#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jxn n ASP 2 N 0.00 2.05 -4.38 -3.46 8.00 -1.26 -4.51 116.55 112.99 1jxn n ASP 2 Ca 0.00 0.03 -0.30 0.00 0.71 0.00 0.00 54.79 55.23 1jxn n ASP 2 Cb 0.00 -0.48 -0.14 0.00 -0.02 0.00 0.00 41.12 40.48 1jxn n ASP 2 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1jxn s ASP 3 N -6.51 3.38 -0.08 -2.24 -0.00 -1.26 -2.08 116.67 107.88 1jxn s ASP 3 Ca -0.31 -0.54 -0.17 0.00 -0.00 0.00 0.00 52.55 51.52 1jxn s ASP 3 Cb 0.10 -0.39 0.04 0.00 -0.00 0.00 0.00 42.92 42.66 1jxn s ASP 3 CO 0.47 0.26 0.42 -0.22 -0.00 0.00 0.00 175.17 176.10 1jxn s LEU 4 N -1.33 0.41 -0.28 1.23 0.20 -0.90 -4.94 118.68 113.08 1jxn s LEU 4 Ca 0.13 0.49 -0.24 0.00 0.69 0.00 0.00 54.13 55.20 1jxn s LEU 4 Cb -0.10 1.56 0.11 0.00 -0.43 0.00 0.00 46.19 47.33 1jxn s LEU 4 CO 0.03 -0.36 0.95 -0.94 -0.29 0.00 0.00 176.35 175.74 1jxn s SER 5 N -0.71 -0.54 -0.15 3.68 1.04 -1.26 0.32 113.70 116.10 1jxn s SER 5 Ca -0.08 1.01 -0.17 0.00 0.48 0.00 0.00 55.95 57.19 1jxn s SER 5 Cb -0.04 1.05 0.04 0.00 0.10 0.00 0.00 66.02 67.18 1jxn s SER 5 CO 0.04 -0.17 0.47 0.72 0.98 0.00 0.00 173.24 175.27 1jxn s PHE 6 N 0.40 -0.49 -0.05 5.02 -0.12 -0.89 -4.99 117.98 116.86 1jxn s PHE 6 Ca 0.01 1.13 0.03 0.00 -0.05 0.00 0.00 56.93 58.05 1jxn s PHE 6 Cb -0.05 0.19 0.00 0.00 -0.63 0.00 0.00 43.02 42.53 1jxn s PHE 6 CO -0.06 -0.30 -0.13 0.21 -0.05 0.00 0.00 175.22 174.89 1jxn s LYS 7 N -0.07 1.52 -0.24 1.99 2.20 -1.26 -2.54 119.74 121.33 1jxn s LYS 7 Ca -0.03 -0.46 -0.02 0.00 -0.36 0.00 0.00 55.97 55.10 1jxn s LYS 7 Cb -0.03 -1.32 0.02 0.00 -1.51 0.00 0.00 37.83 34.99 1jxn s LYS 7 CO 0.02 0.14 -0.06 -0.06 -0.36 0.00 0.00 175.35 175.03 1jxn s PHE 8 N 0.28 3.04 -0.16 4.03 0.08 0.36 -4.96 117.98 120.67 1jxn s PHE 8 Ca -0.07 -1.46 0.18 0.00 0.12 0.00 0.00 56.93 55.71 1jxn s PHE 8 Cb -0.12 -2.07 -0.09 0.00 -0.57 0.00 0.00 43.02 40.17 1jxn s PHE 8 CO 0.02 -0.70 0.91 0.87 -0.10 0.00 0.00 175.22 176.22 1jxn h LYS 9 N 8.03 0.00 0.00 0.44 1.57 -1.91 -1.54 116.57 123.17 1jxn h LYS 9 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 1jxn h LYS 9 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.43 1jxn h LYS 9 CO 0.58 0.21 0.00 -1.71 -0.57 0.00 0.00 179.45 177.96 1jxn n ASN 10 N -2.84 0.00 -3.53 0.86 2.85 -1.26 -4.69 115.26 106.65 1jxn n ASN 10 Ca -0.07 -0.93 -0.09 0.00 -0.11 0.00 0.00 54.58 53.39 1jxn n ASN 10 Cb 0.75 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 41.68 1jxn n ASN 10 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1jxn s PHE 11 N -2.68 -0.77 0.19 1.20 0.40 -1.09 -4.92 117.98 110.30 1jxn s PHE 11 Ca 0.00 1.17 -0.17 0.00 -0.60 0.00 0.00 56.93 57.33 1jxn s PHE 11 Cb 0.00 0.15 -0.08 0.00 0.51 0.00 0.00 43.02 43.60 1jxn s PHE 11 CO 0.00 -0.57 0.63 -1.54 0.70 0.00 0.00 175.22 174.44 1jxn s SER 12 N 2.56 6.92 0.00 1.36 1.04 -1.26 -4.33 113.70 120.00 1jxn s SER 12 Ca 0.05 1.24 0.23 0.00 0.48 0.00 0.00 55.95 57.94 1jxn s SER 12 Cb -0.13 -2.35 1.26 0.00 0.10 0.00 0.00 66.02 64.89 1jxn s SER 12 CO -0.14 0.06 1.73 0.00 0.98 0.00 0.00 173.24 175.87 1jxn n GLN 13 N 0.71 0.54 -0.39 4.02 6.02 -1.26 -2.13 117.38 124.89 1jxn n GLN 13 Ca -0.04 0.04 0.08 0.00 -0.01 0.00 0.00 57.00 57.07 1jxn n GLN 13 Cb 0.52 -1.50 0.22 0.00 1.02 0.00 0.00 30.24 30.50 1jxn n GLN 13 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1jxn n ASN 14 N -1.13 3.34 -4.56 1.08 6.94 -1.26 -5.00 115.26 114.68 1jxn n ASN 14 Ca 0.14 -3.12 -0.35 0.00 -0.02 0.00 0.00 54.58 51.23 1jxn n ASN 14 Cb 0.12 -0.53 0.09 0.00 -2.36 0.00 0.00 39.78 37.11 1jxn n ASN 14 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1jxn n GLY 15 N -0.81 -0.87 0.00 4.83 0.00 -0.91 -4.95 105.19 102.48 1jxn n GLY 15 Ca 0.21 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1jxn n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jxn n LYS 16 N -1.70 0.79 -0.61 1.61 4.76 -1.26 -4.82 118.16 116.92 1jxn n LYS 16 Ca 0.12 -0.72 0.04 0.00 -2.87 0.00 0.00 58.31 54.87 1jxn n LYS 16 Cb 0.50 -0.69 0.20 0.00 -1.84 0.00 0.00 35.03 33.21 1jxn n LYS 16 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1jxn n ASP 17 N -0.14 2.00 -3.74 4.39 3.85 -1.26 -4.98 116.55 116.67 1jxn n ASP 17 Ca 0.00 -3.79 -0.14 0.00 -0.71 0.00 0.00 54.79 50.14 1jxn n ASP 17 Cb 0.35 -0.55 -0.15 0.00 -1.35 0.00 0.00 41.12 39.42 1jxn n ASP 17 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1jxn s LEU 18 N -3.21 0.63 -0.16 -2.12 1.43 -1.26 -1.66 118.68 112.34 1jxn s LEU 18 Ca 0.39 0.28 -0.07 0.00 -1.03 0.00 0.00 54.13 53.71 1jxn s LEU 18 Cb 0.37 0.31 -0.04 0.00 0.03 0.00 0.00 46.19 46.86 1jxn s LEU 18 CO -0.04 -0.16 0.07 -0.94 0.23 0.00 0.00 176.35 175.51 1jxn s SER 19 N 1.33 5.73 0.09 2.29 1.04 -0.79 -4.89 113.70 118.49 1jxn s SER 19 Ca -0.07 0.16 0.07 0.00 0.48 0.00 0.00 55.95 56.59 1jxn s SER 19 Cb -0.12 -1.91 -0.04 0.00 0.10 0.00 0.00 66.02 64.05 1jxn s SER 19 CO -0.06 0.24 -0.11 -0.36 0.98 0.00 0.00 173.24 173.94 1jxn s PHE 20 N -0.05 2.72 0.08 5.02 0.40 -1.26 -1.71 117.98 123.17 1jxn s PHE 20 Ca 0.07 -0.16 0.02 0.00 -0.60 0.00 0.00 56.93 56.25 1jxn s PHE 20 Cb -0.12 -1.44 -0.04 0.00 0.51 0.00 0.00 43.02 41.93 1jxn s PHE 20 CO 0.01 0.40 -0.07 -0.65 0.70 0.00 0.00 175.22 175.61 1jxn s GLN 21 N -2.06 0.72 5.56 0.44 -0.21 -0.31 -4.98 119.66 118.82 1jxn s GLN 21 Ca 0.20 -1.13 0.00 0.00 0.02 0.00 0.00 55.36 54.45 1jxn s GLN 21 Cb -0.11 -0.21 0.00 0.00 1.00 0.00 0.00 33.01 33.69 1jxn s GLN 21 CO 0.12 -0.00 0.00 0.41 -2.12 0.00 0.00 175.29 173.70 1jxn n GLY 22 N 0.47 2.36 2.84 3.09 0.00 -1.26 -1.89 105.19 110.80 1jxn n GLY 22 Ca -0.16 -0.50 -0.29 0.00 0.00 0.00 0.00 46.02 45.07 1jxn n GLY 22 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jxn n ASN 23 N 1.86 4.98 -4.56 1.61 3.02 -0.72 -4.93 115.26 116.52 1jxn n ASN 23 Ca 0.00 -3.70 -0.32 0.00 -0.03 0.00 0.00 54.58 50.54 1jxn n ASN 23 Cb 0.00 -0.64 -0.11 0.00 -0.61 0.00 0.00 39.78 38.42 1jxn n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jxn s ALA 24 N -3.62 2.90 -0.20 5.41 0.00 -1.22 -2.99 121.76 122.04 1jxn s ALA 24 Ca 0.48 -1.07 -0.36 0.00 0.00 0.00 0.00 51.96 51.01 1jxn s ALA 24 Cb 0.29 -1.02 0.14 0.00 0.00 0.00 0.00 23.12 22.53 1jxn s ALA 24 CO -0.15 0.60 1.25 -1.54 0.00 0.00 0.00 175.76 175.92 1jxn s SER 25 N -1.43 -0.11 0.38 0.00 1.04 0.73 -4.67 113.70 109.64 1jxn s SER 25 Ca 0.16 -0.01 -0.24 0.00 0.48 0.00 0.00 55.95 56.35 1jxn s SER 25 Cb -0.11 0.12 -0.10 0.00 0.10 0.00 0.00 66.02 66.03 1jxn s SER 25 CO 0.07 -0.19 0.95 -0.69 0.98 0.00 0.00 173.24 174.36 1jxn s VAL 26 N -2.34 4.26 0.47 5.02 1.01 -1.26 -0.98 120.40 126.58 1jxn s VAL 26 Ca 0.10 1.63 0.05 0.00 0.00 0.00 0.00 61.98 63.76 1jxn s VAL 26 Cb -0.01 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 1jxn s VAL 26 CO -0.04 -0.09 0.14 0.27 0.00 0.00 0.00 175.10 175.38 1jxn s ILE 27 N -1.89 1.76 0.47 2.22 -4.36 0.14 -4.86 121.20 114.68 1jxn s ILE 27 Ca 0.56 -1.81 0.17 0.00 -0.26 0.00 0.00 60.65 59.32 1jxn s ILE 27 Cb -0.14 -2.57 0.34 0.00 1.25 0.00 0.00 42.46 41.34 1jxn s ILE 27 CO 0.19 0.00 2.00 -0.33 0.24 0.00 0.00 174.94 177.04 1jxn h GLU 28 N 1.33 0.25 -0.24 0.37 5.08 -1.94 0.47 114.58 119.90 1jxn h GLU 28 Ca -0.42 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1jxn h GLU 28 Cb 1.28 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1jxn h GLU 28 CO 0.71 0.17 0.00 0.25 -1.00 0.00 0.00 179.01 179.13 1jxn n THR 29 N -4.45 0.03 -1.22 1.13 -2.24 -1.26 -4.83 114.28 101.42 1jxn n THR 29 Ca 0.08 -0.02 -0.08 0.00 -2.27 0.00 0.00 64.05 61.77 1jxn n THR 29 Cb 0.40 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.49 1jxn n THR 29 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jxn n GLY 30 N 0.41 0.93 3.84 3.38 0.00 0.15 -5.00 105.19 108.90 1jxn n GLY 30 Ca 0.00 -0.36 -0.37 0.00 0.00 0.00 0.00 46.02 45.29 1jxn n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jxn s VAL 31 N -2.12 5.27 -0.66 1.61 1.01 -1.24 -2.68 120.40 121.58 1jxn s VAL 31 Ca 0.00 0.53 -0.25 0.00 0.00 0.00 0.00 61.98 62.26 1jxn s VAL 31 Cb 0.00 -3.57 0.05 0.00 0.00 0.00 0.00 36.38 32.86 1jxn s VAL 31 CO 0.00 0.57 1.09 -0.22 0.00 0.00 0.00 175.10 176.53 1jxn