#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jx2 n GLN 3 N 0.00 2.63 0.08 -1.24 6.02 -1.26 -4.83 117.38 118.78 1jx2 n GLN 3 Ca 0.00 -4.41 -0.07 0.00 -0.01 0.00 0.00 57.00 52.52 1jx2 n GLN 3 Cb 0.00 -2.07 -0.06 0.00 1.02 0.00 0.00 30.24 29.13 1jx2 n GLN 3 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1jx2 h LEU 4 N 2.94 0.04 -0.37 1.08 3.38 -2.00 -3.32 115.31 117.06 1jx2 h LEU 4 Ca 0.13 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.09 1jx2 h LEU 4 Cb 0.69 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 1jx2 h LEU 4 CO 0.73 0.95 0.18 0.40 0.09 0.00 0.00 178.44 180.79 1jx2 h ILE 5 N 0.01 0.97 -0.92 1.22 2.04 -1.94 -2.42 117.51 116.47 1jx2 h ILE 5 Ca -0.02 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 1jx2 h ILE 5 Cb 1.64 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 38.25 1jx2 h ILE 5 CO 0.12 0.07 0.53 -0.65 0.00 0.00 0.00 178.15 178.22 1jx2 h PRO 6 N 0.36 1.26 -0.51 2.37 0.11 -1.98 -0.61 132.00 133.01 1jx2 h PRO 6 Ca 0.16 -0.13 0.03 0.00 0.11 0.00 0.00 66.00 66.17 1jx2 h PRO 6 Cb 0.07 -0.26 -0.04 0.00 0.11 0.00 0.00 31.00 30.89 1jx2 h PRO 6 CO -0.12 0.90 0.28 0.28 -0.21 0.00 0.00 178.00 179.13 1jx2 h VAL 7 N 1.27 1.01 -0.21 3.15 2.07 -1.57 0.97 116.25 122.94 1jx2 h VAL 7 Ca 0.33 -0.19 -0.11 0.00 0.82 0.00 0.00 66.70 67.55 1jx2 h VAL 7 Cb -0.02 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 1jx2 h VAL 7 CO -0.06 0.10 -0.33 0.40 0.02 0.00 0.00 177.57 177.71 1jx2 h ILE 8 N 0.55 1.28 -0.96 4.57 1.08 -1.13 -2.50 117.51 120.41 1jx2 h ILE 8 Ca 0.21 -1.40 -0.00 0.00 -0.39 0.00 0.00 64.86 63.28 1jx2 h ILE 8 Cb 0.07 1.48 -0.05 0.00 -3.07 0.00 0.00 36.82 35.26 1jx2 h ILE 8 CO -0.12 0.44 0.58 0.78 -0.69 0.00 0.00 178.15 179.13 1jx2 h ASN 9 N 0.38 1.15 0.08 1.72 -0.26 0.20 -0.23 115.58 118.61 1jx2 h ASN 9 Ca 0.05 -0.07 -0.00 0.00 -0.56 0.00 0.00 56.30 55.71 1jx2 h ASN 9 Cb 0.76 -0.29 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 1jx2 h ASN 9 CO 0.06 0.88 -0.04 0.11 -1.06 0.00 0.00 177.43 177.38 1jx2 h LYS 10 N 1.32 -0.10 -0.64 0.81 1.79 -0.43 -1.00 116.57 118.32 1jx2 h LYS 10 Ca 0.34 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.84 1jx2 h LYS 10 Cb -0.06 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.58 1jx2 h LYS 10 CO -0.06 0.07 0.42 -0.07 -1.08 0.00 0.00 179.45 178.73 1jx2 h LEU 11 N -0.26 0.68 -0.62 2.94 3.38 -1.28 -1.11 115.31 119.03 1jx2 h LEU 11 Ca -0.01 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1jx2 h LEU 11 Cb 0.22 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1jx2 h LEU 11 CO 0.02 0.48 0.12 -0.61 0.09 0.00 0.00 178.44 178.54 1jx2 h GLN 12 N 0.80 1.02 0.00 1.13 4.15 -0.68 0.40 115.11 121.92 1jx2 h GLN 12 Ca 0.25 -0.26 -0.07 0.00 0.77 0.00 0.00 58.65 59.34 1jx2 h GLN 12 Cb 0.01 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.56 1jx2 h GLN 12 CO -0.06 0.94 -0.31 -0.44 -1.93 0.00 0.00 178.83 177.02 1jx2 h ASP 13 N 0.93 0.00 0.46 -0.69 3.32 -0.31 -1.62 116.42 118.51 1jx2 h ASP 13 Ca 0.19 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.94 1jx2 h ASP 13 Cb 0.40 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.92 1jx2 h ASP 13 CO 0.01 0.31 -1.64 0.58 -1.72 0.00 0.00 179.24 176.78 1jx2 h VAL 14 N 0.00 0.98 0.00 -1.35 2.07 -0.68 -3.42 116.25 113.85 1jx2 h VAL 14 Ca -0.00 -2.73 0.00 0.00 0.82 0.00 0.00 66.70 64.79 1jx2 h VAL 14 Cb 0.79 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 33.14 1jx2 h VAL 14 CO 0.04 0.71 -0.43 0.49 0.02 0.00 0.00 177.57 178.40 1jx2 n PHE 15 N -3.28 0.00 -1.17 1.57 3.01 0.08 -4.75 117.46 112.93 1jx2 n PHE 15 Ca -0.18 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.31 1jx2 n PHE 15 Cb 1.04 -0.02 0.23 0.00 -0.01 0.00 0.00 39.48 40.72 1jx2 n PHE 15 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1jx2 n ASN 16 N -1.22 3.33 0.02 4.37 4.13 -0.61 -4.58 115.26 120.69 1jx2 n ASN 16 Ca 0.00 -3.30 -0.19 0.00 1.68 0.00 0.00 54.58 52.77 1jx2 n ASN 16 Cb 0.05 -0.58 -0.10 0.00 -1.54 0.00 0.00 39.78 37.61 1jx2 n ASN 16 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 1jx2 h THR 17 N 1.42 1.31 0.00 3.41 1.35 -1.81 -3.18 112.91 115.41 1jx2 h THR 17 Ca 0.10 -2.14 0.00 0.00 -0.55 0.00 0.00 66.41 63.82 1jx2 h THR 17 Cb 1.55 2.34 0.00 0.00 -1.73 0.00 0.00 68.15 70.30 1jx2 h THR 17 CO 0.30 0.66 0.00 0.18 -0.25 0.00 0.00 175.52 176.40 1jx2 n LEU 18 N -3.96 0.00 0.00 3.87 4.77 -1.26 -3.86 117.00 116.56 1jx2 n LEU 18 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1jx2 n LEU 18 Cb 0.80 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.89 1jx2 n LEU 18 CO 0.53 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1jx2 n GLY 19 N 0.32 0.84 3.54 -0.72 0.00 -1.20 -4.42 105.19 103.55 1jx2 n GLY 19 Ca 0.16 -0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 1jx2 n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jx2 s SER 20 N -2.11 4.15 -0.56 1.61 0.01 -1.26 -4.90 113.70 110.64 1jx2 s SER 20 Ca 0.00 -0.55 0.07 0.00 1.31 0.00 0.00 55.95 56.78 1jx2 s SER 20 Cb 0.00 -0.68 0.25 0.00 0.21 0.00 0.00 66.02 65.81 1jx2 s SER 20 CO 0.00 0.14 0.68 -0.67 0.41 0.00 0.00 173.24 173.80 1jx2 n ASP 21 N 0.39 2.65 0.27 2.44 2.03 -1.26 -3.96 116.55 119.10 1jx2 n ASP 21 Ca -0.13 -3.22 0.10 0.00 0.52 0.00 0.00 54.79 52.07 1jx2 n ASP 21 Cb 0.54 -0.66 0.72 0.00 -0.72 0.00 0.00 41.12 41.00 1jx2 n ASP 21 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1jx2 h PRO 22 N 4.08 0.00 -0.05 -0.67 0.13 -1.98 -2.46 132.00 131.05 1jx2 h PRO 22 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1jx2 h PRO 22 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1jx2 h PRO 22 CO 0.72 0.04 0.00 1.28 -0.23 0.00 0.00 178.00 179.81 1jx2 n LEU 23 N -4.21 1.99 -3.76 1.56 4.77 -1.26 -4.96 117.00 111.14 1jx2 n LEU 23 Ca -0.03 -0.69 -0.25 0.00 -0.03 0.00 0.00 56.01 55.01 1jx2 n LEU 23 Cb 0.12 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 41.21 1jx2 n LEU 23 CO 0.32 0.34 -0.12 0.47 -1.33 0.00 0.00 177.39 177.07 1jx2 n ASP 24 N 0.55 -2.15 -4.74 -1.43 8.00 -0.93 -4.85 116.55 111.01 1jx2 n ASP 24 Ca 0.17 -0.92 -0.42 0.00 0.71 0.00 0.00 54.79 54.33 1jx2 n ASP 24 Cb 0.43 -3.62 -0.02 0.00 -0.02 0.00 0.00 41.12 37.89 1jx2 n ASP 24 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1jx2 s LEU 25 N -6.66 4.35 -0.07 0.64 1.02 -1.26 -4.83 118.68 111.87 1jx2 s LEU 25 Ca 0.14 2.88 -0.30 0.00 0.02 0.00 0.00 54.13 56.88 1jx2 s LEU 25 Cb -0.05 -3.62 -0.05 0.00 0.02 0.00 0.00 46.19 42.49 1jx2 s LEU 25 CO 0.85 -0.90 1.62 -2.16 0.02 0.00 0.00 176.35 175.78 1jx2 s PRO 26 N -0.10 4.17 0.25 1.29 0.04 -1.25 -4.68 135.00 134.72 1jx2 s PRO 26 Ca 0.65 2.13 -0.03 0.00 0.04 0.00 0.00 61.00 63.79 1jx2 s PRO 26 Cb -0.47 -3.97 -0.02 0.00 0.04 0.00 0.00 34.50 30.08 1jx2 s PRO 26 CO 0.44 -0.85 0.29 -0.65 0.04 0.00 0.00 177.00 176.27 1jx2 s GLN 27 N 4.01 1.47 -0.20 4.56 -0.21 -0.77 -4.91 119.66 123.62 1jx2 s GLN 27 Ca 0.72 -1.61 -0.01 0.00 0.02 0.00 0.00 55.36 54.47 1jx2 s GLN 27 Cb -0.32 0.35 0.01 0.00 1.00 0.00 0.00 33.01 34.05 1jx2 s GLN 27 CO 0.28 -0.55 -0.13 0.42 -2.12 0.00 0.00 175.29 173.20 1jx2 s ILE 28 N -3.86 2.69 -0.18 1.08 1.01 -1.26 -0.33 121.20 120.35 1jx2 s ILE 28 Ca 0.34 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 60.23 1jx2 s ILE 28 Cb 0.03 -2.18 -0.01 0.00 0.01 0.00 0.00 42.46 40.31 1jx2 s ILE 28 CO 0.15 0.48 -0.06 -0.69 0.00 0.00 0.00 174.94 174.82 1jx2 s VAL 29 N 1.35 3.44 -0.21 2.92 1.01 0.67 -1.28 120.40 128.30 1jx2 s VAL 29 Ca 0.05 -0.50 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 1jx2 s VAL 29 Cb -0.14 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 1jx2 s VAL 29 CO -0.08 0.46 0.35 -0.69 0.00 0.00 0.00 175.10 175.14 1jx2 s VAL 30 N 0.92 5.23 -0.06 2.92 1.01 -0.64 0.02 120.40 129.79 1jx2 s VAL 30 Ca -0.01 0.60 0.04 0.00 0.00 0.00 0.00 61.98 62.60 1jx2 s VAL 30 Cb -0.15 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1jx2 s VAL 30 CO 0.01 0.26 -0.18 -0.69 0.00 0.00 0.00 175.10 174.50 1jx2 s VAL 31 N 1.31 1.56 0.11 2.92 1.01 0.54 -3.34 120.40 124.51 1jx2 s VAL 31 Ca 0.16 -0.76 -0.26 0.00 0.00 0.00 0.00 61.98 61.12 1jx2 s VAL 31 Cb -0.15 -1.36 0.08 0.00 0.00 0.00 0.00 36.38 34.95 1jx2 s VAL 31 CO 0.07 0.45 1.00 -0.83 0.00 0.00 0.00 175.10 175.79 1jx2 s GLY 32 N 0.26 -0.28 0.71 4.51 0.00 -1.26 -0.19 107.32 111.07 1jx2 s GLY 32 Ca -0.10 0.31 -0.11 0.00 0.00 0.00 0.00 44.72 44.81 1jx2 s GLY 32 CO 0.04 0.06 1.09 -1.35 0.00 0.00 0.00 173.10 172.94 1jx2 s SER 33 N -2.89 5.35 0.62 1.64 1.04 -1.26 -2.74 113.70 115.45 1jx2 s SER 33 Ca 0.12 1.20 0.36 0.00 0.48 0.00 0.00 55.95 58.11 1jx2 s SER 33 Cb -0.00 -2.01 2.05 0.00 0.10 0.00 0.00 66.02 66.16 1jx2 s SER 33 CO 0.00 -1.41 2.29 1.56 0.98 0.00 0.00 173.24 176.66 1jx2 h GLN 34 N -0.70 0.00 -0.24 4.02 4.20 -1.80 -1.21 115.11 119.38 1jx2 h GLN 34 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1jx2 h GLN 34 Cb 1.