#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxr s GLY 1 N 0.00 1.63 -0.41 -0.02 0.00 -1.26 -4.73 107.32 102.54 2jxr s GLY 1 Ca 0.00 -0.14 -0.08 0.00 0.00 0.00 0.00 44.72 44.49 2jxr s GLY 1 CO 0.00 0.28 0.23 0.30 0.00 0.00 0.00 173.10 173.91 2jxr s HIS 2 N -3.11 3.34 0.11 1.90 0.09 -0.66 -4.91 115.29 112.05 2jxr s HIS 2 Ca 0.61 -1.56 -0.20 0.00 -0.00 0.00 0.00 55.06 53.91 2jxr s HIS 2 Cb -0.15 -2.87 -0.07 0.00 -0.00 0.00 0.00 32.58 29.50 2jxr s HIS 2 CO 0.55 -0.83 0.61 -0.51 -0.00 0.00 0.00 174.74 174.56 2jxr s ASP 3 N 1.98 7.10 0.02 1.40 1.01 -1.26 -0.55 116.67 126.37 2jxr s ASP 3 Ca 0.03 1.32 0.03 0.00 0.71 0.00 0.00 52.55 54.64 2jxr s ASP 3 Cb -0.22 -2.38 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 2jxr s ASP 3 CO 0.02 0.23 -0.09 0.68 0.21 0.00 0.00 175.17 176.22 2jxr s VAL 4 N -1.18 0.73 0.28 -1.27 -7.23 1.00 -4.81 120.40 107.91 2jxr s VAL 4 Ca 0.32 -0.66 -0.08 0.00 -1.81 0.00 0.00 61.98 59.74 2jxr s VAL 4 Cb -0.20 -0.66 -0.06 0.00 0.56 0.00 0.00 36.38 36.02 2jxr s VAL 4 CO 0.20 0.01 0.59 -2.16 -0.31 0.00 0.00 175.10 173.44 2jxr s PRO 5 N -0.73 3.75 0.12 4.82 0.04 -1.26 -1.35 135.00 140.38 2jxr s PRO 5 Ca -0.00 0.23 0.05 0.00 0.04 0.00 0.00 61.00 61.32 2jxr s PRO 5 Cb -0.06 -2.60 -0.04 0.00 0.04 0.00 0.00 34.50 31.85 2jxr s PRO 5 CO 0.00 0.22 0.07 -0.51 0.04 0.00 0.00 177.00 176.82 2jxr s LEU 6 N -3.23 3.66 -0.08 -3.56 1.43 -0.19 -4.37 118.68 112.34 2jxr s LEU 6 Ca 0.47 -0.13 -0.01 0.00 -1.03 0.00 0.00 54.13 53.43 2jxr s LEU 6 Cb -0.11 -2.33 -0.03 0.00 0.03 0.00 0.00 46.19 43.75 2jxr s LEU 6 CO 0.25 0.13 -0.01 -0.89 0.23 0.00 0.00 176.35 176.06 2jxr s THR 7 N -1.51 4.16 -0.20 5.49 2.01 0.37 -2.97 115.64 122.98 2jxr s THR 7 Ca 0.29 -0.33 -0.04 0.00 0.31 0.00 0.00 61.69 61.92 2jxr s THR 7 Cb -0.11 -2.75 -0.01 0.00 0.01 0.00 0.00 72.50 69.64 2jxr s THR 7 CO 0.21 0.59 -0.04 0.21 -0.69 0.00 0.00 174.62 174.89 2jxr s ASN 8 N -0.92 4.40 -0.57 3.53 3.84 -1.26 -1.02 114.94 122.94 2jxr s ASN 8 Ca 0.14 -0.33 -0.12 0.00 0.21 0.00 0.00 52.86 52.75 2jxr s ASN 8 Cb -0.11 -1.74 0.14 0.00 -0.55 0.00 0.00 41.25 38.99 2jxr s ASN 8 CO 0.03 0.03 0.49 -0.47 -2.79 0.00 0.00 177.10 174.38 2jxr s TYR 9 N 1.19 3.43 -1.88 0.43 5.04 0.25 -4.60 117.35 121.20 2jxr s TYR 9 Ca 0.02 -1.76 0.00 0.00 -2.44 0.00 0.00 57.07 52.89 2jxr s TYR 9 Cb -0.14 -3.64 0.00 0.00 0.35 0.00 0.00 41.96 38.52 2jxr s TYR 9 CO -0.01 -0.99 0.00 1.28 -1.34 0.00 0.00 175.55 174.49 2jxr n LEU 10 N 4.74 -1.82 0.00 6.97 4.32 -1.26 -2.47 117.00 127.48 2jxr n LEU 10 Ca -0.05 0.13 0.00 0.00 -0.02 0.00 0.00 56.01 56.07 2jxr n LEU 10 Cb 0.41 -2.89 0.00 0.00 -1.62 0.00 0.00 43.42 39.32 2jxr n LEU 10 CO 0.44 -0.45 0.00 0.59 -1.22 0.00 0.00 177.39 176.75 2jxr n ASN 11 N -1.77 -0.99 -0.06 -1.43 4.13 -1.26 -4.78 115.26 109.10 2jxr n ASN 11 Ca -0.23 0.00 -0.07 0.00 1.68 0.00 0.00 54.58 55.96 2jxr n ASN 11 Cb 0.68 -0.94 -0.08 0.00 -1.54 0.00 0.00 39.78 37.89 2jxr n ASN 11 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2jxr n ALA 12 N 1.00 1.71 -3.54 5.41 0.00 -1.03 -4.91 120.51 119.15 2jxr n ALA 12 Ca 0.00 -0.72 -0.20 0.00 0.00 0.00 0.00 53.44 52.52 2jxr n ALA 12 Cb 0.04 0.05 -0.16 0.00 0.00 0.00 0.00 19.45 19.37 2jxr n ALA 12 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jxr s GLN 13 N -2.28 0.89 -0.12 0.00 -0.21 -1.22 -4.50 119.66 112.23 2jxr s GLN 13 Ca -0.09 -0.15 0.02 0.00 0.02 0.00 0.00 55.36 55.16 2jxr s GLN 13 Cb 0.04 -0.86 0.01 0.00 1.00 0.00 0.00 33.01 33.20 2jxr s GLN 13 CO 0.43 -0.05 -0.17 0.71 -2.12 0.00 0.00 175.29 174.10 2jxr s TYR 14 N 0.78 2.17 0.13 0.91 1.51 -1.25 0.85 117.35 122.44 2jxr s TYR 14 Ca -0.11 -1.06 -0.09 0.00 -1.01 0.00 0.00 57.07 54.80 2jxr s TYR 14 Cb -0.14 -1.54 -0.01 0.00 -0.11 0.00 0.00 41.96 40.17 2jxr s TYR 14 CO 0.01 -0.53 0.24 1.52 -1.11 0.00 0.00 175.55 175.67 2jxr s TYR 15 N 1.00 0.31 0.43 2.71 1.13 -0.18 -4.32 117.35 118.42 2jxr s TYR 15 Ca -0.05 -0.70 0.00 0.00 -1.41 0.00 0.00 57.07 54.91 2jxr s TYR 15 Cb -0.15 -0.07 -0.00 0.00 -1.10 0.00 0.00 41.96 40.64 2jxr s TYR 15 CO -0.03 -0.64 0.02 0.25 -2.51 0.00 0.00 175.55 172.64 2jxr n THR 16 N -0.14 0.00 -4.26 -3.49 -2.24 -0.96 0.14 114.28 103.33 2jxr n THR 16 Ca -0.11 -2.09 -0.35 0.00 -2.27 0.00 0.00 64.05 59.24 2jxr n THR 16 Cb 0.63 0.46 -0.10 0.00 -2.10 0.00 0.00 70.33 69.22 2jxr n THR 16 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2jxr s ASP 17 N -3.40 5.35 0.25 3.42 1.01 -1.26 -1.29 116.67 120.75 2jxr s ASP 17 Ca 0.02 0.12 0.08 0.00 0.71 0.00 0.00 52.55 53.48 2jxr s ASP 17 Cb 0.00 -1.68 -0.05 0.00 1.01 0.00 0.00 42.92 42.20 2jxr s ASP 17 CO 0.02 0.31 -0.10 0.27 0.21 0.00 0.00 175.17 175.87 2jxr s ILE 18 N -0.44 1.76 0.05 0.77 -4.36 -0.38 -4.19 121.20 114.41 2jxr s ILE 18 Ca 0.08 -2.18 0.04 0.00 -0.26 0.00 0.00 60.65 58.33 2jxr s ILE 18 Cb -0.12 -2.28 -0.04 0.00 1.25 0.00 0.00 42.46 41.27 2jxr s ILE 18 CO 0.02 -0.42 -0.04 0.42 0.24 0.00 0.00 174.94 175.15 2jxr s THR 19 N -2.95 3.78 -0.20 8.37 -4.23 0.45 -1.90 115.64 118.96 2jxr s THR 19 Ca 0.27 -0.90 0.02 0.00 -1.18 0.00 0.00 61.69 59.90 2jxr s THR 19 Cb 0.01 -2.72 -0.14 0.00 1.34 0.00 0.00 72.50 71.00 2jxr s THR 19 CO 0.10 0.26 -0.17 -0.11 -0.54 0.00 0.00 174.62 174.16 2jxr n LEU 20 N 1.09 2.85 0.00 4.79 7.94 -0.34 -0.39 117.00 132.94 2jxr n LEU 20 Ca -0.14 -0.10 0.00 0.00 -1.11 0.00 0.00 56.01 54.66 2jxr n LEU 20 Cb 0.52 -0.66 0.00 0.00 0.53 0.00 0.00 43.42 43.81 2jxr n LEU 20 CO 0.34 0.82 0.00 0.61 -1.11 0.00 0.00 177.39 178.05 2jxr n GLY 21 N 2.51 5.54 3.08 -3.96 0.00 -1.26 -3.35 105.19 107.74 2jxr n GLY 21 Ca -0.35 -1.41 -0.32 0.00 0.00 0.00 0.00 46.02 43.93 2jxr n GLY 21 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jxr s THR 22 N 0.24 1.94 1.16 2.61 2.01 -1.26 -2.05 115.64 120.29 2jxr s THR 22 Ca 0.00 -1.04 -0.17 0.00 0.31 0.00 0.00 61.69 60.79 2jxr s THR 22 Cb 0.00 -1.86 0.27 0.00 0.01 0.00 0.00 72.50 70.92 2jxr s THR 22 CO 0.00 0.36 1.09 -2.16 -0.69 0.00 0.00 174.62 173.22 2jxr s PRO 23 N 1.30 -0.92 0.50 4.92 0.04 -1.26 0.11 135.00 139.69 2jxr s PRO 23 Ca 0.01 0.12 -0.23 0.00 0.04 0.00 0.00 61.00 60.95 2jxr s PRO 23 Cb -0.15 -1.62 -0.06 0.00 0.04 0.00 0.00 34.50 32.71 2jxr s PRO 23 CO -0.10 -3.55 1.27 -2.14 0.04 0.00 0.00 177.00 172.52 2jxr s PRO 24 N -5.24 3.47 -0.28 0.56 0.02 -0.87 -4.89 135.00 127.78 2jxr s PRO 24 Ca 0.69 2.03 -0.06 0.00 0.02 0.00 0.00 61.00 63.69 2jxr s PRO 24 Cb -0.13 -2.36 0.01 0.00 0.02 0.00 0.00 34.50 32.04 2jxr s PRO 24 CO 0.57 -0.86 0.04 -0.65 -0.33 0.00 0.00 177.00 175.77 2jxr s GLN 25 N -2.76 3.10 0.04 5.54 -0.21 -1.26 -4.77 119.66 119.33 2jxr s GLN 25 Ca 0.67 -0.84 -0.22 0.00 0.02 0.00 0.00 55.36 54.99 2jxr s GLN 25 Cb -0.35 -3.26 -0.06 0.00 1.00 0.00 0.00 33.01 30.33 2jxr s GLN 25 CO 0.42 -0.40 0.66 1.21 -2.12 0.00 0.00 175.29 175.07 2jxr s ASN 26 N 1.47 7.11 0.08 5.90 2.47 -1.26 -1.20 114.94 129.52 2jxr s ASN 26 Ca 0.03 1.32 0.06 0.00 0.42 0.00 0.00 52.86 54.69 2jxr s ASN 26 Cb -0.17 -2.41 -0.03 0.00 -1.45 0.00 0.00 41.25 37.19 2jxr s ASN 26 CO 0.01 0.12 -0.16 -0.36 -3.72 0.00 0.00 177.10 172.99 2jxr s PHE 27 N -0.42 1.36 -0.27 0.43 0.40 -0.80 -4.88 117.98 113.80 2jxr s PHE 27 Ca 0.33 -0.46 -0.08 0.00 -0.60 0.00 0.00 56.93 56.12 2jxr s PHE 27 Cb -0.20 -0.75 -0.03 0.00 0.51 0.00 0.00 43.02 42.55 2jxr s PHE 27 CO 0.20 0.10 0.11 0.15 0.70 0.00 0.00 175.22 176.48 2jxr s LYS 28 N -1.89 3.66 0.12 0.44 1.02 -1.26 -1.25 119.74 120.59 2jxr s LYS 28 Ca 0.01 -0.48 0.08 0.00 0.02 0.00 0.00 55.97 55.59 2jxr s LYS 28 Cb -0.09 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 33.75 2jxr s LYS 28 CO 0.03 -0.22 -0.18 0.14 -0.92 0.00 0.00 175.35 174.19 2jxr s VAL 29 N 1.64 1.62 0.14 3.17 -7.23 -0.41 0.44 120.40 119.78 2jxr s VAL 29 Ca 0.06 -1.66 -0.27 0.00 -1.81 0.00 0.00 61.98 58.30 2jxr s VAL 29 Cb -0.16 -1.59 -0.07 0.00 0.56 0.00 0.00 36.38 35.12 2jxr s VAL 29 CO 0.06 -0.21 0.83 -0.63 -0.31 0.00 0.00 175.10 174.83 2jxr s ILE 30 N -1.60 4.43 -0.60 -0.62 1.09 0.12 -2.26 121.20 121.76 2jxr s ILE 30 Ca 0.09 1.81 -0.18 0.00 -1.10 0.00 0.00 60.65 61.27 2jxr s ILE 30 Cb -0.08 -4.20 0.12 0.00 -1.06 0.00 0.00 42.46 37.25 2jxr s ILE 30 CO 0.05 0.45 0.65 -0.76 -0.10 0.00 0.00 174.94 175.22 2jxr s LEU 31 N -0.69 5.75 -0.46 2.97 1.43 -1.26 0.72 118.68 127.14 2jxr s LEU 31 Ca 0.39 -1.66 -0.14 0.00 -1.03 0.00 0.00 54.13 51.69 2jxr s LEU 31 Cb -0.23 -2.27 0.08 0.00 0.03 0.00 0.00 46.19 43.80 2jxr s LEU 31 CO 0.27 -0.99 0.37 -0.62 0.23 0.00 0.00 176.35 175.61 2jxr s ASP 32 N 3.53 6.03 0.00 2.29 2.15 -1.03 -4.57 116.67 125.07 2jxr s ASP 32 Ca 0.10 -1.39 0.23 0.00 0.43 0.00 0.00 52.55 51.92 2jxr s ASP 32 Cb -0.25 -2.14 1.25 0.00 -0.30 0.00 0.00 42.92 41.49 2jxr s ASP 32 CO 0.04 -0.63 1.75 0.35 -0.17 0.00 0.00 175.17 176.51 2jxr n THR 33 N 5.14 0.17 0.68 1.71 -2.24 -1.26 -0.63 114.28 117.85 2jxr n THR 33 Ca -0.12 0.04 0.12 0.00 -2.27 0.00 0.00 64.05 61.82 2jxr n THR 33 Cb 0.43 -0.67 0.18 0.00 -2.10 0.00 0.00 70.33 68.17 2jxr n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jxr n GLY 34 N 0.57 -1.35 3.53 3.38 0.00 -1.26 -4.15 105.19 105.91 2jxr n GLY 34 Ca 0.14 -0.29 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 2jxr n GLY 34 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jxr s SER 35 N -3.88 4.08 -0.13 1.61 0.01 -1.24 -4.89 113.70 109.26 2jxr s SER 35 Ca 0.07 -0.57 0.16 0.00 1.31 0.00 0.00 55.95 56.92 2jxr s SER 35 Cb 0.15 -0.64 0.38 0.00 0.21 0.00 0.00 66.02 66.12 2jxr s SER 35 CO 0.72 0.14 1.18 -1.20 0.41 0.00 0.00 173.24 174.50 2jxr n SER 36 N 0.42 1.48 -4.15 2.44 7.64 -1.26 -0.17 113.62 120.01 2jxr n SER 36 Ca -0.13 -3.15 -0.18 0.00 1.01 0.00 0.00 58.87 56.42 2jxr n SER 36 Cb 0.54 -0.43 -0.12 0.00 -1.01 0.00 0.00 64.21 63.19 2jxr n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2jxr s ASN 37 N -2.71 1.53 -0.13 6.43 0.02 -1.26 -4.44 114.94 114.38 2jxr s ASN 37 Ca 0.34 -0.58 -0.03 0.00 -1.02 0.00 0.00 52.86 51.57 2jxr s ASN 37 Cb 0.34 -0.04 -0.03 0.00 0.02 0.00 0.00 41.25 41.54 2jxr s ASN 37 CO -0.08 -0.08 -0.01 -0.22 0.02 0.00 0.00 177.10 176.73 2jxr s LEU 38 N -1.62 3.46 0.18 0.60 2.96 -1.26 -1.04 118.68 121.97 2jxr s LEU 38 Ca -0.03 0.02 -0.11 0.00 -0.22 0.00 0.00 54.13 53.79 2jxr s LEU 38 Cb -0.10 -1.82 -0.00 0.00 0.50 0.00 0.00 46.19 44.77 2jxr s LEU 38 CO 0.02 0.26 0.35 -1.66 -1.32 0.00 0.00 176.35 174.00 2jxr s TRP 39 N -0.19 0.29 0.18 5.38 1.48 -0.71 -1.47 118.94 123.90 2jxr s TRP 39 Ca 0.05 -0.65 -0.14 0.00 -1.06 0.00 0.00 56.10 54.30 2jxr s TRP 39 Cb -0.13 0.05 0.01 0.00 -1.16 0.00 0.00 33.47 32.25 2jxr s TRP 39 CO 0.02 -0.78 0.43 0.14 -4.06 0.00 0.00 176.95 172.70 2jxr s VAL 40 N -3.95 0.04 0.47 -0.66 -7.23 -1.17 -2.62 120.40 105.29 2jxr s VAL 40 Ca 0.16 -1.03 -0.20 0.00 -1.81 0.00 0.00 61.98 59.10 2jxr s VAL 40 Cb 0.02 -1.68 -0.09 0.00 0.56 0.00 0.00 36.38 35.19 2jxr s VAL 40 CO 0.00 -0.19 0.99 -2.84 -0.31 0.00 0.00 175.10 172.75 2jxr s PRO 41 N -3.91 3.97 0.49 4.82 0.02 -1.26 -0.67 135.00 138.46 2jxr s PRO 41 Ca 0.12 1.19 0.03 0.00 0.02 0.00 0.00 61.00 62.37 2jxr s PRO 41 Cb 0.01 -2.13 0.02 0.00 0.02 0.00 0.00 34.50 