s LEU 32 N -0.83 3.84 -0.21 3.92 2.96 -0.62 -0.69 118.68 127.06 1jxn s LEU 32 Ca 0.19 -0.62 -0.19 0.00 -0.22 0.00 0.00 54.13 53.29 1jxn s LEU 32 Cb -0.14 -2.59 -0.03 0.00 0.50 0.00 0.00 46.19 43.93 1jxn s LEU 32 CO 0.08 -1.55 0.55 -1.58 -1.32 0.00 0.00 176.35 172.53 1jxn s GLN 33 N 4.69 4.17 0.22 1.98 0.74 -0.15 -0.35 119.66 130.96 1jxn s GLN 33 Ca 0.29 0.45 0.18 0.00 0.05 0.00 0.00 55.36 56.33 1jxn s GLN 33 Cb -0.12 -3.58 0.03 0.00 1.10 0.00 0.00 33.01 30.43 1jxn s GLN 33 CO 0.14 -0.22 1.21 -0.07 -0.55 0.00 0.00 175.29 175.81 1jxn h LEU 34 N 8.19 0.00 -7.30 3.68 3.38 -1.59 0.21 115.31 121.87 1jxn h LEU 34 Ca -0.32 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.54 1jxn h LEU 34 Cb 1.15 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.67 1jxn h LEU 34 CO 0.75 0.39 -0.18 0.54 0.09 0.00 0.00 178.44 180.03 1jxn s ASN 35 N -6.05 -0.42 0.06 -0.43 4.22 -1.25 -0.44 114.94 110.62 1jxn s ASN 35 Ca 0.02 0.71 -0.05 0.00 -2.14 0.00 0.00 52.86 51.39 1jxn s ASN 35 Cb 0.08 0.75 -0.05 0.00 1.28 0.00 0.00 41.25 43.31 1jxn s ASN 35 CO 0.76 -0.26 0.30 -0.54 -2.04 0.00 0.00 177.10 175.32 1jxn s LYS 36 N -0.22 3.58 0.40 3.55 1.02 -1.16 -4.47 119.74 122.44 1jxn s LYS 36 Ca -0.04 -0.11 0.07 0.00 0.02 0.00 0.00 55.97 55.92 1jxn s LYS 36 Cb -0.03 -3.01 -0.07 0.00 -0.52 0.00 0.00 37.83 34.20 1jxn s LYS 36 CO 0.02 0.59 0.07 0.14 -0.92 0.00 0.00 175.35 175.25 1jxn s VAL 37 N -1.43 2.19 0.00 3.17 -7.23 -1.26 -4.87 120.40 110.97 1jxn s VAL 37 Ca 0.32 -1.89 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 1jxn s VAL 37 Cb -0.13 -2.97 0.00 0.00 0.56 0.00 0.00 36.38 33.85 1jxn s VAL 37 CO 0.20 -0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.57 1jxn n GLY 38 N -1.06 -0.68 3.85 2.32 0.00 -1.26 -5.03 105.19 103.32 1jxn n GLY 38 Ca -0.03 -2.04 -0.29 0.00 0.00 0.00 0.00 46.02 43.65 1jxn n GLY 38 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jxn s ASN 39 N -4.00 4.44 -1.22 1.61 0.01 -1.26 -4.51 114.94 110.02 1jxn s ASN 39 Ca 0.00 1.01 -0.06 0.00 -0.71 0.00 0.00 52.86 53.09 1jxn s ASN 39 Cb 0.00 -1.63 -0.01 0.00 0.41 0.00 0.00 41.25 40.01 1jxn s ASN 39 CO 0.00 -1.97 0.77 0.59 -1.51 0.00 0.00 177.10 174.98 1jxn n ASN 40 N -3.39 -3.20 -3.96 -1.22 3.02 -1.26 -5.02 115.26 100.22 1jxn n ASN 40 Ca 0.07 -0.85 -0.09 0.00 -0.03 0.00 0.00 54.58 53.68 1jxn n ASN 40 Cb 0.59 -4.12 -0.11 0.00 -0.61 0.00 0.00 39.78 35.53 1jxn n ASN 40 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1jxn s LEU 41 N -6.38 2.16 0.78 3.41 1.43 -1.26 -5.15 118.68 113.66 1jxn s LEU 41 Ca 0.20 -0.42 -0.11 0.00 -1.03 0.00 0.00 54.13 52.78 1jxn s LEU 41 Cb -0.05 0.14 0.06 0.00 0.03 0.00 0.00 46.19 46.36 1jxn s LEU 41 CO 0.81 -0.27 1.09 -2.16 0.23 0.00 0.00 176.35 176.05 1jxn s PRO 42 N -1.29 2.19 0.32 1.29 0.04 -1.26 -4.89 135.00 131.40 1jxn s PRO 42 Ca -0.14 1.14 0.10 0.00 0.04 0.00 0.00 61.00 62.14 1jxn s PRO 42 Cb -0.09 -1.89 0.92 0.00 0.04 0.00 0.00 34.50 33.48 1jxn s PRO 42 CO -0.01 -1.68 1.70 -0.44 0.04 0.00 0.00 177.00 176.61 1jxn h ASP 43 N -1.15 0.55 -3.46 6.66 3.45 -1.99 -3.23 116.42 117.23 1jxn h ASP 43 Ca -0.44 0.16 -0.70 0.00 0.43 0.00 0.00 57.03 56.48 1jxn h ASP 43 Cb 1.23 0.09 -0.33 0.00 -0.56 0.00 0.00 39.33 39.76 1jxn h ASP 43 CO 0.52 -0.00 -0.52 -1.61 -1.57 0.00 0.00 179.24 176.05 1jxn s GLU 44 N -5.76 2.12 0.24 3.56 2.02 -1.26 -1.17 118.70 118.44 1jxn s GLU 44 Ca -0.11 -1.78 0.11 0.00 0.02 0.00 0.00 54.97 53.21 1jxn s GLU 44 Cb 0.28 -3.64 -0.05 0.00 0.10 0.00 0.00 34.13 30.83 1jxn s GLU 44 CO 0.79 -1.08 -0.13 -0.08 0.02 0.00 0.00 175.26 174.78 1jxn s THR 45 N 1.19 2.86 0.00 3.63 -1.32 -1.22 -4.46 115.64 116.33 1jxn s THR 45 Ca 0.07 -2.06 0.00 0.00 -1.21 0.00 0.00 61.69 58.49 1jxn s THR 45 Cb -0.23 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.28 1jxn s THR 45 CO -0.03 -0.29 0.00 0.61 -2.21 0.00 0.00 174.62 172.70 1jxn n GLY 46 N -0.42 -0.64 3.25 6.08 0.00 -1.26 -2.50 105.19 109.71 1jxn n GLY 46 Ca -0.08 -1.03 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 1jxn n GLY 46 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jxn s GLY 47 N 0.00 -0.13 0.04 -0.02 0.00 0.41 -1.76 107.32 105.86 1jxn s GLY 47 Ca 0.00 0.03 0.08 0.00 0.00 0.00 0.00 44.72 44.84 1jxn s GLY 47 CO 0.00 -0.19 -0.23 -0.42 0.00 0.00 0.00 173.10 172.26 1jxn s ILE 48 N -2.51 2.39 -0.17 0.90 1.01 -0.79 -1.19 121.20 120.83 1jxn s ILE 48 Ca -0.05 -1.31 -0.04 0.00 0.00 0.00 0.00 60.65 59.25 1jxn s ILE 48 Cb -0.01 -1.96 0.08 0.00 0.01 0.00 0.00 42.46 40.58 1jxn s ILE 48 CO -0.03 0.36 0.18 0.00 0.00 0.00 0.00 174.94 175.45 1jxn s ALA 49 N -0.85 -0.09 0.20 9.38 0.00 -0.39 -1.16 121.76 128.84 1jxn s ALA 49 Ca 0.13 0.19 0.10 0.00 0.00 0.00 0.00 51.96 52.37 1jxn s ALA 49 Cb -0.10 -1.16 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 1jxn s ALA 49 CO 0.03 -1.08 -0.19 -0.98 0.00 0.00 0.00 175.76 173.54 1jxn s ARG 50 N 2.28 1.40 0.23 0.00 1.70 -0.70 -0.84 118.95 123.02 1jxn s ARG 50 Ca 0.05 -1.52 -0.31 0.00 -0.47 0.00 0.00 55.73 53.48 1jxn s ARG 50 Cb -0.15 -1.47 -0.11 0.00 -0.57 0.00 0.00 34.95 32.65 1jxn s ARG 50 CO -0.10 0.29 1.59 -0.47 -1.08 0.00 0.00 175.30 175.53 1jxn s TYR 51 N -2.19 2.91 0.47 5.89 6.14 -0.49 -1.89 117.35 128.20 1jxn s TYR 51 Ca 0.20 0.69 0.19 0.00 0.64 0.00 0.00 57.07 58.78 1jxn s TYR 51 Cb -0.05 -4.00 1.17 0.00 0.42 0.00 0.00 41.96 39.50 1jxn s TYR 51 CO 0.09 -3.55 1.97 0.97 0.64 0.00 0.00 175.55 175.67 1jxn h ILE 52 N 3.67 0.80 -3.12 3.14 6.09 -1.66 -3.42 117.51 123.01 1jxn h ILE 52 Ca -0.45 -0.09 -0.61 0.00 -1.37 0.00 0.00 64.86 62.34 1jxn h ILE 52 Cb 1.21 0.52 -0.10 0.00 0.47 0.00 0.00 36.82 38.92 1jxn h ILE 52 CO 0.86 0.05 -0.45 0.00 -3.07 0.00 0.00 178.15 175.54 1jxn s ALA 53 N -5.26 3.71 0.26 0.18 0.00 -1.26 -5.00 121.76 114.40 1jxn s ALA 53 Ca -0.07 -0.62 -0.30 0.00 0.00 0.00 0.00 51.96 50.98 1jxn s ALA 53 Cb 0.20 -2.18 -0.09 0.00 0.00 0.00 0.00 23.12 21.05 1jxn s ALA 53 CO 0.75 0.26 1.24 -2.14 0.00 0.00 0.00 175.76 175.87 1jxn s PRO 54 N 0.02 4.45 0.15 0.00 0.02 -1.26 -4.80 135.00 133.57 1jxn s PRO 54 Ca 0.12 2.02 -0.21 0.00 0.02 0.00 0.00 61.00 62.94 1jxn s PRO 54 Cb -0.12 -3.16 -0.08 0.00 0.02 0.00 0.00 34.50 31.16 1jxn s PRO 54 CO 0.01 -0.10 0.68 0.42 -0.33 0.00 0.00 177.00 177.68 1jxn s ILE 55 N -0.58 4.58 -0.81 2.83 -1.09 0.24 -4.84 121.20 121.52 1jxn s ILE 55 Ca 0.51 1.37 -0.23 0.00 -2.23 0.00 0.00 60.65 60.07 1jxn s ILE 55 Cb -0.36 -3.96 0.07 0.00 -1.58 0.00 0.00 42.46 36.63 1jxn s ILE 55 CO 0.43 0.43 1.19 -2.28 -1.23 0.00 0.00 174.94 173.48 1jxn s HIS 56 N -1.26 2.61 0.00 3.97 2.46 -1.26 -1.05 115.29 120.76 1jxn s HIS 56 Ca 0.36 -0.63 -0.19 0.00 0.47 0.00 0.00 55.06 55.07 1jxn s HIS 56 Cb -0.20 -4.48 -0.29 0.00 -0.13 0.00 0.00 32.58 27.49 1jxn s HIS 56 CO 0.22 -1.81 1.02 0.97 -2.47 0.00 0.00 174.74 172.67 1jxn h ILE 57 N 6.15 1.41 -3.17 0.89 6.09 -1.51 -3.45 117.51 123.93 1jxn h ILE 57 Ca -0.09 -2.40 -0.13 0.00 -1.37 0.00 0.00 64.86 60.87 1jxn h ILE 57 Cb 1.04 2.88 -0.21 0.00 0.47 0.00 0.00 36.82 41.00 1jxn h ILE 57 CO 1.25 0.70 -0.36 -1.66 -3.07 0.00 0.00 178.15 175.02 1jxn s TRP 58 N -2.82 -0.15 -0.34 2.19 1.48 -1.15 -2.40 118.94 115.76 1jxn s TRP 58 Ca -0.12 0.26 -0.12 0.00 -1.06 0.00 0.00 56.10 55.06 1jxn s TRP 58 Cb 0.03 0.06 -0.01 0.00 -1.16 0.00 0.00 33.47 32.39 1jxn s TRP 58 CO 0.87 -0.31 0.21 1.21 -4.06 0.00 0.00 176.95 174.86 1jxn s ASN 59 N -1.04 5.86 0.00 -2.66 3.84 -0.35 -4.70 114.94 115.90 1jxn s ASN 59 Ca -0.11 -0.52 0.21 0.00 0.21 0.00 0.00 52.86 52.65 1jxn s ASN 59 Cb -0.05 -2.08 1.10 0.00 -0.55 0.00 0.00 41.25 39.66 1jxn s ASN 59 CO 0.03 -0.24 1.67 0.00 -2.79 0.00 0.00 177.10 175.77 1jxn n ASN 61 N -1.24 2.25 0.04 0.00 4.13 -1.26 -4.57 115.26 114.62 1jxn n ASN 61 Ca 0.11 -0.05 -0.04 0.00 1.68 0.00 0.00 54.58 56.29 1jxn n ASN 61 Cb 0.15 -0.38 -0.09 0.00 -1.54 0.00 0.00 39.78 37.92 1jxn n ASN 61 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 1jxn h THR 62 N -0.13 0.96 0.00 3.41 1.35 -2.00 -3.47 112.91 113.02 1jxn h THR 62 Ca -0.48 -2.58 0.00 0.00 -0.55 0.00 0.00 66.41 62.80 1jxn h THR 62 Cb 1.68 2.41 0.00 0.00 -1.73 0.00 0.00 68.15 70.51 1jxn h THR 62 CO -0.12 