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.03 1jx2 h GLN 34 CO 0.63 0.01 0.00 -1.13 -0.67 0.00 0.00 178.83 177.66 1jx2 n SER 35 N -3.50 2.87 0.19 1.46 3.41 -1.26 -4.52 113.62 112.26 1jx2 n SER 35 Ca -0.03 -2.24 0.14 0.00 -0.26 0.00 0.00 58.87 56.48 1jx2 n SER 35 Cb 0.09 -0.25 0.51 0.00 -0.26 0.00 0.00 64.21 64.30 1jx2 n SER 35 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1jx2 h SER 36 N 1.44 0.00 -1.38 4.04 4.64 -1.57 -3.47 113.55 117.26 1jx2 h SER 36 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 1jx2 h SER 36 Cb 0.82 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.92 1jx2 h SER 36 CO 0.04 0.00 -0.18 0.61 -0.87 0.00 0.00 176.83 176.42 1jx2 n GLY 37 N 0.34 0.19 0.20 -0.77 0.00 -1.26 -4.37 105.19 99.53 1jx2 n GLY 37 Ca 0.02 -0.55 -0.08 0.00 0.00 0.00 0.00 46.02 45.41 1jx2 n GLY 37 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1jx2 h LYS 38 N -0.23 0.46 -0.09 1.61 2.10 -1.90 -2.94 116.57 115.57 1jx2 h LYS 38 Ca -0.17 -0.30 -0.01 0.00 -2.00 0.00 0.00 60.65 58.17 1jx2 h LYS 38 Cb 1.12 0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 32.48 1jx2 h LYS 38 CO 0.19 0.91 0.01 0.66 -2.00 0.00 0.00 179.45 179.22 1jx2 h SER 39 N 0.35 0.11 0.22 7.07 4.64 -1.94 0.80 113.55 124.80 1jx2 h SER 39 Ca 0.00 -0.01 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 1jx2 h SER 39 Cb 1.11 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 1jx2 h SER 39 CO 0.10 0.13 -0.60 0.77 -0.87 0.00 0.00 176.83 176.36 1jx2 h SER 40 N 0.13 0.43 -0.52 4.97 4.64 -1.92 -1.62 113.55 119.65 1jx2 h SER 40 Ca 0.03 -0.24 0.01 0.00 -0.47 0.00 0.00 61.79 61.12 1jx2 h SER 40 Cb 0.07 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 1jx2 h SER 40 CO -0.00 0.93 0.34 0.58 -0.87 0.00 0.00 176.83 177.81 1jx2 h VAL 41 N 0.28 1.11 -0.40 0.95 2.07 -0.78 0.41 116.25 119.89 1jx2 h VAL 41 Ca -0.00 -0.23 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 1jx2 h VAL 41 Cb 1.13 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1jx2 h VAL 41 CO 0.10 0.12 0.05 -0.07 0.02 0.00 0.00 177.57 177.80 1jx2 h LEU 42 N 0.68 0.66 -1.36 2.57 3.38 -1.16 -0.23 115.31 119.85 1jx2 h LEU 42 Ca 0.20 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 1jx2 h LEU 42 Cb -0.05 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1jx2 h LEU 42 CO -0.06 0.76 -0.32 -0.33 0.09 0.00 0.00 178.44 178.59 1jx2 h GLU 43 N 0.52 0.00 -0.28 1.13 5.08 -0.91 0.17 114.58 120.30 1jx2 h GLU 43 Ca 0.12 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.30 1jx2 h GLU 43 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1jx2 h GLU 43 CO 0.01 0.32 -0.54 -0.91 -1.00 0.00 0.00 179.01 176.89 1jx2 h ASN 44 N 0.00 0.96 -0.20 1.42 -0.26 0.34 0.40 115.58 118.25 1jx2 h ASN 44 Ca -0.00 -0.54 -0.12 0.00 -0.56 0.00 0.00 56.30 55.08 1jx2 h ASN 44 Cb 0.57 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 37.55 1jx2 h ASN 44 CO 0.04 1.32 -0.29 0.40 -1.06 0.00 0.00 177.43 177.83 1jx2 h ILE 45 N 0.64 1.28 -0.06 2.81 2.04 -0.48 -2.26 117.51 121.47 1jx2 h ILE 45 Ca 0.01 -1.42 -0.17 0.00 1.00 0.00 0.00 64.86 64.29 1jx2 h ILE 45 Cb 1.15 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.57 1jx2 h ILE 45 CO 0.12 0.46 -0.69 0.58 0.00 0.00 0.00 178.15 178.63 1jx2 h VAL 46 N 0.59 1.41 0.00 1.67 2.07 -0.59 -3.45 116.25 117.95 1jx2 h VAL 46 Ca 0.07 -2.15 0.00 0.00 0.82 0.00 0.00 66.70 65.44 1jx2 h VAL 46 Cb 0.80 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.69 1jx2 h VAL 46 CO 0.07 0.64 0.00 0.61 0.02 0.00 0.00 177.57 178.90 1jx2 n GLY 47 N 0.46 0.69 3.63 2.17 0.00 0.13 -4.74 105.19 107.54 1jx2 n GLY 47 Ca -0.03 -0.72 -0.06 0.00 0.00 0.00 0.00 46.02 45.21 1jx2 n GLY 47 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1jx2 s ARG 48 N -2.47 0.26 0.28 1.61 3.52 -0.67 -4.41 118.95 117.06 1jx2 s ARG 48 Ca 0.00 0.21 -0.29 0.00 -0.13 0.00 0.00 55.73 55.52 1jx2 s ARG 48 Cb 0.00 0.12 -0.09 0.00 -1.56 0.00 0.00 34.95 33.42 1jx2 s ARG 48 CO 0.00 -0.05 1.17 0.16 -0.81 0.00 0.00 175.30 175.77 1jx2 s ASP 49 N -0.30 7.10 0.00 -2.12 -4.77 -1.26 -4.72 116.67 110.61 1jx2 s ASP 49 Ca 0.05 2.37 0.00 0.00 -3.30 0.00 0.00 52.55 51.68 1jx2 s ASP 49 Cb -0.04 -2.63 0.00 0.00 -1.09 0.00 0.00 42.92 39.17 1jx2 s ASP 49 CO -0.09 -0.29 0.00 2.22 0.70 0.00 0.00 175.17 177.71 1jx2 n PHE 50 N 1.34 0.00 -4.05 2.11 1.16 -1.26 -4.66 117.46 112.10 1jx2 n PHE 50 Ca 0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.26 1jx2 n PHE 50 Cb 0.44 0.06 -0.06 0.00 -1.61 0.00 0.00 39.48 38.30 1jx2 n PHE 50 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1jx2 s LEU 51 N 0.00 3.98 0.00 5.98 1.43 -1.26 -3.36 118.68 125.45 1jx2 s LEU 51 Ca 0.00 0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.27 1jx2 s LEU 51 Cb 0.00 -2.38 0.00 0.00 0.03 0.00 0.00 46.19 43.84 1jx2 s LEU 51 CO 0.00 0.25 0.14 -2.65 0.23 0.00 0.00 176.35 174.32 1jx2 n PRO 52 N 1.02 0.00 -1.14 1.29 -0.02 -1.26 -4.99 135.00 129.90 1jx2 n PRO 52 Ca -0.12 0.06 0.02 0.00 -2.02 0.00 0.00 63.50 61.43 1jx2 n PRO 52 Cb 0.52 -0.64 -0.01 0.00 -0.02 0.00 0.00 33.50 33.36 1jx2 n PRO 52 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1jx2 n ARG 61 N -0.19 -1.47 -2.05 -0.52 1.74 -1.26 -5.13 116.66 107.77 1jx2 n ARG 61 Ca 0.00 1.15 -0.36 0.00 -0.77 0.00 0.00 57.85 57.87 1jx2 n ARG 61 Cb 0.00 -1.80 0.03 0.00 -1.02 0.00 0.00 32.46 29.66 1jx2 n ARG 61 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 1jx2 s PRO 62 N -4.59 3.07 -0.27 5.56 0.02 -1.26 -4.65 135.00 132.89 1jx2 s PRO 62 Ca 0.00 1.81 0.02 0.00 0.02 0.00 0.00 61.00 62.86 1jx2 s PRO 62 Cb 0.00 -1.98 0.07 0.00 0.02 0.00 0.00 34.50 32.61 1jx2 s PRO 62 CO 0.00 -1.12 -0.05 -1.17 -0.33 0.00 0.00 177.00 174.33 1jx2 s LEU 63 N -3.95 3.41 -0.55 -5.54 2.96 0.12 -1.09 118.68 114.02 1jx2 s LEU 63 Ca 0.76 -1.50 -0.23 0.00 -0.22 0.00 0.00 54.13 52.94 1jx2 s LEU 63 Cb -0.30 -1.43 0.05 0.00 0.50 0.00 0.00 46.19 45.01 1jx2 s LEU 63 CO 0.33 -0.25 0.86 -0.63 -1.32 0.00 0.00 176.35 175.33 1jx2 s ILE 64 N 1.17 4.51 -0.38 6.68 1.01 -0.63 -0.35 121.20 133.22 1jx2 s ILE 64 Ca -0.03 -0.02 -0.15 0.00 0.00 0.00 0.00 60.65 60.45 1jx2 s ILE 64 Cb -0.19 -4.49 0.00 0.00 0.01 0.00 0.00 42.46 37.78 1jx2 s ILE 64 CO -0.07 -1.08 0.30 -0.22 0.00 0.00 0.00 174.94 173.87 1jx2 s LEU 65 N 3.60 4.80 -0.39 2.97 2.96 0.17 -1.81 118.68 130.97 1jx2 s LEU 65 Ca 0.25 -0.63 -0.07 0.00 -0.22 0.00 0.00 54.13 53.46 1jx2 s LEU 65 Cb -0.15 -2.20 0.08 0.00 0.50 0.00 0.00 46.19 44.42 1jx2 s LEU 65 CO 0.16 -0.38 0.20 -1.10 -1.32 0.00 0.00 176.35 173.91 1jx2 s GLN 66 N 1.79 2.46 -0.08 1.98 -0.21 -0.49 -0.86 119.66 124.25 1jx2 s GLN 66 Ca 0.07 -1.48 -0.15 0.00 0.02 0.00 0.00 55.36 53.82 1jx2 s GLN 66 Cb -0.18 -3.63 -0.05 0.00 1.00 0.00 0.00 33.01 30.15 1jx2 s GLN 66 CO 0.11 -0.91 0.38 -0.51 -2.12 0.00 0.00 175.29 172.24 1jx2 s LEU 67 N 1.35 4.36 -0.09 2.90 1.43 0.80 -1.40 118.68 128.02 1jx2 s LEU 67 Ca 0.03 0.78 0.01 0.00 -1.03 0.00 0.00 54.13 53.92 1jx2 s LEU 67 Cb -0.22 -2.53 0.02 0.00 0.03 0.00 0.00 46.19 43.48 1jx2 s LEU 67 CO 0.01 0.18 -0.13 -0.89 0.23 0.00 0.00 176.35 175.75 1jx2 s THR 68 N -0.22 1.27 0.18 5.49 2.01 -0.28 -2.03 115.64 122.07 1jx2 s THR 68 Ca 0.22 -0.51 -0.30 0.00 0.31 0.00 0.00 61.69 61.41 1jx2 s THR 68 Cb -0.15 -1.19 -0.08 0.00 0.01 0.00 0.00 72.50 71.09 1jx2 s THR 68 CO 0.09 0.40 1.11 -2.28 -0.69 0.00 0.00 174.62 173.25 1jx2 s HIS 69 N 1.03 3.58 -0.26 4.92 2.46 -1.26 -1.94 115.29 123.82 1jx2 s HIS 69 Ca -0.07 1.59 -0.07 0.00 0.47 0.00 0.00 55.06 56.99 1jx2 s HIS 69 Cb -0.15 -3.29 -0.02 0.00 -0.13 0.00 0.00 32.58 29.00 1jx2 s HIS 69 CO -0.01 -0.64 0.06 -0.51 -2.47 0.00 0.00 174.74 171.17 1jx2 s LEU 70 N -0.43 3.49 0.80 8.88 1.43 -0.57 -4.87 118.68 127.40 1jx2 s LEU 70 Ca 0.49 -0.34 -0.13 0.00 -1.03 0.00 0.00 54.13 53.12 1jx2 s LEU 70 Cb -0.30 -1.90 0.08 0.00 0.03 0.00 0.00 46.19 44.11 1jx2 s LEU 70 CO 0.35 -0.07 1.17 -2.84 0.23 0.00 0.00 176.35 175.19 1jx2 s PRO 71 N 1.58 1.74 0.39 1.29 0.02 -1.26 -4.17 135.00 134.59 1jx2 s PRO 71 Ca 0.05 1.62 -0.27 0.00 0.02 0.00 0.00 61.00 62.43 1jx2 s PRO 71 Cb -0.15 -1.80 -0.11 0.00 0.02 0.00 0.00 34.50 32.46 1jx2 s PRO 71 CO 0.03 -2.11 1.30 1.51 -0.33 0.00 0.00 177.00 177.40 1jx2 n ILE 72 N -3.36 2.32 -1.53 2.83 3.06 -1.26 -4.76 119.36 116.67 1jx2 n ILE 72 Ca 0.12 -0.50 -0.38 0.00 -2.50 0.00 0.00 62.75 59.50 1jx2 n ILE 72 Cb 0.51 -1.61 0.05 0.00 0.54 0.00 0.00 39.64 39.13 1jx2 n ILE 72 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1jx2 n ALA 73 N 0.03 -0.56 0.20 1.51 0.00 0.95 -4.80 120.51 117.84 1jx2 n ALA 73 Ca 0.05 -0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.56 1jx2 n ALA 73 Cb 0.38 -1.96 0.62 0.00 0.00 0.00 0.00 19.45 18.50 1jx2 n ALA 73 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1jx2 h ASP 74 N 0.29 0.05 1.60 0.00 3.45 -1.90 0.30 116.42 120.22 1jx2 h ASP 74 Ca -0.47 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.99 1jx2 h ASP 74 Cb 1.38 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 40.14 1jx2 h ASP 74 CO 0.48 0.04 -0.14 -2.24 -1.57 0.00 0.00 179.24 175.81 1jx2 h ASP 75 N 0.06 0.00 0.00 6.45 2.03 -2.02 -3.47 116.42 119.48 1jx2 h ASP 75 Ca 0.05 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.33 1jx2 h ASP 75 Cb 0.11 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.61 1jx2 h ASP 75 CO -0.01 0.01 0.00 0.61 -1.03 0.00 0.00 179.24 178.83 1jx2 n GLY 76 N 1.21 0.74 3.93 7.15 0.00 0.11 -5.11 105.19 113.22 1jx2 n GLY 76 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 1jx2 n GLY 76 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jx2 s SER 77 N -1.58 4.29 -0.35 1.61 0.15 -1.26 -4.63 113.70 111.93 1jx2 s SER 77 Ca 0.00 0.41 -0.11 0.00 0.70 0.00 0.00 55.95 56.95 1jx2 s SER 77 Cb 0.00 -0.85 0.01 0.00 -1.71 0.00 0.00 66.02 63.47 1jx2 s SER 77 CO 0.00 -1.97 0.20 -1.58 1.20 0.00 0.00 173.24 171.09 1jx2 s GLN 78 N -5.47 3.11 0.46 5.44 0.74 -1.26 -0.03 119.66 122.65 1jx2 s GLN 78 Ca 0.64 -0.89 -0.25 0.00 0.05 0.00 0.00 55.36 54.92 1jx2 s GLN 78 Cb -0.09 -3.71 -0.08 0.00 1.10 0.00 0.00 33.01 30.23 1jx2 s GLN 78 CO 0.48 -0.57 1.43 2.41 -0.55 0.00 0.00 175.29 178.49 1jx2 n THR 79 N 5.02 2.85 -2.45 -0.34 -1.04 -1.26 -4.95 114.28 112.11 1jx2 n THR 79 Ca -0.13 -0.50 -0.40 0.00 -2.04 0.00 0.00 64.05 60.98 1jx2 n THR 79 Cb 0.48 -1.84 -0.04 0.00 -1.82 0.00 0.00 70.33 67.11 1jx2 n THR 79 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1jx2 s GLN 80 N -2.47 4.62 0.23 -2.82 0.74 -1.26 -4.62 119.66 114.08 1jx2 s GLN 80 Ca 0.62 1.83 -0.21 0.00 0.05 0.00 0.00 55.36 57.65 1jx2 s GLN 80 Cb -0.45 -3.19 -0.08 0.00 1.10 0.00 0.00 33.01 30.39 1jx2 s GLN 80 CO 0.57 0.18 0.75 -1.83 -0.55 0.00 0.00 175.29 174.41 1jx2 s GLU 81 N -1.40 4.30 0.26 1.67 -1.05 -1.26 -4.93 118.70 116.30 1jx2 s GLU 81 Ca 0.45 0.93 -0.09 0.00 -0.15 0.00 0.00 54.97 56.11 1jx2 s GLU 81 Cb -0.32 -2.89 -0.01 0.00 -0.44 0.00 0.00 34.13 30.47 1jx2 s GLU 81 CO 0.41 