32.41 2jxr s PRO 41 CO -0.02 -0.26 0.68 0.45 -0.33 0.00 0.00 177.00 177.52 2jxr s SER 42 N -2.26 5.49 0.29 2.53 0.15 -0.06 -0.22 113.70 119.63 2jxr s SER 42 Ca 0.64 -0.11 -0.02 0.00 0.70 0.00 0.00 55.95 57.15 2jxr s SER 42 Cb -0.12 -0.91 0.42 0.00 -1.71 0.00 0.00 66.02 63.70 2jxr s SER 42 CO 0.20 -0.94 1.96 -0.55 1.20 0.00 0.00 173.24 175.11 2jxr h ASN 43 N 0.33 0.98 0.00 5.45 -1.07 -1.79 -3.11 115.58 116.37 2jxr h ASN 43 Ca -0.42 -0.02 0.00 0.00 0.07 0.00 0.00 56.30 55.92 2jxr h ASN 43 Cb 1.28 -0.24 0.00 0.00 -2.07 0.00 0.00 38.32 37.29 2jxr h ASN 43 CO 0.51 0.70 0.00 -0.62 0.07 0.00 0.00 177.43 178.09 2jxr n GLU 44 N -4.41 0.95 -4.10 4.14 1.02 -1.26 -4.83 120.64 112.15 2jxr n GLU 44 Ca 0.10 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.89 2jxr n GLU 44 Cb 0.03 -1.06 -0.09 0.00 -0.02 0.00 0.00 31.44 30.30 2jxr n GLU 44 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jxr n GLY 46 N 3.00 4.88 3.82 0.00 0.00 -1.26 -4.59 105.19 111.04 2jxr n GLY 46 Ca -0.18 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.33 2jxr n GLY 46 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jxr s SER 47 N -2.77 4.79 0.13 1.61 0.01 -1.26 -4.81 113.70 111.40 2jxr s SER 47 Ca 0.40 1.29 -0.30 0.00 1.31 0.00 0.00 55.95 58.64 2jxr s SER 47 Cb 0.36 -2.05 -0.07 0.00 0.21 0.00 0.00 66.02 64.46 2jxr s SER 47 CO -0.01 -1.78 1.57 0.25 0.41 0.00 0.00 173.24 173.69 2jxr h LEU 48 N -0.95 -1.46 -0.98 2.44 5.85 -1.88 0.14 115.31 118.46 2jxr h LEU 48 Ca -0.46 0.19 0.17 0.00 0.84 0.00 0.00 57.88 58.62 2jxr h LEU 48 Cb 1.26 0.59 -0.10 0.00 0.37 0.00 0.00 40.66 42.78 2jxr h LEU 48 CO 0.60 -0.44 0.59 0.00 -0.34 0.00 0.00 178.44 178.85 2jxr h ALA 49 N 0.02 1.58 -0.50 1.25 0.00 -1.82 -0.94 119.26 118.85 2jxr h ALA 49 Ca 0.07 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2jxr h ALA 49 Cb 0.64 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2jxr h ALA 49 CO -0.43 -0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.82 2jxr h PHE 51 N 0.75 0.00 -0.01 0.00 3.04 0.25 -3.14 116.94 117.83 2jxr h PHE 51 Ca 0.14 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.09 2jxr h PHE 51 Cb 0.52 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.03 2jxr h PHE 51 CO 0.04 0.24 -0.20 1.28 -2.02 0.00 0.00 178.31 177.65 2jxr n LEU 52 N -3.79 1.13 -4.44 0.59 4.77 -0.49 -4.92 117.00 109.84 2jxr n LEU 52 Ca -0.02 -0.31 -0.21 0.00 -0.03 0.00 0.00 56.01 55.44 2jxr n LEU 52 Cb 0.34 -0.10 -0.10 0.00 -2.33 0.00 0.00 43.42 41.23 2jxr n LEU 52 CO 0.34 0.20 -0.26 -1.00 -1.33 0.00 0.00 177.39 175.34 2jxr s HIS 53 N -2.39 1.91 0.21 -1.77 3.76 -1.06 -5.09 115.29 110.85 2jxr s HIS 53 Ca 0.27 -1.00 -0.32 0.00 -0.15 0.00 0.00 55.06 53.86 2jxr s HIS 53 Cb 0.20 -1.23 -0.13 0.00 1.11 0.00 0.00 32.58 32.52 2jxr s HIS 53 CO 0.48 -0.05 1.60 0.43 -0.85 0.00 0.00 174.74 176.35 2jxr n SER 54 N -0.69 3.43 -4.33 1.40 7.64 -1.26 -4.88 113.62 114.93 2jxr n SER 54 Ca -0.02 1.10 -0.31 0.00 1.01 0.00 0.00 58.87 60.64 2jxr n SER 54 Cb 0.66 -1.50 -0.16 0.00 -1.01 0.00 0.00 64.21 62.21 2jxr n SER 54 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2jxr s LYS 55 N 0.55 2.28 -0.05 1.43 3.01 -1.26 -4.12 119.74 121.58 2jxr s LYS 55 Ca 0.74 -0.89 -0.25 0.00 -1.01 0.00 0.00 55.97 54.56 2jxr s LYS 55 Cb -0.59 -2.12 -0.04 0.00 -1.01 0.00 0.00 37.83 34.07 2jxr s LYS 55 CO 0.40 0.53 0.75 -0.47 0.51 0.00 0.00 175.35 177.06 2jxr s TYR 56 N -0.52 3.60 -0.49 3.18 5.04 0.70 -4.87 117.35 123.99 2jxr s TYR 56 Ca 0.07 1.34 0.02 0.00 -2.44 0.00 0.00 57.07 56.06 2jxr s TYR 56 Cb -0.11 -2.86 0.13 0.00 0.35 0.00 0.00 41.96 39.47 2jxr s TYR 56 CO 0.00 0.09 0.24 0.34 -1.34 0.00 0.00 175.55 174.87 2jxr s ASP 57 N 0.77 4.63 0.46 4.32 -1.08 -1.26 -2.66 116.67 121.86 2jxr s ASP 57 Ca 0.40 -2.72 0.21 0.00 -0.52 0.00 0.00 52.55 49.91 2jxr s ASP 57 Cb -0.18 -1.69 1.13 0.00 -1.46 0.00 0.00 42.92 40.72 2jxr s ASP 57 CO 0.20 -0.31 1.97 1.12 0.52 0.00 0.00 175.17 178.67 2jxr h HIS 58 N 6.95 0.00 -0.09 -5.34 2.07 -1.96 -2.73 115.15 114.05 2jxr h HIS 58 Ca -0.06 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.46 2jxr h HIS 58 Cb 0.94 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.92 2jxr h HIS 58 CO 0.54 0.21 0.00 -0.85 -3.07 0.00 0.00 177.93 174.75 2jxr n GLU 59 N -3.86 1.22 -0.00 5.12 0.28 -1.26 -2.51 120.64 119.63 2jxr n GLU 59 Ca -0.02 -0.33 0.03 0.00 -0.16 0.00 0.00 57.16 56.69 2jxr n GLU 59 Cb 0.30 -1.09 -0.04 0.00 1.43 0.00 0.00 31.44 32.03 2jxr n GLU 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2jxr n ALA 60 N -0.22 2.72 -2.48 -1.84 0.00 -1.03 -4.99 120.51 112.67 2jxr n ALA 60 Ca 0.03 -0.19 -0.39 0.00 0.00 0.00 0.00 53.44 52.89 2jxr n ALA 60 Cb 0.09 -0.25 -0.06 0.00 0.00 0.00 0.00 19.45 19.23 2jxr n ALA 60 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jxr s SER 61 N -2.00 6.98 0.19 0.00 0.15 -1.04 -4.42 113.70 113.56 2jxr s SER 61 Ca 0.01 1.17 0.11 0.00 0.70 0.00 0.00 55.95 57.94 2jxr s SER 61 Cb 0.05 -2.37 -0.08 0.00 -1.71 0.00 0.00 66.02 61.91 2jxr s SER 61 CO 0.29 0.10 1.34 0.28 1.20 0.00 0.00 173.24 176.45 2jxr h SER 62 N 5.61 0.00 0.52 5.45 0.02 0.51 -3.33 113.55 122.32 2jxr h SER 62 Ca -0.45 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.41 2jxr h SER 62 Cb 1.20 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 2jxr h SER 62 CO 0.69 0.76 -0.42 0.77 -1.14 0.00 0.00 176.83 177.49 2jxr h SER 63 N 0.00 0.00 -2.15 3.07 4.64 -1.94 -3.47 113.55 113.70 2jxr h SER 63 Ca -0.02 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.71 2jxr h SER 63 Cb 1.59 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.71 2jxr h SER 63 CO 0.10 0.42 1.03 0.00 -0.87 0.00 0.00 176.83 177.51 2jxr n TYR 64 N -3.89 2.35 -4.03 4.77 9.36 -1.25 -4.53 117.16 119.94 2jxr n TYR 64 Ca -0.01 0.02 -0.31 0.00 3.32 0.00 0.00 57.90 60.92 2jxr n TYR 64 Cb 0.47 -2.65 -0.15 0.00 -0.63 0.00 0.00 39.34 36.38 2jxr n TYR 64 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 2jxr s LYS 65 N 3.20 1.86 0.89 2.98 2.47 -1.13 -5.02 119.74 124.98 2jxr s LYS 65 Ca 0.88 -1.48 -0.11 0.00 -1.56 0.00 0.00 55.97 53.70 2jxr s LYS 65 Cb -0.65 -2.94 0.12 0.00 -1.46 0.00 0.00 37.83 32.90 2jxr s LYS 65 CO 0.46 -0.71 1.10 0.00 0.16 0.00 0.00 175.35 176.36 2jxr s ALA 66 N 1.08 1.57 0.00 3.13 0.00 -1.26 -0.67 121.76 125.61 2jxr s ALA 66 Ca -0.01 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.12 2jxr s ALA 66 Cb -0.19 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2jxr s ALA 66 CO -0.07 -2.39 0.00 -1.71 0.00 0.00 0.00 175.76 171.59 2jxr n ASN 67 N -3.94 0.00 0.00 0.00 2.85 -1.25 -4.78 115.26 108.14 2jxr n ASN 67 Ca 0.08 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.55 2jxr n ASN 67 Cb 0.54 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.56 2jxr n ASN 67 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2jxr n GLY 68 N -0.28 0.00 3.66 8.20 0.00 -0.48 -4.89 105.19 111.40 2jxr n GLY 68 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2jxr n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jxr n THR 69 N -1.11 3.47 -2.29 2.61 -1.04 -1.26 -4.45 114.28 110.21 2jxr n THR 69 Ca 0.00 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.05 61.10 2jxr n THR 69 Cb 0.18 -1.34 -0.03 0.00 -1.82 0.00 0.00 70.33 67.32 2jxr n THR 69 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2jxr s GLU 70 N -2.64 4.44 -0.04 -2.82 2.12 -1.26 -0.61 118.70 117.89 2jxr s GLU 70 Ca 0.72 1.97 0.06 0.00 0.36 0.00 0.00 54.97 58.08 2jxr s GLU 70 Cb -0.45 -3.21 -0.01 0.00 0.26 0.00 0.00 34.13 30.72 2jxr s GLU 70 CO 0.50 -0.16 -0.23 0.12 -0.54 0.00 0.00 175.26 174.95 2jxr s PHE 71 N -0.03 2.15 -0.28 5.30 5.36 -0.07 -4.80 117.98 125.62 2jxr s PHE 71 Ca 0.54 -0.54 -0.12 0.00 -0.96 0.00 0.00 56.93 55.85 2jxr s PHE 71 Cb -0.35 -1.41 0.10 0.00 -0.34 0.00 0.00 43.02 41.03 2jxr s PHE 71 CO 0.38 -0.13 0.63 0.00 -1.46 0.00 0.00 175.22 174.64 2jxr s ALA 72 N -0.29 -1.85 -0.00 11.12 0.00 -1.26 -2.30 121.76 127.18 2jxr s ALA 72 Ca 0.02 2.27 0.04 0.00 0.00 0.00 0.00 51.96 54.29 2jxr s ALA 72 Cb -0.11 -1.55 -0.01 0.00 0.00 0.00 0.00 23.12 21.45 2jxr s ALA 72 CO 0.01 -0.65 -0.13 -1.50 0.00 0.00 0.00 175.76 173.50 2jxr s ILE 73 N 2.26 0.99 -0.08 0.00 2.07 -1.22 -5.02 121.20 120.20 2jxr s ILE 73 Ca -0.08 -0.62 0.01 0.00 -1.41 0.00 0.00 60.65 58.56 2jxr s ILE 73 Cb -0.09 -0.85 0.02 0.00 0.13 0.00 0.00 42.46 41.67 2jxr s ILE 73 CO -0.19 0.22 -0.09 0.00 -1.91 0.00 0.00 174.94 172.97 2jxr s GLN 74 N -0.46 1.49 0.34 3.50 1.03 -1.26 -0.84 119.66 123.46 2jxr s GLN 74 Ca 0.04 -0.31 0.06 0.00 0.04 0.00 0.00 55.36 55.19 2jxr s GLN 74 Cb -0.05 -1.36 0.06 0.00 0.03 0.00 0.00 33.01 31.68 2jxr s GLN 74 CO -0.00 -0.09 0.47 0.66 -2.54 0.00 0.00 175.29 173.79 2jxr n TYR 75 N 4.22 -2.58 0.26 9.60 4.01 0.19 -4.99 117.16 127.88 2jxr n TYR 75 Ca -0.20 -1.24 0.13 0.00 -0.16 0.00 0.00 57.90 56.44 2jxr n TYR 75 Cb 0.51 -0.32 0.69 0.00 -0.31 0.00 0.00 39.34 39.91 2jxr n TYR 75 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2jxr h GLY 76 N 0.06 0.00 -6.46 2.72 0.00 -2.01 -3.39 103.07 93.99 2jxr h GLY 76 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 46.94 2jxr h GLY 76 CO 0.23 0.00 -0.56 -0.51 0.00 0.00 0.00 176.54 175.70 2jxr s THR 77 N -3.99 -0.53 0.00 4.70 -4.23 -1.26 -5.11 115.64 105.22 2jxr s THR 77 Ca -0.02 -0.27 0.00 0.00 -1.18 0.00 0.00 61.69 60.23 2jxr s THR 77 Cb 0.12 -0.91 0.00 0.00 1.34 0.00 0.00 72.50 73.05 2jxr s THR 77 CO 0.58 -0.28 0.00 0.61 -0.54 0.00 0.00 174.62 174.99 2jxr n GLY 78 N 5.34 2.54 3.24 3.99 0.00 -1.26 -4.98 105.19 114.06 2jxr n GLY 78 Ca -0.02 -1.54 -0.22 0.00 0.00 0.00 0.00 46.02 44.24 2jxr n GLY 78 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jxr s SER 79 N 0.00 2.22 0.32 1.61 0.15 -1.26 0.57 113.70 117.30 2jxr s SER 79 Ca 0.00 -0.67 -0.04 0.00 0.70 0.00 0.00 55.95 55.94 2jxr s SER 79 Cb 0.00 -0.10 -0.00 0.00 -1.71 0.00 0.00 66.02 64.20 2jxr s SER 79 CO 0.00 0.00 0.46 -1.48 1.20 0.00 0.00 173.24 173.42 2jxr s LEU 80 N -1.87 0.90 -0.29 3.45 0.05 -0.02 -4.29 118.68 116.61 2jxr s LEU 80 Ca 0.04 -1.38 -0.12 0.00 0.05 0.00 0.00 54.13 52.71 2jxr s LEU 80 Cb -0.10 1.46 0.11 0.00 -2.05 0.00 0.00 46.19 45.62 2jxr s LEU 80 CO 0.04 -1.25 0.66 -1.61 -0.55 0.00 0.00 176.35 173.64 2jxr s GLU 81 N -3.28 0.61 0.00 1.48 2.02 -1.00 -3.40 118.70 115.13 2jxr s GLU 81 Ca 0.30 1.38 0.00 0.00 0.02 0.00 0.00 54.97 56.67 2jxr s GLU 81 Cb -0.00 0.64 0.00 0.00 0.10 0.00 0.00 34.13 34.87 2jxr s GLU 81 CO 0.18 -0.19 0.00 0.41 0.02 0.00 0.00 175.26 175.68 2jxr n GLY 82 N 5.10 3.86 3.28 -1.39 0.00 -0.97 -0.54 105.19 114.53 2jxr n GLY 82 Ca -0.14 -0.43 -0.12 0.00 0.00 0.00 0.00 46.02 45.33 2jxr n GLY 82 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jxr s TYR 83 N -0.22 -0.18 0.73 1.61 1.13 -0.49 -0.89 117.35 119.04 2jxr s TYR 83 Ca 0.00 0.11 -0.11 0.00 -1.41 0.00 0.00 57.07 55.67 2jxr s TYR 83 Cb 0.00 0.15 0.03 0.00 -1.10 0.00 0.00 41.96 41.04 2jxr s TYR 83 CO 0.00 -0.52 1.07 0.42 -2.51 0.00 0.00 175.55 174.01 2jxr s ILE 84 N -2.38 3.70 0.26 -3.49 1.09 0.22 -1.31 121.20 119.29 2jxr s ILE 84 Ca -0.06 