0.55 0.00 0.61 -0.25 0.00 0.00 175.52 176.31 1jxn n GLY 63 N 1.40 1.57 3.73 5.82 0.00 0.82 -5.03 105.19 113.50 1jxn n GLY 63 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 1jxn n GLY 63 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jxn n GLU 64 N -2.00 1.69 -4.76 1.61 -0.58 -1.23 -4.77 120.64 110.60 1jxn n GLU 64 Ca 0.00 0.62 -0.28 0.00 -0.42 0.00 0.00 57.16 57.08 1jxn n GLU 64 Cb 0.00 -2.53 -0.14 0.00 -0.57 0.00 0.00 31.44 28.20 1jxn n GLU 64 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1jxn s LEU 65 N -3.13 2.17 -0.19 -4.62 0.20 -1.26 -1.21 118.68 110.65 1jxn s LEU 65 Ca 0.70 -0.56 -0.11 0.00 0.69 0.00 0.00 54.13 54.85 1jxn s LEU 65 Cb -0.43 -1.13 -0.05 0.00 -0.43 0.00 0.00 46.19 44.15 1jxn s LEU 65 CO 0.50 0.21 0.16 0.00 -0.29 0.00 0.00 176.35 176.93 1jxn s ALA 66 N -0.81 3.68 0.35 5.97 0.00 -1.01 -4.63 121.76 125.30 1jxn s ALA 66 Ca 0.10 -0.65 -0.11 0.00 0.00 0.00 0.00 51.96 51.30 1jxn s ALA 66 Cb -0.09 -2.20 -0.07 0.00 0.00 0.00 0.00 23.12 20.75 1jxn s ALA 66 CO 0.02 0.16 0.71 -1.12 0.00 0.00 0.00 175.76 175.54 1jxn s SER 67 N 0.33 6.61 0.12 0.00 0.01 -0.55 -4.65 113.70 115.56 1jxn s SER 67 Ca 0.10 1.12 -0.14 0.00 1.31 0.00 0.00 55.95 58.34 1jxn s SER 67 Cb -0.11 -2.31 0.02 0.00 0.21 0.00 0.00 66.02 63.83 1jxn s SER 67 CO -0.01 -0.28 0.34 0.72 0.41 0.00 0.00 173.24 174.42 1jxn s PHE 68 N -2.16 -0.07 -0.05 2.43 -0.71 -0.80 -2.02 117.98 114.59 1jxn s PHE 68 Ca 0.51 -0.28 -0.06 0.00 -1.04 0.00 0.00 56.93 56.05 1jxn s PHE 68 Cb -0.10 0.16 0.01 0.00 -1.21 0.00 0.00 43.02 41.88 1jxn s PHE 68 CO 0.26 -0.66 0.16 -1.50 -1.34 0.00 0.00 175.22 172.14 1jxn s ILE 69 N -3.83 0.01 -0.07 -4.49 2.07 -0.93 -0.50 121.20 113.47 1jxn s ILE 69 Ca 0.04 -0.09 -0.09 0.00 -1.41 0.00 0.00 60.65 59.11 1jxn s ILE 69 Cb 0.03 -0.27 0.02 0.00 0.13 0.00 0.00 42.46 42.37 1jxn s ILE 69 CO -0.11 -0.05 0.23 0.28 -1.91 0.00 0.00 174.94 173.38 1jxn s THR 70 N -0.10 0.02 0.02 4.00 -1.32 -0.62 -1.22 115.64 116.42 1jxn s THR 70 Ca -0.02 -0.15 0.01 0.00 -1.21 0.00 0.00 61.69 60.32 1jxn s THR 70 Cb -0.02 -0.38 -0.01 0.00 -1.51 0.00 0.00 72.50 70.58 1jxn s THR 70 CO 0.00 -0.08 -0.04 -0.94 -2.21 0.00 0.00 174.62 171.35 1jxn s SER 71 N -0.25 0.43 -0.03 8.08 1.04 -0.70 -0.99 113.70 121.29 1jxn s SER 71 Ca -0.04 -0.34 -0.29 0.00 0.48 0.00 0.00 55.95 55.76 1jxn s SER 71 Cb -0.03 0.03 0.08 0.00 0.10 0.00 0.00 66.02 66.20 1jxn s SER 71 CO 0.01 -0.14 0.72 0.72 0.98 0.00 0.00 173.24 175.52 1jxn s PHE 72 N -0.89 -0.58 -0.08 5.02 -0.12 -0.77 0.16 117.98 120.71 1jxn s PHE 72 Ca -0.08 0.88 0.02 0.00 -0.05 0.00 0.00 56.93 57.70 1jxn s PHE 72 Cb -0.06 0.45 -0.02 0.00 -0.63 0.00 0.00 43.02 42.75 1jxn s PHE 72 CO -0.00 -0.61 -0.12 -1.12 -0.05 0.00 0.00 175.22 173.32 1jxn s SER 73 N -1.51 4.19 0.15 1.98 0.01 -1.25 -0.36 113.70 116.90 1jxn s SER 73 Ca -0.07 -0.19 -0.00 0.00 1.31 0.00 0.00 55.95 57.00 1jxn s SER 73 Cb -0.00 -1.17 -0.04 0.00 0.21 0.00 0.00 66.02 65.01 1jxn s SER 73 CO 0.04 0.29 0.04 0.72 0.41 0.00 0.00 173.24 174.74 1jxn s PHE 74 N -0.39 1.00 0.14 2.43 -0.12 -0.28 0.80 117.98 121.57 1jxn s PHE 74 Ca 0.05 -1.17 -0.06 0.00 -0.05 0.00 0.00 56.93 55.70 1jxn s PHE 74 Cb -0.12 -0.57 -0.02 0.00 -0.63 0.00 0.00 43.02 41.68 1jxn s PHE 74 CO 0.02 -0.41 0.18 -0.59 -0.05 0.00 0.00 175.22 174.37 1jxn s PHE 75 N -3.91 0.52 0.11 3.49 -0.71 -0.78 -1.16 117.98 115.54 1jxn s PHE 75 Ca 0.25 -0.91 0.06 0.00 -1.04 0.00 0.00 56.93 55.28 1jxn s PHE 75 Cb 0.07 -0.22 -0.04 0.00 -1.21 0.00 0.00 43.02 41.63 1jxn s PHE 75 CO 0.03 -0.61 -0.14 -1.64 -1.34 0.00 0.00 175.22 171.52 1jxn s MET 76 N -3.98 0.98 -0.02 1.99 -1.94 -1.26 -2.15 119.30 112.92 1jxn s MET 76 Ca 0.17 -1.19 0.00 0.00 -1.71 0.00 0.00 55.69 52.97 1jxn s MET 76 Cb 0.05 -0.88 0.02 0.00 2.01 0.00 0.00 34.83 36.03 1jxn s MET 76 CO -0.02 0.17 0.00 -1.21 -0.01 0.00 0.00 175.02 173.96 1jxn s GLU 77 N -2.52 0.14 0.02 2.03 2.02 -0.83 0.44 118.70 120.00 1jxn s GLU 77 Ca 0.07 0.06 -0.01 0.00 0.02 0.00 0.00 54.97 55.11 1jxn s GLU 77 Cb -0.06 -0.29 -0.02 0.00 0.10 0.00 0.00 34.13 33.87 1jxn s GLU 77 CO 0.03 -0.08 -0.01 -0.08 0.02 0.00 0.00 175.26 175.14 1jxn s THR 78 N 0.65 0.10 -0.15 3.63 -1.32 -1.26 -1.31 115.64 115.98 1jxn s THR 78 Ca -0.06 -0.83 -0.12 0.00 -1.21 0.00 0.00 61.69 59.47 1jxn s THR 78 Cb -0.09 -0.27 -0.24 0.00 -1.51 0.00 0.00 72.50 70.40 1jxn s THR 78 CO -0.01 -0.46 0.31 -1.54 -2.21 0.00 0.00 174.62 170.70 1jxn n SER 79 N 1.67 2.03 -0.92 8.08 3.41 -1.26 -4.97 113.62 121.66 1jxn n SER 79 Ca -0.23 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1jxn n SER 79 Cb 0.55 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 1jxn n SER 79 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jxn n ALA 80 N -3.16 0.00 -0.61 7.33 0.00 -1.26 -4.98 120.51 117.83 1jxn n ALA 80 Ca -0.32 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 52.98 1jxn n ALA 80 Cb 0.92 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.29 1jxn n ALA 80 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1jxn n ASN 81 N -1.21 -0.16 0.06 0.00 2.85 -1.26 -4.87 115.26 110.66 1jxn n ASN 81 Ca 0.00 -0.04 -0.13 0.00 -0.11 0.00 0.00 54.58 54.30 1jxn n ASN 81 Cb 0.00 -0.31 -0.08 0.00 1.24 0.00 0.00 39.78 40.63 1jxn n ASN 81 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1jxn h PRO 82 N 4.72 -0.08 0.00 1.20 0.11 -1.94 -1.89 132.00 134.12 1jxn h PRO 82 Ca -0.01 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 1jxn h PRO 82 Cb 0.50 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.63 1jxn h PRO 82 CO 0.60 0.04 -0.00 0.87 -0.21 0.00 0.00 178.00 179.30 1jxn h LYS 83 N -0.18 0.00 -0.26 1.05 6.56 -1.95 -0.66 116.57 121.14 1jxn h LYS 83 Ca -0.01 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.58 1jxn h LYS 83 Cb 0.15 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.81 1jxn h LYS 83 CO 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 179.45 177.41 1jxn n ALA 84 N -2.16 2.39 -1.76 3.86 0.00 -1.01 -4.99 120.51 116.84 1jxn n ALA 84 Ca -0.03 -0.90 -0.39 0.00 0.00 0.00 0.00 53.44 52.12 1jxn n ALA 84 Cb 0.08 -0.64 -0.04 0.00 0.00 0.00 0.00 19.45 18.85 1jxn n ALA 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jxn s ALA 85 N -1.27 3.32 0.27 0.00 0.00 -0.26 -4.81 121.76 119.01 1jxn s ALA 85 Ca 0.28 0.84 0.10 0.00 0.00 0.00 0.00 51.96 53.18 1jxn s ALA 85 Cb 0.17 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 1jxn s ALA 85 CO 0.24 -0.17 -0.05 0.95 0.00 0.00 0.00 175.76 176.72 1jxn s THR 86 N -1.29 3.19 0.00 0.00 -4.23 -0.75 -4.22 115.64 108.34 1jxn s THR 86 Ca 0.48 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 1jxn s THR 86 Cb -0.29 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 70.84 1jxn s THR 86 CO 0.37 -0.38 0.00 0.47 -0.54 0.00 0.00 174.62 174.54 1jxn n ASP 87 N -0.83 2.50 0.00 3.99 9.92 0.75 -4.12 116.55 128.76 1jxn n ASP 87 Ca -0.06 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.20 1jxn n ASP 87 Cb 0.59 0.42 0.00 0.00 -0.64 0.00 0.00 41.12 41.49 1jxn n ASP 87 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1jxn n GLY 88 N 1.41 0.53 3.47 0.44 0.00 -0.87 -1.28 105.19 108.89 1jxn n GLY 88 Ca 0.00 -2.18 -0.26 0.00 0.00 0.00 0.00 46.02 43.58 1jxn n GLY 88 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1jxn n LEU 89 N 0.00 0.00 -3.53 0.99 -0.00 -1.07 -1.35 117.00 112.05 1jxn n LEU 89 Ca 0.00 -3.25 -0.15 0.00 -0.00 0.00 0.00 56.01 52.62 1jxn n LEU 89 Cb 0.00 1.13 -0.05 0.00 -0.00 0.00 0.00 43.42 44.50 1jxn n LEU 89 CO 0.00 -0.50 0.35 -0.89 -0.00 0.00 0.00 177.39 176.35 1jxn s THR 90 N -3.17 0.01 -0.13 1.47 2.01 0.46 -1.99 115.64 114.30 1jxn s THR 90 Ca 0.23 -0.11 0.02 0.00 0.31 0.00 0.00 61.69 62.14 1jxn s THR 90 Cb 0.01 -0.98 -0.00 0.00 0.01 0.00 0.00 72.50 71.54 1jxn s THR 90 CO 0.17 -0.06 -0.19 0.12 -0.69 0.00 0.00 174.62 173.97 1jxn s PHE 91 N -2.23 2.70 0.05 4.92 2.19 -1.07 -1.93 117.98 122.61 1jxn s PHE 91 Ca -0.06 -1.03 -0.04 0.00 0.33 0.00 0.00 56.93 56.13 1jxn s PHE 91 Cb -0.01 -1.82 -0.02 0.00 -1.31 0.00 0.00 43.02 39.87 1jxn s PHE 91 CO 0.00 -0.44 0.06 -0.59 1.83 0.00 0.00 175.22 176.08 1jxn s PHE 92 N 0.60 0.30 -0.07 10.12 -0.71 -0.80 -0.98 117.98 126.43 1jxn s PHE 92 Ca -0.11 -0.69 0.04 0.00 -1.04 0.00 0.00 56.93 55.14 1jxn s PHE 92 Cb -0.16 -0.21 -0.01 0.00 -1.21 0.00 0.00 43.02 41.42 1jxn s PHE 92 CO 0.03 -0.37 -0.21 -0.51 -1.34 0.00 0.00 175.22 172.82 1jxn s LEU 93 N -2.39 2.31 0.11 -1.99 1.02 -0.49 -2.17 118.68 115.08 1jxn s LEU 93 Ca -0.01 -0.42 -0.26 0.00 0.02 0.00 0.00 54.13 53.46 1jxn s LEU 93 Cb 0.02 -1.45 0.08 0.00 0.02 0.00 0.00 46.19 44.86 1jxn s LEU 93 CO -0.07 0.25 1.06 0.00 0.02 0.00 0.00 176.35 177.61 1jxn s ALA 94 N -0.17 -1.81 0.08 4.21 0.00 -1.15 -1.91 121.76 121.02 1jxn s ALA 94 Ca -0.03 0.19 -0.32 0.00 0.00 0.00 0.00 51.96 51.80 1jxn s ALA 94 Cb -0.14 0.59 -0.12 0.00 0.00 0.00 0.00 23.12 23.46 1jxn s ALA 94 CO 0.04 -1.05 1.80 -2.30 0.00 0.00 0.00 175.76 174.24 1jxn n PRO 95 N -0.52 2.52 0.27 0.00 -0.02 -1.26 -0.62 135.00 135.37 1jxn n PRO 95 Ca -0.06 0.92 0.12 0.00 -2.02 0.00 0.00 63.50 62.45 1jxn n PRO 95 Cb 0.61 -2.78 0.51 0.00 -0.02 0.00 0.00 33.50 31.82 1jxn n PRO 95 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1jxn h PRO 96 N 8.19 0.00 -0.45 0.52 0.13 -1.84 0.84 132.00 139.39 1jxn h PRO 96 Ca -0.47 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.58 1jxn h PRO 96 Cb 1.24 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.32 1jxn h PRO 96 CO 0.93 0.00 0.06 -0.40 -0.23 0.00 0.00 178.00 178.37 1jxn n ASP 97 N -2.87 4.22 -4.75 1.44 3.85 -1.26 -4.90 116.55 112.28 1jxn n ASP 97 Ca 0.02 -3.17 -0.41 0.00 -0.71 0.00 0.00 54.79 50.52 1jxn n ASP 97 Cb 0.70 -0.63 -0.04 0.00 -1.35 0.00 0.00 41.12 39.80 1jxn n ASP 97 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 1jxn s SER 98 N -1.62 7.22 0.99 -1.12 1.04 0.29 -5.02 113.70 115.48 1jxn s SER 98 Ca 0.48 2.23 -0.12 0.00 0.48 0.00 0.00 55.95 59.01 1jxn s SER 98 Cb 0.39 -2.62 0.18 0.00 0.10 0.00 0.00 66.02 64.08 1jxn s SER 98 CO 0.10 -0.22 1.10 -2.16 0.98 0.00 0.00 173.24 173.04 1jxn s PRO 99 N -0.91 0.48 -0.04 4.02 0.04 -1.26 -5.01 135.00 132.32 1jxn s PRO 99 Ca 0.48 0.45 -0.22 0.00 0.04 0.00 0.00 61.00 61.75 1jxn s PRO 99 Cb -0.32 -1.75 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 1jxn s PRO 99 CO 0.39 -2.68 0.65 -1.17 0.04 0.00 0.00 177.00 174.23 1jxn s LEU 100 N -6.41 4.36 0.00 -3.56 1.98 -1.26 -4.92 118.68 108.87 1jxn s LEU 100 Ca 0.65 1.18 0.00 0.00 -2.89 0.00 0.00 54.13 53.07 1jxn s LEU 100 Cb -0.18 -3.01 0.00 0.00 0.66 0.00 0.00 46.19 43.66 1jxn s LEU 100 CO 0.57 -0.02 0.00 0.54 -1.89 0.00 0.00 176.35 175.55 1jxn n ARG 101 N 3.32 0.40 -2.89 1.98 1.74 0.37 -5.06 116.66 116.53 1jxn n ARG 101 Ca -0.04 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.64 1jxn n ARG 101 Cb 0.51 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.91 1jxn n ARG 101 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1jxn s ARG 102 N 4.13 4.54 0.00 5.56 3.52 -1.12 -4.75 118.95 130.84 1jxn s ARG 102 Ca 0.00 1.18 0.00 0.00 -0.13 0.00 0.00 55.73 56.78 1jxn s ARG 102 Cb 0.00 -3.39 0.00 0.00 -1.56 0.00 0.00 34.95 30.00 1jxn s ARG 102 CO 0.00 0.19 0.00 0.00 -0.81 0.00 0.00 175.30 174.68 1jxn n ALA 103 N 3.08 0.00 -0.15 6.12 0.00 -1.26 -0.13 120.51 128.17 1jxn n ALA 103 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1jxn n ALA 103 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1jxn n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jxn n GLY 104 N 5.00 1.25 0.07 0.00 0.00 -1.25 -3.06 105.19 107.20 1jxn n GLY 104 Ca 0.00 -0.55 0.11 0.00 0.00 0.00 0.00 46.02 45.58 1jxn n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jxn n GLY 105 N 0.00 -1.26 0.39 -0.02 0.00 -1.26 -2.55 105.19 100.48 1jxn n GLY 105 Ca 0.00 0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.16 1jxn n GLY 105 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1jxn n TYR 106 N -1.93 0.00 -0.54 1.61 4.02 -1.17 -4.96 117.16 114.18 1jxn n TYR 106 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 1jxn n TYR 106 Cb 0.25 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.50 1jxn n TYR 106 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1jxn n PHE 107 N -0.21 0.00 0.00 -0.72 3.01 -1.06 -2.55 117.46 115.93 1jxn n PHE 107 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.60 1jxn n PHE 107 Cb 0.38 -1.41 0.00 0.00 -0.01 0.00 0.00 39.48 38.44 1jxn n PHE 107 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jxn n GLY 108 N -1.93 1.98 0.10 1.37 0.00 0.82 -4.26 105.19 103.27 1jxn n GLY 108 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1jxn n GLY 108 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1jxn h LEU 109 N 0.00 0.33 -8.76 0.99 3.38 -1.65 0.11 115.31 109.70 1jxn h LEU 109 Ca 0.00 -0.42 -0.65 0.00 0.09 0.00 0.00 57.88 56.90 1jxn h LEU 109 Cb 0.00 -0.11 -0.24 0.00 0.09 0.00 0.00 40.66 40.40 1jxn h LEU 109 CO 0.00 1.34 -0.86 -0.36 0.09 0.00 0.00 178.44 178.65 1jxn s PHE 110 N -2.64 2.14 -2.29 1.13 0.08 -1.19 -4.81 117.98 110.41 1jxn s PHE 110 Ca -0.06 -0.40 0.26 0.00 0.12 0.00 0.00 56.93 56.85 1jxn s PHE 110 Cb 0.07 -1.22 0.64 0.00 -0.57 0.00 0.00 43.02 41.94 1jxn s PHE 110 CO 0.85 0.21 1.50 0.27 -0.10 0.00 0.00 175.22 177.95 1jxn n ASN 111 N 1.38 1.71 -3.36 1.36 0.23 -1.26 -2.78 115.26 112.54 1jxn n ASN 111 Ca -0.18 -1.40 0.04 0.00 -0.53 0.00 0.00 54.58 52.51 1jxn n ASN 111 Cb 0.53 0.12 0.01 0.00 -2.08 0.00 0.00 39.78 38.35 1jxn n ASN 111 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1jxn n ASP 112 N 0.10 -0.79 0.10 0.53 3.85 -1.26 -4.80 116.55 114.27 1jxn n ASP 112 Ca 0.14 -1.02 0.13 0.00 -0.71 0.00 0.00 54.79 53.33 1jxn n ASP 112 Cb 0.41 1.19 0.45 0.00 -1.35 0.00 0.00 41.12 41.82 1jxn n ASP 112 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 1jxn n THR 113 N -0.77 0.60 -1.90 2.12 -1.04 -1.26 -4.66 114.28 107.37 1jxn n THR 113 Ca 0.05 -0.11 -0.42 0.00 -2.04 0.00 0.00 64.05 61.53 1jxn n THR 113 Cb 0.45 -0.73 -0.03 0.00 -1.82 0.00 0.00 70.33 68.20 1jxn n THR 113 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1jxn s LYS 114 N -3.14 4.20 0.01 -2.82 1.02 -1.26 -4.65 119.74 113.11 1jxn s LYS 114 Ca 0.09 2.41 -0.22 0.00 0.02 0.00 0.00 55.97 58.28 1jxn s LYS 114 Cb 0.12 -3.11 -0.05 0.00 -0.52 0.00 0.00 37.83 34.26 1jxn s LYS 114 CO 0.53 -0.59 0.65 0.00 -0.92 0.00 0.00 175.35 175.01 1jxn s ASP 116 N -0.17 0.19 0.62 0.00 3.68 -0.79 -5.02 116.67 115.19 1jxn s ASP 116 Ca 0.33 0.06 0.40 0.00 2.13 0.00 0.00 52.55 55.48 1jxn s ASP 116 Cb -0.19 -0.06 2.05 0.00 -1.45 0.00 0.00 42.92 43.27 1jxn s ASP 116 CO 0.19 -0.15 2.24 0.28 0.13 0.00 0.00 175.17 177.86 1jxn h SER 117 N 7.44 0.00 0.89 -0.34 0.02 -1.97 -2.88 113.55 116.72 1jxn h SER 117 Ca -0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1jxn h SER 117 Cb 1.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1jxn h SER 117 CO 0.44 0.00 0.00 0.77 -1.14 0.00 0.00 176.83 176.90 1jxn h SER 118 N 0.00 0.00 -0.41 3.07 4.64 -1.95 -2.93 113.55 115.97 1jxn h SER 118 Ca -0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1jxn h SER 118 Cb 0.18 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 1jxn h SER 118 CO 0.00 0.00 0.14 1.88 -0.87 0.00 0.00 176.83 177.98 1jxn h TYR 119 N 0.00 0.70 -6.69 4.77 0.05 -1.85 -3.46 116.97 110.48 1jxn h TYR 119 Ca 0.00 -0.04 -0.54 0.00 0.05 0.00 0.00 58.73 58.20 1jxn h TYR 119 Cb 0.45 -0.21 -0.12 0.00 1.01 0.00 0.00 36.73 37.86 1jxn h TYR 119 CO 0.00 0.58 -0.90 1.04 -1.05 0.00 0.00 178.16 177.82 1jxn n GLN 120 N -4.32 -2.61 -5.11 4.88 6.02 -1.11 -4.52 117.38 110.62 1jxn n GLN 120 Ca 0.03 0.31 -0.31 0.00 -0.01 0.00 0.00 57.00 57.03 1jxn n GLN 120 Cb 0.19 -4.33 -0.15 0.00 1.02 0.00 0.00 30.24 26.97 1jxn n GLN 120 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1jxn s THR 121 N -4.00 2.28 -0.18 5.09 2.01 -1.26 -4.13 115.64 115.45 1jxn s THR 121 Ca 0.09 -1.12 -0.05 0.00 0.31 0.00 0.00 61.69 60.92 1jxn s THR 121 Cb -0.05 -1.84 0.07 0.00 0.01 0.00 0.00 72.50 70.69 1jxn s THR 121 CO 0.92 0.52 0.11 -0.69 -0.69 0.00 0.00 174.62 174.79 1jxn s VAL 122 N -0.70 -0.13 0.06 3.82 1.01 -0.80 -2.03 120.40 121.62 1jxn s VAL 122 Ca 0.11 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 61.97 1jxn s VAL 122 Cb -0.10 