0.39 0.44 1.67 0.95 0.00 0.00 175.26 179.12 1jx2 s TRP 82 N -1.52 0.60 0.33 4.83 -2.14 -0.76 -4.78 118.94 115.50 1jx2 s TRP 82 Ca 0.43 -0.93 0.07 0.00 2.66 0.00 0.00 56.10 58.34 1jx2 s TRP 82 Cb -0.17 0.06 -0.06 0.00 -3.10 0.00 0.00 33.47 30.19 1jx2 s TRP 82 CO 0.21 -0.99 -0.05 0.20 -2.66 0.00 0.00 176.95 173.66 1jx2 s GLY 83 N -3.08 2.08 -0.18 3.67 0.00 -0.14 -1.21 107.32 108.47 1jx2 s GLY 83 Ca 0.26 -2.05 -0.14 0.00 0.00 0.00 0.00 44.72 42.80 1jx2 s GLY 83 CO 0.12 -1.94 0.46 -0.54 0.00 0.00 0.00 173.10 171.19 1jx2 s GLU 84 N -3.71 0.50 -0.06 2.90 2.02 0.13 -1.06 118.70 119.42 1jx2 s GLU 84 Ca 0.32 0.72 -0.02 0.00 0.02 0.00 0.00 54.97 56.02 1jx2 s GLU 84 Cb 0.05 0.16 -0.04 0.00 0.10 0.00 0.00 34.13 34.40 1jx2 s GLU 84 CO 0.15 -0.10 0.05 -0.06 0.02 0.00 0.00 175.26 175.32 1jx2 s PHE 85 N 0.72 3.26 0.42 1.61 0.40 -1.26 0.11 117.98 123.23 1jx2 s PHE 85 Ca -0.04 0.24 0.16 0.00 -0.60 0.00 0.00 56.93 56.69 1jx2 s PHE 85 Cb -0.05 -1.78 1.00 0.00 0.51 0.00 0.00 43.02 42.70 1jx2 s PHE 85 CO -0.05 0.54 1.96 1.25 0.70 0.00 0.00 175.22 179.61 1jx2 h LEU 86 N 4.69 0.00 -0.73 -0.37 5.85 -1.41 -2.27 115.31 121.08 1jx2 h LEU 86 Ca -0.51 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1jx2 h LEU 86 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1jx2 h LEU 86 CO 0.58 0.22 0.00 0.00 -0.34 0.00 0.00 178.44 178.90 1jx2 n HIS 87 N -4.13 0.13 -2.92 1.25 1.44 -1.26 -3.93 115.22 105.80 1jx2 n HIS 87 Ca -0.02 -0.06 -0.22 0.00 -2.01 0.00 0.00 57.72 55.40 1jx2 n HIS 87 Cb 0.29 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.38 1jx2 n HIS 87 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1jx2 n LYS 88 N -0.06 2.38 -0.21 -1.40 4.01 -0.85 -5.00 118.16 117.02 1jx2 n LYS 88 Ca 0.16 -4.21 0.20 0.00 -0.51 0.00 0.00 58.31 53.95 1jx2 n LYS 88 Cb 0.24 -1.98 0.36 0.00 -0.51 0.00 0.00 35.03 33.14 1jx2 n LYS 88 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99 1jx2 n PRO 89 N -0.11 -0.03 -0.16 1.97 -0.02 -1.25 -1.20 135.00 134.19 1jx2 n PRO 89 Ca 0.28 0.78 0.05 0.00 -2.02 0.00 0.00 63.50 62.60 1jx2 n PRO 89 Cb 0.55 -1.45 0.13 0.00 -0.02 0.00 0.00 33.50 32.71 1jx2 n PRO 89 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1jx2 n ASN 90 N -4.18 2.77 -4.84 2.55 3.02 -1.26 -5.02 115.26 108.30 1jx2 n ASN 90 Ca 0.23 -2.33 -0.32 0.00 -0.03 0.00 0.00 54.58 52.12 1jx2 n ASN 90 Cb 0.80 -0.25 -0.06 0.00 -0.61 0.00 0.00 39.78 39.67 1jx2 n ASN 90 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1jx2 s ASP 91 N -1.42 5.94 -0.16 6.41 1.01 -0.34 -5.10 116.67 123.02 1jx2 s ASP 91 Ca 0.21 0.17 0.00 0.00 0.71 0.00 0.00 52.55 53.65 1jx2 s ASP 91 Cb 0.15 -1.74 0.03 0.00 1.01 0.00 0.00 42.92 42.36 1jx2 s ASP 91 CO 0.08 0.22 -0.11 -0.04 0.21 0.00 0.00 175.17 175.53 1jx2 s MET 92 N -2.16 2.02 -0.66 8.23 -1.94 -1.26 -4.66 119.30 118.86 1jx2 s MET 92 Ca 0.29 -0.57 -0.17 0.00 -1.71 0.00 0.00 55.69 53.53 1jx2 s MET 92 Cb -0.12 -2.08 0.13 0.00 2.01 0.00 0.00 34.83 34.77 1jx2 s MET 92 CO 0.21 -0.31 0.71 -0.06 -0.01 0.00 0.00 175.02 175.56 1jx2 s PHE 93 N 1.52 3.21 -0.54 -0.03 0.40 -0.23 -4.85 117.98 117.47 1jx2 s PHE 93 Ca 0.03 -1.27 0.24 0.00 -0.60 0.00 0.00 56.93 55.33 1jx2 s PHE 93 Cb -0.14 -3.96 0.40 0.00 0.51 0.00 0.00 43.02 39.83 1jx2 s PHE 93 CO -0.09 -1.20 1.46 1.88 0.70 0.00 0.00 175.22 177.96 1jx2 h TYR 94 N 8.83 0.00 -3.27 0.36 -1.99 -1.86 -0.33 116.97 118.70 1jx2 h TYR 94 Ca -0.18 0.00 -0.74 0.00 2.00 0.00 0.00 58.73 59.81 1jx2 h TYR 94 Cb 1.07 0.00 -0.23 0.00 2.00 0.00 0.00 36.73 39.58 1jx2 h TYR 94 CO 0.88 0.00 -0.32 0.34 -0.00 0.00 0.00 178.16 179.07 1jx2 s ASP 95 N -5.02 6.13 0.59 3.88 -1.08 -1.26 -4.89 116.67 115.03 1jx2 s ASP 95 Ca 0.06 -1.42 0.29 0.00 -0.52 0.00 0.00 52.55 50.97 1jx2 s ASP 95 Cb 0.10 -2.18 1.78 0.00 -1.46 0.00 0.00 42.92 41.17 1jx2 s ASP 95 CO 0.69 -0.68 2.23 -0.26 0.52 0.00 0.00 175.17 177.67 1jx2 h PHE 96 N 8.76 0.00 -0.78 -5.34 -1.00 -1.90 -0.85 116.94 115.84 1jx2 h PHE 96 Ca -0.28 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.45 1jx2 h PHE 96 Cb 1.11 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.63 1jx2 h PHE 96 CO 0.65 0.00 0.30 1.03 -1.61 0.00 0.00 178.31 178.68 1jx2 h SER 97 N 0.00 1.09 0.37 2.17 0.87 -1.92 -1.34 113.55 114.79 1jx2 h SER 97 Ca 0.01 -0.18 -0.03 0.00 -1.23 0.00 0.00 61.79 60.36 1jx2 h SER 97 Cb 0.09 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 61.76 1jx2 h SER 97 CO -0.00 0.97 -0.15 -0.33 -0.53 0.00 0.00 176.83 176.79 1jx2 h GLU 98 N 1.14 0.00 -0.43 2.24 5.08 -1.57 -2.18 114.58 118.85 1jx2 h GLU 98 Ca 0.26 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.48 1jx2 h GLU 98 Cb 0.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1jx2 h GLU 98 CO -0.02 0.15 -0.27 0.82 -1.00 0.00 0.00 179.01 178.70 1jx2 h ILE 99 N 0.00 1.27 -0.73 3.13 2.04 -1.17 0.13 117.51 122.17 1jx2 h ILE 99 Ca -0.00 -1.44 -0.03 0.00 1.00 0.00 0.00 64.86 64.40 1jx2 h ILE 99 Cb 0.38 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 1jx2 h ILE 99 CO 0.02 0.49 0.36 -0.09 0.00 0.00 0.00 178.15 178.92 1jx2 h ARG 100 N 0.79 1.04 -0.18 2.37 2.43 -1.07 -1.81 114.38 117.96 1jx2 h ARG 100 Ca 0.09 -0.14 -0.07 0.00 -0.81 0.00 0.00 59.98 59.05 1jx2 h ARG 100 Cb 0.85 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1jx2 h ARG 100 CO 0.08 0.80 -0.18 0.93 -1.51 0.00 0.00 179.97 180.09 1jx2 h GLU 101 N 1.04 0.43 -0.34 0.20 5.08 -1.06 -2.79 114.58 117.14 1jx2 h GLU 101 Ca 0.25 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1jx2 h GLU 101 Cb 0.10 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1jx2 h GLU 101 CO -0.03 0.79 0.14 1.49 -1.00 0.00 0.00 179.01 180.41 1jx2 h GLU 102 N 0.09 0.47 -0.32 2.33 4.57 -0.46 0.14 114.58 121.40 1jx2 h GLU 102 Ca 0.03 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 1jx2 h GLU 102 Cb 0.71 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.20 1jx2 h GLU 102 CO 0.04 0.39 0.12 0.82 -1.18 0.00 0.00 179.01 179.20 1jx2 h ILE 103 N 0.48 1.19 -0.49 2.32 2.04 -1.29 -1.37 117.51 120.38 1jx2 h ILE 103 Ca 0.12 -0.59 -0.08 0.00 1.00 0.00 0.00 64.86 65.31 1jx2 h ILE 103 Cb 0.09 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1jx2 h ILE 103 CO -0.01 0.20 -0.01 0.40 0.00 0.00 0.00 178.15 178.73 1jx2 h ILE 104 N 0.36 1.25 0.54 -0.67 2.04 -1.00 -2.01 117.51 118.02 1jx2 h ILE 104 Ca 0.10 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 64.89 1jx2 h ILE 104 Cb 0.20 0.88 0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1jx2 h ILE 104 CO -0.01 0.37 -0.26 0.03 0.00 0.00 0.00 178.15 178.28 1jx2 h ARG 105 N 0.77 -0.69 -0.05 2.37 3.08 -0.50 -2.81 114.38 116.54 1jx2 h ARG 105 Ca 0.15 0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.26 1jx2 h ARG 105 Cb 0.48 0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 1jx2 h ARG 105 CO 0.02 -0.46 0.12 0.22 -1.07 0.00 0.00 179.97 178.80 1jx2 h ASP 106 N -0.87 0.00 0.57 7.04 3.58 -1.30 -2.40 116.42 123.04 1jx2 h ASP 106 Ca -0.07 0.00 -0.28 0.00 0.42 0.00 0.00 57.03 57.09 1jx2 h ASP 106 Cb 0.55 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.61 1jx2 h ASP 106 CO 0.12 0.00 -1.30 0.00 -2.88 0.00 0.00 179.24 175.18 1jx2 h THR 107 N 0.00 1.44 -0.26 2.25 1.03 -1.31 -3.51 112.91 112.54 1jx2 h THR 107 Ca 0.02 -3.00 -0.01 0.00 -0.01 0.00 0.00 66.41 63.42 1jx2 h THR 107 Cb 0.26 2.94 -0.00 0.00 -1.07 0.00 0.00 68.15 70.28 1jx2 h THR 107 CO -0.00 0.88 0.02 -1.81 -0.01 0.00 0.00 175.52 174.59 1jx2 s ASP 108 N -7.17 3.70 0.30 0.00 1.01 -0.91 -5.03 116.67 108.56 1jx2 s ASP 108 Ca -0.05 -0.29 -0.29 0.00 0.71 0.00 0.00 52.55 52.63 1jx2 s ASP 108 Cb 0.07 -2.57 -0.10 0.00 1.01 0.00 0.00 42.92 41.33 1jx2 s ASP 108 CO 0.89 -4.22 1.19 -0.63 0.21 0.00 0.00 175.17 172.61 1jx2 s ILE 117 N 15.69 3.15 0.08 0.77 -1.09 -1.26 -5.15 121.20 133.39 1jx2 s ILE 117 Ca 0.89 1.16 0.03 0.00 -2.23 0.00 0.00 60.65 60.50 1jx2 s ILE 117 Cb -0.10 -3.74 -0.03 0.00 -1.58 0.00 0.00 42.46 37.01 1jx2 s ILE 117 CO 0.11 0.27 -0.09 -0.44 -1.23 0.00 0.00 174.94 173.57 1jx2 s SER 118 N -0.68 1.26 0.05 3.58 0.01 -1.26 -4.98 113.70 111.68 1jx2 s SER 118 Ca 0.47 -0.78 0.25 0.00 1.31 0.00 0.00 55.95 57.20 1jx2 s SER 118 Cb -0.35 0.03 0.44 0.00 0.21 0.00 0.00 66.02 66.35 1jx2 s SER 118 CO 0.46 -0.28 1.37 0.00 0.41 0.00 0.00 173.24 175.21 1jx2 n ALA 119 N 0.70 3.23 -2.50 1.44 0.00 -1.26 -4.00 120.51 118.11 1jx2 n ALA 119 Ca -0.17 -0.30 -0.43 0.00 0.00 0.00 0.00 53.44 52.54 1jx2 n ALA 119 Cb 0.57 -1.15 -0.02 0.00 0.00 0.00 0.00 19.45 18.85 1jx2 n ALA 119 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1jx2 s GLN 120 N -3.08 3.61 0.51 0.00 0.74 -1.26 -4.06 119.66 116.12 1jx2 s GLN 120 Ca 0.09 0.64 -0.21 0.00 0.05 0.00 0.00 55.36 55.92 1jx2 s GLN 120 Cb 0.16 -3.98 -0.06 0.00 1.10 0.00 0.00 33.01 30.23 1jx2 s GLN 120 CO 0.71 -1.53 1.20 -2.14 -0.55 0.00 0.00 175.29 172.97 1jx2 s PRO 121 N 4.77 3.45 -0.18 1.67 0.02 -1.25 -4.46 135.00 139.02 1jx2 s PRO 121 Ca 0.52 1.83 -0.13 0.00 0.02 0.00 0.00 61.00 63.24 1jx2 s PRO 121 Cb -0.09 -2.23 -0.05 0.00 0.02 0.00 0.00 34.50 32.15 1jx2 s PRO 121 CO 0.31 -0.82 0.28 -1.50 -0.33 0.00 0.00 177.00 174.94 1jx2 s ILE 122 N -1.55 5.30 -0.62 2.83 2.07 -0.25 -4.95 121.20 124.03 1jx2 s ILE 122 Ca 0.69 0.49 -0.14 0.00 -1.41 0.00 0.00 60.65 60.28 1jx2 s ILE 122 Cb -0.30 -3.62 0.16 0.00 0.13 0.00 0.00 42.46 38.83 1jx2 s ILE 122 CO 0.35 0.36 0.56 0.21 -1.91 0.00 0.00 174.94 174.51 1jx2 s ASN 123 N 0.66 6.27 -0.25 4.50 3.84 -1.26 -1.60 114.94 127.10 1jx2 s ASN 123 Ca 0.15 -2.10 -0.09 0.00 0.21 0.00 0.00 52.86 51.03 1jx2 s ASN 123 Cb -0.13 -2.18 -0.04 0.00 -0.55 0.00 0.00 41.25 38.35 1jx2 s ASN 123 CO 0.04 -0.74 0.14 -0.22 -2.79 0.00 0.00 177.10 173.52 1jx2 s LEU 124 N 1.10 3.83 -0.10 3.21 2.96 -0.75 -0.86 118.68 128.07 1jx2 s LEU 124 Ca 0.08 -0.05 -0.02 0.00 -0.22 0.00 0.00 54.13 53.92 1jx2 s LEU 124 Cb -0.24 -2.04 -0.03 0.00 0.50 0.00 0.00 46.19 44.38 1jx2 s LEU 124 