0.56 -0.02 0.00 -1.10 0.00 0.00 60.65 60.04 2jxr s ILE 84 Cb -0.01 -3.18 -0.03 0.00 -1.06 0.00 0.00 42.46 38.18 2jxr s ILE 84 CO -0.02 -0.71 0.27 -0.44 -0.10 0.00 0.00 174.94 173.94 2jxr s SER 85 N -3.57 0.52 0.06 3.58 0.01 -0.85 -1.38 113.70 112.06 2jxr s SER 85 Ca 0.60 -1.39 0.02 0.00 1.31 0.00 0.00 55.95 56.48 2jxr s SER 85 Cb -0.16 0.49 -0.03 0.00 0.21 0.00 0.00 66.02 66.54 2jxr s SER 85 CO 0.55 -1.01 -0.07 -1.58 0.41 0.00 0.00 173.24 171.54 2jxr s GLN 86 N -3.83 0.63 0.00 12.44 0.74 0.16 -2.34 119.66 127.46 2jxr s GLN 86 Ca 0.35 -0.99 0.00 0.00 0.05 0.00 0.00 55.36 54.77 2jxr s GLN 86 Cb 0.04 -0.21 0.00 0.00 1.10 0.00 0.00 33.01 33.94 2jxr s GLN 86 CO 0.16 0.01 0.00 -3.47 -0.55 0.00 0.00 175.29 171.44 2jxr n ASP 87 N 0.83 0.00 -4.74 6.67 -0.08 -1.20 -2.85 116.55 115.18 2jxr n ASP 87 Ca -0.18 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.74 2jxr n ASP 87 Cb 0.57 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.95 2jxr n ASP 87 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2jxr s THR 88 N -2.00 5.38 -0.07 5.18 2.01 -1.21 -0.84 115.64 124.10 2jxr s THR 88 Ca 0.00 0.18 -0.17 0.00 0.31 0.00 0.00 61.69 62.01 2jxr s THR 88 Cb 0.00 -3.44 -0.05 0.00 0.01 0.00 0.00 72.50 69.02 2jxr s THR 88 CO 0.00 0.47 0.45 -0.22 -0.69 0.00 0.00 174.62 174.62 2jxr s LEU 89 N 0.17 4.36 -0.13 4.42 2.96 0.24 -3.99 118.68 126.71 2jxr s LEU 89 Ca 0.09 0.88 0.01 0.00 -0.22 0.00 0.00 54.13 54.88 2jxr s LEU 89 Cb -0.11 -2.65 0.02 0.00 0.50 0.00 0.00 46.19 43.95 2jxr s LEU 89 CO -0.01 0.14 -0.16 -0.55 -1.32 0.00 0.00 176.35 174.45 2jxr s SER 90 N -0.09 2.67 -0.66 3.68 0.15 0.47 0.59 113.70 120.51 2jxr s SER 90 Ca 0.25 -0.49 -0.10 0.00 0.70 0.00 0.00 55.95 56.31 2jxr s SER 90 Cb -0.16 -1.19 0.17 0.00 -1.71 0.00 0.00 66.02 63.13 2jxr s SER 90 CO 0.11 -0.01 0.55 -0.63 1.20 0.00 0.00 173.24 174.46 2jxr s ILE 91 N 1.21 4.72 0.00 6.45 1.01 -0.15 -0.41 121.20 134.02 2jxr s ILE 91 Ca -0.01 -2.35 0.00 0.00 0.00 0.00 0.00 60.65 58.30 2jxr s ILE 91 Cb -0.14 -4.00 0.00 0.00 0.01 0.00 0.00 42.46 38.33 2jxr s ILE 91 CO -0.06 -0.91 0.00 0.61 0.00 0.00 0.00 174.94 174.58 2jxr n GLY 92 N 4.19 3.49 0.14 6.18 0.00 -1.26 -3.09 105.19 114.84 2jxr n GLY 92 Ca 0.04 -0.09 -0.16 0.00 0.00 0.00 0.00 46.02 45.81 2jxr n GLY 92 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2jxr h ASP 93 N 0.00 0.49 -3.39 1.61 3.58 -1.94 -3.47 116.42 113.30 2jxr h ASP 93 Ca 0.00 -0.69 -0.51 0.00 0.42 0.00 0.00 57.03 56.25 2jxr h ASP 93 Cb 0.00 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.90 2jxr h ASP 93 CO 0.00 1.11 -0.05 -0.76 -2.88 0.00 0.00 179.24 176.66 2jxr s LEU 94 N -8.54 3.99 -0.11 2.28 1.43 -1.18 -5.10 118.68 111.46 2jxr s LEU 94 Ca -0.14 0.88 -0.01 0.00 -1.03 0.00 0.00 54.13 53.83 2jxr s LEU 94 Cb 0.04 -3.71 0.03 0.00 0.03 0.00 0.00 46.19 42.58 2jxr s LEU 94 CO 0.80 -0.25 -0.05 -0.89 0.23 0.00 0.00 176.35 176.19 2jxr s THR 95 N -2.15 0.82 -0.37 5.49 2.01 -1.26 -0.98 115.64 119.20 2jxr s THR 95 Ca 0.47 -0.20 -0.06 0.00 0.31 0.00 0.00 61.69 62.20 2jxr s THR 95 Cb -0.11 -0.91 0.06 0.00 0.01 0.00 0.00 72.50 71.55 2jxr s THR 95 CO 0.29 0.29 0.15 -0.63 -0.69 0.00 0.00 174.62 174.03 2jxr s ILE 96 N 1.79 3.71 0.44 1.82 1.09 0.20 -4.98 121.20 125.27 2jxr s ILE 96 Ca 0.04 -1.38 -0.08 0.00 -1.10 0.00 0.00 60.65 58.14 2jxr s ILE 96 Cb -0.13 -3.22 -0.05 0.00 -1.06 0.00 0.00 42.46 38.00 2jxr s ILE 96 CO -0.07 -0.33 0.78 -2.84 -0.10 0.00 0.00 174.94 172.37 2jxr s PRO 97 N 1.35 3.66 -0.99 2.79 0.02 -1.26 0.81 135.00 141.37 2jxr s PRO 97 Ca 0.01 0.35 -0.05 0.00 0.02 0.00 0.00 61.00 61.32 2jxr s PRO 97 Cb -0.21 -2.38 0.01 0.00 0.02 0.00 0.00 34.50 31.94 2jxr s PRO 97 CO 0.01 -0.13 0.86 1.63 -0.33 0.00 0.00 177.00 179.04 2jxr n LYS 98 N -1.78 -5.74 -3.14 5.54 5.02 -1.10 -4.88 118.16 112.09 2jxr n LYS 98 Ca 0.02 0.63 -0.40 0.00 -2.02 0.00 0.00 58.31 56.54 2jxr n LYS 98 Cb 0.54 -5.05 -0.06 0.00 -0.02 0.00 0.00 35.03 30.44 2jxr n LYS 98 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 2jxr s GLN 99 N -5.72 4.22 0.25 1.97 2.00 -0.02 -4.83 119.66 117.53 2jxr s GLN 99 Ca 0.32 0.59 -0.25 0.00 -2.00 0.00 0.00 55.36 54.02 2jxr s GLN 99 Cb -0.14 -3.57 -0.09 0.00 0.80 0.00 0.00 33.01 30.01 2jxr s GLN 99 CO 0.55 -0.21 0.84 -0.51 -0.50 0.00 0.00 175.29 175.46 2jxr s ASP 100 N 1.17 7.32 0.24 6.67 1.01 -1.26 -3.22 116.67 128.59 2jxr s ASP 100 Ca 0.28 1.69 -0.09 0.00 0.71 0.00 0.00 52.55 55.14 2jxr s ASP 100 Cb -0.16 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.24 2jxr s ASP 100 CO 0.10 0.06 0.40 0.72 0.21 0.00 0.00 175.17 176.66 2jxr s PHE 101 N -1.42 0.59 0.00 4.23 -0.12 -0.99 -4.78 117.98 115.49 2jxr s PHE 101 Ca 0.43 -0.91 0.04 0.00 -0.05 0.00 0.00 56.93 56.44 2jxr s PHE 101 Cb -0.20 0.00 -0.03 0.00 -0.63 0.00 0.00 43.02 42.16 2jxr s PHE 101 CO 0.25 -0.92 -0.09 0.00 -0.05 0.00 0.00 175.22 174.41 2jxr s ALA 102 N -4.00 2.94 -0.20 1.99 0.00 -0.54 -2.02 121.76 119.94 2jxr s ALA 102 Ca 0.27 -1.03 -0.08 0.00 0.00 0.00 0.00 51.96 51.12 2jxr s ALA 102 Cb 0.01 -1.08 -0.04 0.00 0.00 0.00 0.00 23.12 22.01 2jxr s ALA 102 CO 0.10 0.60 0.07 -1.83 0.00 0.00 0.00 175.76 174.71 2jxr s GLU 103 N -1.34 3.92 -0.05 0.00 -1.05 -0.43 -3.02 118.70 116.73 2jxr s GLU 103 Ca 0.16 -0.37 -0.30 0.00 -0.15 0.00 0.00 54.97 54.32 2jxr s GLU 103 Cb -0.11 -3.27 -0.02 0.00 -0.44 0.00 0.00 34.13 30.29 2jxr s GLU 103 CO 0.06 0.16 1.03 0.00 0.95 0.00 0.00 175.26 177.46 2jxr s ALA 104 N 0.70 3.33 -0.09 -0.84 0.00 0.15 -1.40 121.76 123.61 2jxr s ALA 104 Ca 0.04 0.49 0.19 0.00 0.00 0.00 0.00 51.96 52.68 2jxr s ALA 104 Cb -0.13 -3.41 -0.28 0.00 0.00 0.00 0.00 23.12 19.30 2jxr s ALA 104 CO 0.02 -0.48 0.28 0.25 0.00 0.00 0.00 175.76 175.83 2jxr n THR 105 N 4.29 0.55 -3.96 0.00 -2.24 0.12 -0.88 114.28 112.16 2jxr n THR 105 Ca 0.08 -0.61 -0.13 0.00 -2.27 0.00 0.00 64.05 61.13 2jxr n THR 105 Cb 0.49 -0.19 -0.14 0.00 -2.10 0.00 0.00 70.33 68.39 2jxr n THR 105 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2jxr s SER 106 N -4.75 0.23 -0.42 3.42 0.15 0.30 -4.06 113.70 108.57 2jxr s SER 106 Ca -0.08 -0.12 0.06 0.00 0.70 0.00 0.00 55.95 56.51 2jxr s SER 106 Cb 0.10 -0.00 0.20 0.00 -1.71 0.00 0.00 66.02 64.61 2jxr s SER 106 CO 0.81 -0.03 0.47 -0.62 1.20 0.00 0.00 173.24 175.06 2jxr n GLU 107 N 2.77 0.41 -2.00 5.44 1.02 -1.26 -2.37 120.64 124.65 2jxr n GLU 107 Ca -0.14 -2.99 -0.28 0.00 -0.02 0.00 0.00 57.16 53.72 2jxr n GLU 107 Cb 0.59 -1.50 0.12 0.00 -0.02 0.00 0.00 31.44 30.63 2jxr n GLU 107 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 2jxr s PRO 108 N -0.20 1.48 0.00 3.49 0.02 -1.26 -4.56 135.00 133.96 2jxr s PRO 108 Ca 0.33 -0.22 0.00 0.00 0.02 0.00 0.00 61.00 61.14 2jxr s PRO 108 Cb 0.09 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.64 2jxr s PRO 108 CO -0.16 -1.85 0.00 0.41 -0.33 0.00 0.00 177.00 175.07 2jxr n GLY 109 N -3.40 -1.74 0.04 0.52 0.00 -1.26 -4.75 105.19 94.60 2jxr n GLY 109 Ca 0.11 -2.16 -0.05 0.00 0.00 0.00 0.00 46.02 43.93 2jxr n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jxr n LEU 110 N 0.00 0.29 -0.33 0.99 4.77 -1.26 -4.47 117.00 116.99 2jxr n LEU 110 Ca 0.00 -0.01 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 2jxr n LEU 110 Cb 0.00 0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.20 2jxr n LEU 110 CO 0.00 0.26 0.42 0.41 -1.33 0.00 0.00 177.39 177.15 2jxr n THR 111 N -2.37 -0.52 0.15 -5.08 -1.04 -1.26 0.69 114.28 104.85 2jxr n THR 111 Ca -0.15 1.96 0.03 0.00 -2.04 0.00 0.00 64.05 63.85 2jxr n THR 111 Cb 0.77 -2.46 0.07 0.00 -1.82 0.00 0.00 70.33 66.89 2jxr n THR 111 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 2jxr h PHE 112 N 0.00 0.00 -0.69 -1.42 0.04 -1.87 -2.55 116.94 110.45 2jxr h PHE 112 Ca 0.18 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.89 2jxr h PHE 112 Cb 0.38 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.50 2jxr h PHE 112 CO -0.80 0.48 0.21 0.00 -0.60 0.00 0.00 178.31 177.60 2jxr h ALA 113 N 1.52 0.91 0.00 2.45 0.00 0.04 -0.19 119.26 123.98 2jxr h ALA 113 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2jxr h ALA 113 Cb 1.32 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2jxr h ALA 113 CO 0.06 0.59 0.00 1.19 0.00 0.00 0.00 179.25 181.10 2jxr n PHE 114 N -4.30 0.58 -1.25 0.00 3.01 0.48 -4.81 117.46 111.17 2jxr n PHE 114 Ca 0.05 0.20 -0.34 0.00 1.01 0.00 0.00 57.45 58.37 2jxr n PHE 114 Cb 0.23 -0.83 0.11 0.00 -0.01 0.00 0.00 39.48 38.98 2jxr n PHE 114 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jxr n GLY 115 N 0.51 -0.00 0.41 1.37 0.00 -0.08 -4.93 105.19 102.47 2jxr n GLY 115 Ca 0.04 -0.41 0.05 0.00 0.00 0.00 0.00 46.02 45.70 2jxr n GLY 115 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jxr n LYS 116 N -2.78 0.85 -4.10 1.61 5.02 -1.26 -4.97 118.16 112.53 2jxr n LYS 116 Ca 0.14 -1.25 -0.32 0.00 -2.02 0.00 0.00 58.31 54.86 2jxr n LYS 116 Cb 0.50 -1.19 -0.07 0.00 -0.02 0.00 0.00 35.03 34.25 2jxr n LYS 116 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 2jxr s PHE 117 N -0.83 3.23 -0.15 2.13 -0.12 -1.26 -4.96 117.98 116.02 2jxr s PHE 117 Ca 0.13 0.15 0.16 0.00 -0.05 0.00 0.00 56.93 57.32 2jxr s PHE 117 Cb 0.08 -1.69 -0.02 0.00 -0.63 0.00 0.00 43.02 40.76 2jxr s PHE 117 CO 0.12 0.53 1.17 -0.44 -0.05 0.00 0.00 175.22 176.55 2jxr h ASP 118 N 3.85 0.00 -0.13 1.98 3.32 -0.37 -3.49 116.42 121.58 2jxr h ASP 118 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2jxr h ASP 118 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2jxr h ASP 118 CO 0.63 0.50 0.00 0.61 -1.72 0.00 0.00 179.24 179.26 2jxr n GLY 119 N 1.29 2.79 3.03 2.75 0.00 -0.91 -4.03 105.19 110.11 2jxr n GLY 119 Ca -0.03 -0.79 -0.17 0.00 0.00 0.00 0.00 46.02 45.03 2jxr n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jxr s ILE 120 N -2.96 0.67 -0.27 -0.61 1.01 -1.08 -0.70 121.20 117.26 2jxr s ILE 120 Ca 0.00 -0.50 0.02 0.00 0.00 0.00 0.00 60.65 60.17 2jxr s ILE 120 Cb 0.00 -0.59 0.07 0.00 0.01 0.00 0.00 42.46 41.96 2jxr s ILE 120 CO 0.00 0.09 -0.03 -0.22 0.00 0.00 0.00 174.94 174.78 2jxr s LEU 121 N -0.45 3.24 0.21 2.97 2.96 0.22 -1.74 118.68 126.09 2jxr s LEU 121 Ca 0.01 -1.48 -0.32 0.00 -0.22 0.00 0.00 54.13 52.12 2jxr s LEU 121 Cb -0.04 -1.35 -0.12 0.00 0.50 0.00 0.00 46.19 45.18 2jxr s LEU 121 CO -0.00 -0.27 1.71 0.61 -1.32 0.00 0.00 176.35 177.08 2jxr n GLY 122 N 4.53 1.50 0.11 7.98 0.00 -0.20 -2.45 105.19 116.66 2jxr n GLY 122 Ca -0.08 0.61 0.03 0.00 0.00 0.00 0.00 46.02 46.58 2jxr n GLY 122 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jxr n LEU 123 N 3.80 1.42 -4.93 0.99 4.77 0.20 -4.51 117.00 118.74 2jxr n LEU 123 Ca 0.15 -1.84 -0.29 0.00 -0.03 0.00 0.00 56.01 54.00 2jxr n LEU 123 Cb 0.35 -0.14 0.17 0.00 -2.33 0.00 0.00 43.42 41.47 2jxr n LEU 123 CO 0.64 0.44 0.85 -0.83 -1.33 0.00 0.00 177.39 177.16 2jxr s GLY 124 N -1.45 1.77 0.67 -0.72 0.00 0.75 -4.80 107.32 103.53 2jxr s GLY 124 Ca 0.11 -1.20 -0.17 0.00 0.00 0.00 0.00 44.72 43.45 2jxr s GLY 124 CO 0.01 -0.47 1.23 -0.19 0.00 0.00 0.00 173.10 173.69 2jxr s TYR 125 N -3.82 2.15 0.38 1.90 1.51 -1.04 -4.70 117.35 113.74 2jxr