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.64 1jxn s VAL 122 CO 0.00 -0.29 -0.19 0.00 0.00 0.00 0.00 175.10 174.62 1jxn s ALA 123 N 2.17 1.64 -0.49 5.51 0.00 -0.70 -1.39 121.76 128.50 1jxn s ALA 123 Ca 0.03 -1.06 -0.10 0.00 0.00 0.00 0.00 51.96 50.83 1jxn s ALA 123 Cb -0.16 -0.28 0.12 0.00 0.00 0.00 0.00 23.12 22.80 1jxn s ALA 123 CO -0.11 0.35 0.38 0.08 0.00 0.00 0.00 175.76 176.45 1jxn s VAL 124 N -0.91 4.40 0.38 0.00 1.01 -0.15 0.03 120.40 125.17 1jxn s VAL 124 Ca 0.06 -1.75 -0.11 0.00 0.00 0.00 0.00 61.98 60.18 1jxn s VAL 124 Cb -0.09 -3.88 -0.07 0.00 0.00 0.00 0.00 36.38 32.34 1jxn s VAL 124 CO 0.02 -0.80 0.75 -1.83 0.00 0.00 0.00 175.10 173.25 1jxn s GLU 125 N 1.39 3.81 -0.53 2.72 -1.05 0.16 -2.60 118.70 122.60 1jxn s GLU 125 Ca 0.05 0.48 0.04 0.00 -0.15 0.00 0.00 54.97 55.39 1jxn s GLU 125 Cb -0.27 -2.41 0.16 0.00 -0.44 0.00 0.00 34.13 31.17 1jxn s GLU 125 CO -0.00 0.01 0.37 -0.06 0.95 0.00 0.00 175.26 176.53 1jxn s PHE 126 N -2.28 2.35 -0.24 4.83 0.40 -0.84 -1.25 117.98 120.94 1jxn s PHE 126 Ca 0.51 -2.76 -0.26 0.00 -0.60 0.00 0.00 56.93 53.82 1jxn s PHE 126 Cb -0.10 -1.93 0.00 0.00 0.51 0.00 0.00 43.02 41.50 1jxn s PHE 126 CO 0.29 -0.70 0.92 0.34 0.70 0.00 0.00 175.22 176.76 1jxn s ASP 127 N -0.44 6.94 0.04 1.36 3.68 0.18 -2.59 116.67 125.84 1jxn s ASP 127 Ca 0.25 1.16 0.24 0.00 2.13 0.00 0.00 52.55 56.32 1jxn s ASP 127 Cb -0.08 -2.48 0.22 0.00 -1.45 0.00 0.00 42.92 39.12 1jxn s ASP 127 CO -0.12 -0.60 1.19 0.35 0.13 0.00 0.00 175.17 176.12 1jxn n THR 128 N 5.32 0.11 -3.64 1.71 -2.24 -0.40 -0.01 114.28 115.13 1jxn n THR 128 Ca 0.08 -0.13 -0.24 0.00 -2.27 0.00 0.00 64.05 61.49 1jxn n THR 128 Cb 0.47 0.27 -0.17 0.00 -2.10 0.00 0.00 70.33 68.80 1jxn n THR 128 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1jxn s ILE 129 N -3.10 -0.04 0.00 2.28 1.10 -1.26 -4.45 121.20 115.73 1jxn s ILE 129 Ca 0.07 0.03 0.00 0.00 -0.51 0.00 0.00 60.65 60.24 1jxn s ILE 129 Cb 0.16 -0.45 0.00 0.00 0.15 0.00 0.00 42.46 42.32 1jxn s ILE 129 CO 0.76 -0.09 0.00 0.61 -2.11 0.00 0.00 174.94 174.11 1jxn n GLY 130 N 5.27 3.61 3.74 1.50 0.00 -1.26 -4.52 105.19 113.52 1jxn n GLY 130 Ca -0.06 -1.97 -0.37 0.00 0.00 0.00 0.00 46.02 43.62 1jxn n GLY 130 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jxn s SER 131 N -0.29 4.80 0.00 1.61 0.15 0.13 -1.42 113.70 118.67 1jxn s SER 131 Ca 0.00 2.66 0.30 0.00 0.70 0.00 0.00 55.95 59.61 1jxn s SER 131 Cb 0.00 -2.62 1.40 0.00 -1.71 0.00 0.00 66.02 63.09 1jxn s SER 131 CO 0.00 -1.88 1.98 -0.81 1.20 0.00 0.00 173.24 173.73 1jxn n PRO 132 N -1.66 0.43 -0.04 5.44 -0.04 -1.26 -4.20 135.00 133.67 1jxn n PRO 132 Ca 0.14 -0.05 -0.12 0.00 -0.04 0.00 0.00 63.50 63.44 1jxn n PRO 132 Cb 0.47 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.37 1jxn n PRO 132 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1jxn h VAL 133 N 0.12 1.22 -3.54 0.52 2.07 -1.86 -3.33 116.25 111.45 1jxn h VAL 133 Ca 0.00 -0.69 -0.72 0.00 0.82 0.00 0.00 66.70 66.11 1jxn h VAL 133 Cb 0.33 1.41 -0.33 0.00 -1.52 0.00 0.00 31.29 31.18 1jxn h VAL 133 CO 0.00 0.20 -0.17 0.20 0.02 0.00 0.00 177.57 177.82 1jxn s ASN 134 N -5.66 5.79 0.16 0.57 0.02 -0.51 -4.99 114.94 110.32 1jxn s ASN 134 Ca -0.14 -3.10 -0.22 0.00 -1.02 0.00 0.00 52.86 48.38 1jxn s ASN 134 Cb 0.06 -1.95 0.04 0.00 0.02 0.00 0.00 41.25 39.42 1jxn s ASN 134 CO 0.70 -0.35 1.32 0.33 0.02 0.00 0.00 177.10 179.12 1jxn n PHE 135 N 3.21 -0.22 0.00 2.20 7.35 -1.25 -1.61 117.46 127.14 1jxn n PHE 135 Ca 0.13 1.06 0.00 0.00 -0.76 0.00 0.00 57.45 57.88 1jxn n PHE 135 Cb 0.39 -0.67 0.00 0.00 0.35 0.00 0.00 39.48 39.56 1jxn n PHE 135 CO 0.00 0.00 0.00 -2.67 -0.76 0.00 0.00 176.76 173.33 1jxn n TRP 136 N -5.14 0.00 -4.04 -5.13 2.14 -1.26 -4.62 117.44 99.39 1jxn n TRP 136 Ca 0.04 0.00 -0.22 0.00 2.07 0.00 0.00 57.50 59.40 1jxn n TRP 136 Cb 0.27 -0.26 -0.05 0.00 -0.81 0.00 0.00 31.31 30.46 1jxn n TRP 136 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1jxn s ASP 137 N -2.52 5.28 1.07 -0.67 -0.00 -0.63 -4.80 116.67 114.40 1jxn s ASP 137 Ca 0.00 -0.41 -0.12 0.00 -0.00 0.00 0.00 52.55 52.02 1jxn s ASP 137 Cb 0.00 -1.16 0.23 0.00 -0.00 0.00 0.00 42.92 41.99 1jxn s ASP 137 CO 0.00 -0.15 1.06 -2.16 -0.00 0.00 0.00 175.17 173.93 1jxn s PRO 138 N -3.87 -0.16 -1.34 8.23 0.04 -1.26 -3.09 135.00 133.55 1jxn s PRO 138 Ca 0.35 0.68 -0.08 0.00 0.04 0.00 0.00 61.00 62.00 1jxn s PRO 138 Cb -0.07 -1.66 -0.04 0.00 0.04 0.00 0.00 34.50 32.77 1jxn s PRO 138 CO 0.25 -3.17 2.87 0.41 0.04 0.00 0.00 177.00 177.40 1jxn n GLY 139 N -0.24 4.40 0.00 0.56 0.00 -1.26 -0.70 105.19 107.95 1jxn n GLY 139 Ca 0.04 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1jxn n GLY 139 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1jxn n PHE 140 N 2.85 0.00 -1.91 1.61 -1.74 -1.26 -4.91 117.46 112.11 1jxn n PHE 140 Ca 0.70 0.00 -0.39 0.00 -0.56 0.00 0.00 57.45 57.20 1jxn n PHE 140 Cb 0.32 0.00 0.02 0.00 1.52 0.00 0.00 39.48 41.33 1jxn n PHE 140 CO 0.00 0.00 0.00 -1.25 -0.56 0.00 0.00 176.76 174.95 1jxn s PRO 141 N -2.00 3.59 0.32 3.97 0.04 -1.26 -4.16 135.00 135.51 1jxn s PRO 141 Ca 0.00 2.23 -0.12 0.00 0.04 0.00 0.00 61.00 63.15 1jxn s PRO 141 Cb 0.00 -2.53 0.05 0.00 0.04 0.00 0.00 34.50 32.06 1jxn s PRO 141 CO 0.00 -0.82 0.65 -2.39 0.04 0.00 0.00 177.00 174.47 1jxn n HIS 142 N -0.40 -2.12 -5.15 0.56 1.44 0.98 -0.21 115.22 110.33 1jxn n HIS 142 Ca 0.07 -1.52 -0.29 0.00 -2.01 0.00 0.00 57.72 53.97 1jxn n HIS 142 Cb 0.44 0.76 -0.16 0.00 0.12 0.00 0.00 29.99 31.15 1jxn n HIS 142 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1jxn s ILE 143 N -2.26 1.85 0.17 0.61 1.01 -0.27 0.50 121.20 122.81 1jxn s ILE 143 Ca 0.13 -0.98 -0.13 0.00 0.00 0.00 0.00 60.65 59.67 1jxn s ILE 143 Cb -0.04 -1.55 0.01 0.00 0.01 0.00 0.00 42.46 40.89 1jxn s ILE 143 CO 0.10 0.52 0.39 -0.83 0.00 0.00 0.00 174.94 175.12 1jxn s GLY 144 N -0.32 0.14 -0.29 6.18 0.00 -0.38 -0.43 107.32 112.21 1jxn s GLY 144 Ca 0.03 -0.51 -0.08 0.00 0.00 0.00 0.00 44.72 44.16 1jxn s GLY 144 CO 0.01 -0.54 0.11 -0.42 0.00 0.00 0.00 173.10 172.26 1jxn s ILE 145 N -3.91 4.32 -0.28 0.90 1.01 -1.03 0.40 121.20 122.62 1jxn s ILE 145 Ca 0.12 -0.45 -0.11 0.00 0.00 0.00 0.00 60.65 60.21 1jxn s ILE 145 Cb 0.01 -3.17 -0.05 0.00 0.01 0.00 0.00 42.46 39.27 1jxn s ILE 145 CO -0.03 0.14 0.20 -1.81 0.00 0.00 0.00 174.94 173.44 1jxn s ASP 146 N 1.58 6.04 -0.32 3.58 1.11 0.10 -1.44 116.67 127.33 1jxn s ASP 146 Ca 0.04 0.02 0.02 0.00 0.18 0.00 0.00 52.55 52.81 1jxn s ASP 146 Cb -0.17 -2.12 0.08 0.00 1.07 0.00 0.00 42.92 41.78 1jxn s ASP 146 CO 0.04 -0.05 0.01 -0.69 1.18 0.00 0.00 175.17 175.67 1jxn s VAL 147 N 1.70 2.49 -1.61 -1.27 1.01 -1.26 -1.71 120.40 119.76 1jxn s VAL 147 Ca 0.07 -1.91 0.00 0.00 0.00 0.00 0.00 61.98 60.15 1jxn s VAL 147 Cb -0.16 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.59 1jxn s VAL 147 CO 0.10 -0.34 0.00 0.59 0.00 0.00 0.00 175.10 175.46 1jxn n ASN 148 N 4.42 -4.68 -3.58 3.32 3.02 -0.86 -4.91 115.26 111.99 1jxn n ASN 148 Ca -0.06 0.25 -0.11 0.00 -0.03 0.00 0.00 54.58 54.63 1jxn n ASN 148 Cb 0.42 -4.07 -0.05 0.00 -0.61 0.00 0.00 39.78 35.46 1jxn n ASN 148 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jxn n VAL 150 N 0.91 0.79 -3.32 0.00 3.14 -1.26 -4.53 118.33 114.07 1jxn n VAL 150 Ca -0.11 0.15 -0.39 0.00 -2.96 0.00 0.00 64.34 61.02 1jxn n VAL 150 Cb 0.58 -1.07 -0.08 0.00 -1.06 0.00 0.00 33.84 32.21 1jxn n VAL 150 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 1jxn s LYS 151 N -3.28 4.07 0.82 1.45 2.20 -1.26 -4.98 119.74 118.76 1jxn s LYS 151 Ca 0.05 0.20 -0.11 0.00 -0.36 0.00 0.00 55.97 55.75 1jxn s LYS 151 Cb 0.10 -3.63 0.09 0.00 -1.51 0.00 0.00 37.83 32.87 1jxn s LYS 151 CO 0.42 -0.27 1.14 -1.12 -0.36 0.00 0.00 175.35 175.16 1jxn s SER 152 N 1.50 3.75 -0.05 1.43 0.01 -1.26 -4.59 113.70 114.49 1jxn s SER 152 Ca 0.19 2.11 -0.17 0.00 1.31 0.00 0.00 55.95 59.39 1jxn s SER 152 Cb -0.16 -2.56 -0.31 0.00 0.21 0.00 0.00 66.02 63.21 1jxn s SER 152 CO 0.09 -2.55 0.78 -0.29 0.41 0.00 0.00 173.24 171.68 1jxn h ILE 153 N -1.23 1.21 -3.31 1.44 6.09 -1.63 -3.47 117.51 116.62 1jxn h ILE 153 