CO -0.01 -0.01 -0.01 -0.54 -1.32 0.00 0.00 176.35 174.46 1jx2 s LYS 125 N 1.48 3.10 -0.10 1.98 1.02 0.30 -1.40 119.74 126.12 1jx2 s LYS 125 Ca 0.06 -0.43 0.00 0.00 0.02 0.00 0.00 55.97 55.62 1jx2 s LYS 125 Cb -0.15 -2.81 0.02 0.00 -0.52 0.00 0.00 37.83 34.37 1jx2 s LYS 125 CO 0.07 0.61 -0.08 0.42 -0.92 0.00 0.00 175.35 175.45 1jx2 s ILE 126 N -0.64 0.97 -0.29 2.17 1.01 -0.49 0.17 121.20 124.10 1jx2 s ILE 126 Ca 0.10 -0.28 -0.07 0.00 0.00 0.00 0.00 60.65 60.40 1jx2 s ILE 126 Cb -0.12 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.38 1jx2 s ILE 126 CO 0.02 0.35 0.08 -0.31 0.00 0.00 0.00 174.94 175.08 1jx2 s TYR 127 N 1.47 3.13 -0.08 3.97 1.51 -0.35 -1.13 117.35 125.88 1jx2 s TYR 127 Ca 0.00 -0.86 -0.13 0.00 -1.01 0.00 0.00 57.07 55.08 1jx2 s TYR 127 Cb -0.13 -2.26 0.03 0.00 -0.11 0.00 0.00 41.96 39.49 1jx2 s TYR 127 CO -0.05 -0.53 0.32 0.45 -1.11 0.00 0.00 175.55 174.62 1jx2 s SER 128 N 1.53 -0.27 0.00 2.29 0.15 -0.82 -1.82 113.70 114.76 1jx2 s SER 128 Ca 0.03 0.41 0.31 0.00 0.70 0.00 0.00 55.95 57.40 1jx2 s SER 128 Cb -0.17 0.52 1.62 0.00 -1.71 0.00 0.00 66.02 66.28 1jx2 s SER 128 CO 0.03 -0.25 2.09 -0.81 1.20 0.00 0.00 173.24 175.50 1jx2 n PRO 129 N 2.22 0.62 -0.07 5.44 -0.04 -1.26 -1.51 135.00 140.40 1jx2 n PRO 129 Ca -0.17 -0.02 0.11 0.00 -0.04 0.00 0.00 63.50 63.38 1jx2 n PRO 129 Cb 0.57 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.66 1jx2 n PRO 129 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1jx2 n HIS 130 N -1.17 0.18 -4.47 0.54 8.25 -1.26 -4.73 115.22 112.55 1jx2 n HIS 130 Ca 0.17 -0.10 -0.24 0.00 -0.26 0.00 0.00 57.72 57.29 1jx2 n HIS 130 Cb 0.21 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.22 1jx2 n HIS 130 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1jx2 s VAL 131 N -1.66 2.48 0.41 1.59 -7.23 -1.18 -4.92 120.40 109.89 1jx2 s VAL 131 Ca 0.30 -2.31 0.01 0.00 -1.81 0.00 0.00 61.98 58.16 1jx2 s VAL 131 Cb 0.19 -2.44 -0.01 0.00 0.56 0.00 0.00 36.38 34.68 1jx2 s VAL 131 CO 0.28 -0.34 0.62 0.68 -0.31 0.00 0.00 175.10 176.03 1jx2 s VAL 132 N -2.53 4.37 -0.18 1.32 -7.23 -1.26 -4.15 120.40 110.74 1jx2 s VAL 132 Ca 0.31 -0.50 -0.29 0.00 -1.81 0.00 0.00 61.98 59.69 1jx2 s VAL 132 Cb -0.03 -3.60 -0.02 0.00 0.56 0.00 0.00 36.38 33.29 1jx2 s VAL 132 CO 0.16 -0.41 1.33 0.20 -0.31 0.00 0.00 175.10 176.07 1jx2 s ASN 133 N -4.16 6.84 -0.15 4.85 0.01 -1.26 -4.35 114.94 116.73 1jx2 s ASN 133 Ca 0.45 1.66 -0.29 0.00 -0.71 0.00 0.00 52.86 53.97 1jx2 s ASN 133 Cb -0.10 -2.54 0.11 0.00 0.41 0.00 0.00 41.25 39.13 1jx2 s ASN 133 CO 0.37 -0.86 0.90 -0.22 -1.51 0.00 0.00 177.10 175.78 1jx2 s LEU 134 N 3.79 -0.48 -0.08 0.60 2.96 -0.86 -4.63 118.68 119.99 1jx2 s LEU 134 Ca 0.58 0.61 0.02 0.00 -0.22 0.00 0.00 54.13 55.11 1jx2 s LEU 134 Cb -0.22 2.08 0.01 0.00 0.50 0.00 0.00 46.19 48.57 1jx2 s LEU 134 CO 0.18 -0.38 -0.13 -0.89 -1.32 0.00 0.00 176.35 173.81 1jx2 s THR 135 N -0.87 1.21 0.08 3.68 2.01 -1.26 -0.14 115.64 120.34 1jx2 s THR 135 Ca -0.04 -0.51 0.07 0.00 0.31 0.00 0.00 61.69 61.53 1jx2 s THR 135 Cb -0.01 -1.11 -0.03 0.00 0.01 0.00 0.00 72.50 71.36 1jx2 s THR 135 CO 0.03 0.38 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.39 1jx2 s LEU 136 N 0.78 2.26 -0.33 4.42 1.43 -0.03 -4.31 118.68 122.90 1jx2 s LEU 136 Ca -0.12 -0.61 0.03 0.00 -1.03 0.00 0.00 54.13 52.39 1jx2 s LEU 136 Cb -0.16 -0.75 0.09 0.00 0.03 0.00 0.00 46.19 45.40 1jx2 s LEU 136 CO 0.02 0.03 0.03 -0.69 0.23 0.00 0.00 176.35 175.97 1jx2 s VAL 137 N -1.10 2.42 -0.13 -1.59 1.01 -0.40 0.43 120.40 121.04 1jx2 s VAL 137 Ca 0.03 -2.08 -0.22 0.00 0.00 0.00 0.00 61.98 59.71 1jx2 s VAL 137 Cb -0.10 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 1jx2 s VAL 137 CO 0.03 -0.44 0.67 -0.62 0.00 0.00 0.00 175.10 174.74 1jx2 s ASP 138 N 1.08 6.85 0.07 3.32 2.15 0.53 -1.63 116.67 129.04 1jx2 s ASP 138 Ca 0.05 1.02 0.05 0.00 0.43 0.00 0.00 52.55 54.10 1jx2 s ASP 138 Cb -0.20 -2.38 -0.04 0.00 -0.30 0.00 0.00 42.92 40.00 1jx2 s ASP 138 CO -0.06 -0.20 -0.04 -0.76 -0.17 0.00 0.00 175.17 173.94 1jx2 s LEU 139 N 1.35 3.29 0.44 -1.34 1.43 -1.21 0.10 118.68 122.74 1jx2 s LEU 139 Ca 0.33 -0.22 -0.23 0.00 -1.03 0.00 0.00 54.13 52.98 1jx2 s LEU 139 Cb -0.17 -2.01 -0.10 0.00 0.03 0.00 0.00 46.19 43.94 1jx2 s LEU 139 CO 0.14 0.20 0.91 -2.65 0.23 0.00 0.00 176.35 175.18 1jx2 n PRO 140 N 0.85 1.14 -1.75 1.29 -0.02 -1.26 -4.79 135.00 130.45 1jx2 n PRO 140 Ca -0.13 0.41 -0.33 0.00 -2.02 0.00 0.00 63.50 61.44 1jx2 n PRO 140 Cb 0.52 -1.94 0.05 0.00 -0.02 0.00 0.00 33.50 32.10 1jx2 n PRO 140 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1jx2 s GLY 141 N -0.84 2.12 0.02 -1.23 0.00 -1.26 -4.85 107.32 101.28 1jx2 s GLY 141 Ca 0.65 0.51 -0.01 0.00 0.00 0.00 0.00 44.72 45.86 1jx2 s GLY 141 CO 0.56 0.85 0.16 -0.26 0.00 0.00 0.00 173.10 174.42 1jx2 s ILE 142 N -2.39 5.21 0.00 0.90 -4.36 -1.11 -4.64 121.20 114.81 1jx2 s ILE 142 Ca 0.66 -0.34 0.00 0.00 -0.26 0.00 0.00 60.65 60.72 1jx2 s ILE 142 Cb -0.20 -3.47 0.00 0.00 1.25 0.00 0.00 42.46 40.04 1jx2 s ILE 142 CO 0.42 0.25 0.00 0.41 0.24 0.00 0.00 174.94 176.26 1jx2 n THR 152 N 0.72 0.00 -0.14 8.37 -1.04 -1.26 -3.05 114.28 117.89 1jx2 n THR 152 Ca -0.09 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.81 1jx2 n THR 152 Cb 0.52 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 69.01 1jx2 n THR 152 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1jx2 h ASP 153 N 0.00 0.73 0.19 8.00 -0.00 -2.07 -3.03 116.42 120.24 1jx2 h ASP 153 Ca 0.00 -0.33 -0.30 0.00 -0.00 0.00 0.00 57.03 56.39 1jx2 h ASP 153 Cb 0.00 -0.20 0.02 0.00 -0.00 0.00 0.00 39.33 39.15 1jx2 h ASP 153 CO 0.00 0.89 -1.44 0.16 -0.00 0.00 0.00 179.24 178.85 1jx2 h ILE 154 N 0.55 1.16 0.00 2.25 3.07 -2.04 -3.29 117.51 119.22 1jx2 h ILE 154 Ca 0.11 -2.55 0.00 0.00 1.55 0.00 0.00 64.86 63.96 1jx2 h ILE 154 Cb 0.54 2.92 0.00 0.00 -0.27 0.00 0.00 36.82 40.01 1jx2 h ILE 154 CO 0.03 0.79 0.00 -0.62 -1.05 0.00 0.00 178.15 177.30 1jx2 n GLU 155 N -3.79 0.54 -0.11 0.16 1.02 -1.24 -2.06 120.64 115.17 1jx2 n GLU 155 Ca -0.20 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.76 1jx2 n GLU 155 Cb 1.01 -1.10 -0.09 0.00 -0.02 0.00 0.00 31.44 31.24 1jx2 n GLU 155 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1jx2 n GLN 156 N -0.23 0.52 0.06 3.49 7.27 -1.14 -4.15 117.38 123.19 1jx2 n GLN 156 Ca 0.00 0.15 -0.10 0.00 0.07 0.00 0.00 57.00 57.12 1jx2 n GLN 156 Cb 0.05 -1.39 0.03 0.00 2.41 0.00 0.00 30.24 31.33 1jx2 n GLN 156 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 1jx2 h GLN 157 N -0.22 0.38 0.57 3.69 7.50 -1.55 -2.52 115.11 122.97 1jx2 h GLN 157 Ca -0.50 -0.32 -0.02 0.00 0.50 0.00 0.00 58.65 58.31 1jx2 h GLN 157 Cb 1.67 0.07 -0.01 0.00 0.05 0.00 0.00 27.48 29.27 1jx2 h GLN 157 CO -0.15 0.96 -0.36 0.82 -1.50 0.00 0.00 178.83 178.61 1jx2 h ILE 158 N 0.26 0.27 -0.56 2.54 2.04 -1.69 0.37 117.51 120.74 1jx2 h ILE 158 Ca -0.03 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.91 1jx2 h ILE 158 Cb 1.32 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1jx2 h ILE 158 CO 0.13 0.00 0.37 0.03 0.00 0.00 0.00 178.15 178.68 1jx2 h ARG 159 N -0.88 0.43 -0.24 2.37 3.08 -1.72 0.23 114.38 117.64 1jx2 h ARG 159 Ca -0.07 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 1jx2 h ARG 159 Cb 0.72 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 1jx2 h ARG 159 CO 0.06 0.28 0.02 -0.09 -1.07 0.00 0.00 179.97 179.18 1jx2 h ARG 160 N 0.44 0.41 0.30 0.04 9.65 -0.90 -1.00 114.38 123.33 1jx2 h ARG 160 Ca 0.25 -0.12 -0.01 0.00 -1.10 0.00 0.00 59.98 58.99 1jx2 h ARG 160 Cb 0.41 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.95 1jx2 h ARG 160 CO -0.07 0.57 -0.15 1.98 2.80 0.00 0.00 179.97 185.10 1jx2 h MET 161 N 0.20 -0.39 -0.26 0.20 4.05 0.15 -0.98 114.93 117.90 1jx2 h MET 161 Ca 0.07 0.03 0.06 0.00 -0.28 0.00 0.00 59.70 59.58 1jx2 h MET 161 Cb 0.37 0.09 -0.07 0.00 -0.80 0.00 0.00 31.60 31.18 1jx2 h MET 161 CO 0.01 -0.18 -0.27 0.28 0.23 0.00 0.00 176.91 176.98 1jx2 h VAL 162 N -0.54 0.34 -0.68 -5.77 2.07 -0.61 -0.94 116.25 110.12 1jx2 h VAL 162 Ca -0.04 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.58 1jx2 h VAL 162 Cb 0.40 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 30.44 1jx2 h VAL 162 CO 0.07 0.00 0.30 0.24 0.02 0.00 0.00 177.57 178.20 1jx2 h MET 163 N -0.27 0.49 0.00 1.57 2.07 -1.10 0.34 114.93 118.02 1jx2 h MET 163 Ca 0.14 -0.03 0.00 0.00 -2.07 0.00 0.00 59.70 57.74 1jx2 h MET 163 Cb 0.49 -0.11 0.00 0.00 -1.87 0.00 0.00 31.60 30.11 1jx2 h MET 163 CO -0.41 0.32 0.00 0.00 1.07 0.00 0.00 176.91 177.89 1jx2 h ALA 164 N 1.45 1.00 0.00 6.32 0.00 0.13 -0.80 119.26 127.35 1jx2 h ALA 164 Ca 0.35 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 55.00 1jx2 h ALA 164 Cb 0.42 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1jx2 h ALA 164 CO -0.31 0.00 -1.56 0.66 0.00 0.00 0.00 179.25 178.04 1jx2 n TYR 165 N -2.31 0.55 1.10 0.00 4.02 0.10 -4.39 117.16 116.24 1jx2 n TYR 165 Ca 0.00 0.24 0.12 0.00 -0.01 0.00 0.00 57.90 58.25 1jx2 n TYR 165 Cb 0.13 -0.95 0.60 0.00 -0.02 0.00 0.00 39.34 39.10 1jx2 n TYR 165 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 176.86 176.29 1jx2 n ILE 166 N -4.40 0.23 -0.09 -0.72 -5.35 -0.12 -3.39 119.36 105.52 1jx2 n ILE 166 Ca -0.34 0.06 -0.09 0.00 -0.27 0.00 0.00 62.75 62.10 1jx2 n ILE 166 Cb 0.67 -0.64 -0.02 0.00 -1.74 0.00 0.00 39.64 37.91 1jx2 n ILE 166 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1jx2 h LYS 167 N 0.00 0.40 -6.96 6.28 1.63 -1.34 -3.44 116.57 113.14 1jx2 h LYS 167 Ca 0.00 -0.04 -0.54 0.00 -0.85 0.00 0.00 60.65 59.22 1jx2 h LYS 167 Cb 0.28 -0.08 0.11 0.00 -0.60 0.00 0.00 32.23 31.94 1jx2 h LYS 167 CO 0.00 0.33 0.74 0.15 -3.45 0.00 0.00 179.45 177.22 1jx2 s LYS 168 N -5.93 3.96 0.00 1.90 1.02 -1.22 -4.91 119.74 114.56 1jx2 s LYS 168 Ca -0.13 2.48 0.28 0.00 0.02 0.00 0.00 55.97 58.62 1jx2 