s TYR 125 Ca 0.73 1.54 0.19 0.00 -1.01 0.00 0.00 57.07 58.52 2jxr s TYR 125 Cb -0.04 -3.54 1.03 0.00 -0.11 0.00 0.00 41.96 39.30 2jxr s TYR 125 CO 0.52 -2.60 1.94 0.38 -1.11 0.00 0.00 175.55 174.68 2jxr h ASP 126 N 0.28 0.00 -0.41 2.29 3.04 -1.92 -2.90 116.42 116.80 2jxr h ASP 126 Ca -0.49 0.00 0.12 0.00 -3.24 0.00 0.00 57.03 53.41 2jxr h ASP 126 Cb 1.31 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.58 2jxr h ASP 126 CO 0.52 0.24 0.73 0.74 -2.04 0.00 0.00 179.24 179.44 2jxr h THR 127 N 0.00 0.11 0.00 1.15 2.02 -1.91 0.42 112.91 114.71 2jxr h THR 127 Ca -0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2jxr h THR 127 Cb 0.50 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 2jxr h THR 127 CO 0.03 0.00 -0.24 0.00 0.37 0.00 0.00 175.52 175.68 2jxr n ILE 128 N -3.17 1.35 -2.76 3.11 3.06 -1.09 -5.01 119.36 114.86 2jxr n ILE 128 Ca 0.08 -1.74 -0.42 0.00 -2.50 0.00 0.00 62.75 58.17 2jxr n ILE 128 Cb 0.88 0.01 -0.03 0.00 0.54 0.00 0.00 39.64 41.05 2jxr n ILE 128 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 2jxr s SER 129 N -2.40 7.30 0.14 9.51 0.15 0.15 -4.45 113.70 124.10 2jxr s SER 129 Ca 0.25 1.58 -0.30 0.00 0.70 0.00 0.00 55.95 58.17 2jxr s SER 129 Cb 0.23 -2.55 -0.07 0.00 -1.71 0.00 0.00 66.02 61.92 2jxr s SER 129 CO -0.00 -0.26 1.21 -0.69 1.20 0.00 0.00 173.24 174.70 2jxr s VAL 130 N 1.10 3.68 -1.38 4.45 1.01 -1.26 -2.52 120.40 125.48 2jxr s VAL 130 Ca 0.50 1.33 0.00 0.00 0.00 0.00 0.00 61.98 63.81 2jxr s VAL 130 Cb -0.20 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.33 2jxr s VAL 130 CO 0.25 0.17 0.00 0.47 0.00 0.00 0.00 175.10 176.00 2jxr n ASP 131 N 3.05 -4.55 -2.41 3.32 8.00 -1.26 -2.49 116.55 120.21 2jxr n ASP 131 Ca 0.06 0.28 -0.12 0.00 0.71 0.00 0.00 54.79 55.72 2jxr n ASP 131 Cb 0.45 -3.31 -0.01 0.00 -0.02 0.00 0.00 41.12 38.24 2jxr n ASP 131 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2jxr n LYS 132 N -2.56 -2.22 -1.45 -1.24 5.02 -1.05 -4.92 118.16 109.74 2jxr n LYS 132 Ca -0.14 0.58 -0.36 0.00 -2.02 0.00 0.00 58.31 56.38 2jxr n LYS 132 Cb 0.47 -5.17 0.09 0.00 -0.02 0.00 0.00 35.03 30.40 2jxr n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2jxr n VAL 133 N -3.31 3.45 -2.94 -0.18 0.31 -1.04 -4.91 118.33 109.71 2jxr n VAL 133 Ca -0.14 -0.39 -0.42 0.00 -0.01 0.00 0.00 64.34 63.37 2jxr n VAL 133 Cb 0.60 -1.25 -0.05 0.00 -0.91 0.00 0.00 33.84 32.23 2jxr n VAL 133 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2jxr s VAL 134 N -1.71 4.69 0.43 2.52 1.01 -1.26 -4.79 120.40 121.28 2jxr s VAL 134 Ca 0.77 0.82 -0.26 0.00 0.00 0.00 0.00 61.98 63.30 2jxr s VAL 134 Cb -0.35 -4.25 -0.09 0.00 0.00 0.00 0.00 36.38 31.69 2jxr s VAL 134 CO 0.47 -0.52 1.40 -2.84 0.00 0.00 0.00 175.10 173.60 2jxr s PRO 135 N 3.21 3.83 0.41 2.72 0.02 -1.26 -4.59 135.00 139.33 2jxr s PRO 135 Ca 0.32 2.36 0.18 0.00 0.02 0.00 0.00 61.00 63.87 2jxr s PRO 135 Cb -0.13 -2.73 1.09 0.00 0.02 0.00 0.00 34.50 32.75 2jxr s PRO 135 CO 0.19 -0.68 1.81 -1.35 -0.33 0.00 0.00 177.00 176.64 2jxr h PRO 136 N 2.53 0.40 -0.00 5.54 0.11 -1.89 0.39 132.00 139.08 2jxr h PRO 136 Ca -0.50 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.46 2jxr h PRO 136 Cb 1.26 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 2jxr h PRO 136 CO 0.62 0.26 -0.59 0.35 -0.21 0.00 0.00 178.00 178.44 2jxr h PHE 137 N 0.41 0.01 -0.24 0.65 3.57 -1.90 -2.76 116.94 116.68 2jxr h PHE 137 Ca 0.54 -0.00 -0.18 0.00 3.53 0.00 0.00 57.97 61.85 2jxr h PHE 137 Cb 1.34 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.08 2jxr h PHE 137 CO -0.00 0.60 -0.56 1.88 -2.23 0.00 0.00 178.31 177.99 2jxr h TYR 138 N 0.01 1.03 0.14 0.41 -1.99 -0.59 -2.75 116.97 113.22 2jxr h TYR 138 Ca -0.01 -0.39 0.02 0.00 2.00 0.00 0.00 58.73 60.36 2jxr h TYR 138 Cb 1.04 -0.18 -0.04 0.00 2.00 0.00 0.00 36.73 39.55 2jxr h TYR 138 CO 0.00 1.20 -0.34 -0.91 -0.00 0.00 0.00 178.16 178.12 2jxr h ASN 139 N 0.55 -0.97 -0.32 3.88 4.21 -1.37 -1.03 115.58 120.53 2jxr h ASN 139 Ca -0.00 0.11 0.09 0.00 1.21 0.00 0.00 56.30 57.71 2jxr h ASN 139 Cb 1.17 0.36 -0.01 0.00 -1.12 0.00 0.00 38.32 38.73 2jxr h ASN 139 CO 0.12 -0.43 0.41 0.00 -1.29 0.00 0.00 177.43 176.24 2jxr h ALA 140 N 0.04 1.96 0.08 -0.83 0.00 -1.51 0.43 119.26 119.43 2jxr h ALA 140 Ca 0.03 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.67 2jxr h ALA 140 Cb 0.60 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2jxr h ALA 140 CO -0.19 -0.57 -1.33 0.82 0.00 0.00 0.00 179.25 177.98 2jxr h ILE 141 N 0.00 1.01 -0.21 0.00 2.04 -1.04 -1.80 117.51 117.50 2jxr h ILE 141 Ca 0.15 -2.33 0.06 0.00 1.00 0.00 0.00 64.86 63.75 2jxr h ILE 141 Cb 0.97 2.60 -0.01 0.00 -0.74 0.00 0.00 36.82 39.64 2jxr h ILE 141 CO -0.00 0.61 0.20 -0.61 0.00 0.00 0.00 178.15 178.35 2jxr h GLN 142 N -0.51 0.00 -0.55 2.37 4.15 0.10 -0.03 115.11 120.64 2jxr h GLN 142 Ca -0.31 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.11 2jxr h GLN 142 Cb 1.61 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.30 2jxr h GLN 142 CO -0.02 0.00 0.00 1.04 -1.93 0.00 0.00 178.83 177.92 2jxr n GLN 143 N -3.97 3.77 -1.83 1.69 6.02 0.14 -4.95 117.38 118.24 2jxr n GLN 143 Ca 0.02 -2.86 -0.18 0.00 -0.01 0.00 0.00 57.00 53.96 2jxr n GLN 143 Cb 0.34 -1.90 -0.06 0.00 1.02 0.00 0.00 30.24 29.64 2jxr n GLN 143 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2jxr n ASP 144 N 0.71 -5.02 0.00 1.08 8.00 -0.03 -4.86 116.55 116.43 2jxr n ASP 144 Ca 0.24 0.32 0.13 0.00 0.71 0.00 0.00 54.79 56.19 2jxr n ASP 144 Cb 0.91 -4.39 0.78 0.00 -0.02 0.00 0.00 41.12 38.40 2jxr n ASP 144 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2jxr n LEU 145 N -2.46 0.00 -4.39 0.64 4.77 -0.68 -4.84 117.00 110.04 2jxr n LEU 145 Ca -0.20 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.57 2jxr n LEU 145 Cb 0.63 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.61 2jxr n LEU 145 CO 0.27 0.00 -0.46 -0.76 -1.33 0.00 0.00 177.39 175.11 2jxr s LEU 146 N -1.84 2.55 0.06 2.23 1.43 -1.24 -5.05 118.68 116.82 2jxr s LEU 146 Ca 0.40 -1.00 0.17 0.00 -1.03 0.00 0.00 54.13 52.66 2jxr s LEU 146 Cb 0.18 -0.87 -0.14 0.00 0.03 0.00 0.00 46.19 45.39 2jxr s LEU 146 CO 0.30 -0.06 0.82 0.47 0.23 0.00 0.00 176.35 178.11 2jxr n ASP 147 N -0.35 0.87 -3.80 2.29 8.00 -1.26 -4.93 116.55 117.37 2jxr n ASP 147 Ca -0.08 0.39 -0.13 0.00 0.71 0.00 0.00 54.79 55.68 2jxr n ASP 147 Cb 0.60 0.13 -0.12 0.00 -0.02 0.00 0.00 41.12 41.71 2jxr n ASP 147 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2jxr s GLU 148 N -2.91 0.23 -1.18 -1.24 2.02 -1.25 -5.07 118.70 109.30 2jxr s GLU 148 Ca -0.03 0.27 -0.16 0.00 0.02 0.00 0.00 54.97 55.07 2jxr s GLU 148 Cb 0.09 0.11 0.13 0.00 0.10 0.00 0.00 34.13 34.56 2jxr s GLU 148 CO 0.81 -0.03 1.48 0.15 0.02 0.00 0.00 175.26 177.69 2jxr s LYS 149 N 0.10 3.96 -0.18 1.61 1.02 -1.26 -4.34 119.74 120.65 2jxr s LYS 149 Ca -0.00 -2.20 -0.31 0.00 0.02 0.00 0.00 55.97 53.48 2jxr s LYS 149 Cb -0.01 -5.20 0.14 0.00 -0.52 0.00 0.00 37.83 32.24 2jxr s LYS 149 CO 0.00 -1.94 1.12 -0.98 -0.92 0.00 0.00 175.35 172.63 2jxr s ARG 150 N 2.72 0.43 0.42 1.68 1.70 -1.26 -1.96 118.95 122.67 2jxr s ARG 150 Ca 0.45 0.02 0.04 0.00 -0.47 0.00 0.00 55.73 55.77 2jxr s ARG 150 Cb -0.01 0.20 -0.01 0.00 -0.57 0.00 0.00 34.95 34.56 2jxr s ARG 150 CO 0.00 -0.15 0.14 1.97 -1.08 0.00 0.00 175.30 176.18 2jxr n PHE 151 N 0.44 0.20 -3.50 5.89 -1.74 -0.92 0.03 117.46 117.86 2jxr n PHE 151 Ca -0.06 -2.65 -0.13 0.00 -0.56 0.00 0.00 57.45 54.06 2jxr n PHE 151 Cb 0.59 -0.02 -0.04 0.00 1.52 0.00 0.00 39.48 41.52 2jxr n PHE 151 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2jxr s ALA 152 N -3.11 -1.77 -0.00 1.98 0.00 0.01 -1.38 121.76 117.49 2jxr s ALA 152 Ca 0.20 1.07 0.03 0.00 0.00 0.00 0.00 51.96 53.26 2jxr s ALA 152 Cb 0.01 0.20 -0.01 0.00 0.00 0.00 0.00 23.12 23.33 2jxr s ALA 152 CO 0.14 -0.54 -0.08 -0.06 0.00 0.00 0.00 175.76 175.21 2jxr s PHE 153 N -2.33 0.75 -0.38 0.00 0.40 0.18 -2.29 117.98 114.31 2jxr s PHE 153 Ca -0.02 -0.16 -0.11 0.00 -0.60 0.00 0.00 56.93 56.03 2jxr s PHE 153 Cb -0.01 -0.48 0.03 0.00 0.51 0.00 0.00 43.02 43.08 2jxr s PHE 153 CO -0.02 -0.01 0.22 -0.47 0.70 0.00 0.00 175.22 175.63 2jxr s TYR 154 N -0.28 3.25 -0.21 0.36 5.04 0.26 -2.26 117.35 123.52 2jxr s TYR 154 Ca 0.02 -1.02 -0.09 0.00 -2.44 0.00 0.00 57.07 53.55 2jxr s TYR 154 Cb -0.04 -2.50 -0.04 0.00 0.35 0.00 0.00 41.96 39.72 2jxr s TYR 154 CO -0.00 -0.67 0.11 -0.51 -1.34 0.00 0.00 175.55 173.13 2jxr s LEU 155 N 1.54 3.96 0.52 6.97 1.43 -1.26 -1.84 118.68 130.00 2jxr s LEU 155 Ca 0.02 0.10 0.09 0.00 -1.03 0.00 0.00 54.13 53.31 2jxr s LEU 155 Cb -0.20 -2.03 0.06 0.00 0.03 0.00 0.00 46.19 44.05 2jxr s LEU 155 CO 0.06 0.13 0.72 -0.83 0.23 0.00 0.00 176.35 176.66 2jxr s GLY 156 N 0.65 1.81 -0.06 -3.19 0.00 -0.54 -4.62 107.32 101.37 2jxr s GLY 156 Ca 0.06 -1.97 0.02 0.00 0.00 0.00 0.00 44.72 42.83 2jxr s GLY 156 CO 0.01 -1.61 -0.11 -0.35 0.00 0.00 0.00 173.10 171.04 2jxr s ASP 157 N -4.56 4.28 0.58 1.64 -1.08 -1.26 -4.92 116.67 111.34 2jxr s ASP 157 Ca 0.59 -0.13 0.28 0.00 -0.52 0.00 0.00 52.55 52.77 2jxr s ASP 157 Cb -0.07 -1.00 1.54 0.00 -1.46 0.00 0.00 42.92 41.92 2jxr s ASP 157 CO 0.37 0.35 2.01 0.71 0.52 0.00 0.00 175.17 179.13 2jxr h THR 158 N 4.34 0.50 0.02 1.71 1.35 -1.90 -2.65 112.91 116.28 2jxr h THR 158 Ca -0.47 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.39 2jxr h THR 158 Cb 1.16 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 2jxr h THR 158 CO 0.51 0.00 -0.01 0.28 -0.25 0.00 0.00 175.52 176.05 2jxr h SER 159 N 0.00 -0.02 -0.63 5.36 0.02 -1.98 -3.38 113.55 112.92 2jxr h SER 159 Ca 0.16 0.00 0.18 0.00 -0.84 0.00 0.00 61.79 61.29 2jxr h SER 159 Cb 0.81 0.01 -0.12 0.00 0.14 0.00 0.00 62.40 63.24 2jxr h SER 159 CO -0.00 0.08 0.03 1.17 -1.14 0.00 0.00 176.83 176.96 2jxr n LYS 159 N -2.61 -0.05 0.00 3.45 4.81 -1.15 -4.56 118.16 118.05 2jxr n LYS 159 Ca -0.00 0.94 0.00 0.00 -0.87 0.00 0.00 58.31 58.38 2jxr n LYS 159 Cb 0.01 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.56 2jxr n LYS 159 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2jxr n ASP 159 N -4.80 0.16 0.00 3.14 8.00 -1.01 -5.03 116.55 117.01 2jxr n ASP 159 Ca 0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.65 2jxr n ASP 159 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 2jxr n ASP 159 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2jxr n THR 159 N 0.00 0.00 -0.05 -3.53 -2.24 -1.26 -4.84 114.28 102.37 2jxr n THR 159 Ca 0.00 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 2jxr n THR 159 Cb 0.00 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.15 2jxr n THR 159 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2jxr h GLU 160 N 0.00 0.29 -5.26 -0.78 5.08 -1.96 -3.41 114.58 108.54 2jxr h GLU 160 Ca 0.00 -0.16 -0.47 0.00 -1.00 0.00 0.00 59.36 57.74 2jxr h GLU 160 Cb 0.00 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 2jxr h GLU 160 CO 0.00 0.70 1.67 -1.71 -1.00 0.00 0.00 179.01 178.67 2jxr n ASN 161 N -4.61 1.11 0.01 1.42 2.85 -1.26 -4.71 115.26 110.07 2jxr n ASN 161 Ca -0.07 -0.18 0.11 0.00 -0.11 0.00 0.00 54.58 54.34 2jxr n ASN 161 Cb 0.35 -1.20 0.04 0.00 1.24 0.00 0.00 39.78 40.21 2jxr n ASN 161 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2jxr n GLY 162 N 6.27 -1.14 0.00 8.20 0.00 -1.16 -4.63 105.19 112.74 2jxr n GLY 162 Ca 0.54 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2jxr n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jxr n GLY 163 N 1.46 0.81 3.16 -0.02 0.00 -1.20 -1.47 105.19 107.93 2jxr n GLY 163 Ca 0.04 -2.08 -0.12 0.00 0.00 0.00 0.00 46.02 43.86 2jxr n GLY 163 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jxr s GLU 164 N -1.14 0.30 -0.20 1.61 2.12 -0.77 -1.02 118.70 119.60 2jxr s GLU 164 Ca 0.00 0.59 -0.06 0.00 0.36 0.00 0.00 54.97 55.86 2jxr s GLU 164 Cb 0.00 -0.02 -0.03 0.00 0.26 0.00 0.00 34.13 34.34 2jxr s GLU 164 CO 0.00 -0.13 0.02 0.00 -0.54 0.00 0.00 175.26 174.61 2jxr s ALA 165 N 1.05 3.14 -0.39 6.30 0.00 -0.46 -0.57 121.76 130.83 2jxr s ALA 165 Ca -0.07 -0.93 -0.18 0.00 0.00 0.00 0.00 51.96 50.78 2jxr s ALA 165 Cb -0.08 -1.83 0.01 0.00 0.00 0.00 0.00 23.12 21.22 2jxr s ALA 165 CO -0.08 -0.07 0.48 0.99 0.00 0.00 0.00 175.76 177.08 2jxr s THR 166 N 0.85 5.04 -0.32 0.00 2.01 -0.97 -0.00 115.64 122.25 2jxr s THR 166 Ca 0.02 -0.04 -0.08 0.00 0.31 0.00 0.00 61.69 61.90 2jxr s THR 166 Cb -0.14 -4.02 0.01 0.00 0.01 0.00 0.00 72.50 68.36 2jxr s THR 166 CO 0.02 -0.35 0.13 -0.36 -0.69 0.00 0.00 174.62 173.37 2jxr s PHE 167 N 2.30 3.19 0.00 4.92 0.08 0.29 -0.81 117.98 127.95 2jxr s PHE 167 Ca 0.15 -0.89 0.00 0.00 0.12 0.00 0.00 56.93 56.32 2jxr s PHE 167 Cb -0.16 -2.32 0.00 0.00 -0.57 0.00 0.00 43.02 39.97 2jxr s PHE 167 CO 0.14 -0.57 0.00 0.41 -0.10 0.00 0.00 175.22 175.11 2jxr n GLY 168 N 4.92 0.51 0.00 4.36 0.00 0.10 -1.66 105.19 113.43 2jxr n GLY 168 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2jxr n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jxr n GLY 169 N -2.00 1.46 3.10 -0.02 0.00 -1.24 -3.77 105.19 102.72 2jxr n GLY 169 Ca 0.00 -0.72 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 2jxr n GLY 169 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2jxr s ILE 170 N -2.39 0.63 -0.35 -0.61 -4.36 -1.26 -4.34 121.20 108.52 2jxr s ILE 170 Ca 0.00 -1.34 -0.07 0.00 -0.26 0.00 0.00 60.65 58.99 2jxr s ILE 170 Cb 0.00 -0.94 0.04 0.00 1.25 0.00 0.00 42.46 42.81 2jxr s ILE 170 CO 0.00 -0.51 0.12 -0.62 0.24 0.00 0.00 174.94 174.18 2jxr s ASP 171 N -2.00 5.36 0.44 4.36 -1.08 -1.26 -4.84 116.67 117.65 2jxr s ASP 171 Ca -0.03 -1.20 0.20 0.00 -0.52 0.00 0.00 52.55 51.00 2jxr s ASP 171 Cb -0.06 -1.88 1.04 0.00 -1.46 0.00 0.00 42.92 40.56 2jxr s ASP 171 CO -0.01 -0.35 1.93 -0.33 0.52 0.00 0.00 175.17 176.93 2jxr h GLU 172 N 8.24 0.00 -0.10 4.34 5.08 -2.00 -3.09 114.58 127.04 2jxr h GLU 172 Ca -0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 2jxr h GLU 172 Cb 1.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 2jxr h GLU 172 CO 0.62 0.24 0.00 -1.13 -1.00 0.00 0.00 179.01 177.74 2jxr n SER 173 N -3.83 0.10 0.00 1.42 3.41 -1.26 -3.65 113.62 109.81 2jxr n SER 173 Ca -0.02 -1.60 0.00 0.00 -0.26 0.00 0.00 58.87 56.99 2jxr n SER 173 Cb 0.34 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 2jxr n SER 173 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jxr n LYS 174 N -0.42 0.64 -3.91 4.33 4.76 -1.17 -4.95 118.16 117.44 2jxr n LYS 174 Ca 0.00 -0.38 -0.09 0.00 -2.87 0.00 0.00 58.31 54.97 2jxr n LYS 174 Cb 0.03 -0.87 -0.06 0.00 -1.84 0.00 0.00 35.03 32.28 2jxr n LYS 174 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 2jxr s PHE 175 N -0.20 0.29 0.15 2.13 -0.12 -1.24 -1.32 117.98 117.67 2jxr s PHE 175 Ca 0.00 -0.66 0.03 0.00 -0.05 0.00 0.00 56.93 56.26 2jxr s PHE 175 Cb 0.00 0.02 -0.04 0.00 -0.63 0.00 0.00 43.02 42.36 2jxr s PHE 175 CO 0.00 -0.74 -0.07 -1.59 -0.05 0.00 0.00 175.22 172.77 2jxr s LYS 176 N -3.94 1.06 2.32 1.99 -2.85 -0.96 -4.83 119.74 112.52 2jxr s LYS 176 Ca 0.15 -1.47 0.00 0.00 -1.00 0.00 0.00 55.97 53.65 2jxr s LYS 176 Cb 0.03 -0.50 0.00 0.00 -2.06 0.00 0.00 37.83 35.30 2jxr s LYS 176 CO -0.01 0.01 0.00 0.41 0.10 0.00 0.00 175.35 175.86 2jxr n GLY 177 N -0.20 -0.31 3.89 0.59 0.00 -1.26 -3.89 105.19 104.00 2jxr n GLY 177 Ca -0.09 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.66 2jxr n GLY 177 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jxr s ASP 178 N -4.00 6.39 0.06 1.61 1.01 -1.26 -4.94 116.67 115.54 2jxr s ASP 178 Ca 0.00 1.11 -0.16 0.00 0.71 0.00 0.00 52.55 54.20 2jxr s ASP 178 Cb 0.00 -2.32 -0.06 0.00 1.01 0.00 0.00 42.92 41.55 2jxr s ASP 178 CO 0.00 -0.54 0.51 -0.63 0.21 0.00 0.00 175.17 174.72 2jxr s ILE 179 N -2.63 4.87 -0.17 0.77 1.01 -1.26 -4.65 121.20 119.15 2jxr s ILE 179 Ca 0.51 0.99 0.01 0.00 0.00 0.00 0.00 60.65 62.15 2jxr s ILE 179 Cb -0.10 -3.80 0.02 0.00 0.01 0.00 0.00 42.46 38.59 2jxr s ILE 179 CO 0.39 0.49 -0.17 -0.89 0.00 0.00 0.00 174.94 174.77 2jxr s THR 180 N -1.18 1.81 -0.06 2.92 2.01 0.19 -4.88 115.64 116.44 2jxr s THR 180 Ca 0.29 -0.80 -0.23 0.00 0.31 0.00 0.00 61.69 61.26 2jxr s THR 180 Cb -0.17 -1.67 -0.04 0.00 0.01 0.00 0.00 72.50 70.62 2jxr s THR 180 CO 0.17 0.48 0.69 0.26 -0.69 0.00 0.00 174.62 175.54 2jxr s TRP 181 N 1.39 3.59 -0.26 4.92 0.52 -1.26 0.17 118.94 128.00 2jxr s TRP 181 Ca 0.05 1.25 -0.02 0.00 0.02 0.00 0.00 56.10 57.39 2jxr s TRP 181 Cb -0.13 -2.79 0.03 0.00 -1.15 0.00 0.00 33.47 29.43 2jxr s TRP 181 CO -0.12 0.12 -0.03 -0.51 0.02 0.00 0.00 176.95 176.43 2jxr s LEU 182 N 0.69 3.42 0.26 2.99 2.01 -0.10 -4.98 118.68 122.97 2jxr s LEU 182 Ca 0.37 -0.92 -0.30 0.00 0.01 0.00 0.00 54.13 53.29 2jxr s LEU 182 Cb -0.18 -1.70 -0.09 0.00 0.01 0.00 0.00 46.19 44.22 2jxr s LEU 182 CO 0.18 -0.16 1.10 -2.16 1.01 0.00 0.00 176.35 176.32 2jxr s PRO 183 N 1.34 4.64 0.17 1.29 0.04 -1.26 -1.12 135.00 140.10 2jxr s PRO 183 Ca -0.00 1.79 -0.32 0.00 0.04 0.00 0.00 61.00 62.50 2jxr s PRO 183 Cb -0.17 -3.20 -0.12 0.00 0.04 0.00 0.00 34.50 31.04 2jxr s PRO 183 CO -0.03 0.19 1.73 0.28 0.04 0.00 0.00 177.00 179.21 2jxr n VAL 184 N 1.38 0.10 -0.06 -0.36 0.31 -0.46 -4.57 118.33 114.66 2jxr n VAL 184 Ca -0.01 -0.02 -0.15 0.00 -0.01 0.00 0.00 64.34 64.16 2jxr n VAL 184 Cb 0.45 -1.94 -0.13 0.00 -0.91 0.00 0.00 33.84 31.31 2jxr n VAL 184 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2jxr h ARG 185 N 7.09 0.02 -4.97 5.55 2.43 -0.27 -3.47 114.38 120.76 2jxr h ARG 185 Ca -0.44 -0.03 -0.36 0.00 -0.81 0.00 0.00 59.98 58.33 2jxr h ARG 185 Cb 1.22 0.01 -0.23 0.00 -0.42 0.00 0.00 29.97 30.55 2jxr h ARG 185 CO 0.94 1.02 -0.76 0.50 -1.51 0.00 0.00 179.97 180.15 2jxr s ARG 186 N -2.24 0.71 -1.04 0.20 3.52 -1.25 -5.07 118.95 113.77 2jxr s ARG 186 Ca -0.19 -0.76 -0.17 0.00 -0.13 0.00 0.00 55.73 54.47 2jxr s ARG 186 Cb -0.02 -0.63 0.13 0.00 -1.56 0.00 0.00 34.95 32.87 2jxr s ARG 186 CO 0.69 0.14 1.28 0.15 -0.81 0.00 0.00 175.30 176.75 2jxr s LYS 187 N -1.38 3.77 0.36 5.12 1.02 -1.26 -4.26 119.74 123.12 2jxr s LYS 187 Ca -0.04 -1.98 0.00 0.00 0.02 0.00 0.00 55.97 53.98 2jxr s LYS 187 Cb -0.09 -5.03 0.00 0.00 -0.52 0.00 0.00 37.83 32.20 2jxr s LYS 187 CO 0.01 -1.83 0.00 0.00 -0.92 0.00 0.00 175.35 172.61 2jxr n ALA 188 N 6.54 1.74 -2.23 5.17 0.00 -1.26 -4.76 120.51 125.71 2jxr n ALA 188 Ca 0.30 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.51 2jxr n ALA 188 Cb 0.47 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.93 2jxr n ALA 188 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2jxr s TYR 189 N -2.00 1.83 -1.18 0.00 2.02 -1.26 -2.48 117.35 114.27 2jxr s TYR 189 Ca 0.00 -0.71 -0.12 0.00 -0.37 0.00 0.00 57.07 55.87 2jxr s TYR 189 Cb 0.00 -2.08 0.21 0.00 -0.40 0.00 0.00 41.96 39.69 2jxr s TYR 189 CO 0.00 -0.62 1.37 0.91 -1.57 0.00 0.00 175.55 175.64 2jxr n TRP 190 N -1.88 4.86 -3.06 2.71 7.02 -1.26 -4.81 117.44 121.02 2jxr n TRP 190 Ca 0.05 -3.47 -0.41 0.00 -1.02 0.00 0.00 57.50 52.65 2jxr n TRP 190 Cb 0.63 -2.00 -0.06 0.00 -2.42 0.00 0.00 31.31 27.46 2jxr n TRP 190 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2jxr s GLU 191 N 0.48 4.03 0.22 -0.99 2.12 -1.26 -1.51 118.70 121.79 2jxr s GLU 191 Ca 0.39 0.51 0.07 0.00 0.36 0.00 0.00 54.97 56.30 2jxr s GLU 191 Cb -0.04 -3.69 -0.04 0.00 0.26 0.00 0.00 34.13 30.63 2jxr s GLU 191 CO -0.02 -0.52 0.13 0.14 -0.54 0.00 0.00 175.26 174.46 2jxr s VAL 192 N 2.65 4.23 -0.04 3.70 -7.23 -0.38 0.51 120.40 123.85 2jxr s VAL 192 Ca 0.28 -1.40 -0.30 0.00 -1.81 0.00 0.00 61.98 58.74 2jxr s VAL 192 Cb -0.15 -3.24 -0.03 0.00 0.56 0.00 0.00 36.38 33.52 2jxr s VAL 192 CO 0.10 -0.27 1.04 -0.54 -0.31 0.00 0.00 175.10 175.12 2jxr s LYS 193 N -3.55 4.47 -0.89 4.82 1.02 -1.26 -0.39 119.74 123.96 2jxr s LYS 193 Ca 0.32 1.49 -0.15 0.00 0.02 0.00 0.00 55.97 57.64 2jxr s LYS 193 Cb -0.08 -3.49 0.19 0.00 -0.52 0.00 0.00 37.83 33.93 2jxr s LYS 193 CO 0.23 -0.22 0.94 0.12 -0.92 0.00 0.00 175.35 175.50 2jxr s PHE 194 N 1.52 3.56 -0.83 3.18 5.36 -0.56 -0.32 117.98 129.90 2jxr s PHE 194 Ca 0.52 -1.83 0.26 0.00 -0.96 0.00 0.00 56.93 54.92 2jxr s PHE 194 Cb -0.22 -4.00 0.68 0.00 -0.34 0.00 0.00 43.02 39.15 2jxr s PHE 194 CO 0.24 -1.18 1.58 0.39 -1.46 0.00 0.00 175.22 174.79 2jxr n GLU 195 N 4.86 0.15 0.00 10.12 1.02 -0.67 -4.20 120.64 131.92 2jxr n GLU 195 Ca 0.19 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 2jxr n GLU 195 Cb 0.47 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 2jxr n GLU 195 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jxr n GLY 196 N 1.41 1.31 2.94 0.62 0.00 -1.21 -0.82 105.19 109.43 2jxr n GLY 196 Ca 0.05 -0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 2jxr n GLY 196 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jxr s ILE 197 N -1.27 0.78 0.06 -0.61 2.07 -0.14 -0.58 121.20 121.51 2jxr s ILE 197 Ca 0.00 -0.25 -0.14 0.00 -1.41 0.00 0.00 60.65 58.85 2jxr s ILE 197 Cb 0.00 -0.76 0.02 0.00 0.13 0.00 0.00 42.46 41.85 2jxr s ILE 197 CO 0.00 0.28 0.32 -0.83 -1.91 0.00 0.00 174.94 172.80 2jxr s GLY 198 N 0.92 -0.14 -0.27 1.50 0.00 -0.80 -0.26 107.32 108.27 2jxr s GLY 198 Ca -0.11 -0.05 -0.08 0.00 0.00 0.00 0.00 44.72 44.48 2jxr s GLY 198 CO 0.01 -0.28 0.57 -2.27 0.00 0.00 0.00 173.10 171.13 2jxr s LEU 199 N -2.30 -1.02 0.00 0.66 0.20 -0.17 -0.58 118.68 115.47 2jxr s LEU 199 Ca -0.02 1.29 0.00 0.00 0.69 0.00 0.00 54.13 56.08 2jxr s LEU 199 Cb 0.00 1.98 0.00 0.00 -0.43 0.00 0.00 46.19 47.75 2jxr s LEU 199 CO -0.06 -0.23 0.00 0.61 -0.29 0.00 0.00 176.35 176.38 2jxr n GLY 200 N 5.43 0.72 0.03 7.98 0.00 -1.26 -3.31 105.19 114.78 2jxr n GLY 200 Ca -0.09 -0.70 0.12 0.00 0.00 0.00 0.00 46.02 45.35 2jxr n GLY 200 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jxr n ASP 201 N 6.90 0.56 -4.17 1.61 9.92 -1.26 -4.90 116.55 125.21 2jxr n ASP 201 Ca 0.00 -0.32 -0.33 0.00 -0.53 0.00 0.00 54.79 53.61 2jxr n ASP 201 Cb 0.00 0.22 -0.16 0.00 -0.64 0.00 0.00 41.12 40.54 2jxr n ASP 201 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2jxr s GLU 202 N -2.93 3.03 -0.21 -1.24 2.02 -1.21 -5.11 118.70 113.04 2jxr s GLU 202 Ca 0.13 -0.84 0.02 0.00 0.02 0.00 0.00 54.97 54.29 2jxr s GLU 202 