Ca -0.44 -2.53 -0.14 0.00 -1.37 0.00 0.00 64.86 60.38 1jxn h ILE 153 Cb 1.26 2.95 -0.21 0.00 0.47 0.00 0.00 36.82 41.29 1jxn h ILE 153 CO 0.47 0.76 -0.41 0.21 -3.07 0.00 0.00 178.15 176.10 1jxn s ASN 154 N -7.19 -0.08 0.21 2.19 2.47 -1.26 -5.06 114.94 106.21 1jxn s ASN 154 Ca -0.15 -0.02 -0.06 0.00 0.42 0.00 0.00 52.86 53.05 1jxn s ASN 154 Cb 0.03 0.28 -0.02 0.00 -1.45 0.00 0.00 41.25 40.09 1jxn s ASN 154 CO 0.84 -0.35 0.27 0.00 -3.72 0.00 0.00 177.10 174.14 1jxn s ALA 155 N -1.15 0.50 -0.08 1.71 0.00 -1.26 -2.45 121.76 119.03 1jxn s ALA 155 Ca -0.12 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 50.51 1jxn s ALA 155 Cb -0.06 1.18 0.04 0.00 0.00 0.00 0.00 23.12 24.28 1jxn s ALA 155 CO 0.02 -0.69 0.17 -1.21 0.00 0.00 0.00 175.76 174.06 1jxn s GLU 156 N -4.08 0.11 -0.07 0.00 0.41 0.42 -4.97 118.70 110.52 1jxn s GLU 156 Ca 0.29 0.42 -0.35 0.00 -0.41 0.00 0.00 54.97 54.93 1jxn s GLU 156 Cb 0.04 -0.17 -0.12 0.00 -1.78 0.00 0.00 34.13 32.09 1jxn s GLU 156 CO 0.09 -0.17 1.82 -2.13 -0.49 0.00 0.00 175.26 174.37 1jxn n ARG 157 N 4.29 2.05 -4.21 1.61 0.63 -1.26 -1.11 116.66 118.65 1jxn n ARG 157 Ca -0.25 0.75 -0.33 0.00 -0.92 0.00 0.00 57.85 57.10 1jxn n ARG 157 Cb 0.52 -2.57 -0.16 0.00 0.45 0.00 0.00 32.46 30.71 1jxn n ARG 157 CO 0.00 0.00 0.00 -0.46 -2.51 0.00 0.00 177.63 174.66 1jxn s TRP 158 N 3.52 2.80 -0.90 -0.14 -0.00 0.71 -4.87 118.94 120.06 1jxn s TRP 158 Ca 0.91 -1.38 -0.19 0.00 -0.00 0.00 0.00 56.10 55.45 1jxn s TRP 158 Cb -0.73 -1.94 0.13 0.00 -0.00 0.00 0.00 33.47 30.93 1jxn s TRP 158 CO 0.51 -0.68 1.07 -0.80 -0.00 0.00 0.00 176.95 177.05 1jxn s ASN 159 N 1.19 6.60 0.43 5.86 0.02 -1.26 -4.10 114.94 123.68 1jxn s ASN 159 Ca 0.02 -2.03 -0.26 0.00 -1.02 0.00 0.00 52.86 49.57 1jxn s ASN 159 Cb -0.14 -2.38 -0.09 0.00 0.02 0.00 0.00 41.25 38.66 1jxn s ASN 159 CO -0.08 -1.04 1.45 -1.59 0.02 0.00 0.00 177.10 175.86 1jxn s LYS 160 N 2.54 3.79 0.04 -0.60 -2.85 -1.26 -5.06 119.74 116.33 1jxn s LYS 160 Ca 0.30 2.47 0.06 0.00 -1.00 0.00 0.00 55.97 57.80 1jxn s LYS 160 Cb -0.06 -2.73 -0.02 0.00 -2.06 0.00 0.00 37.83 32.95 1jxn s LYS 160 CO -0.08 -0.75 -0.17 1.03 0.10 0.00 0.00 175.35 175.48 1jxn s ARG 161 N -2.37 1.14 0.40 1.78 0.52 -1.26 -5.01 118.95 114.16 1jxn s ARG 161 Ca 0.59 -0.82 0.07 0.00 -0.52 0.00 0.00 55.73 55.06 1jxn s ARG 161 Cb -0.45 -1.20 -0.06 0.00 0.52 0.00 0.00 34.95 33.77 1jxn s ARG 161 CO 0.58 0.30 0.10 0.71 0.02 0.00 0.00 175.30 177.01 1jxn s TYR 162 N -0.79 2.57 0.00 -0.53 1.51 -1.26 -4.65 117.35 114.20 1jxn s TYR 162 Ca 0.04 -0.60 0.00 0.00 -1.01 0.00 0.00 57.07 55.50 1jxn s TYR 162 Cb -0.08 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 39.93 1jxn s TYR 162 CO 0.01 0.32 0.00 0.41 -1.11 0.00 0.00 175.55 175.18 1jxn n GLY 163 N -1.10 0.88 0.28 0.71 0.00 0.17 -4.31 105.19 101.82 1jxn n GLY 163 Ca -0.03 -1.67 0.14 0.00 0.00 0.00 0.00 46.02 44.46 1jxn n GLY 163 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jxn h LEU 164 N 0.00 0.00 -2.51 0.99 5.85 -1.98 -1.38 115.31 116.28 1jxn h LEU 164 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1jxn h LEU 164 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1jxn h LEU 164 CO 0.00 0.07 0.00 -0.55 -0.34 0.00 0.00 178.44 177.62 1jxn h ASN 165 N 0.00 0.00 -2.17 1.25 -1.07 -1.94 -3.25 115.58 108.40 1jxn h ASN 165 Ca -0.00 0.00 -0.58 0.00 0.07 0.00 0.00 56.30 55.79 1jxn h ASN 165 Cb 0.20 0.00 -0.41 0.00 -2.07 0.00 0.00 38.32 36.03 1jxn h ASN 165 CO 0.01 0.00 -0.74 0.59 0.07 0.00 0.00 177.43 177.36 1jxn n ASN 166 N -2.89 3.10 -4.77 6.14 4.13 -0.52 -4.99 115.26 115.46 1jxn n ASN 166 Ca -0.02 -3.34 -0.40 0.00 1.68 0.00 0.00 54.58 52.49 1jxn n ASN 166 Cb 0.08 -0.63 -0.02 0.00 -1.54 0.00 0.00 39.78 37.67 1jxn n ASN 166 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1jxn s VAL 167 N -2.75 2.84 -0.06 2.41 1.01 -1.23 -4.79 120.40 117.83 1jxn s VAL 167 Ca 0.41 0.82 0.05 0.00 0.00 0.00 0.00 61.98 63.26 1jxn s VAL 167 Cb 0.20 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.06 1jxn s VAL 167 CO -0.06 0.18 -0.22 0.00 0.00 0.00 0.00 175.10 175.00 1jxn s ALA 168 N -1.18 2.31 -0.23 5.51 0.00 -0.31 -4.05 121.76 123.81 1jxn s ALA 168 Ca 0.50 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 51.35 1jxn s ALA 168 Cb -0.38 -0.79 -0.04 0.00 0.00 0.00 0.00 23.12 21.91 1jxn s ALA 168 CO 0.50 0.42 0.12 -0.80 0.00 0.00 0.00 175.76 176.00 1jxn s ASN 169 N -0.21 5.74 0.02 0.00 0.02 -0.68 -1.12 114.94 118.71 1jxn s ASN 169 Ca -0.01 0.01 0.05 0.00 -1.02 0.00 0.00 52.86 51.89 1jxn s ASN 169 Cb -0.13 -2.03 -0.03 0.00 0.02 0.00 0.00 41.25 39.08 1jxn s ASN 169 CO 0.03 0.05 -0.12 -0.69 0.02 0.00 0.00 177.10 176.40 1jxn s VAL 170 N 1.11 3.24 -0.08 1.60 1.01 0.51 -1.50 120.40 126.29 1jxn s VAL 170 Ca 0.06 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 1jxn s VAL 170 Cb -0.14 -2.39 0.04 0.00 0.00 0.00 0.00 36.38 33.89 1jxn s VAL 170 CO 0.04 0.36 0.17 -0.70 0.00 0.00 0.00 175.10 174.97 1jxn s GLU 171 N -1.46 0.09 -0.05 2.72 2.12 -0.94 -1.84 118.70 119.34 1jxn s GLU 171 Ca 0.16 0.48 0.06 0.00 0.36 0.00 0.00 54.97 56.04 1jxn s GLU 171 Cb -0.11 -0.19 -0.01 0.00 0.26 0.00 0.00 34.13 34.08 1jxn s GLU 171 CO 0.07 -0.22 -0.25 0.42 -0.54 0.00 0.00 175.26 174.74 1jxn s ILE 172 N 1.63 2.07 -0.04 -3.70 1.01 -0.16 -1.54 121.20 120.47 1jxn s ILE 172 Ca -0.05 -1.07 0.01 0.00 0.00 0.00 0.00 60.65 59.54 1jxn s ILE 172 Cb -0.12 -1.74 0.02 0.00 0.01 0.00 0.00 42.46 40.64 1jxn s ILE 172 CO -0.06 0.57 -0.03 0.27 0.00 0.00 0.00 174.94 175.68 1jxn s ILE 173 N -0.22 0.45 -0.28 2.92 -5.25 -0.20 -1.59 121.20 117.03 1jxn s ILE 173 Ca -0.02 -0.07 -0.02 0.00 -0.99 0.00 0.00 60.65 59.55 1jxn s ILE 173 Cb -0.13 -0.50 0.04 0.00 2.95 0.00 0.00 42.46 44.82 1jxn s ILE 173 CO 0.03 0.21 -0.01 -0.47 -1.79 0.00 0.00 174.94 172.90 1jxn s TYR 174 N 0.97 3.17 -0.48 1.37 5.04 0.35 -1.15 117.35 126.62 1jxn s TYR 174 Ca -0.10 -1.64 -0.22 0.00 -2.44 0.00 0.00 57.07 52.67 1jxn s TYR 174 Cb -0.14 -2.11 0.04 0.00 0.35 0.00 0.00 41.96 40.10 1jxn s TYR 174 CO -0.00 -0.75 0.73 -2.00 -1.34 0.00 0.00 175.55 172.19 1jxn s GLU 175 N 1.31 3.27 0.22 4.97 -6.30 0.02 -1.91 118.70 120.28 1jxn s GLU 175 Ca -0.02 -0.43 -0.09 0.00 -2.50 0.00 0.00 54.97 51.93 1jxn s GLU 175 Cb -0.18 -4.01 0.26 0.00 0.00 0.00 0.00 34.13 30.20 1jxn s GLU 175 CO -0.02 -1.19 1.81 0.00 0.02 0.00 0.00 175.26 175.88 1jxn h ALA 176 N 9.03 0.94 -0.37 6.30 0.00 -1.87 0.24 119.26 133.53 1jxn h ALA 176 Ca -0.26 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1jxn h ALA 176 Cb 1.09 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1jxn h ALA 176 CO 0.97 0.07 0.14 0.66 0.00 0.00 0.00 179.25 181.09 1jxn h SER 177 N 0.72 0.52 -0.04 0.00 4.64 -1.93 -2.97 113.55 114.48 1jxn h SER 177 Ca 0.31 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1jxn h SER 177 Cb 0.20 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1jxn h SER 177 CO -0.19 0.56 0.00 -1.54 -0.87 0.00 0.00 176.83 174.79 1jxn n SER 178 N -4.66 2.26 -2.02 4.97 3.41 -1.21 -4.95 113.62 111.43 1jxn n SER 178 Ca -0.01 -1.75 -0.15 0.00 -0.26 0.00 0.00 58.87 56.70 1jxn n SER 178 Cb 0.15 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 1jxn n SER 178 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1jxn n LYS 179 N 0.76 -1.75 -2.95 4.33 5.02 0.80 -4.89 118.16 119.48 1jxn n LYS 179 Ca 0.17 0.80 -0.42 0.00 -2.02 0.00 0.00 58.31 56.84 1jxn n LYS 179 Cb 0.47 -5.28 -0.05 0.00 -0.02 0.00 0.00 35.03 30.16 1jxn n LYS 179 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1jxn s THR 180 N -2.56 4.84 -0.31 -0.18 2.01 -0.84 -1.78 115.64 116.83 1jxn s THR 180 Ca 0.00 1.34 -0.09 0.00 0.31 0.00 0.00 61.69 63.24 1jxn s THR 180 Cb 0.00 -4.10 -0.00 0.00 0.01 0.00 0.00 72.50 68.41 1jxn s THR 180 CO 0.00 -0.13 0.14 -0.22 -0.69 0.00 0.00 174.62 173.72 1jxn s LEU 181 N 2.84 4.09 -0.10 4.42 2.96 0.91 -0.80 118.68 132.99 1jxn s LEU 181 Ca 0.32 -0.55 0.02 0.00 -0.22 0.00 0.00 54.13 53.70 1jxn s LEU 181 Cb -0.15 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.57 1jxn s LEU 181 CO 0.10 -0.20 -0.14 -0.89 -1.32 0.00 0.00 176.35 173.90 1jxn s THR 182 N 