26 -5.17 119.66 114.72 1jx9 s GLN 550 Ca 0.15 -0.04 -0.19 0.00 0.05 0.00 0.00 55.36 55.33 1jx9 s GLN 550 Cb -0.02 0.42 0.07 0.00 1.10 0.00 0.00 33.01 34.57 1jx9 s GLN 550 CO 0.04 -0.29 0.62 -2.00 -0.55 0.00 0.00 175.29 173.11 1jx9 s GLU 551 N -1.57 0.69 -0.09 1.67 2.12 -1.26 -5.16 118.70 115.10 1jx9 s GLU 551 Ca -0.10 0.95 0.03 0.00 0.36 0.00 0.00 54.97 56.20 1jx9 s GLU 551 Cb -0.02 0.26 -0.01 0.00 0.26 0.00 0.00 34.13 34.62 1jx9 s GLU 551 CO 0.05 -0.11 -0.19 0.08 -0.54 0.00 0.00 175.26 174.55 1jx9 s VAL 552 N 0.76 2.60 0.03 3.70 1.01 -1.26 -5.12 120.40 122.12 1jx9 s VAL 552 Ca -0.03 -0.85 0.05 0.00 0.00 0.00 0.00 61.98 61.14 1jx9 s VAL 552 Cb -0.05 -2.03 -0.03 0.00 0.00 0.00 0.00 36.38 34.27 1jx9 s VAL 552 CO -0.06 0.56 -0.10 -0.76 0.00 0.00 0.00 175.10 174.74 1jx9 s LEU 553 N -0.01 3.03 -0.22 3.92 1.43 -1.26 -5.11 118.68 120.46 1jx9 s LEU 553 Ca -0.06 -0.25 0.01 0.00 -1.03 0.00 0.00 54.13 52.80 1jx9 s LEU 553 Cb -0.15 -1.77 0.05 0.00 0.03 0.00 0.00 46.19 44.36 1jx9 s LEU 553 CO 0.05 0.26 -0.07 -1.00 0.23 0.00 0.00 176.35 175.82 1jx9 s HIS 554 N -1.02 2.38 -0.01 0.29 3.76 -1.26 -5.11 115.29 114.32 1jx9 s HIS 554 Ca 0.17 -1.69 -0.00 0.00 -0.15 0.00 0.00 55.06 53.39 1jx9 s HIS 554 Cb -0.11 -1.59 0.01 0.00 1.11 0.00 0.00 32.58 32.00 1jx9 s HIS 554 CO 0.08 -0.76 0.01 0.08 -0.85 0.00 0.00 174.74 173.30 1jx9 s VAL 555 N 1.40 -0.01 -0.22 -0.90 1.01 -1.26 -5.13 120.40 115.29 1jx9 s VAL 555 Ca -0.05 0.04 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 1jx9 s VAL 555 Cb -0.18 -0.03 -0.04 0.00 0.00 0.00 0.00 36.38 36.13 1jx9 s VAL 555 CO -0.07 0.02 0.09 -1.58 0.00 0.00 0.00 175.10 173.56 1jx9 s GLN 556 N 0.22 3.86 0.00 2.72 2.00 -1.26 -5.37 119.66 121.84 1jx9 s GLN 556 Ca -0.02 -0.38 0.07 0.00 -2.00 0.00 0.00 55.36 53.03 1jx9 s GLN 556 Cb -0.03 -3.34 0.41 0.00 0.80 0.00 0.00 33.01 30.86 1jx9 s GLN 556 CO -0.01 0.03 0.87 -2.13 -0.50 0.00 0.00 175.29 173.55