Cb 0.18 -2.47 0.04 0.00 0.10 0.00 0.00 34.13 31.97 2jxr s GLU 202 CO 0.67 -0.05 -0.14 -0.47 0.02 0.00 0.00 175.26 175.29 2jxr s TYR 203 N 0.91 2.85 -0.35 1.61 6.14 -1.26 -1.00 117.35 126.25 2jxr s TYR 203 Ca -0.05 -1.87 -0.21 0.00 0.64 0.00 0.00 57.07 55.58 2jxr s TYR 203 Cb -0.15 -1.85 0.00 0.00 0.42 0.00 0.00 41.96 40.39 2jxr s TYR 203 CO -0.04 -0.82 0.69 0.00 0.64 0.00 0.00 175.55 176.03 2jxr s ALA 204 N 1.25 3.46 -0.17 3.97 0.00 0.64 -4.94 121.76 125.97 2jxr s ALA 204 Ca -0.02 -0.75 -0.29 0.00 0.00 0.00 0.00 51.96 50.91 2jxr s ALA 204 Cb -0.16 -3.23 -0.00 0.00 0.00 0.00 0.00 23.12 19.72 2jxr s ALA 204 CO -0.09 -1.35 1.01 -1.21 0.00 0.00 0.00 175.76 174.12 2jxr s GLU 205 N 2.83 4.33 0.18 0.00 2.02 -1.26 -0.97 118.70 125.84 2jxr s GLU 205 Ca 0.27 1.34 0.09 0.00 0.02 0.00 0.00 54.97 56.69 2jxr s GLU 205 Cb -0.14 -3.59 -0.04 0.00 0.10 0.00 0.00 34.13 30.45 2jxr s GLU 205 CO 0.15 -0.47 -0.20 -0.51 0.02 0.00 0.00 175.26 174.26 2jxr s LEU 206 N 2.59 2.46 -0.02 1.80 1.43 0.00 -4.93 118.68 122.01 2jxr s LEU 206 Ca 0.45 -0.89 0.04 0.00 -1.03 0.00 0.00 54.13 52.71 2jxr s LEU 206 Cb -0.17 -0.93 -0.01 0.00 0.03 0.00 0.00 46.19 45.12 2jxr s LEU 206 CO 0.12 0.00 -0.15 -1.61 0.23 0.00 0.00 176.35 174.94 2jxr s GLU 207 N -2.87 1.34 -1.42 1.70 0.41 -1.26 -4.57 118.70 112.02 2jxr s GLU 207 Ca 0.18 -0.53 -0.07 0.00 -0.41 0.00 0.00 54.97 54.15 2jxr s GLU 207 Cb -0.06 -1.24 0.04 0.00 -1.78 0.00 0.00 34.13 31.09 2jxr s GLU 207 CO 0.08 0.28 0.82 0.43 -0.49 0.00 0.00 175.26 176.37 2jxr n SER 208 N 2.90 -2.85 -4.47 -0.19 7.64 -1.26 -5.01 113.62 110.37 2jxr n SER 208 Ca -0.16 -0.81 -0.28 0.00 1.01 0.00 0.00 58.87 58.62 2jxr n SER 208 Cb 0.54 -3.90 -0.11 0.00 -1.01 0.00 0.00 64.21 59.72 2jxr n SER 208 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2jxr s HIS 209 N -3.51 2.47 0.31 1.43 3.76 -1.26 -4.32 115.29 114.17 2jxr s HIS 209 Ca 0.32 -0.29 0.05 0.00 -0.15 0.00 0.00 55.06 54.99 2jxr s HIS 209 Cb -0.16 -1.28 -0.06 0.00 1.11 0.00 0.00 32.58 32.18 2jxr s HIS 209 CO 0.83 0.42 0.01 0.20 -0.85 0.00 0.00 174.74 175.35 2jxr s GLY 210 N -2.34 2.00 -0.09 -2.22 0.00 -0.87 -1.50 107.32 102.30 2jxr s GLY 210 Ca 0.19 -2.02 0.02 0.00 0.00 0.00 0.00 44.72 42.91 2jxr s GLY 210 CO 0.10 -1.84 -0.13 0.00 0.00 0.00 0.00 173.10 171.23 2jxr s ALA 212 N -3.16 1.46 -0.56 3.20 0.00 0.48 -0.35 121.76 122.83 2jxr s ALA 212 Ca 0.34 -0.57 -0.21 0.00 0.00 0.00 0.00 51.96 51.51 2jxr s ALA 212 Cb 0.07 -0.73 0.06 0.00 0.00 0.00 0.00 23.12 22.52 2jxr s ALA 212 CO 0.14 -0.04 0.81 0.00 0.00 0.00 0.00 175.76 176.66 2jxr s ALA 213 N 0.95 3.26 -0.43 0.00 0.00 0.59 -1.25 121.76 124.89 2jxr s ALA 213 Ca -0.08 -1.67 -0.28 0.00 0.00 0.00 0.00 51.96 49.92 2jxr s ALA 213 Cb -0.15 -3.60 -0.00 0.00 0.00 0.00 0.00 23.12 19.37 2jxr s ALA 213 CO -0.00 -2.33 1.57 0.42 0.00 0.00 0.00 175.76 175.42 2jxr s ILE 214 N 3.35 3.70 -0.16 0.00 -1.09 -0.57 -1.99 121.20 124.45 2jxr s ILE 214 Ca 0.21 0.68 0.01 0.00 -2.23 0.00 0.00 60.65 59.31 2jxr s ILE 214 Cb -0.17 -4.04 0.02 0.00 -1.58 0.00 0.00 42.46 36.69 2jxr s ILE 214 CO 0.13 -0.73 -0.16 -0.62 -1.23 0.00 0.00 174.94 172.33 2jxr s ASP 215 N 5.07 2.89 0.22 3.58 -1.08 -0.88 -4.47 116.67 122.00 2jxr s ASP 215 Ca 0.66 -0.57 0.26 0.00 -0.52 0.00 0.00 52.55 52.38 2jxr s ASP 215 Cb -0.16 -1.29 0.73 0.00 -1.46 0.00 0.00 42.92 40.74 2jxr s ASP 215 CO 0.31 -0.04 1.71 0.71 0.52 0.00 0.00 175.17 178.38 2jxr h THR 216 N 6.04 0.00 -0.71 1.71 1.35 -1.86 -3.29 112.91 116.15 2jxr h THR 216 Ca -0.40 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 2jxr h THR 216 Cb 1.13 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 2jxr h THR 216 CO 0.56 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.44 2jxr n GLY 217 N 1.30 2.60 3.25 5.82 0.00 -1.26 -4.74 105.19 112.17 2jxr n GLY 217 Ca 0.05 -0.83 -0.34 0.00 0.00 0.00 0.00 46.02 44.91 2jxr n GLY 217 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jxr s THR 218 N -1.34 2.79 0.29 2.61 2.01 -1.24 -5.03 115.64 115.73 2jxr s THR 218 Ca 0.50 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.81 2jxr s THR 218 Cb 0.29 -2.21 0.11 0.00 0.01 0.00 0.00 72.50 70.69 2jxr s THR 218 CO 0.30 0.49 1.77 0.28 -0.69 0.00 0.00 174.62 176.78 2jxr h SER 219 N 7.67 0.58 -0.13 3.53 0.02 -1.90 -1.71 113.55 121.60 2jxr h SER 219 Ca -0.38 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 2jxr h SER 219 Cb 1.17 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.55 2jxr h SER 219 CO 0.60 0.72 0.00 0.18 -1.14 0.00 0.00 176.83 177.19 2jxr n LEU 220 N -4.19 0.00 -4.07 5.07 4.77 -1.26 -3.15 117.00 114.16 2jxr n LEU 220 Ca 0.01 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.73 2jxr n LEU 220 Cb 0.33 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.25 2jxr n LEU 220 CO 0.41 0.00 -0.49 -0.63 -1.33 0.00 0.00 177.39 175.35 2jxr s ILE 221 N 2.28 1.32 0.09 -0.08 1.01 -0.83 -1.52 121.20 123.48 2jxr s ILE 221 Ca 0.00 -0.60 0.09 0.00 0.00 0.00 0.00 60.65 60.14 2jxr s ILE 221 Cb 0.00 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.25 2jxr s ILE 221 CO 0.00 0.39 -0.21 0.42 0.00 0.00 0.00 174.94 175.54 2jxr s THR 222 N 0.48 2.60 0.05 2.92 -4.23 0.66 -0.77 115.64 117.35 2jxr s THR 222 Ca -0.13 -1.48 0.01 0.00 -1.18 0.00 0.00 61.69 58.91 2jxr s THR 222 Cb -0.15 -2.14 -0.03 0.00 1.34 0.00 0.00 72.50 71.52 2jxr s THR 222 CO 0.04 0.18 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.50 2jxr s LEU 223 N -1.85 2.36 0.18 4.79 1.43 0.15 -1.37 118.68 124.38 2jxr s LEU 223 Ca 0.15 -0.73 -0.30 0.00 -1.03 0.00 0.00 54.13 52.22 2jxr s LEU 223 Cb -0.10 0.02 -0.17 0.00 0.03 0.00 0.00 46.19 45.97 2jxr s LEU 223 CO 0.07 -0.38 0.72 -2.65 0.23 0.00 0.00 176.35 174.34 2jxr n PRO 224 N 0.88 0.30 -0.38 1.29 -0.02 -1.24 -0.82 135.00 135.00 2jxr n PRO 224 Ca -0.19 0.11 -0.07 0.00 -2.02 0.00 0.00 63.50 61.32 2jxr n PRO 224 Cb 0.58 -1.27 -0.05 0.00 -0.02 0.00 0.00 33.50 32.73 2jxr n PRO 224 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2jxr n SER 225 N 1.82 -0.87 -0.22 2.55 3.41 -1.26 -2.43 113.62 116.62 2jxr n SER 225 Ca 0.17 1.66 -0.04 0.00 -0.26 0.00 0.00 58.87 60.40 2jxr n SER 225 Cb 0.24 -0.27 0.13 0.00 -0.26 0.00 0.00 64.21 64.05 2jxr n SER 225 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2jxr h GLY 226 N 0.00 1.10 0.64 5.00 0.00 -1.98 -1.39 103.07 106.44 2jxr h GLY 226 Ca 0.21 -0.60 0.08 0.00 0.00 0.00 0.00 47.33 47.02 2jxr h GLY 226 CO -0.90 0.57 0.62 1.41 0.00 0.00 0.00 176.54 178.24 2jxr h LEU 227 N 1.00 0.97 0.07 3.11 3.38 -1.83 -1.46 115.31 120.54 2jxr h LEU 227 Ca 0.23 0.02 -0.24 0.00 0.09 0.00 0.00 57.88 57.98 2jxr h LEU 227 Cb 0.23 -0.18 0.02 0.00 0.09 0.00 0.00 40.66 40.83 2jxr h LEU 227 CO -0.01 0.58 -0.99 0.00 0.09 0.00 0.00 178.44 178.10 2jxr h ALA 228 N 1.47 0.03 -0.28 1.53 0.00 -1.20 -2.40 119.26 118.42 2jxr h ALA 228 Ca 0.44 -0.70 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2jxr h ALA 228 Cb 0.28 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2jxr h ALA 228 CO -0.21 0.57 0.16 0.93 0.00 0.00 0.00 179.25 180.70 2jxr h GLU 229 N 0.14 0.37 0.28 0.00 5.08 -1.18 -2.51 114.58 116.76 2jxr h GLU 229 Ca -0.14 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 2jxr h GLU 229 Cb 1.69 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.86 2jxr h GLU 229 CO 0.19 0.27 -0.14 1.98 -1.00 0.00 0.00 179.01 180.32 2jxr h MET 230 N 0.38 -0.36 -0.69 2.33 4.05 -1.21 -1.09 114.93 118.34 2jxr h MET 230 Ca 0.10 0.02 0.12 0.00 -0.28 0.00 0.00 59.70 59.67 2jxr h MET 230 Cb 0.00 0.08 -0.13 0.00 -0.80 0.00 0.00 31.60 30.75 2jxr h MET 230 CO -0.02 -0.24 -0.29 0.82 0.23 0.00 0.00 176.91 177.41 2jxr h ILE 231 N -0.42 0.18 -0.03 1.77 5.03 -1.41 -0.15 117.51 122.47 2jxr h ILE 231 Ca -0.04 0.00 -0.06 0.00 -0.12 0.00 0.00 64.86 64.64 2jxr h ILE 231 Cb 0.29 0.18 -0.01 0.00 -3.03 0.00 0.00 36.82 34.25 2jxr h ILE 231 CO 0.06 0.00 -0.28 0.78 -0.68 0.00 0.00 178.15 178.03 2jxr h ASN 232 N -0.09 0.06 -0.22 1.72 -0.26 -1.53 -0.88 115.58 114.38 2jxr h ASN 232 Ca 0.29 -0.02 -0.08 0.00 -0.56 0.00 0.00 56.30 55.93 2jxr h ASN 232 Cb 0.56 -0.02 -0.00 0.00 -1.06 0.00 0.00 38.32 37.80 2jxr h ASN 232 CO -0.74 0.34 -0.18 0.00 -1.06 0.00 0.00 177.43 175.79 2jxr h ALA 233 N 1.66 0.32 -0.32 -0.83 0.00 0.33 0.21 119.26 120.62 2jxr h ALA 233 Ca 0.01 -0.34 0.07 0.00 0.00 0.00 0.00 54.91 54.64 2jxr h ALA 233 Cb 0.53 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2jxr h ALA 233 CO 0.04 0.23 0.22 0.93 0.00 0.00 0.00 179.25 180.67 2jxr h GLU 234 N 0.20 0.12 -0.58 0.00 5.08 -1.36 -1.35 114.58 116.70 2jxr h GLU 234 Ca 0.04 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2jxr h GLU 234 Cb 0.71 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2jxr h GLU 234 CO 0.05 0.08 0.00 0.44 -1.00 0.00 0.00 179.01 178.58 2jxr n ILE 235 N -4.47 0.92 -1.32 3.13 -5.35 -0.35 -4.96 119.36 106.96 2jxr n ILE 235 Ca 0.04 -0.96 -0.02 0.00 -0.27 0.00 0.00 62.75 61.54 2jxr n ILE 235 Cb 0.31 0.58 -0.01 0.00 -1.74 0.00 0.00 39.64 38.78 2jxr n ILE 235 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jxr n GLY 236 N 1.31 0.48 3.78 3.28 0.00 -0.51 -4.97 105.19 108.57 2jxr n GLY 236 Ca 0.20 -0.93 -0.38 0.00 0.00 0.00 0.00 46.02 44.91 2jxr n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jxr s ALA 237 N -2.09 3.60 0.03 4.61 0.00 0.04 -4.70 121.76 123.26 2jxr s ALA 237 Ca 0.00 -0.23 0.09 0.00 0.00 0.00 0.00 51.96 51.81 2jxr s ALA 237 Cb 0.00 -2.48 -0.03 0.00 0.00 0.00 0.00 23.12 20.61 2jxr s ALA 237 CO 0.00 0.26 -0.25 0.15 0.00 0.00 0.00 175.76 175.92 2jxr s LYS 238 N -0.28 1.74 -0.56 0.00 3.01 0.14 -4.52 119.74 119.27 2jxr s LYS 238 Ca 0.24 -1.03 -0.26 0.00 -1.01 0.00 0.00 55.97 53.90 2jxr s LYS 238 Cb -0.16 -1.86 -0.06 0.00 -1.01 0.00 0.00 37.83 34.74 2jxr s LYS 238 CO 0.11 0.49 2.22 0.21 0.51 0.00 0.00 175.35 178.88 2jxr s LYS 239 N -1.10 2.25 0.00 1.68 2.20 -1.26 -1.34 119.74 122.16 2jxr s LYS 239 Ca 0.10 1.03 0.00 0.00 -0.36 0.00 0.00 55.97 56.75 2jxr s LYS 239 Cb -0.10 -4.55 0.00 0.00 -1.51 0.00 0.00 37.83 31.67 2jxr s LYS 239 CO 0.01 -3.18 0.00 0.41 -0.36 0.00 0.00 175.35 172.23 2jxr n GLY 240 N 5.98 0.56 0.00 5.54 0.00 -0.74 -4.78 105.19 111.75 2jxr n GLY 240 Ca 0.32 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2jxr n GLY 240 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2jxr n TRP 241 N 0.00 0.00 1.31 1.61 -0.00 -1.26 -2.13 117.44 116.96 2jxr n TRP 241 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.50 57.60 2jxr n TRP 241 Cb 0.00 0.00 0.38 0.00 -0.00 0.00 0.00 31.31 31.69 2jxr n TRP 241 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 177.69 180.10 2jxr n THR 242 N -0.04 0.20 -0.68 -1.67 -1.04 -1.26 -4.94 114.28 104.85 2jxr n THR 242 Ca 0.00 -0.31 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 2jxr n THR 242 Cb 0.00 0.28 0.00 0.00 -1.82 0.00 0.00 70.33 68.79 2jxr n THR 242 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jxr n GLY 243 N 1.08 0.71 3.52 3.41 0.00 -0.91 -5.03 105.19 107.97 2jxr n GLY 243 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2jxr n GLY 243 