1.60 1.39 -0.03 3.68 2.01 -0.30 -0.94 115.64 123.05 1jxn s THR 182 Ca 0.04 -0.58 0.06 0.00 0.31 0.00 0.00 61.69 61.52 1jxn s THR 182 Cb -0.17 -1.28 -0.01 0.00 0.01 0.00 0.00 72.50 71.05 1jxn s THR 182 CO 0.06 0.42 -0.21 0.00 -0.69 0.00 0.00 174.62 174.20 1jxn s ALA 183 N 1.01 1.78 -0.01 7.40 0.00 -0.68 -1.04 121.76 130.22 1jxn s ALA 183 Ca -0.07 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.05 1jxn s ALA 183 Cb -0.15 -0.51 -0.00 0.00 0.00 0.00 0.00 23.12 22.45 1jxn s ALA 183 CO -0.01 0.38 -0.10 -1.54 0.00 0.00 0.00 175.76 174.49 1jxn s SER 184 N -0.27 1.26 -0.12 0.00 1.04 -0.59 -1.32 113.70 113.70 1jxn s SER 184 Ca 0.02 -0.20 -0.02 0.00 0.48 0.00 0.00 55.95 56.24 1jxn s SER 184 Cb -0.10 -0.20 -0.03 0.00 0.10 0.00 0.00 66.02 65.79 1jxn s SER 184 CO 0.01 0.11 -0.05 -0.22 0.98 0.00 0.00 173.24 174.07 1jxn s LEU 185 N -0.12 3.22 -0.07 2.42 0.20 0.38 -2.22 118.68 122.49 1jxn s LEU 185 Ca 0.02 -0.08 -0.01 0.00 0.69 0.00 0.00 54.13 54.74 1jxn s LEU 185 Cb -0.05 -1.75 0.03 0.00 -0.43 0.00 0.00 46.19 43.99 1jxn s LEU 185 CO -0.00 0.25 0.01 -0.89 -0.29 0.00 0.00 176.35 175.42 1jxn s THR 186 N -0.11 0.34 -0.45 3.68 2.01 -0.56 -1.08 115.64 119.47 1jxn s THR 186 Ca 0.02 0.14 -0.26 0.00 0.31 0.00 0.00 61.69 61.90 1jxn s THR 186 Cb -0.13 -0.50 0.03 0.00 0.01 0.00 0.00 72.50 71.90 1jxn s THR 186 CO 0.03 0.25 0.95 -0.31 -0.69 0.00 0.00 174.62 174.85 1jxn s TYR 187 N 1.95 2.94 0.52 4.92 2.02 -0.42 -1.68 117.35 127.59 1jxn s TYR 187 Ca 0.04 0.48 0.23 0.00 -0.37 0.00 0.00 57.07 57.46 1jxn s TYR 187 Cb -0.12 -3.97 1.48 0.00 -0.40 0.00 0.00 41.96 38.95 1jxn s TYR 187 CO -0.05 -1.07 2.15 -1.00 -1.57 0.00 0.00 175.55 174.01 1jxn h PRO 188 N 8.99 0.00 -0.26 -1.71 0.13 -1.90 0.41 132.00 137.66 1jxn h PRO 188 Ca -0.24 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.97 1jxn h PRO 188 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1jxn h PRO 188 CO 1.03 0.06 0.23 0.66 -0.23 0.00 0.00 178.00 179.74 1jxn h SER 189 N 0.00 0.00 0.00 1.44 4.64 -1.91 -3.28 113.55 114.44 1jxn h SER 189 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jxn h SER 189 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1jxn h SER 189 CO 0.01 0.00 -0.07 -0.90 -0.87 0.00 0.00 176.83 175.00 1jxn n ASP 190 N -4.11 0.00 -1.80 4.97 3.85 -1.13 -5.02 116.55 113.31 1jxn n ASP 190 Ca 0.03 -1.14 -0.21 0.00 -0.71 0.00 0.00 54.79 52.76 1jxn n ASP 190 Cb 0.38 -0.03 -0.07 0.00 -1.35 0.00 0.00 41.12 40.05 1jxn n ASP 190 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1jxn n GLN 191 N 0.00 -1.51 -1.96 0.11 1.13 0.14 -4.88 117.38 110.41 1jxn n GLN 191 Ca 0.00 1.19 -0.35 0.00 -1.94 0.00 0.00 57.00 55.89 1jxn n GLN 191 Cb 0.53 -5.64 -0.03 0.00 0.11 0.00 0.00 30.24 25.20 1jxn n GLN 191 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1jxn s THR 192 N -2.84 3.31 0.39 5.09 2.01 -1.04 -4.78 115.64 117.79 1jxn s THR 192 Ca 0.00 0.08 0.06 0.00 0.31 0.00 0.00 61.69 62.13 1jxn s THR 192 Cb 0.00 -3.80 0.00 0.00 0.01 0.00 0.00 72.50 68.71 1jxn s THR 192 CO 0.00 -0.77 0.55 -0.44 -0.69 0.00 0.00 174.62 173.28 1jxn s SER 193 N 8.74 5.80 -0.14 3.53 0.01 -1.26 -1.30 113.70 129.08 1jxn s SER 193 Ca 0.73 -0.17 -0.30 0.00 1.31 0.00 0.00 55.95 57.52 1jxn s SER 193 Cb -0.12 -1.09 0.11 0.00 0.21 0.00 0.00 66.02 65.13 1jxn s SER 193 CO 0.18 -0.63 0.90 -0.51 0.41 0.00 0.00 173.24 173.59 1jxn s ILE 194 N -2.33 0.00 -0.06 1.44 2.07 -0.24 -4.97 121.20 117.10 1jxn s ILE 194 Ca 0.49 0.00 -0.23 0.00 -1.41 0.00 0.00 60.65 59.50 1jxn s ILE 194 Cb -0.10 -1.00 0.05 0.00 0.13 0.00 0.00 42.46 41.54 1jxn s ILE 194 CO 0.33 0.00 0.53 -0.94 -1.91 0.00 0.00 174.94 172.95 1jxn s SER 195 N -0.97 -0.48 -0.09 4.50 1.04 -1.26 -0.47 113.70 115.97 1jxn s SER 195 Ca -0.04 0.55 0.02 0.00 0.48 0.00 0.00 55.95 56.96 1jxn s SER 195 Cb -0.01 0.55 0.01 0.00 0.10 0.00 0.00 66.02 66.68 1jxn s SER 195 CO 0.03 -0.49 -0.13 0.54 0.98 0.00 0.00 173.24 174.17 1jxn s VAL 196 N -1.01 1.33 0.35 5.02 0.11 -0.44 -4.90 120.40 120.87 1jxn s VAL 196 Ca -0.10 -0.55 0.08 0.00 -2.93 0.00 0.00 61.98 58.47 1jxn s VAL 196 Cb -0.02 -1.23 -0.03 0.00 -1.53 0.00 0.00 36.38 33.56 1jxn s VAL 196 CO 0.06 0.41 0.22 -0.89 -3.33 0.00 0.00 175.10 171.57 1jxn s THR 197 N 0.95 3.14 -0.24 5.04 2.01 -1.26 -1.68 115.64 123.60 1jxn s THR 197 Ca -0.08 -1.54 -0.31 0.00 0.31 0.00 0.00 61.69 60.06 1jxn s THR 197 Cb -0.15 -3.06 0.17 0.00 0.01 0.00 0.00 72.50 69.47 1jxn s THR 197 CO -0.00 -0.15 1.26 -0.55 -0.69 0.00 0.00 174.62 174.49 1jxn s SER 198 N -3.93 -0.12 -0.33 3.53 0.15 -0.12 -4.89 113.70 108.00 1jxn s SER 198 Ca 0.40 0.09 -0.03 0.00 0.70 0.00 0.00 55.95 57.12 1jxn s SER 198 Cb -0.03 0.10 0.06 0.00 -1.71 0.00 0.00 66.02 64.44 1jxn s SER 198 CO 0.25 -0.13 0.06 -0.63 1.20 0.00 0.00 173.24 173.98 1jxn s ILE 199 N -1.44 3.18 -0.05 6.45 1.09 -1.26 -0.06 121.20 129.10 1jxn s ILE 199 Ca 0.07 -1.47 0.03 0.00 -1.10 0.00 0.00 60.65 58.18 1jxn s ILE 199 Cb -0.01 -2.90 0.01 0.00 -1.06 0.00 0.00 42.46 38.50 1jxn s ILE 199 CO -0.05 -0.23 -0.13 -0.69 -0.10 0.00 0.00 174.94 173.73 1jxn s VAL 200 N 1.25 1.17 -0.79 2.92 1.01 -0.74 -5.01 120.40 120.21 1jxn s VAL 200 Ca -0.02 -0.53 -0.19 0.00 0.00 0.00 0.00 61.98 61.24 1jxn s VAL 200 Cb -0.20 -1.04 0.12 0.00 0.00 0.00 0.00 36.38 35.26 1jxn s VAL 200 CO -0.01 0.35 0.97 -0.62 0.00 0.00 0.00 175.10 175.79 1jxn s ASP 201 N 0.43 6.46 0.64 3.32 3.68 -1.26 -4.74 116.67 125.19 1jxn s ASP 201 Ca -0.10 -1.77 0.35 0.00 2.13 0.00 0.00 52.55 53.15 1jxn s ASP 201 Cb -0.14 -2.36 1.93 0.00 -1.45 0.00 0.00 42.92 40.90 1jxn s ASP 201 CO 0.03 -1.10 2.16 -0.07 0.13 0.00 0.00 175.17 176.31 1jxn h LEU 202 N 10.24 0.00 -1.27 -1.34 3.38 -1.97 -1.02 115.31 123.33 1jxn h LEU 202 Ca -0.03 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1jxn h LEU 202 Cb 1.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1jxn h LEU 202 CO 1.08 0.00 -0.03 0.50 0.09 0.00 0.00 178.44 180.08 1jxn h LYS 203 N 0.00 0.46 0.10 1.13 3.64 -1.90 0.45 116.57 120.44 1jxn h LYS 203 Ca 0.03 -0.10 -0.30 0.00 -1.27 0.00 0.00 60.65 59.02 1jxn h LYS 203 Cb 0.34 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 1jxn h LYS 203 CO -0.00 0.51 -1.51 0.93 -2.27 0.00 0.00 179.45 177.12 1jxn h GLU 204 N 0.44 0.20 0.00 1.90 5.08 -1.62 -3.41 114.58 117.18 1jxn h GLU 204 Ca 0.09 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1jxn h GLU 204 Cb 0.34 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 1jxn h GLU 204 CO 0.01 1.05 -0.09 0.82 -1.00 0.00 0.00 179.01 179.80 1jxn h ILE 205 N 0.06 0.50 -3.13 3.13 1.08 -1.17 -3.49 117.51 114.50 1jxn h ILE 205 Ca -0.23 -1.40 -0.48 0.00 -0.39 0.00 0.00 64.86 62.36 1jxn h ILE 205 Cb 1.99 0.97 0.02 0.00 -3.07 0.00 0.00 36.82 36.73 1jxn h ILE 205 CO 0.15 0.17 -0.07 -0.76 -0.69 0.00 0.00 178.15 176.95 1jxn s LEU 206 N -8.41 3.87 0.83 1.44 1.43 0.15 -4.34 118.68 113.66 1jxn s LEU 206 Ca -0.07 0.66 -0.12 0.00 -1.03 0.00 0.00 54.13 53.56 1jxn s LEU 206 Cb -0.00 -3.55 0.09 0.00 0.03 0.00 0.00 46.19 42.76 1jxn s LEU 206 CO 0.22 -0.39 1.20 -2.16 0.23 0.00 0.00 176.35 175.45 1jxn s PRO 207 N -4.40 1.81 0.31 1.29 0.04 -1.26 -4.72 135.00 128.08 1jxn s PRO 207 Ca 0.43 0.05 0.06 0.00 0.04 0.00 0.00 61.00 61.58 1jxn s PRO 207 Cb -0.10 -1.94 0.74 0.00 0.04 0.00 0.00 34.50 33.25 1jxn s PRO 207 CO 0.39 -1.69 1.80 0.93 0.04 0.00 0.00 177.00 178.47 1jxn h GLU 208 N -1.12 0.75 -5.51 4.56 5.08 -1.95 -3.41 114.58 112.97 1jxn h GLU 208 Ca -0.46 -0.04 -0.57 0.00 -1.00 0.00 0.00 59.36 57.28 1jxn h GLU 208 Cb 1.32 -0.17 -0.31 0.00 0.50 0.00 0.00 28.75 30.09 1jxn h GLU 208 CO 0.63 0.49 -0.84 -1.58 -1.00 0.00 0.00 179.01 176.71 1jxn s TRP 209 N -5.82 1.74 0.22 4.33 0.52 -1.26 -1.38 118.94 117.29 1jxn s TRP 209 Ca -0.11 -0.45 0.00 0.00 0.02 0.00 0.00 56.10 55.56 1jxn s TRP 209 Cb 0.24 -1.16 -0.04 0.00 -1.15 0.00 0.00 33.47 31.36 1jxn s TRP 209 CO 0.80 -0.12 0.10 0.14 0.02 0.00 0.00 176.95 177.89 1jxn s VAL 210 N -0.13 0.27 0.13 4.03 -7.23 -0.22 -4.47 120.40 112.78 1jxn s VAL 210 Ca -0.00 -1.99 0.03 0.00 -1.81 0.00 0.00 61.98 58.21 1jxn s VAL 210 Cb -0.10 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.31 1jxn s