s LYS 168 Cb 0.09 -2.85 1.00 0.00 -0.52 0.00 0.00 37.83 35.56 1jx2 s LYS 168 CO 0.71 -0.62 1.76 1.04 -0.92 0.00 0.00 175.35 177.32 1jx2 n GLN 169 N 0.21 0.01 -0.23 1.68 3.00 -1.26 -3.14 117.38 117.65 1jx2 n GLN 169 Ca 0.03 -0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.06 1jx2 n GLN 169 Cb 0.40 -1.50 0.16 0.00 0.00 0.00 0.00 30.24 29.31 1jx2 n GLN 169 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1jx2 n ASN 170 N -1.49 2.16 -4.42 1.08 0.23 -1.26 -4.83 115.26 106.73 1jx2 n ASN 170 Ca 0.07 -2.10 -0.31 0.00 -0.53 0.00 0.00 54.58 51.70 1jx2 n ASN 170 Cb 0.34 -0.31 -0.14 0.00 -2.08 0.00 0.00 39.78 37.59 1jx2 n ASN 170 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1jx2 s ALA 171 N -1.60 2.49 -0.16 -2.53 0.00 -1.19 -1.84 121.76 116.92 1jx2 s ALA 171 Ca 0.24 -1.11 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 1jx2 s ALA 171 Cb 0.14 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 1jx2 s ALA 171 CO 0.14 0.55 -0.01 0.42 0.00 0.00 0.00 175.76 176.86 1jx2 s ILE 172 N -0.78 4.13 -0.22 0.00 1.01 0.55 -4.95 121.20 120.93 1jx2 s ILE 172 Ca 0.12 -0.27 -0.13 0.00 0.00 0.00 0.00 60.65 60.37 1jx2 s ILE 172 Cb -0.10 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 1jx2 s ILE 172 CO 0.02 0.48 0.29 -0.63 0.00 0.00 0.00 174.94 175.10 1jx2 s ILE 173 N 0.38 5.27 -0.55 2.92 1.01 -0.48 -0.24 121.20 129.51 1jx2 s ILE 173 Ca -0.02 0.47 -0.13 0.00 0.00 0.00 0.00 60.65 60.98 1jx2 s ILE 173 Cb -0.14 -3.63 0.14 0.00 0.01 0.00 0.00 42.46 38.84 1jx2 s ILE 173 CO 0.02 0.29 0.47 -0.69 0.00 0.00 0.00 174.94 175.03 1jx2 s VAL 174 N 1.19 4.80 -0.58 2.92 1.01 0.10 -0.59 120.40 129.25 1jx2 s VAL 174 Ca 0.14 -1.78 -0.24 0.00 0.00 0.00 0.00 61.98 60.09 1jx2 s VAL 174 Cb -0.14 -4.10 0.05 0.00 0.00 0.00 0.00 36.38 32.19 1jx2 s VAL 174 CO 0.06 -0.85 0.97 0.00 0.00 0.00 0.00 175.10 175.28 1jx2 s ALA 175 N 1.27 3.12 -0.04 5.51 0.00 -0.66 -0.34 121.76 130.63 1jx2 s ALA 175 Ca 0.06 -1.35 -0.21 0.00 0.00 0.00 0.00 51.96 50.46 1jx2 s ALA 175 Cb -0.26 -3.80 -0.05 0.00 0.00 0.00 0.00 23.12 19.02 1jx2 s ALA 175 CO -0.00 -2.52 0.63 0.08 0.00 0.00 0.00 175.76 173.95 1jx2 s VAL 176 N 4.10 4.99 -0.11 0.00 1.01 0.73 -0.50 120.40 130.61 1jx2 s VAL 176 Ca 0.29 1.30 -0.06 0.00 0.00 0.00 0.00 61.98 63.52 1jx2 s VAL 176 Cb -0.13 -3.97 0.05 0.00 0.00 0.00 0.00 36.38 32.33 1jx2 s VAL 176 CO 0.17 0.34 0.26 -0.89 0.00 0.00 0.00 175.10 174.99 1jx2 s THR 177 N 0.30 -0.05 0.39 3.92 2.01 0.06 -4.36 115.64 117.91 1jx2 s THR 177 Ca 0.33 0.15 -0.27 0.00 0.31 0.00 0.00 61.69 62.20 1jx2 s THR 177 Cb -0.18 -0.41 -0.10 0.00 0.01 0.00 0.00 72.50 71.83 1jx2 s THR 177 CO 0.17 0.06 1.45 -2.84 -0.69 0.00 0.00 174.62 172.77 1jx2 s PRO 178 N 1.31 4.02 0.51 4.92 0.02 -1.26 -2.21 135.00 142.30 1jx2 s PRO 178 Ca -0.09 2.49 0.30 0.00 0.02 0.00 0.00 61.00 63.72 1jx2 s PRO 178 Cb -0.10 -2.89 1.02 0.00 0.02 0.00 0.00 34.50 32.54 1jx2 s PRO 178 CO -0.09 -0.57 1.86 0.00 -0.33 0.00 0.00 177.00 177.86 1jx2 h ALA 179 N 2.85 1.00 -0.70 -1.55 0.00 -0.19 -3.19 119.26 117.48 1jx2 h ALA 179 Ca -0.51 -0.01 -0.51 0.00 0.00 0.00 0.00 54.91 53.88 1jx2 h ALA 179 Cb 1.24 -0.00 -0.21 0.00 0.00 0.00 0.00 17.79 18.83 1jx2 h ALA 179 CO 0.63 0.02 0.62 0.27 0.00 0.00 0.00 179.25 180.79 1jx2 n ASN 180 N -3.11 6.98 -2.75 0.00 2.04 -1.26 -4.29 115.26 112.86 1jx2 n ASN 180 Ca 0.02 -3.39 -0.09 0.00 -0.44 0.00 0.00 54.58 50.67 1jx2 n ASN 180 Cb 0.38 -1.06 0.08 0.00 -2.53 0.00 0.00 39.78 36.65 1jx2 n ASN 180 CO 0.00 0.00 0.00 0.41 -0.44 0.00 0.00 177.26 177.23 1jx2 n THR 181 N -0.06 0.14 0.00 5.53 -1.04 -1.21 -5.04 114.28 112.60 1jx2 n THR 181 Ca 0.46 -2.08 0.00 0.00 -2.04 0.00 0.00 64.05 60.39 1jx2 n THR 181 Cb 0.57 0.96 0.00 0.00 -1.82 0.00 0.00 70.33 70.03 1jx2 n THR 181 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1jx2 n ASP 182 N -0.14 0.00 0.00 8.00 3.85 -1.26 -4.76 116.55 122.24 1jx2 n ASP 182 Ca 0.05 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.13 1jx2 n ASP 182 Cb 0.78 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.55 1jx2 n ASP 182 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 1jx2 n LEU 183 N 0.00 0.64 -4.77 -2.12 -0.00 -1.26 -4.91 117.00 104.57 1jx2 n LEU 183 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 56.01 55.63 1jx2 n LEU 183 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.38 1jx2 n LEU 183 CO 0.00 0.11 0.76 0.00 -0.00 0.00 0.00 177.39 178.26 1jx2 s ALA 184 N -1.34 3.20 -1.17 1.96 0.00 -1.26 -3.59 121.76 119.56 1jx2 s ALA 184 Ca 0.00 0.79 -0.02 0.00 0.00 0.00 0.00 51.96 52.74 1jx2 s ALA 184 Cb 0.00 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 1jx2 s ALA 184 CO 0.00 -0.23 0.95 0.09 0.00 0.00 0.00 175.76 176.57 1jx2 n ASN 185 N 0.38 -3.15 0.00 0.00 3.02 -1.26 -5.01 115.26 109.24 1jx2 n ASN 185 Ca 0.03 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.91 1jx2 n ASN 185 Cb 0.48 -5.02 0.00 0.00 -0.61 0.00 0.00 39.78 34.62 1jx2 n ASN 185 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1jx2 n SER 186 N -3.14 0.00 0.06 6.41 7.64 -1.24 -5.08 113.62 118.28 1jx2 n SER 186 Ca -0.23 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.65 1jx2 n SER 186 Cb 0.66 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.86 1jx2 n SER 186 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1jx2 n ASP 187 N 0.00 -1.08 -0.01 6.43 5.68 -1.26 -4.92 116.55 121.39 1jx2 n ASP 187 Ca 0.00 0.39 -0.13 0.00 -0.50 0.00 0.00 54.79 54.55 1jx2 n ASP 187 Cb 0.00 1.25 -0.09 0.00 -1.14 0.00 0.00 41.12 41.13 1jx2 n ASP 187 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1jx2 h ALA 188 N 0.00 0.02 -0.10 2.12 0.00 -1.89 -2.82 119.26 116.60 1jx2 h ALA 188 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1jx2 h ALA 188 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1jx2 h ALA 188 CO 0.00 -0.24 0.03 -0.07 0.00 0.00 0.00 179.25 178.97 1jx2 h LEU 189 N -0.39 0.11 0.48 0.00 4.07 -1.91 0.80 115.31 118.47 1jx2 h LEU 189 Ca 0.00 -0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 1jx2 h LEU 189 Cb 0.46 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.17 1jx2 h LEU 189 CO 0.00 0.11 -0.23 1.56 -1.08 0.00 0.00 178.44 178.81 1jx2 h GLN 190 N 0.13 -0.61 -0.30 1.13 4.20 -1.88 0.11 115.11 117.89 1jx2 h GLN 190 Ca 0.03 0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.76 1jx2 h GLN 190 Cb 0.04 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 1jx2 h GLN 190 CO -0.00 -0.36 0.05 -0.07 -0.67 0.00 0.00 178.83 177.78 1jx2 h LEU 191 N -0.75 0.40 0.70 1.46 3.38 -1.22 -1.90 115.31 117.37 1jx2 h LEU 191 Ca -0.07 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1jx2 h LEU 191 Cb 0.54 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.20 1jx2 h LEU 191 CO 0.11 0.42 -0.34 0.00 0.09 0.00 0.00 178.44 178.72 1jx2 h ALA 192 N 1.64 -0.94 0.00 1.53 0.00 -0.47 -2.68 119.26 118.34 1jx2 h ALA 192 Ca 0.10 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1jx2 h ALA 192 Cb 0.20 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1jx2 h ALA 192 CO -0.00 -1.00 -0.01 -0.22 0.00 0.00 0.00 179.25 178.03 1jx2 h LYS 193 N -1.00 0.00 -0.58 0.00 3.64 -0.54 0.62 116.57 118.71 1jx2 h LYS 193 Ca -0.10 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.19 1jx2 h LYS 193 Cb 0.74 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 1jx2 h LYS 193 CO 0.16 0.01 -0.01 1.49 -2.27 0.00 0.00 179.45 178.83 1jx2 h GLU 194 N 0.00 1.03 0.00 1.90 4.81 -1.01 -2.40 114.58 118.91 1jx2 h GLU 194 Ca -0.00 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1jx2 h GLU 194 Cb 0.03 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1jx2 h GLU 194 CO 0.00 1.02 -1.78 1.33 -0.73 0.00 0.00 179.01 178.85 1jx2 n VAL 195 N -4.21 0.02 -3.43 0.32 0.24 -0.70 -4.61 118.33 105.96 1jx2 n VAL 195 Ca 0.02 -0.41 -0.26 0.00 -2.04 0.00 0.00 64.34 61.65 1jx2 n VAL 195 Cb 0.35 0.16 -0.09 0.00 -1.47 0.00 0.00 33.84 32.79 1jx2 n VAL 195 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1jx2 n ASP 196 N -2.14 2.32 -0.16 -1.34 2.03 0.21 -4.97 116.55 112.49 1jx2 n ASP 196 Ca -0.02 -3.12 -0.02 0.00 0.52 0.00 0.00 54.79 52.15 1jx2 n ASP 196 Cb 0.53 -0.67 0.07 0.00 -0.72 0.00 0.00 41.12 40.33 1jx2 n ASP 196 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1jx2 h PRO 197 N 4.44 0.16 -0.01 -0.67 0.11 -1.66 -1.62 132.00 132.75 1jx2 h PRO 197 Ca 0.16 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1jx2 h PRO 197 Cb 0.76 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1jx2 h PRO 197 CO 0.68 0.11 0.00 0.39 -0.21 0.00 0.00 178.00 178.96 1jx2 n GLU 198 N -5.18 1.17 -3.92 1.05 1.02 -1.26 -4.92 120.64 108.59 1jx2 n GLU 198 Ca 0.06 -0.25 -0.26 0.00 -0.02 0.00 0.00 57.16 56.69 1jx2 n GLU 198 Cb 0.27 -1.46 -0.00 0.00 -0.02 0.00 0.00 31.44 30.22 1jx2 n GLU 198 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1jx2 n GLY 199 N 1.01 -0.29 0.29 0.62 0.00 -0.61 -4.76 105.19 101.45 1jx2 n GLY 199 Ca 0.21 0.15 0.11 0.00 0.00 0.00 0.00 46.02 46.48 1jx2 n GLY 199 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1jx2 n LYS 200 N -4.40 0.72 -2.29 1.61 2.85 -1.26 -1.80 118.16 113.58 1jx2 n LYS 200 Ca -0.22 -0.59 0.00 0.00 -1.05 0.00 0.00 58.31 56.45 1jx2 n LYS 200 Cb 0.64 -1.49 0.04 0.00 -0.65 0.00 0.00 35.03 33.58 1jx2 n LYS 200 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 1jx2 n ARG 201 N -0.62 1.26 -4.33 -1.58 1.85 -1.26 -4.72 116.66 107.26 1jx2 n ARG 201 Ca 0.07 -3.05 -0.24 0.00 -1.00 0.00 0.00 57.85 53.64 1jx2 n ARG 201 Cb 0.41 -1.12 -0.17 0.00 -1.05 0.00 0.00 32.46 30.53 1jx2 n ARG 201 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1jx2 s THR 202 N -2.59 0.97 -0.18 8.89 2.01 -1.26 -1.38 115.64 122.09 1jx2 s THR 202 Ca 0.31 -0.35 0.01 0.00 0.31 0.00 0.00 61.69 61.97 1jx2 s THR 202 Cb 0.35 -0.93 0.02 0.00 0.01 0.00 0.00 72.50 71.95 1jx2 s THR 202 CO -0.08 0.33 -0.19 -0.51 -0.69 0.00 0.00 174.62 173.48 1jx2 