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2jxr s GLN 244 N -0.32 2.00 -0.23 1.61 -2.07 -1.26 -4.93 119.66 114.45 2jxr s GLN 244 Ca 0.00 -1.07 -0.26 0.00 -1.82 0.00 0.00 55.36 52.21 2jxr s GLN 244 Cb 0.00 -2.22 -0.00 0.00 -1.09 0.00 0.00 33.01 29.70 2jxr s GLN 244 CO 0.00 0.51 0.91 0.71 -1.32 0.00 0.00 175.29 176.09 2jxr s TYR 245 N -1.13 3.33 -0.07 9.60 1.51 -1.26 -1.79 117.35 127.53 2jxr s TYR 245 Ca 0.19 1.27 0.01 0.00 -1.01 0.00 0.00 57.07 57.53 2jxr s TYR 245 Cb -0.11 -3.13 -0.03 0.00 -0.11 0.00 0.00 41.96 38.58 2jxr s TYR 245 CO 0.11 -0.42 -0.08 0.95 -1.11 0.00 0.00 175.55 175.00 2jxr s THR 246 N 2.92 3.63 0.06 -0.71 -4.23 -0.45 -0.85 115.64 116.00 2jxr s THR 246 Ca 0.39 -0.51 -0.02 0.00 -1.18 0.00 0.00 61.69 60.36 2jxr s THR 246 Cb -0.15 -2.48 -0.03 0.00 1.34 0.00 0.00 72.50 71.18 2jxr s THR 246 CO 0.07 0.60 0.01 -1.48 -0.54 0.00 0.00 174.62 173.28 2jxr s LEU 247 N -0.77 2.28 -0.10 4.79 2.34 -0.63 0.25 118.68 126.84 2jxr s LEU 247 Ca 0.12 -0.93 -0.30 0.00 0.06 0.00 0.00 54.13 53.08 2jxr s LEU 247 Cb -0.11 0.36 -0.03 0.00 -0.56 0.00 0.00 46.19 45.84 2jxr s LEU 247 CO 0.01 -0.62 1.41 -0.62 -1.06 0.00 0.00 176.35 175.47 2jxr s ASP 248 N -2.89 6.84 0.35 1.48 2.15 -1.26 -3.98 116.67 119.37 2jxr s ASP 248 Ca 0.06 1.94 0.20 0.00 0.43 0.00 0.00 52.55 55.18 2jxr s ASP 248 Cb 0.07 -2.54 1.11 0.00 -0.30 0.00 0.00 42.92 41.26 2jxr s ASP 248 CO -0.10 -0.80 1.59 0.00 -0.17 0.00 0.00 175.17 175.69 2jxr n ASN 250 N -2.25 1.58 0.05 0.00 4.13 -1.26 -3.57 115.26 113.93 2jxr n ASN 250 Ca -0.01 -1.41 0.12 0.00 1.68 0.00 0.00 54.58 54.96 2jxr n ASN 250 Cb 0.13 0.05 0.24 0.00 -1.54 0.00 0.00 39.78 38.67 2jxr n ASN 250 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 2jxr n THR 251 N 0.10 0.30 -0.31 3.41 -2.24 -1.03 -4.14 114.28 110.36 2jxr n THR 251 Ca 0.16 -0.21 0.16 0.00 -2.27 0.00 0.00 64.05 61.90 2jxr n THR 251 Cb 0.39 -0.14 0.41 0.00 -2.10 0.00 0.00 70.33 68.88 2jxr n THR 251 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2jxr h ARG 252 N 0.00 0.58 0.00 -0.78 3.08 -1.73 0.52 114.38 116.05 2jxr h ARG 252 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2jxr h ARG 252 Cb 0.69 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.61 2jxr h ARG 252 CO 0.00 0.38 0.00 -0.25 -1.07 0.00 0.00 179.97 179.03 2jxr n ASP 253 N -4.65 0.00 -1.50 7.04 8.00 -1.26 -2.91 116.55 121.27 2jxr n ASP 253 Ca 0.22 -0.16 -0.04 0.00 0.71 0.00 0.00 54.79 55.52 2jxr n ASP 253 Cb 0.65 -0.23 0.10 0.00 -0.02 0.00 0.00 41.12 41.62 2jxr n ASP 253 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2jxr n ASN 254 N -1.23 2.55 -4.52 -2.24 5.03 0.16 -5.01 115.26 110.00 2jxr n ASN 254 Ca 0.12 -3.26 -0.29 0.00 0.87 0.00 0.00 54.58 52.01 2jxr n ASN 254 Cb 0.15 -0.42 -0.11 0.00 -1.02 0.00 0.00 39.78 38.38 2jxr n ASN 254 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2jxr s LEU 255 N -2.86 2.83 0.77 3.41 1.43 -1.14 -5.06 118.68 118.06 2jxr s LEU 255 Ca 0.40 -0.50 -0.05 0.00 -1.03 0.00 0.00 54.13 52.95 2jxr s LEU 255 Cb 0.38 -1.65 0.13 0.00 0.03 0.00 0.00 46.19 45.08 2jxr s LEU 255 CO -0.05 0.18 1.07 -2.16 0.23 0.00 0.00 176.35 175.62 2jxr s PRO 256 N -2.18 1.51 0.43 1.29 0.04 -1.26 -4.80 135.00 130.03 2jxr s PRO 256 Ca 0.19 -0.82 -0.22 0.00 0.04 0.00 0.00 61.00 60.19 2jxr s PRO 256 Cb -0.11 -2.20 -0.10 0.00 0.04 0.00 0.00 34.50 32.14 2jxr s PRO 256 CO 0.12 -1.64 0.99 -0.51 0.04 0.00 0.00 177.00 175.99 2jxr s ASP 257 N -4.74 6.77 -0.19 6.66 1.11 -1.26 -4.43 116.67 120.59 2jxr s ASP 257 Ca 0.67 1.82 -0.13 0.00 0.18 0.00 0.00 52.55 55.10 2jxr s ASP 257 Cb -0.06 -2.56 -0.05 0.00 1.07 0.00 0.00 42.92 41.33 2jxr s ASP 257 CO 0.46 -0.48 0.25 -0.22 1.18 0.00 0.00 175.17 176.36 2jxr s LEU 258 N -3.08 4.20 -0.09 1.23 2.96 -0.43 -4.22 118.68 119.23 2jxr s LEU 258 Ca 0.62 0.37 0.01 0.00 -0.22 0.00 0.00 54.13 54.90 2jxr s LEU 258 Cb -0.14 -2.28 -0.02 0.00 0.50 0.00 0.00 46.19 44.25 2jxr s LEU 258 CO 0.18 0.08 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.56 2jxr s ILE 259 N 0.69 3.36 0.14 6.68 1.01 0.25 -1.76 121.20 131.58 2jxr s ILE 259 Ca 0.13 -0.58 0.09 0.00 0.00 0.00 0.00 60.65 60.29 2jxr s ILE 259 Cb -0.13 -2.38 -0.04 0.00 0.01 0.00 0.00 42.46 39.92 2jxr s ILE 259 CO 0.03 0.56 -0.17 -0.36 0.00 0.00 0.00 174.94 175.01 2jxr s PHE 260 N -0.30 2.54 -0.27 3.97 0.40 0.22 -1.90 117.98 122.64 2jxr s PHE 260 Ca 0.03 -0.26 -0.01 0.00 -0.60 0.00 0.00 56.93 56.09 2jxr s PHE 260 Cb -0.13 -1.31 0.04 0.00 0.51 0.00 0.00 43.02 42.13 2jxr s PHE 260 CO 0.03 0.42 -0.05 1.21 0.70 0.00 0.00 175.22 177.53 2jxr s ASN 261 N -2.33 4.53 -0.21 1.36 3.04 0.25 -1.69 114.94 119.88 2jxr s ASN 261 Ca 0.20 -1.13 -0.04 0.00 0.04 0.00 0.00 52.86 51.93 2jxr s ASN 261 Cb -0.10 -1.65 -0.01 0.00 -1.54 0.00 0.00 41.25 37.95 2jxr s ASN 261 CO 0.11 -0.19 -0.05 -0.36 -3.04 0.00 0.00 177.10 173.58 2jxr s PHE 262 N 1.25 2.96 0.00 0.43 0.08 0.99 -1.67 117.98 122.01 2jxr s PHE 262 Ca -0.04 -0.88 0.00 0.00 0.12 0.00 0.00 56.93 56.14 2jxr s PHE 262 Cb -0.18 -2.09 0.00 0.00 -0.57 0.00 0.00 43.02 40.18 2jxr s PHE 262 CO -0.03 -0.50 0.00 -1.71 -0.10 0.00 0.00 175.22 172.88 2jxr n ASN 263 N 4.66 -4.46 0.00 1.36 5.15 0.57 -1.98 115.26 120.56 2jxr n ASN 263 Ca -0.18 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.80 2jxr n ASN 263 Cb 0.51 -3.08 0.00 0.00 -0.53 0.00 0.00 39.78 36.68 2jxr n ASN 263 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jxr n GLY 264 N 0.40 0.89 3.49 8.20 0.00 -1.26 -5.08 105.19 111.82 2jxr n GLY 264 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2jxr n GLY 264 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jxr s TYR 265 N -2.00 2.60 -0.03 1.61 1.51 -0.84 -5.09 117.35 115.12 2jxr s TYR 265 Ca 0.00 -0.23 -0.08 0.00 -1.01 0.00 0.00 57.07 55.76 2jxr s TYR 265 Cb 0.00 -1.45 -0.05 0.00 -0.11 0.00 0.00 41.96 40.36 2jxr s TYR 265 CO 0.00 0.31 0.25 -0.80 -1.11 0.00 0.00 175.55 174.20 2jxr s ASN 266 N -1.68 6.50 -0.05 2.29 0.01 -1.26 -0.01 114.94 120.76 2jxr s ASN 266 Ca 0.16 0.58 -0.02 0.00 -0.71 0.00 0.00 52.86 52.87 2jxr s ASN 266 Cb -0.11 -2.10 0.03 0.00 0.41 0.00 0.00 41.25 39.48 2jxr s ASN 266 CO 0.07 0.30 0.06 -0.36 -1.51 0.00 0.00 177.10 175.67 2jxr s PHE 267 N -1.20 0.09 -0.05 2.20 0.08 -0.68 -4.96 117.98 113.45 2jxr s PHE 267 Ca 0.24 0.23 -0.01 0.00 0.12 0.00 0.00 56.93 57.51 2jxr s PHE 267 Cb -0.13 -0.50 -0.04 0.00 -0.57 0.00 0.00 43.02 41.78 2jxr s PHE 267 CO 0.13 -0.21 0.02 0.99 -0.10 0.00 0.00 175.22 176.05 2jxr s THR 268 N 2.16 4.39 -0.04 0.64 2.01 -1.26 0.72 115.64 124.25 2jxr s THR 268 Ca 0.05 -0.36 0.03 0.00 0.31 0.00 0.00 61.69 61.72 2jxr s THR 268 Cb -0.12 -2.91 0.00 0.00 0.01 0.00 0.00 72.50 69.48 2jxr s THR 268 CO -0.03 0.49 -0.13 0.27 -0.69 0.00 0.00 174.62 174.53 2jxr s ILE 269 N -1.00 1.14 1.02 1.82 -4.36 -0.72 -5.00 121.20 114.10 2jxr s ILE 269 Ca 0.17 -0.54 -0.16 0.00 -0.26 0.00 0.00 60.65 59.85 2jxr s ILE 269 Cb -0.12 -1.01 0.21 0.00 1.25 0.00 0.00 42.46 42.80 2jxr s ILE 269 CO 0.07 0.34 1.23 -0.83 0.24 0.00 0.00 174.94 175.99 2jxr s GLY 270 N 0.23 1.69 0.46 6.27 0.00 -1.26 -1.32 107.32 113.39 2jxr s GLY 270 Ca -0.06 -1.02 0.16 0.00 0.00 0.00 0.00 44.72 43.81 2jxr s GLY 270 CO 0.02 -0.25 2.01 -2.55 0.00 0.00 0.00 173.10 172.33 2jxr h PRO 271 N -1.87 0.00 -0.10 2.90 0.11 -1.87 0.14 132.00 131.31 2jxr h PRO 271 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2jxr h PRO 271 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2jxr h PRO 271 CO 0.41 0.17 0.00 0.66 -0.21 0.00 0.00 178.00 179.03 2jxr n TYR 272 N -4.24 0.13 -0.06 0.65 4.01 -1.26 -2.44 117.16 113.94 2jxr n TYR 272 Ca -0.02 -0.06 -0.13 0.00 -0.16 0.00 0.00 57.90 57.52 2jxr n TYR 272 Cb 0.24 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.22 2jxr n TYR 272 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2jxr n ASP 273 N -0.23 0.89 -0.40 7.72 8.00 -0.28 -4.59 116.55 127.66 2jxr n ASP 273 Ca 0.11 0.15 0.10 0.00 0.71 0.00 0.00 54.79 55.86 2jxr n ASP 273 Cb 0.16 -0.37 0.41 0.00 -0.02 0.00 0.00 41.12 41.29 2jxr n ASP 273 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jxr n TYR 274 N -3.57 0.16 -4.49 1.24 0.18 0.33 -4.77 117.16 106.24 2jxr n TYR 274 Ca -0.25 -0.08 -0.23 0.00 1.88 0.00 0.00 57.90 59.22 2jxr n TYR 274 Cb 0.67 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.53 2jxr n TYR 274 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 2jxr s THR 275 N -1.84 1.62 -0.02 -3.48 -4.23 -1.02 -0.57 115.64 106.10 2jxr s THR 275 Ca 0.30 -2.06 -0.07 0.00 -1.18 0.00 0.00 61.69 58.68 2jxr s THR 275 Cb 0.16 -2.70 0.01 0.00 1.34 0.00 0.00 72.50 71.30 2jxr s THR 275 CO 0.24 -0.13 0.15 -0.22 -0.54 0.00 0.00 174.62 174.12 2jxr s LEU 276 N -3.53 1.50 -0.19 4.79 2.96 0.14 -4.81 118.68 119.54 2jxr s LEU 276 Ca 0.33 -0.04 -0.07 0.00 -0.22 0.00 0.00 54.13 54.13 2jxr s LEU 276 Cb 0.07 0.64 -0.04 0.00 0.50 0.00 0.00 46.19 47.36 2jxr s LEU 276 CO 0.15 -0.27 0.05 -0.70 -1.32 0.00 0.00 176.35 174.25 2jxr s GLU 277 N -0.93 3.86 -0.33 1.98 2.12 -1.26 0.52 118.70 124.66 2jxr s GLU 277 Ca -0.10 -0.40 -0.01 0.00 0.36 0.00 0.00 54.97 54.82 2jxr s GLU 277 Cb -0.06 -3.19 0.11 0.00 0.26 0.00 0.00 34.13 31.25 2jxr s GLU 277 CO 0.01 0.17 0.13 0.14 -0.54 0.00 0.00 175.26 175.16 2jxr s VAL 278 N 0.65 0.85 -1.15 3.70 -7.23 0.68 -4.89 120.40 113.01 2jxr s VAL 278 Ca 0.02 -1.54 -0.07 0.00 -1.81 0.00 0.00 61.98 58.58 2jxr s VAL 278 Cb -0.13 -1.64 -0.03 0.00 0.56 0.00 0.00 36.38 35.14 2jxr s VAL 278 CO 0.02 -0.73 0.86 -1.20 -0.31 0.00 0.00 175.10 173.73 2jxr n SER 279 N 4.64 -4.51 0.00 4.85 7.64 -1.26 -2.19 113.62 122.80 2jxr n SER 279 Ca 0.00 -0.79 0.00 0.00 1.01 0.00 0.00 58.87 59.09 2jxr n SER 279 Cb 0.41 -4.53 0.00 0.00 -1.01 0.00 0.00 64.21 59.07 2jxr n SER 279 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jxr n GLY 280 N -1.39 2.15 3.39 0.23 0.00 -1.26 -5.02 105.19 103.29 2jxr n GLY 280 Ca -0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 2jxr n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jxr s SER 281 N -3.30 4.05 -0.14 1.61 1.04 -0.93 -4.97 113.70 111.05 2jxr s SER 281 Ca 0.00 -0.31 -0.14 0.00 0.48 0.00 0.00 55.95 55.99 2jxr s SER 281 Cb 0.00 -1.55 -0.05 0.00 0.10 0.00 0.00 66.02 64.53 2jxr s SER 281 CO 0.00 0.18 0.31 0.00 0.98 0.00 0.00 173.24 174.71 2jxr s ILE 283 N 0.28 1.25 0.38 0.00 -4.36 0.19 -1.61 121.20 117.32 2jxr s ILE 283 Ca 0.18 -1.25 -0.26 0.00 -0.26 0.00 0.00 60.65 59.06 2jxr s ILE 283 Cb -0.13 -1.16 -0.09 0.00 1.25 0.00 0.00 42.46 42.33 2jxr s ILE 283 CO 0.05 -0.10 1.15 -0.55 0.24 0.00 0.00 174.94 175.73 2jxr s SER 284 N -1.55 6.69 0.00 4.36 0.15 -0.03 0.28 113.70 123.61 2jxr s SER 284 Ca 0.01 2.32 0.21 0.00 0.70 0.00 0.00 55.95 59.19 2jxr s SER 284 Cb -0.09 -2.61 0.53 0.00 -1.71 0.00 0.00 66.02 62.13 2jxr s SER 284 CO 0.02 -0.56 1.45 0.00 1.20 0.00 0.00 173.24 175.35 2jxr n ALA 285 N 0.28 2.44 -2.61 5.45 0.00 0.27 -4.73 120.51 121.61 2jxr n ALA 285 Ca 0.03 -0.88 -0.43 0.00 0.00 0.00 0.00 53.44 52.16 2jxr n ALA 285 Cb 0.46 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.90 2jxr n ALA 285 