VAL 210 CO 0.01 -0.07 0.19 -0.94 -0.31 0.00 0.00 175.10 173.99 1jxn s SER 211 N -3.21 5.92 -0.05 4.85 1.04 0.21 0.81 113.70 123.27 1jxn s SER 211 Ca 0.36 0.04 0.04 0.00 0.48 0.00 0.00 55.95 56.88 1jxn s SER 211 Cb 0.07 -1.68 -0.00 0.00 0.10 0.00 0.00 66.02 64.51 1jxn s SER 211 CO 0.11 0.09 -0.16 0.68 0.98 0.00 0.00 173.24 174.94 1jxn s VAL 212 N -1.67 1.39 0.00 5.02 -7.23 -1.25 -2.92 120.40 113.74 1jxn s VAL 212 Ca 0.32 -0.68 0.00 0.00 -1.81 0.00 0.00 61.98 59.81 1jxn s VAL 212 Cb -0.11 -1.20 0.00 0.00 0.56 0.00 0.00 36.38 35.63 1jxn s VAL 212 CO 0.26 0.40 0.00 0.61 -0.31 0.00 0.00 175.10 176.06 1jxn n GLY 213 N 3.24 1.52 3.25 2.32 0.00 -0.92 -1.40 105.19 113.20 1jxn n GLY 213 Ca -0.19 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.29 1jxn n GLY 213 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jxn s PHE 214 N -1.36 1.26 -0.06 1.61 0.40 -0.02 -1.91 117.98 117.89 1jxn s PHE 214 Ca 0.00 -1.02 -0.16 0.00 -0.60 0.00 0.00 56.93 55.15 1jxn s PHE 214 Cb 0.00 -0.72 0.03 0.00 0.51 0.00 0.00 43.02 42.85 1jxn s PHE 214 CO 0.00 -0.21 0.38 -1.54 0.70 0.00 0.00 175.22 174.55 1jxn s SER 215 N -3.19 -0.31 -0.15 1.36 1.04 -0.81 -1.27 113.70 110.37 1jxn s SER 215 Ca 0.25 0.38 -0.10 0.00 0.48 0.00 0.00 55.95 56.97 1jxn s SER 215 Cb 0.06 0.50 0.05 0.00 0.10 0.00 0.00 66.02 66.73 1jxn s SER 215 CO 0.05 -0.37 0.36 -0.83 0.98 0.00 0.00 173.24 173.44 1jxn s GLY 216 N -0.83 -0.27 0.06 7.32 0.00 -0.33 -0.41 107.32 112.86 1jxn s GLY 216 Ca -0.09 1.26 -0.04 0.00 0.00 0.00 0.00 44.72 45.85 1jxn s GLY 216 CO 0.04 1.33 0.04 -1.35 0.00 0.00 0.00 173.10 173.16 1jxn s SER 217 N 0.97 0.34 0.00 1.64 1.04 -0.45 -1.15 113.70 116.09 1jxn s SER 217 Ca -0.06 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.54 1jxn s SER 217 Cb -0.07 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.29 1jxn s SER 217 CO -0.08 -0.61 0.00 1.07 0.98 0.00 0.00 173.24 174.61 1jxn n THR 218 N 0.21 0.00 -3.79 2.02 5.66 -1.04 -0.18 114.28 117.17 1jxn n THR 218 Ca -0.15 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.72 1jxn n THR 218 Cb 0.61 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.29 1jxn n THR 218 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 1jxn s TYR 219 N -3.29 -0.16 0.14 1.09 6.14 -1.26 -3.70 117.35 116.32 1jxn s TYR 219 Ca 0.00 0.28 -0.35 0.00 0.64 0.00 0.00 57.07 57.64 1jxn s TYR 219 Cb 0.00 0.07 -0.16 0.00 0.42 0.00 0.00 41.96 42.29 1jxn s TYR 219 CO 0.00 -0.32 1.35 1.51 0.64 0.00 0.00 175.55 178.73 1jxn n ILE 220 N 1.62 0.32 0.00 3.14 0.13 -0.32 -0.90 119.36 123.35 1jxn n ILE 220 Ca -0.20 -0.08 0.00 0.00 -1.10 0.00 0.00 62.75 61.37 1jxn n ILE 220 Cb 0.56 -1.04 0.00 0.00 -0.84 0.00 0.00 39.64 38.32 1jxn n ILE 220 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1jxn n GLY 221 N 2.54 2.32 2.29 4.50 0.00 -1.26 -4.71 105.19 110.87 1jxn n GLY 221 Ca 0.17 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 1jxn n GLY 221 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jxn n ARG 222 N 0.00 3.15 -2.31 1.61 1.74 -0.08 -4.99 116.66 115.79 1jxn n ARG 222 Ca 0.00 -3.80 -0.40 0.00 -0.77 0.00 0.00 57.85 52.88 1jxn n ARG 222 Cb 0.00 -2.28 -0.03 0.00 -1.02 0.00 0.00 32.46 29.13 1jxn n ARG 222 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1jxn s GLN 223 N -3.73 4.33 -0.10 5.56 -0.21 -0.70 -1.80 119.66 123.00 1jxn s GLN 223 Ca 0.56 1.93 -0.30 0.00 0.02 0.00 0.00 55.36 57.57 1jxn s GLN 223 Cb 0.45 -2.94 0.08 0.00 1.00 0.00 0.00 33.01 31.59 1jxn s GLN 223 CO -0.06 -0.11 0.73 0.00 -2.12 0.00 0.00 175.29 173.73 1jxn s ALA 224 N -1.26 -1.79 0.02 6.09 0.00 -1.26 -4.47 121.76 119.08 1jxn s ALA 224 Ca 0.51 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.95 1jxn s ALA 224 Cb -0.33 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1jxn s ALA 224 CO 0.43 -0.35 0.09 -0.08 0.00 0.00 0.00 175.76 175.85 1jxn s THR 225 N -0.89 4.76 -0.17 0.00 -1.32 -0.43 -4.63 115.64 112.96 1jxn s THR 225 Ca -0.08 -0.47 0.01 0.00 -1.21 0.00 0.00 61.69 59.94 1jxn s THR 225 Cb -0.01 -3.21 0.02 0.00 -1.51 0.00 0.00 72.50 67.78 1jxn s THR 225 CO 0.07 0.29 -0.19 -1.00 -2.21 0.00 0.00 174.62 171.58 1jxn s HIS 226 N -1.26 2.66 -0.02 9.09 3.76 -1.26 -1.97 115.29 126.28 1jxn s HIS 226 Ca 0.25 -1.54 0.02 0.00 -0.15 0.00 0.00 55.06 53.64 1jxn s HIS 226 Cb -0.12 -1.85 0.00 0.00 1.11 0.00 0.00 32.58 31.72 1jxn s HIS 226 CO 0.17 -0.77 -0.06 -1.83 -0.85 0.00 0.00 174.74 171.40 1jxn s GLU 227 N 1.28 0.65 0.04 1.40 -1.05 -0.92 -1.68 118.70 118.43 1jxn s GLU 227 Ca 0.04 -0.20 -0.28 0.00 -0.15 0.00 0.00 54.97 54.38 1jxn s GLU 227 Cb -0.13 -0.64 -0.05 0.00 -0.44 0.00 0.00 34.13 32.87 1jxn s GLU 227 CO -0.12 0.07 0.88 0.08 0.95 0.00 0.00 175.26 177.13 1jxn s VAL 228 N 0.20 4.73 -0.15 1.83 1.01 0.53 -1.87 120.40 126.68 1jxn s VAL 228 Ca -0.02 1.88 0.20 0.00 0.00 0.00 0.00 61.98 64.03 1jxn s VAL 228 Cb -0.07 -4.23 -0.14 0.00 0.00 0.00 0.00 36.38 31.94 1jxn s VAL 228 CO -0.00 0.28 0.76 -0.11 0.00 0.00 0.00 175.10 176.03 1jxn n LEU 229 N 3.21 0.61 0.00 3.92 7.94 0.24 -1.59 117.00 131.33 1jxn n LEU 229 Ca 0.02 0.25 0.01 0.00 -1.11 0.00 0.00 56.01 55.18 1jxn n LEU 229 Cb 0.50 0.05 0.02 0.00 0.53 0.00 0.00 43.42 44.52 1jxn n LEU 229 CO 0.50 0.03 0.95 -0.46 -1.11 0.00 0.00 177.39 177.31 1jxn n ASN 230 N -2.68 -1.32 -3.61 1.96 6.94 -1.24 -4.58 115.26 110.73 1jxn n ASN 230 Ca -0.07 -1.46 -0.12 0.00 -0.02 0.00 0.00 54.58 52.91 1jxn n ASN 230 Cb 0.71 2.10 -0.06 0.00 -2.36 0.00 0.00 39.78 40.17 1jxn n ASN 230 CO 0.00 0.00 0.00 0.86 -1.03 0.00 0.00 177.26 177.09 1jxn s TRP 231 N -2.14 -0.54 0.03 -2.53 -0.00 -0.58 -3.89 118.94 109.30 1jxn s TRP 231 Ca 0.26 1.20 0.01 0.00 -0.00 0.00 0.00 56.10 57.57 1jxn s TRP 231 Cb -0.01 0.37 -0.02 0.00 -0.00 0.00 0.00 33.47 33.80 1jxn s TRP 231 CO 0.01 -0.34 -0.05 -0.47 -0.00 0.00 0.00 176.95 176.11 1jxn s TYR 232 N -0.22 0.46 -0.16 5.86 5.04 0.12 -0.49 117.35 127.97 1jxn s TYR 232 Ca -0.00 -0.54 -0.29 0.00 -2.44 0.00 0.00 57.07 53.81 1jxn s TYR 232 Cb -0.03 -0.30 0.09 0.00 0.35 0.00 0.00 41.96 42.07 1jxn s TYR 232 CO -0.01 -0.15 0.80 0.12 -1.34 0.00 0.00 175.55 174.98 1jxn s PHE 233 N -1.52 -0.61 -0.27 4.97 5.36 -1.05 -1.72 117.98 123.15 1jxn s PHE 233 Ca -0.12 1.24 -0.05 0.00 -0.96 0.00 0.00 56.93 57.03 1jxn s PHE 233 Cb -0.09 0.38 0.14 0.00 -0.34 0.00 0.00 43.02 43.10 1jxn s PHE 233 CO -0.01 -0.45 0.53 0.99 -1.46 0.00 0.00 175.22 174.83 1jxn s THR 234 N -0.59 -0.85 0.29 0.12 2.01 -0.36 -2.09 115.64 114.18 1jxn s THR 234 Ca -0.04 0.02 0.07 0.00 0.31 0.00 0.00 61.69 62.04 1jxn s THR 234 Cb -0.02 -0.89 -0.03 0.00 0.01 0.00 0.00 72.50 71.57 1jxn s THR 234 CO 0.04 -0.01 0.32 -0.44 -0.69 0.00 0.00 174.62 173.84 1jxn s SER 235 N 2.75 5.71 -0.30 3.53 0.01 0.15 -2.19 113.70 123.37 1jxn s SER 235 Ca 0.07 -0.25 -0.19 0.00 1.31 0.00 0.00 55.95 56.90 1jxn s SER 235 Cb -0.14 -1.32 0.19 0.00 0.21 0.00 0.00 66.02 64.96 1jxn s SER 235 CO -0.18 -0.23 1.24 0.28 0.41 0.00 0.00 173.24 174.76 1jxn s THR 236 N -2.17 -0.13 -0.43 1.44 -1.32 -0.86 -2.11 115.64 110.07 1jxn s THR 236 Ca 0.38 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 61.09 1jxn s THR 236 Cb -0.08 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.24 1jxn s THR 236 CO 0.28 0.00 1.59 -0.26 -2.21 0.00 0.00 174.62 174.01 1jxn h PHE 237 N 7.17 0.00 -1.79 9.09 0.04 -1.68 -1.46 116.94 128.31 1jxn h PHE 237 Ca -0.14 0.00 -0.76 0.00 2.80 0.00 0.00 57.97 59.87 1jxn h PHE 237 Cb 1.13 0.00 -0.22 0.00 2.20 0.00 0.00 35.95 39.06 1jxn h PHE 237 CO 0.22 0.01 1.44 1.51 -0.60 0.00 0.00 178.31 180.89 1jxn n ILE 238 N -3.09 5.40 -0.37 -0.55 0.13 -1.26 -4.74 119.36 114.88 1jxn n ILE 238 Ca 0.04 -5.08 0.00 0.00 -1.10 0.00 0.00 62.75 56.61 1jxn n ILE 238 Cb 0.53 -1.69 0.00 0.00 -0.84 0.00 0.00 39.64 37.65 1jxn n ILE 238 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 1jxn n ASN 239 N 0.52 0.00 0.00 9.51 3.02 -1.26 -5.14 115.26 121.91 1jxn n ASN 239 Ca 0.53 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 55.08 1jxn n ASN 239 Cb 0.27 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 1jxn n ASN 239 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99