s ILE 203 N 0.98 2.13 0.01 1.82 2.07 0.24 -4.23 121.20 124.22 1jx2 s ILE 203 Ca -0.09 -0.92 -0.22 0.00 -1.41 0.00 0.00 60.65 58.01 1jx2 s ILE 203 Cb -0.15 -1.89 -0.05 0.00 0.13 0.00 0.00 42.46 40.50 1jx2 s ILE 203 CO 0.00 0.53 0.65 -0.83 -1.91 0.00 0.00 174.94 173.39 1jx2 s GLY 204 N 1.24 2.67 -0.23 1.50 0.00 -0.93 -1.65 107.32 109.91 1jx2 s GLY 204 Ca 0.04 0.11 -0.04 0.00 0.00 0.00 0.00 44.72 44.83 1jx2 s GLY 204 CO -0.11 0.88 -0.03 0.14 0.00 0.00 0.00 173.10 173.98 1jx2 s VAL 205 N -0.10 3.38 -0.37 1.40 1.01 0.34 -1.55 120.40 124.50 1jx2 s VAL 205 Ca 0.34 -0.60 -0.13 0.00 0.00 0.00 0.00 61.98 61.59 1jx2 s VAL 205 Cb -0.19 -2.59 0.01 0.00 0.00 0.00 0.00 36.38 33.61 1jx2 s VAL 205 CO 0.19 0.34 0.24 -0.63 0.00 0.00 0.00 175.10 175.25 1jx2 s ILE 206 N 1.46 5.00 0.56 2.22 -1.09 -0.34 -0.76 121.20 128.24 1jx2 s ILE 206 Ca 0.05 -0.58 0.08 0.00 -2.23 0.00 0.00 60.65 57.96 1jx2 s ILE 206 Cb -0.15 -3.71 0.07 0.00 -1.58 0.00 0.00 42.46 37.09 1jx2 s ILE 206 CO -0.03 -0.18 0.64 0.42 -1.23 0.00 0.00 174.94 174.56 1jx2 s THR 207 N 1.65 1.95 -1.44 2.92 -4.23 -0.94 -0.13 115.64 115.43 1jx2 s THR 207 Ca 0.04 -1.20 -0.12 0.00 -1.18 0.00 0.00 61.69 59.23 1jx2 s THR 207 Cb -0.18 -2.15 0.09 0.00 1.34 0.00 0.00 72.50 71.60 1jx2 s THR 207 CO 0.09 0.00 0.66 0.29 -0.54 0.00 0.00 174.62 175.12 1jx2 n LYS 208 N -2.05 -3.79 -0.23 3.99 5.02 -1.17 0.43 118.16 120.36 1jx2 n LYS 208 Ca 0.09 0.48 -0.03 0.00 -2.02 0.00 0.00 58.31 56.83 1jx2 n LYS 208 Cb 0.63 -5.24 0.15 0.00 -0.02 0.00 0.00 35.03 30.54 1jx2 n LYS 208 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1jx2 h LEU 209 N -1.32 0.95 -0.45 -0.35 3.38 -1.82 -1.37 115.31 114.33 1jx2 h LEU 209 Ca -0.50 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.35 1jx2 h LEU 209 Cb 1.33 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1jx2 h LEU 209 CO 0.62 0.83 0.00 -0.90 0.09 0.00 0.00 178.44 179.08 1jx2 n ASP 210 N -4.31 0.36 -0.30 -0.43 5.75 -1.26 -2.92 116.55 113.44 1jx2 n ASP 210 Ca 0.06 -1.58 0.06 0.00 -0.01 0.00 0.00 54.79 53.32 1jx2 n ASP 210 Cb 0.16 -0.18 0.08 0.00 -1.03 0.00 0.00 41.12 40.16 1jx2 n ASP 210 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1jx2 n LEU 211 N -0.23 1.40 0.00 -2.12 4.77 -0.52 -4.96 117.00 115.35 1jx2 n LEU 211 Ca 0.00 -2.27 0.00 0.00 -0.03 0.00 0.00 56.01 53.71 1jx2 n LEU 211 Cb 0.09 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1jx2 n LEU 211 CO 0.00 0.55 0.00 0.23 -1.33 0.00 0.00 177.39 176.84 1jx2 n MET 212 N -0.81 0.00 -1.97 3.23 2.81 -1.15 -4.60 117.12 114.63 1jx2 n MET 212 Ca 0.10 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.97 1jx2 n MET 212 Cb 0.68 -0.18 0.01 0.00 -0.71 0.00 0.00 33.22 33.01 1jx2 n MET 212 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1jx2 n ASP 213 N 0.00 -0.47 0.00 7.83 8.00 -1.26 -4.91 116.55 125.75 1jx2 n ASP 213 Ca 0.00 -1.26 0.00 0.00 0.71 0.00 0.00 54.79 54.24 1jx2 n ASP 213 Cb 0.00 0.76 0.00 0.00 -0.02 0.00 0.00 41.12 41.86 1jx2 n ASP 213 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1jx2 n LYS 214 N -0.17 0.00 -0.71 -1.24 5.02 -1.26 -3.47 118.16 116.33 1jx2 n LYS 214 Ca -0.01 0.43 0.08 0.00 -2.02 0.00 0.00 58.31 56.80 1jx2 n LYS 214 Cb 0.15 -1.15 0.36 0.00 -0.02 0.00 0.00 35.03 34.37 1jx2 n LYS 214 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jx2 n GLY 215 N -0.85 3.03 3.66 0.72 0.00 -1.26 -4.94 105.19 105.55 1jx2 n GLY 215 Ca 0.00 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 1jx2 n GLY 215 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jx2 s THR 216 N -2.36 4.30 0.36 2.61 2.01 -1.23 -5.02 115.64 116.31 1jx2 s THR 216 Ca 0.51 1.55 0.09 0.00 0.31 0.00 0.00 61.69 64.15 1jx2 s THR 216 Cb 0.36 -4.05 -0.06 0.00 0.01 0.00 0.00 72.50 68.76 1jx2 s THR 216 CO 0.19 -0.19 -0.03 -0.62 -0.69 0.00 0.00 174.62 173.27 1jx2 s ASP 217 N 2.03 3.92 0.00 3.53 -1.08 -1.26 -4.40 116.67 119.41 1jx2 s ASP 217 Ca 0.54 -1.16 0.00 0.00 -0.52 0.00 0.00 52.55 51.41 1jx2 s ASP 217 Cb -0.20 -0.42 0.00 0.00 -1.46 0.00 0.00 42.92 40.84 1jx2 s ASP 217 CO 0.15 -0.27 0.61 0.00 0.52 0.00 0.00 175.17 176.18 1jx2 n ALA 218 N -0.89 1.32 0.31 3.66 0.00 -1.26 -4.81 120.51 118.85 1jx2 n ALA 218 Ca -0.05 -0.61 0.16 0.00 0.00 0.00 0.00 53.44 52.95 1jx2 n ALA 218 Cb 0.64 0.00 0.84 0.00 0.00 0.00 0.00 19.45 20.93 1jx2 n ALA 218 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1jx2 h MET 219 N 0.00 0.00 -0.30 0.00 2.86 -1.98 -1.19 114.93 114.32 1jx2 h MET 219 Ca 0.00 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 1jx2 h MET 219 Cb 0.71 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 1jx2 h MET 219 CO 0.00 0.00 -0.00 1.49 1.06 0.00 0.00 176.91 179.46 1jx2 h GLU 220 N 0.00 0.53 0.19 1.72 4.57 -1.98 -1.74 114.58 117.86 1jx2 h GLU 220 Ca 0.02 -0.17 -0.32 0.00 -1.18 0.00 0.00 59.36 57.72 1jx2 h GLU 220 Cb 0.66 -0.05 0.02 0.00 -0.16 0.00 0.00 28.75 29.22 1jx2 h GLU 220 CO -0.00 0.67 -1.45 -0.24 -1.18 0.00 0.00 179.01 176.81 1jx2 h VAL 221 N 0.32 1.29 -0.53 0.32 3.04 -1.64 -1.74 116.25 117.31 1jx2 h VAL 221 Ca 0.08 -2.81 0.02 0.00 -1.01 0.00 0.00 66.70 62.99 1jx2 h VAL 221 Cb 0.44 2.94 -0.03 0.00 -2.01 0.00 0.00 31.29 32.63 1jx2 h VAL 221 CO 0.02 0.84 0.35 -0.07 -1.01 0.00 0.00 177.57 177.70 1jx2 h LEU 222 N 0.11 0.55 -0.57 3.16 4.07 -1.38 0.31 115.31 121.56 1jx2 h LEU 222 Ca -0.23 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.72 1jx2 h LEU 222 Cb 2.08 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 43.69 1jx2 h LEU 222 CO 0.23 0.39 -0.01 0.35 -1.08 0.00 0.00 178.44 178.32 1jx2 n THR 223 N -4.47 0.00 -2.13 0.22 -2.24 -0.66 -4.54 114.28 100.47 1jx2 n THR 223 Ca 0.06 -0.15 -0.02 0.00 -2.27 0.00 0.00 64.05 61.67 1jx2 n THR 223 Cb 0.11 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 1jx2 n THR 223 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jx2 n GLY 224 N 1.11 -0.82 0.81 3.38 0.00 0.11 -5.03 105.19 104.76 1jx2 n GLY 224 Ca 0.21 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1jx2 n GLY 224 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jx2 n ARG 225 N -0.92 0.00 -0.09 1.61 1.74 -0.66 -4.60 116.66 113.75 1jx2 n ARG 225 Ca 0.02 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.17 1jx2 n ARG 225 Cb 0.36 -0.28 0.42 0.00 -1.02 0.00 0.00 32.46 31.94 1jx2 n ARG 225 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1jx2 h VAL 226 N 0.00 1.02 -0.90 1.55 2.07 -1.85 -3.38 116.25 114.76 1jx2 h VAL 226 Ca 0.00 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 1jx2 h VAL 226 Cb 0.00 0.37 -0.19 0.00 -1.52 0.00 0.00 31.29 29.95 1jx2 h VAL 226 CO 0.00 0.11 -0.40 -0.51 0.02 0.00 0.00 177.57 176.79 1jx2 s ILE 227 N -5.54 -0.90 0.62 4.57 1.10 -1.26 -5.08 121.20 114.71 1jx2 s ILE 227 Ca -0.09 0.00 -0.18 0.00 -0.51 0.00 0.00 60.65 59.88 1jx2 s ILE 227 Cb 0.19 -0.06 -0.05 0.00 0.15 0.00 0.00 42.46 42.69 1jx2 s ILE 227 CO 0.75 0.00 0.88 -2.65 -2.11 0.00 0.00 174.94 171.81 1jx2 n PRO 228 N 4.40 0.75 -3.72 3.50 -0.02 -1.26 -4.94 135.00 133.71 1jx2 n PRO 228 Ca 0.10 0.30 -0.12 0.00 -2.02 0.00 0.00 63.50 61.76 1jx2 n PRO 228 Cb 0.58 -2.09 -0.10 0.00 -0.02 0.00 0.00 33.50 31.86 1jx2 n PRO 228 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1jx2 s LEU 229 N -1.70 0.22 0.25 2.45 1.43 -1.26 -4.93 118.68 115.14 1jx2 s LEU 229 Ca 0.75 0.86 -0.04 0.00 -1.03 0.00 0.00 54.13 54.67 1jx2 s LEU 229 Cb -0.41 1.39 0.45 0.00 0.03 0.00 0.00 46.19 47.66 1jx2 s LEU 229 CO 0.48 -0.16 1.75 0.74 0.23 0.00 0.00 176.35 179.39 1jx2 h THR 230 N 4.90 0.72 0.00 5.49 2.02 -1.62 -1.22 112.91 123.19 1jx2 h THR 230 Ca -0.31 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.69 1jx2 h THR 230 Cb 1.18 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1jx2 h THR 230 CO 0.27 0.10 -0.28 -0.07 0.37 0.00 0.00 175.52 175.90 1jx2 h LEU 231 N 0.54 0.00 0.00 2.58 3.38 -1.80 -3.50 115.31 116.50 1jx2 h LEU 231 Ca 0.41 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1jx2 h LEU 231 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1jx2 h LEU 231 CO -0.36 0.04 0.00 0.61 0.09 0.00 0.00 178.44 178.82 1jx2 n GLY 232 N 1.30 -1.71 3.37 0.83 0.00 -0.46 -4.93 105.19 103.59 1jx2 n GLY 232 Ca 0.04 -1.35 -0.20 0.00 0.00 0.00 0.00 46.02 44.52 1jx2 n GLY 232 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jx2 s PHE 233 N 0.00 1.82 -0.06 1.61 0.40 -1.26 -2.20 117.98 118.29 1jx2 s PHE 233 Ca 0.00 -0.52 -0.03 0.00 -0.60 0.00 0.00 56.93 55.78 1jx2 s PHE 233 Cb 0.00 -0.83 0.04 0.00 0.51 0.00 0.00 43.02 42.73 1jx2 s PHE 233 CO 0.00 0.42 0.12 0.42 0.70 0.00 0.00 175.22 176.88 1jx2 s ILE 234 N -2.83 -0.16 0.18 0.64 1.01 -0.59 -4.98 121.20 114.47 1jx2 s ILE 234 Ca 0.23 0.31 -0.07 0.00 0.00 0.00 0.00 60.65 61.13 1jx2 s ILE 234 Cb -0.02 -0.23 -0.06 0.00 0.01 0.00 0.00 42.46 42.16 1jx2 s ILE 234 CO 0.08 0.13 0.45 -0.83 0.00 0.00 0.00 174.94 174.77 1jx2 s GLY 235 N 1.86 2.25 0.22 6.18 0.00 -1.26 -1.20 107.32 115.36 1jx2 s GLY 235 Ca -0.01 -0.44 -0.14 0.00 0.00 0.00 0.00 44.72 44.13 1jx2 s GLY 235 CO -0.05 -0.34 0.48 -1.34 0.00 0.00 0.00 173.10 171.85 1jx2 s VAL 236 N -1.73 0.02 0.05 1.40 -7.23 0.82 -1.38 120.40 112.35 1jx2 s VAL 236 Ca 0.44 -1.20 0.02 0.00 -1.81 0.00 0.00 61.98 59.43 1jx2 s VAL 236 Cb -0.12 -1.96 -0.03 0.00 0.56 0.00 0.00 36.38 34.84 1jx2 s VAL 236 CO 0.23 -0.08 -0.08 0.27 -0.31 0.00 0.00 175.10 175.13 1jx2 s ILE 237 N -3.96 0.57 0.37 -0.62 -4.36 -1.26 -3.05 121.20 108.89 1jx2 s ILE 237 Ca 0.17 -1.19 0.04 0.00 -0.26 0.00 0.00 60.65 59.40 1jx2 s ILE 237 Cb -0.00 -0.76 -0.04 0.00 1.25 0.00 0.00 42.46 42.91 1jx2 s ILE 237 CO 0.04 -0.44 0.08 0.20 0.24 0.00 0.00 174.94 175.06 1jx2 s ASN 238 N -1.77 2.67 0.64 4.36 -0.87 -1.26 -4.95 114.94 113.75 1jx2 s ASN 238 Ca -0.07 -1.52 -0.18 0.00 -1.57 0.00 0.00 52.86 49.52 1jx2 s ASN 238 Cb -0.08 0.21 -0.02 0.00 -0.02 0.00 0.00 41.25 41.34 1jx2 s ASN 238 CO -0.00 -0.76 1.25 0.54 -2.57 0.00 0.00 