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jxr s ILE 286 N -1.49 4.69 -0.06 0.00 -1.09 -1.26 -1.96 121.20 120.02 2jxr s ILE 286 Ca 0.37 0.10 0.04 0.00 -2.23 0.00 0.00 60.65 58.93 2jxr s ILE 286 Cb 0.21 -4.34 -0.02 0.00 -1.58 0.00 0.00 42.46 36.73 2jxr s ILE 286 CO 0.29 -0.80 -0.17 -0.89 -1.23 0.00 0.00 174.94 172.14 2jxr s THR 287 N 3.17 2.77 -0.00 2.92 2.01 0.05 -4.90 115.64 121.66 2jxr s THR 287 Ca 0.25 -0.81 -0.24 0.00 0.31 0.00 0.00 61.69 61.19 2jxr s THR 287 Cb -0.14 -2.08 -0.05 0.00 0.01 0.00 0.00 72.50 70.24 2jxr s THR 287 CO 0.18 0.57 0.73 -2.16 -0.69 0.00 0.00 174.62 173.26 2jxr s PRO 288 N -0.39 4.46 -0.27 4.92 0.04 -1.26 0.35 135.00 142.84 2jxr s PRO 288 Ca 0.04 0.98 -0.06 0.00 0.04 0.00 0.00 61.00 61.99 2jxr s PRO 288 Cb -0.12 -3.39 0.14 0.00 0.04 0.00 0.00 34.50 31.16 2jxr s PRO 288 CO 0.02 0.20 0.56 1.41 0.04 0.00 0.00 177.00 179.23 2jxr s MET 289 N 0.28 0.50 -0.14 4.56 1.75 -0.00 -4.85 119.30 121.40 2jxr s MET 289 Ca 0.38 1.17 -0.12 0.00 -1.25 0.00 0.00 55.69 55.87 2jxr s MET 289 Cb -0.19 0.54 -0.05 0.00 2.84 0.00 0.00 34.83 37.97 2jxr s MET 289 CO 0.21 -0.35 0.24 -0.51 -0.65 0.00 0.00 175.02 173.95 2jxr s ASP 290 N 2.79 6.43 -0.14 1.11 1.01 -1.26 -3.60 116.67 123.01 2jxr s ASP 290 Ca 0.03 0.51 -0.11 0.00 0.71 0.00 0.00 52.55 53.69 2jxr s ASP 290 Cb -0.13 -2.15 -0.05 0.00 1.01 0.00 0.00 42.92 41.61 2jxr s ASP 290 CO -0.18 0.22 0.21 -0.36 0.21 0.00 0.00 175.17 175.27 2jxr s PHE 291 N -0.14 3.52 0.45 4.23 0.08 -1.26 -5.02 117.98 119.85 2jxr s PHE 291 Ca 0.15 0.54 -0.23 0.00 0.12 0.00 0.00 56.93 57.51 2jxr s PHE 291 Cb -0.13 -2.15 -0.08 0.00 -0.57 0.00 0.00 43.02 40.10 2jxr s PHE 291 CO 0.04 0.46 1.16 -1.25 -0.10 0.00 0.00 175.22 175.53 2jxr s PRO 292 N -0.23 3.79 0.48 0.24 0.04 -1.26 -3.32 135.00 134.74 2jxr s PRO 292 Ca 0.14 1.75 -0.23 0.00 0.04 0.00 0.00 61.00 62.70 2jxr s PRO 292 Cb -0.12 -2.42 -0.07 0.00 0.04 0.00 0.00 34.50 31.93 2jxr s PRO 292 CO 0.03 -0.52 1.29 -2.00 0.04 0.00 0.00 177.00 175.84 2jxr s GLU 293 N -2.68 3.57 0.00 4.56 2.12 -1.26 -0.69 118.70 124.32 2jxr s GLU 293 Ca 0.63 2.09 0.31 0.00 0.36 0.00 0.00 54.97 58.36 2jxr s GLU 293 Cb -0.28 -2.46 1.64 0.00 0.26 0.00 0.00 34.13 33.29 2jxr s GLU 293 CO 0.34 -0.79 2.10 -0.35 -0.54 0.00 0.00 175.26 176.02 2jxr n PRO 294 N -0.51 0.68 0.03 4.30 -0.04 -1.26 -4.81 135.00 133.39 2jxr n PRO 294 Ca 0.07 -0.03 -0.01 0.00 -0.04 0.00 0.00 63.50 63.49 2jxr n PRO 294 Cb 0.45 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.41 2jxr n PRO 294 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2jxr h VAL 295 N 0.08 0.00 -3.75 0.52 2.07 -1.60 -3.44 116.25 110.13 2jxr h VAL 295 Ca 0.00 -0.04 -0.45 0.00 0.82 0.00 0.00 66.70 67.03 2jxr h VAL 295 Cb 0.19 0.00 0.17 0.00 -1.52 0.00 0.00 31.29 30.13 2jxr h VAL 295 CO 0.00 0.00 0.16 -0.83 0.02 0.00 0.00 177.57 176.92 2jxr s GLY 296 N -1.52 1.56 -0.24 2.17 0.00 0.13 -4.31 107.32 105.11 2jxr s GLY 296 Ca -0.01 -0.31 -0.29 0.00 0.00 0.00 0.00 44.72 44.10 2jxr s GLY 296 CO 0.04 0.32 1.18 2.56 0.00 0.00 0.00 173.10 177.20 2jxr s PRO 297 N -4.86 4.15 -0.04 2.90 0.04 -1.26 -4.20 135.00 131.72 2jxr s PRO 297 Ca 0.66 1.40 0.03 0.00 0.04 0.00 0.00 61.00 63.13 2jxr s PRO 297 Cb -0.20 -3.75 0.00 0.00 0.04 0.00 0.00 34.50 30.60 2jxr s PRO 297 CO 0.59 -0.80 -0.13 -1.17 0.04 0.00 0.00 177.00 175.53 2jxr s LEU 298 N 3.62 1.78 0.38 -3.56 2.96 -1.26 -2.05 118.68 120.54 2jxr s LEU 298 Ca 0.51 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 54.15 2jxr s LEU 298 Cb -0.17 -0.78 -0.02 0.00 0.50 0.00 0.00 46.19 45.72 2jxr s LEU 298 CO 0.14 0.08 0.58 0.00 -1.32 0.00 0.00 176.35 175.83 2jxr s ALA 299 N 0.31 3.83 -0.23 5.97 0.00 0.53 -4.40 121.76 127.76 2jxr s ALA 299 Ca -0.07 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.81 2jxr s ALA 299 Cb -0.12 -2.03 0.06 0.00 0.00 0.00 0.00 23.12 21.03 2jxr s ALA 299 CO 0.02 -0.17 -0.05 0.42 0.00 0.00 0.00 175.76 175.99 2jxr s ILE 300 N -2.38 1.46 -0.95 0.00 1.01 -0.47 -0.30 121.20 119.58 2jxr s ILE 300 Ca 0.44 -1.17 -0.15 0.00 0.00 0.00 0.00 60.65 59.77 2jxr s ILE 300 Cb -0.10 -1.74 0.20 0.00 0.01 0.00 0.00 42.46 40.83 2jxr s ILE 300 CO 0.36 -0.11 1.02 -0.69 0.00 0.00 0.00 174.94 175.51 2jxr s VAL 301 N 1.43 5.33 0.00 2.92 1.01 -0.84 -0.25 120.40 130.00 2jxr s VAL 301 Ca -0.06 -2.37 0.00 0.00 0.00 0.00 0.00 61.98 59.56 2jxr s VAL 301 Cb -0.19 -4.64 0.00 0.00 0.00 0.00 0.00 36.38 31.55 2jxr s VAL 301 CO -0.06 -1.27 0.00 0.61 0.00 0.00 0.00 175.10 174.37 2jxr n GLY 302 N 4.26 -1.30 0.41 4.51 0.00 -0.58 -2.06 105.19 110.43 2jxr n GLY 302 Ca 0.21 -1.61 0.24 0.00 0.00 0.00 0.00 46.02 44.87 2jxr n GLY 302 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2jxr h ASP 303 N -0.15 0.42 -0.49 1.61 3.32 -1.38 -1.23 116.42 118.52 2jxr h ASP 303 Ca 0.00 0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 2jxr h ASP 303 Cb 0.00 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 2jxr h ASP 303 CO 0.00 0.06 0.25 0.00 -1.72 0.00 0.00 179.24 177.83 2jxr h ALA 304 N 1.62 1.45 0.10 3.45 0.00 -1.79 -0.41 119.26 123.69 2jxr h ALA 304 Ca 0.62 -0.11 -0.27 0.00 0.00 0.00 0.00 54.91 55.14 2jxr h ALA 304 Cb 1.61 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2jxr h ALA 304 CO -0.31 0.43 -1.43 0.35 0.00 0.00 0.00 179.25 178.29 2jxr h PHE 305 N 0.74 0.38 0.00 0.00 3.04 -1.65 -3.38 116.94 116.06 2jxr h PHE 305 Ca 0.18 -0.28 -0.04 0.00 3.98 0.00 0.00 57.97 61.82 2jxr h PHE 305 Cb 0.08 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 38.57 2jxr h PHE 305 CO 0.01 1.56 -0.18 -0.07 -2.02 0.00 0.00 178.31 177.61 2jxr h LEU 306 N -0.36 0.00 -2.10 0.59 3.38 -1.16 -2.33 115.31 113.33 2jxr h LEU 306 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2jxr h LEU 306 Cb 1.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.47 2jxr h LEU 306 CO 0.03 0.18 0.00 0.03 0.09 0.00 0.00 178.44 178.76 2jxr h ARG 307 N 0.00 0.00 0.00 1.13 3.08 -1.25 -2.57 114.38 114.77 2jxr h ARG 307 Ca -0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2jxr h ARG 307 Cb 0.44 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 2jxr h ARG 307 CO 0.02 0.00 -1.58 1.63 -1.07 0.00 0.00 179.97 178.97 2jxr n LYS 308 N -2.80 0.64 -4.08 0.04 4.76 -0.88 -4.76 118.16 111.08 2jxr n LYS 308 Ca -0.01 -0.06 -0.33 0.00 -2.87 0.00 0.00 58.31 55.04 2jxr n LYS 308 Cb 0.12 -1.65 -0.15 0.00 -1.84 0.00 0.00 35.03 31.51 2jxr n LYS 308 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2jxr s TYR 309 N -3.45 3.04 0.17 2.13 2.02 -0.97 -0.82 117.35 119.48 2jxr s TYR 309 Ca -0.05 -1.95 -0.32 0.00 -0.37 0.00 0.00 57.07 54.38 2jxr s TYR 309 Cb 0.12 -1.94 -0.11 0.00 -0.40 0.00 0.00 41.96 39.63 2jxr s TYR 309 CO 0.86 -0.83 1.66 -0.47 -1.57 0.00 0.00 175.55 175.20 2jxr s TYR 310 N 1.21 2.87 -0.03 2.71 5.04 0.98 -4.69 117.35 125.43 2jxr s TYR 310 Ca -0.02 0.42 0.02 0.00 -2.44 0.00 0.00 57.07 55.06 2jxr s TYR 310 Cb -0.17 -4.05 -0.03 0.00 0.35 0.00 0.00 41.96 38.07 2jxr s TYR 310 CO -0.08 -3.97 -0.08 -1.54 -1.34 0.00 0.00 175.55 168.53 2jxr s SER 311 N 1.39 4.52 -0.11 4.32 1.04 -0.96 -1.84 113.70 122.06 2jxr s SER 311 Ca 0.73 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 57.06 2jxr s SER 311 Cb -0.46 -1.06 0.02 0.00 0.10 0.00 0.00 66.02 64.61 2jxr s SER 311 CO 0.32 0.32 -0.10 -0.63 0.98 0.00 0.00 173.24 174.14 2jxr s ILE 312 N -0.88 1.15 -0.43 -1.02 1.01 -0.61 0.47 121.20 120.89 2jxr s ILE 312 Ca 0.14 -0.39 -0.09 0.00 0.00 0.00 0.00 60.65 60.31 2jxr s ILE 312 Cb -0.11 -1.12 0.09 0.00 0.01 0.00 0.00 42.46 41.33 2jxr s ILE 312 CO 0.04 0.38 0.27 -0.31 0.00 0.00 0.00 174.94 175.32 2jxr s TYR 313 N 1.41 3.37 -0.89 3.97 1.51 -0.48 -1.62 117.35 124.63 2jxr s TYR 313 Ca 0.00 -1.67 -0.15 0.00 -1.01 0.00 0.00 57.07 54.24 2jxr s TYR 313 Cb -0.13 -3.09 0.20 0.00 -0.11 0.00 0.00 41.96 38.83 2jxr s TYR 313 CO -0.06 -0.89 0.90 0.34 -1.11 0.00 0.00 175.55 174.73 2jxr s ASP 314 N 2.22 6.80 0.31 2.29 -1.08 -0.31 -2.17 116.67 124.72 2jxr s ASP 314 Ca 0.04 -2.64 -0.00 0.00 -0.52 0.00 0.00 52.55 49.42 2jxr s ASP 314 Cb -0.24 -2.26 0.50 0.00 -1.46 0.00 0.00 42.92 39.46 2jxr s ASP 314 CO 0.01 -0.66 1.96 -0.29 0.52 0.00 0.00 175.17 176.71 2jxr h ILE 315 N 4.90 1.16 -0.05 4.11 2.10 -1.66 0.18 117.51 128.25 2jxr h ILE 315 Ca 0.13 -0.36 -0.09 0.00 1.08 0.00 0.00 64.86 65.62 2jxr h ILE 315 Cb 1.02 0.01 -0.01 0.00 -1.09 0.00 0.00 36.82 36.75 2jxr h ILE 315 CO 0.87 0.19 -0.37 1.23 -1.08 0.00 0.00 178.15 178.99 2jxr h GLY 316 N 1.06 0.10 -0.05 8.18 0.00 -1.81 -3.23 103.07 107.31 2jxr h GLY 316 Ca 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.56 2jxr h GLY 316 CO -0.09 0.08 -0.72 0.70 0.00 0.00 0.00 176.54 176.51 2jxr n ASN 317 N -4.08 0.81 -3.27 0.19 5.03 -0.97 -5.01 115.26 107.95 2jxr n ASN 317 Ca -0.02 -0.91 -0.11 0.00 0.87 0.00 0.00 54.58 54.42 2jxr n ASN 317 Cb 0.42 0.96 0.03 0.00 -1.02 0.00 0.00 39.78 40.17 2jxr n ASN 317 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2jxr n ASN 318 N -1.29 -6.85 -3.64 6.41 3.02 0.61 -4.88 115.26 108.64 2jxr n ASN 318 Ca 0.03 -0.47 -0.06 0.00 -0.03 0.00 0.00 54.58 54.05 2jxr n ASN 318 Cb 0.25 -4.65 -0.07 0.00 -0.61 0.00 0.00 39.78 34.71 2jxr n ASN 318 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jxr s ALA 319 N -3.17 -1.94 -0.15 5.41 0.00 -1.13 -1.36 121.76 119.42 2jxr s ALA 319 Ca 0.19 2.40 -0.03 0.00 0.00 0.00 0.00 51.96 54.52 2jxr s ALA 319 Cb -0.04 -1.49 -0.02 0.00 0.00 0.00 0.00 23.12 21.57 2jxr s ALA 319 CO 0.78 -0.42 -0.06 0.54 0.00 0.00 0.00 175.76 176.60 2jxr s VAL 320 N 1.69 3.69 0.23 0.00 0.11 -0.27 -1.16 120.40 124.70 2jxr s VAL 320 Ca -0.10 -0.43 0.08 0.00 -2.93 0.00 0.00 61.98 58.60 2jxr s VAL 320 Cb -0.05 -2.61 -0.04 0.00 -1.53 0.00 0.00 36.38 32.15 2jxr s VAL 320 CO -0.19 0.50 0.07 -0.83 -3.33 0.00 0.00 175.10 171.32 2jxr s GLY 321 N 0.39 1.59 0.03 6.54 0.00 -0.64 -0.92 107.32 114.31 2jxr s GLY 321 Ca -0.05 -1.48 0.03 0.00 0.00 0.00 0.00 44.72 43.21 2jxr s GLY 321 CO 0.03 -1.53 -0.09 1.08 0.00 0.00 0.00 173.10 172.59 2jxr s LEU 322 N -3.54 2.16 0.11 0.66 1.43 0.13 -1.57 118.68 118.05 2jxr s LEU 322 Ca 0.31 -0.39 -0.02 0.00 -1.03 0.00 0.00 54.13 53.00 2jxr s LEU 322 Cb -0.08 -0.36 -0.03 0.00 0.03 0.00 0.00 46.19 45.75 2jxr s LEU 322 CO 0.22 -0.04 0.07 0.00 0.23 0.00 0.00 176.35 176.82 2jxr s ALA 323 N -0.83 0.59 0.05 4.21 0.00 -0.77 0.52 121.76 125.54 2jxr s ALA 323 Ca -0.02 -1.27 -0.31 0.00 0.00 0.00 0.00 51.96 50.36 2jxr s ALA 323 Cb -0.07 0.67 -0.06 0.00 0.00 0.00 0.00 23.12 23.66 2jxr s ALA 323 CO 0.01 -0.47 1.37 0.15 0.00 0.00 0.00 175.76 176.81 2jxr s LYS 324 N -3.99 4.32 0.90 0.00 1.02 -1.25 -0.01 119.74 120.72 2jxr s LYS 324 Ca 0.17 1.97 -0.11 0.00 0.02 0.00 0.00 55.97 58.03 2jxr s LYS 324 Cb 0.07 -3.43 0.13 0.00 -0.52 0.00 0.00 37.83 34.08 2jxr s LYS 324 CO -0.03 -0.48 1.13 0.00 -0.92 0.00 0.00 175.35 175.05 2jxr n ALA 325 N 4.67 -0.73 1.25 5.17 0.00 -0.00 -2.26 120.51 128.60 2jxr n ALA 325 Ca 0.12 -0.51 0.13 0.00 0.00 0.00 0.00 53.44 53.18 2jxr n ALA 325 Cb 0.44 -2.19 0.31 0.00 0.00 0.00 0.00 19.45 18.00 2jxr n ALA 325 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01