177.10 175.55 1jx2 n ARG 239 N -0.82 1.10 -2.56 -0.60 1.74 -1.26 -5.02 116.66 109.23 1jx2 n ARG 239 Ca -0.05 0.43 -0.22 0.00 -0.77 0.00 0.00 57.85 57.24 1jx2 n ARG 239 Cb 0.66 -2.48 0.05 0.00 -1.02 0.00 0.00 32.46 29.66 1jx2 n ARG 239 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1jx2 s SER 240 N -1.35 5.14 0.22 0.55 1.04 -1.26 -4.96 113.70 113.08 1jx2 s SER 240 Ca 0.82 0.04 -0.07 0.00 0.48 0.00 0.00 55.95 57.22 1jx2 s SER 240 Cb -0.39 -0.86 0.19 0.00 0.10 0.00 0.00 66.02 65.06 1jx2 s SER 240 CO 0.41 -1.27 1.80 -0.61 0.98 0.00 0.00 173.24 174.56 1jx2 h GLN 241 N -0.08 1.20 0.00 4.02 5.75 -2.00 -2.07 115.11 121.93 1jx2 h GLN 241 Ca -0.42 -0.20 0.00 0.00 -0.15 0.00 0.00 58.65 57.88 1jx2 h GLN 241 Cb 1.30 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 29.64 1jx2 h GLN 241 CO 0.53 0.95 0.00 1.05 -2.65 0.00 0.00 178.83 178.71 1jx2 h GLU 242 N 1.18 0.00 -0.19 1.69 4.11 -1.98 -2.35 114.58 117.03 1jx2 h GLU 242 Ca 0.28 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.50 1jx2 h GLU 242 Cb 0.17 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.43 1jx2 h GLU 242 CO -0.03 0.00 -0.68 -0.44 0.07 0.00 0.00 179.01 177.93 1jx2 h ASP 243 N 0.00 0.93 0.22 3.06 3.32 -1.76 -1.70 116.42 120.50 1jx2 h ASP 243 Ca 0.00 -0.60 -0.09 0.00 0.02 0.00 0.00 57.03 56.36 1jx2 h ASP 243 Cb 0.70 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1jx2 h ASP 243 CO 0.00 1.37 -0.34 0.40 -1.72 0.00 0.00 179.24 178.95 1jx2 h ILE 244 N 0.55 1.27 -0.42 0.35 2.04 -1.25 -2.33 117.51 117.73 1jx2 h ILE 244 Ca -0.03 -1.32 -0.12 0.00 1.00 0.00 0.00 64.86 64.40 1jx2 h ILE 244 Cb 1.31 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.96 1jx2 h ILE 244 CO 0.14 0.39 -0.21 0.40 0.00 0.00 0.00 178.15 178.88 1jx2 h ILE 245 N 0.16 1.27 -1.51 -0.67 2.04 -1.27 -3.45 117.51 114.08 1jx2 h ILE 245 Ca 0.02 -1.33 0.00 0.00 1.00 0.00 0.00 64.86 64.55 1jx2 h ILE 245 Cb 0.69 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 1jx2 h ILE 245 CO 0.05 0.45 0.00 0.00 0.00 0.00 0.00 178.15 178.65 1jx2 n ALA 246 N -2.50 0.00 0.13 1.87 0.00 -0.65 -4.99 120.51 114.37 1jx2 n ALA 246 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1jx2 n ALA 246 Cb 0.43 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.92 1jx2 n ALA 246 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1jx2 h LYS 247 N 0.00 0.00 -5.85 0.00 1.57 -1.87 -3.47 116.57 106.95 1jx2 h LYS 247 Ca 0.00 0.00 -0.76 0.00 -1.87 0.00 0.00 60.65 58.02 1jx2 h LYS 247 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1jx2 h LYS 247 CO 0.00 0.29 1.24 1.63 -0.57 0.00 0.00 179.45 182.04 1jx2 n LYS 248 N -3.07 0.00 -3.45 3.15 4.76 -1.24 -4.93 118.16 113.39 1jx2 n LYS 248 Ca 0.00 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.24 1jx2 n LYS 248 Cb 0.69 -1.46 -0.02 0.00 -1.84 0.00 0.00 35.03 32.39 1jx2 n LYS 248 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1jx2 s SER 249 N 5.63 5.26 1.12 4.39 1.04 -1.26 -4.51 113.70 125.37 1jx2 s SER 249 Ca 1.16 -0.62 -0.16 0.00 0.48 0.00 0.00 55.95 56.81 1jx2 s SER 249 Cb -1.46 -0.66 0.25 0.00 0.10 0.00 0.00 66.02 64.24 1jx2 s SER 249 CO 0.66 -0.64 1.10 -0.63 0.98 0.00 0.00 173.24 174.71 1jx2 s ILE 250 N -2.41 1.78 -1.04 -1.02 1.01 -1.26 -1.99 121.20 116.26 1jx2 s ILE 250 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 60.65 61.14 1jx2 s ILE 250 Cb -0.05 -2.49 0.00 0.00 0.01 0.00 0.00 42.46 39.93 1jx2 s ILE 250 CO 0.29 0.00 0.00 -2.11 0.00 0.00 0.00 174.94 173.12 1jx2 n ARG 251 N -4.52 -1.22 0.00 2.79 1.85 -1.26 -4.30 116.66 110.00 1jx2 n ARG 251 Ca 0.10 0.58 0.00 0.00 -1.00 0.00 0.00 57.85 57.52 1jx2 n ARG 251 Cb 0.59 -4.76 0.00 0.00 -1.05 0.00 0.00 32.46 27.23 1jx2 n ARG 251 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1jx2 n GLU 252 N -1.65 0.30 0.11 2.89 2.13 -1.16 -4.62 120.64 118.64 1jx2 n GLU 252 Ca -0.10 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.85 1jx2 n GLU 252 Cb 0.32 -0.60 0.32 0.00 0.27 0.00 0.00 31.44 31.75 1jx2 n GLU 252 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1jx2 h SER 253 N 0.00 0.00 -0.24 4.31 4.64 -1.59 -2.96 113.55 117.71 1jx2 h SER 253 Ca 0.00 -0.04 -0.14 0.00 -0.47 0.00 0.00 61.79 61.14 1jx2 h SER 253 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 1jx2 h SER 253 CO 0.00 0.02 -0.35 -0.07 -0.87 0.00 0.00 176.83 175.56 1jx2 h LEU 254 N 0.00 0.81 -1.34 5.97 3.38 -1.84 0.27 115.31 122.56 1jx2 h LEU 254 Ca 0.00 -0.35 0.09 0.00 0.09 0.00 0.00 57.88 57.71 1jx2 h LEU 254 Cb 0.79 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.25 1jx2 h LEU 254 CO 0.00 1.09 0.52 0.50 0.09 0.00 0.00 178.44 180.63 1jx2 h LYS 255 N 0.64 0.73 -0.15 1.13 3.64 -1.79 -0.91 116.57 119.87 1jx2 h LYS 255 Ca 0.06 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 1jx2 h LYS 255 Cb 0.90 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1jx2 h LYS 255 CO 0.08 0.48 -0.32 0.77 -2.27 0.00 0.00 179.45 178.19 1jx2 h SER 256 N 0.75 0.55 -0.99 4.20 0.02 -1.36 -3.05 113.55 113.66 1jx2 h SER 256 Ca 0.36 -0.56 0.15 0.00 -0.84 0.00 0.00 61.79 60.90 1jx2 h SER 256 Cb 0.41 -0.16 -0.09 0.00 0.14 0.00 0.00 62.40 62.70 1jx2 h SER 256 CO -0.14 1.01 0.61 -0.08 -1.14 0.00 0.00 176.83 177.09 1jx2 h GLU 257 N 0.11 0.85 -0.31 3.45 4.81 0.31 0.36 114.58 124.15 1jx2 h GLU 257 Ca 0.00 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1jx2 h GLU 257 Cb 0.92 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 1jx2 h GLU 257 CO 0.07 0.56 0.08 0.82 -0.73 0.00 0.00 179.01 179.82 1jx2 h ILE 258 N 0.88 1.21 -0.48 2.32 2.04 -1.24 -1.80 117.51 120.43 1jx2 h ILE 258 Ca 0.53 -0.71 -0.08 0.00 1.00 0.00 0.00 64.86 65.60 1jx2 h ILE 258 Cb 0.68 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 1jx2 h ILE 258 CO -0.32 0.24 -0.01 -0.07 0.00 0.00 0.00 178.15 177.98 1jx2 h LEU 259 N 0.34 0.79 0.41 1.44 3.38 -1.14 0.30 115.31 120.83 1jx2 h LEU 259 Ca 0.10 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1jx2 h LEU 259 Cb 0.28 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1jx2 h LEU 259 CO -0.00 0.86 -0.30 0.22 0.09 0.00 0.00 178.44 179.31 1jx2 h TYR 260 N 0.76 -0.81 -0.43 1.13 3.20 -0.07 0.11 116.97 120.87 1jx2 h TYR 260 Ca 0.14 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.89 1jx2 h TYR 260 Cb 0.48 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.03 1jx2 h TYR 260 CO 0.03 -0.45 -0.22 0.74 -1.64 0.00 0.00 178.16 176.61 1jx2 h PHE 261 N -0.70 1.00 -0.58 -3.82 -1.00 -1.18 -2.20 116.94 108.46 1jx2 h PHE 261 Ca -0.04 -0.24 -0.07 0.00 2.81 0.00 0.00 57.97 60.44 1jx2 h PHE 261 Cb 0.60 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 39.90 1jx2 h PHE 261 CO -0.14 1.01 0.10 0.87 -1.61 0.00 0.00 178.31 178.54 1jx2 h LYS 262 N 0.76 0.96 -0.86 1.51 1.79 -0.31 -2.97 116.57 117.44 1jx2 h LYS 262 Ca 0.10 -0.25 -0.46 0.00 -2.18 0.00 0.00 60.65 57.86 1jx2 h LYS 262 Cb 0.77 -0.11 -0.27 0.00 -1.58 0.00 0.00 32.23 31.04 1jx2 h LYS 262 CO 0.06 0.91 0.50 0.09 -1.08 0.00 0.00 179.45 179.93 1jx2 n ASN 263 N -4.33 3.72 -4.73 0.86 3.02 0.39 -4.65 115.26 109.55 1jx2 n ASN 263 Ca 0.03 -3.66 -0.35 0.00 -0.03 0.00 0.00 54.58 50.56 1jx2 n ASN 263 Cb 0.27 -0.80 -0.08 0.00 -0.61 0.00 0.00 39.78 38.56 1jx2 n ASN 263 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1jx2 s HIS 264 N -3.33 3.41 0.36 3.10 2.46 -0.83 -4.96 115.29 115.49 1jx2 s HIS 264 Ca 0.55 0.34 0.18 0.00 0.47 0.00 0.00 55.06 56.60 1jx2 s HIS 264 Cb 0.47 -2.17 1.25 0.00 -0.13 0.00 0.00 32.58 32.00 1jx2 s HIS 264 CO 0.08 0.28 1.60 -1.35 -2.47 0.00 0.00 174.74 172.88 1jx2 h PRO 265 N 6.69 0.08 0.00 2.88 0.11 -1.91 -1.75 132.00 138.10 1jx2 h PRO 265 Ca -0.41 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.54 1jx2 h PRO 265 Cb 1.15 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1jx2 h PRO 265 CO 0.76 0.06 -1.56 -0.89 -0.21 0.00 0.00 178.00 176.15 1jx2 n ILE 266 N -5.22 0.56 0.28 4.15 2.08 -1.26 -4.68 119.36 115.27 1jx2 n ILE 266 Ca 0.36 -0.19 0.16 0.00 0.56 0.00 0.00 62.75 63.64 1jx2 n ILE 266 Cb 1.18 -1.12 0.77 0.00 -0.75 0.00 0.00 39.64 39.72 1jx2 n ILE 266 CO 0.00 0.00 0.00 1.88 0.56 0.00 0.00 176.55 178.99 1jx2 h TYR 267 N -0.13 0.00 -0.53 1.39 0.99 -1.85 -3.14 116.97 113.69 1jx2 h TYR 267 Ca -0.23 0.00 0.16 0.00 2.00 0.00 0.00 58.73 60.65 1jx2 h TYR 267 Cb 1.30 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 39.01 1jx2 h TYR 267 CO -0.00 0.07 0.50 1.57 -0.00 0.00 0.00 178.16 180.29 1jx2 h LYS 268 N 0.00 0.00 0.00 4.88 2.10 -1.15 0.35 116.57 122.75 1jx2 h LYS 268 Ca -0.00 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.59 1jx2 h LYS 268 Cb 0.40 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.72 1jx2 h LYS 268 CO 0.01 0.00 -0.29 0.66 -2.00 0.00 0.00 179.45 177.83 1jx2 h SER 269 N 0.00 0.00 -0.05 7.07 4.64 -1.82 -2.95 113.55 120.43 1jx2 h SER 269 Ca 0.25 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 1jx2 h SER 269 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 1jx2 h SER 269 CO -0.00 0.29 -0.11 2.30 -0.87 0.00 0.00 176.83 178.43 1jx2 n ILE 270 N -3.54 2.04 -0.32 0.95 -5.35 0.11 -4.74 119.36 108.51 1jx2 n ILE 270 Ca -0.00 -2.46 0.03 0.00 -0.27 0.00 0.00 62.75 60.04 1jx2 n ILE 270 Cb 0.44 -0.25 0.17 0.00 -1.74 0.00 0.00 39.64 38.26 1jx2 n ILE 270 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1jx2 h ALA 271 N 0.49 1.24 0.00 -1.28 0.00 -0.92 -0.55 119.26 118.24 1jx2 h ALA 271 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1jx2 h ALA 271 Cb 1.09 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1jx2 h ALA 271 CO 0.05 0.21 0.00 0.09 0.00 0.00 0.00 179.25 179.60 1jx2 n ASN 272 N -4.66 0.46 -2.03 0.00 5.03 -1.26 -2.19 115.26 110.61 1jx2 n ASN 272 Ca 0.14 0.65 -0.25 0.00 0.87 0.00 0.00 54.58 55.99 1jx2 n ASN 272 Cb 0.24 -0.73 0.03 0.00 -1.02 0.00 0.00 39.78 38.30 1jx2 n ASN 272 CO 0.00 0.00 0.00 -2.11 -1.83 0.00 0.00 177.26 173.32 1jx2 n ARG 273 N -2.04 3.51 -4.15 3.52 1.85 -0.22 -4.90 116.66 114.23 1jx2 n ARG 273 Ca 0.01 -4.08 -0.12 0.00 -1.00 0.00 0.00 57.85 52.67 1jx2 n ARG 273 Cb 0.14 -2.27 -0.08 0.00 -1.05 0.00 0.00 32.46 29.20 1jx2 n ARG 273 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 1jx2 s SER 274 N -3.43 0.20 0.00 2.89 0.01 -0.93 -4.56 113.70 107.87 1jx2 s SER 274 Ca 0.52 -1.29 0.00 0.00 1.31 0.00 0.00 55.95 56.49 1jx2 s SER 274 Cb 0.42 0.45 0.00 0.00 0.21 0.00 0.00 66.02 67.10 1jx2 s SER 274 CO 0.03 -0.95 0.00 0.61 0.41 0.00 0.00 173.24 173.34 1jx2 n GLY 275 N -0.33 -0.18 0.26 3.44 0.00 -0.48 -4.12 105.19 103.77 1jx2 n GLY 275 Ca 0.01 -1.71 -0.08 0.00 0.00 0.00 0.00 46.02 44.24 1jx2 n GLY 275 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1jx2 h THR 276 N 0.00 1.24 -0.54 2.61 2.02 -1.94 -1.34 112.91 114.97 1jx2 h THR 276 Ca 0.00 -0.86 0.08 0.00 0.77 0.00 0.00 66.41 66.40 1jx2 h THR 276 Cb 0.00 0.76 -0.06 0.00 -1.74 0.00 0.00 68.15 67.10 1jx2 h THR 276 CO 0.00 0.32 0.18 0.00 0.37 0.00 0.00 175.52 176.39 1jx2 h ALA 277 N 1.02 0.66 -0.24 6.16 0.00 -1.95 0.71 119.26 125.62 1jx2 h ALA 277 Ca 0.17 0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.98 1jx2 h ALA 277 Cb 0.33 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1jx2 h ALA 277 CO 0.00 -0.22 -0.56 -0.92 0.00 0.00 0.00 179.25 177.55 1jx2 h TYR 278 N 0.35 0.93 -0.31 0.00 3.20 -1.68 -2.48 116.97 116.99 1jx2 h TYR 278 Ca 0.26 -0.33 -0.01 0.00 3.14 0.00 0.00 58.73 61.79 1jx2 h TYR 278 Cb 0.31 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 1jx2 h TYR 278 CO -0.17 1.13 0.14 1.25 -1.64 0.00 0.00 178.16 178.86 1jx2 h LEU 279 N 0.57 0.41 -0.72 2.82 5.85 -0.70 -1.79 115.31 121.74 1jx2 h LEU 279 Ca 0.01 -0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.54 1jx2 h LEU 279 Cb 1.14 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 1jx2 h LEU 279 CO 0.12 0.44 0.26 0.28 -0.34 0.00 0.00 178.44 179.19 1jx2 h SER 280 N 0.35 1.02 -0.69 1.25 0.02 -0.87 -1.28 113.55 113.35 1jx2 h SER 280 Ca 0.10 -0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 60.82 1jx2 h SER 280 Cb 0.14 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 1jx2 h SER 280 CO -0.01 0.93 0.26 0.50 -1.14 0.00 0.00 176.83 177.37 1jx2 h LYS 281 N 1.05 1.05 -0.08 3.45 3.64 -1.34 -1.98 116.57 122.36 1jx2 h LYS 281 Ca 0.24 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1jx2 h LYS 281 Cb 0.25 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1jx2 h LYS 281 CO -0.01 0.88 0.01 1.15 -2.27 0.00 0.00 179.45 179.21 1jx2 h THR 282 N 1.00 1.22 -0.73 1.00 2.02 -1.07 -1.56 112.91 114.79 1jx2 h THR 282 Ca 0.23 -0.69 0.02 0.00 0.77 0.00 0.00 66.41 66.74 1jx2 h THR 282 Cb 0.24 1.54 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 1jx2 h THR 282 CO -0.02 0.19 0.47 -0.07 0.37 0.00 0.00 175.52 176.47 1jx2 h LEU 283 N -0.12 0.79 -0.48 2.58 3.38 -1.18 0.35 115.31 120.64 1jx2 h LEU 283 Ca 0.02 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.01 1jx2 h LEU 283 Cb 0.29 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1jx2 h LEU 283 CO 0.00 0.56 0.27 -1.13 0.09 0.00 0.00 178.44 178.23 1jx2 h ASN 284 N 0.94 0.43 0.06 -0.43 -0.73 -1.25 -0.66 115.58 113.94 1jx2 h ASN 284 Ca 0.28 0.01 -0.00 0.00 1.87 0.00 0.00 56.30 58.46 1jx2 h ASN 284 Cb -0.03 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 38.48 1jx2 h ASN 284 CO -0.09 0.31 -0.03 0.50 -0.37 0.00 0.00 177.43 177.75 1jx2 h LYS 285 N 0.54 -0.08 -0.81 6.67 3.64 -0.30 -0.39 116.57 125.83 1jx2 h LYS 285 Ca 0.20 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.62 1jx2 h LYS 285 Cb 0.04 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.83 1jx2 h LYS 285 CO -0.10 0.05 0.53 -0.07 -2.27 0.00 0.00 179.45 177.59 1jx2 h LEU 286 N -0.19 0.85 -0.08 5.20 3.38 -0.14 -1.97 115.31 122.37 1jx2 h LEU 286 Ca -0.01 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1jx2 h LEU 286 Cb 0.16 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1jx2 h LEU 286 CO 0.01 0.58 -0.24 0.25 0.09 0.00 0.00 178.44 179.13 1jx2 h LEU 287 N 0.98 0.34 0.01 1.67 5.85 -0.92 -1.15 115.31 122.10 1jx2 h LEU 287 Ca 0.33 -0.61 0.03 0.00 0.84 0.00 0.00 57.88 58.47 1jx2 h LEU 287 Cb 0.07 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1jx2 h LEU 287 CO -0.10 0.90 -0.28 -0.03 -0.34 0.00 0.00 178.44 178.59 1jx2 h MET 288 N -0.19 -0.42 -0.05 1.25 4.05 -0.81 -0.41 114.93 118.35 1jx2 h MET 288 Ca -0.01 0.03 -0.09 0.00 -0.28 0.00 0.00 59.70 59.35 1jx2 h MET 288 Cb 0.87 0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.75 1jx2 h MET 288 CO 0.05 -0.28 -0.40 0.74 0.23 0.00 0.00 176.91 177.25 1jx2 h PHE 289 N -0.43 0.11 -0.34 1.39 -1.00 -1.43 -1.90 116.94 113.34 1jx2 h PHE 289 Ca 0.06 -0.03 -0.08 0.00 2.81 0.00 0.00 57.97 60.73 1jx2 h PHE 289 Cb 0.51 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 40.04 1jx2 h PHE 289 CO -0.31 0.49 -0.11 1.25 -1.61 0.00 0.00 178.31 178.03 1jx2 h HIS 290 N 0.08 0.77 -0.64 -0.55 2.76 -0.81 0.11 115.15 116.87 1jx2 h HIS 290 Ca 0.01 -0.17 0.00 0.00 -2.20 0.00 0.00 60.37 58.01 1jx2 h HIS 290 Cb 0.75 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.50 1jx2 h HIS 290 CO 0.01 0.85 0.40 0.82 -1.30 0.00 0.00 177.93 178.71 1jx2 h ILE 291 N 0.46 1.17 -0.62 6.26 2.04 -0.89 0.19 117.51 126.13 1jx2 h ILE 291 Ca 0.08 -0.35 -0.05 0.00 1.00 0.00 0.00 64.86 65.54 1jx2 h ILE 291 Cb 0.62 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 1jx2 h ILE 291 CO 0.04 0.17 0.20 -0.09 0.00 0.00 0.00 178.15 178.47 1jx2 h ARG 292 N 0.86 0.93 -0.12 2.37 2.43 -1.09 0.48 114.38 120.25 1jx2 h ARG 292 Ca 0.23 -0.18 -0.17 0.00 -0.81 0.00 0.00 59.98 59.05 1jx2 h ARG 292 Cb -0.06 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.33 1jx2 h ARG 292 CO -0.05 0.80 -0.65 0.22 -1.51 0.00 0.00 179.97 178.78 1jx2 h ASP 293 N 0.91 0.53 1.42 -3.80 -0.00 0.05 -3.19 116.42 112.34 1jx2 h ASP 293 Ca 0.20 -0.32 0.00 0.00 -0.00 0.00 0.00 57.03 56.91 1jx2 h ASP 293 Cb 0.25 -0.16 0.00 0.00 -0.00 0.00 0.00 39.33 39.43 1jx2 h ASP 293 CO -0.01 1.04 -0.56 0.74 -0.00 0.00 0.00 179.24 180.45 1jx2 h THR 294 N 0.33 0.00 -0.98 2.25 2.02 -0.28 -3.39 112.91 112.86 1jx2 h THR 294 Ca -0.02 -0.98 0.15 0.00 0.77 0.00 0.00 66.41 66.33 1jx2 h THR 294 Cb 1.21 1.70 -0.16 0.00 -1.74 0.00 0.00 68.15 69.16 1jx2 h THR 294 CO 0.12 0.00 -0.39 -0.11 0.37 0.00 0.00 175.52 175.51 1jx2 n LEU 295 N -2.84 -0.65 -0.03 2.58 7.94 0.16 -1.62 117.00 122.55 1jx2 n LEU 295 Ca 0.02 1.71 -0.08 0.00 -1.11 0.00 0.00 56.01 56.54 1jx2 n LEU 295 Cb 0.54 -0.39 -0.02 0.00 0.53 0.00 0.00 43.42 44.08 1jx2 n LEU 295 CO 0.37 -1.53 0.73 1.55 -1.11 0.00 0.00 177.39 177.41 1jx2 h PRO 296 N 0.00 -0.20 -0.58 1.96 0.13 -1.79 -1.86 132.00 129.66 1jx2 h PRO 296 Ca 0.33 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.46 1jx2 h PRO 296 Cb 0.58 0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.73 1jx2 h PRO 296 CO -0.97 -0.13 0.31 -0.44 -0.23 0.00 0.00 178.00 176.54 1jx2 h ASP 297 N -0.21 0.73 -0.35 1.44 3.32 -1.68 -2.77 116.42 116.91 1jx2 h ASP 297 Ca 0.12 -0.10 0.04 0.00 0.02 0.00 0.00 57.03 57.11 1jx2 h ASP 297 Cb 0.39 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 1jx2 h ASP 297 CO -0.32 0.62 0.24 0.25 -1.72 0.00 0.00 179.24 178.31 1jx2 h LEU 298 N 0.79 0.27 -0.75 1.55 5.85 -0.87 -1.05 115.31 121.10 1jx2 h LEU 298 Ca 0.20 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.84 1jx2 h LEU 298 Cb 0.05 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1jx2 h LEU 298 CO -0.03 0.19 0.01 0.11 -0.34 0.00 0.00 178.44 178.38 1jx2 h LYS 299 N 0.32 0.97 -0.37 1.25 1.57 -1.05 -0.59 116.57 118.66 1jx2 h LYS 299 Ca 0.15 -0.28 -0.08 0.00 -1.87 0.00 0.00 60.65 58.57 1jx2 h LYS 299 Cb 0.20 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1jx2 h LYS 299 CO -0.03 0.95 -0.08 0.28 -0.57 0.00 0.00 179.45 180.00 1jx2 h VAL 300 N 0.89 1.27 -0.29 0.50 2.07 -1.21 -1.69 116.25 117.80 1jx2 h VAL 300 Ca 0.17 -1.14 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 1jx2 h VAL 300 Cb 0.50 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1jx2 h VAL 300 CO 0.02 0.38 0.12 0.11 0.02 0.00 0.00 177.57 178.22 1jx2 h LYS 301 N 0.51 0.44 -0.66 1.57 1.57 -1.12 -2.35 116.57 116.53 1jx2 h LYS 301 Ca 0.10 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1jx2 h LYS 301 Cb 0.58 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.79 1jx2 h LYS 301 CO 0.03 0.45 0.40 0.28 -0.57 0.00 0.00 179.45 180.04 1jx2 h VAL 302 N 0.32 1.19 -0.86 0.50 2.07 -1.04 -2.11 116.25 116.33 1jx2 h VAL 302 Ca 0.10 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.19 1jx2 h VAL 302 Cb 0.18 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 1jx2 h VAL 302 CO -0.01 0.20 0.57 0.28 0.02 0.00 0.00 177.57 178.63 1jx2 h SER 303 N 0.90 0.98 0.64 0.57 0.02 -1.19 -2.78 113.55 112.69 1jx2 h SER 303 Ca 0.24 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.13 1jx2 h SER 303 Cb -0.02 -0.24 0.01 0.00 0.14 0.00 0.00 62.40 62.29 1jx2 h SER 303 CO -0.04 0.71 -0.31 0.11 -1.14 0.00 0.00 176.83 176.15 1jx2 h LYS 304 N 1.16 -0.83 0.00 3.45 1.57 -0.97 -2.99 116.57 117.96 1jx2 h LYS 304 Ca 0.32 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 1jx2 h LYS 304 Cb -0.12 0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1jx2 h LYS 304 CO -0.07 -0.55 0.03 0.00 -0.57 0.00 0.00 179.45 178.29 1jx2 n MET 305 N -4.78 0.02 -0.56 3.15 0.00 -0.84 -0.11 117.12 114.02 1jx2 n MET 305 Ca -0.11 0.50 0.10 0.00 0.00 0.00 0.00 57.70 58.19 1jx2 n MET 305 Cb 0.34 -1.61 0.34 0.00 0.00 0.00 0.00 33.22 32.29 1jx2 n MET 305 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1jx2 n LEU 306 N -1.61 4.56 0.00 3.17 4.77 -1.05 -5.11 117.00 121.74 1jx2 n LEU 306 Ca -0.00 -2.37 0.00 0.00 -0.03 0.00 0.00 56.01 53.61 1jx2 n LEU 306 Cb 0.04 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 1jx2 n LEU 306 CO 0.02 0.84 0.00 -1.20 -1.33 0.00 0.00 177.39 175.72