#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jx3 s THR 2 N 0.00 -0.87 0.03 1.97 2.01 -1.26 -5.03 115.64 112.48 2jx3 s THR 2 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 2jx3 s THR 2 Cb 0.00 -0.05 0.00 0.00 0.01 0.00 0.00 72.50 72.46 2jx3 s THR 2 CO 0.00 0.00 0.00 -0.38 -0.69 0.00 0.00 174.62 173.55 2jx3 n ILE 3 N 4.37 0.32 -2.74 1.82 5.41 -1.26 -5.00 119.36 122.27 2jx3 n ILE 3 Ca 0.10 0.10 -0.03 0.00 1.00 0.00 0.00 62.75 63.92 2jx3 n ILE 3 Cb 0.58 -1.52 0.02 0.00 -0.71 0.00 0.00 39.64 38.01 2jx3 n ILE 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2jx3 s ALA 4 N -2.00 -3.15 -0.97 -1.39 0.00 -1.26 -3.37 121.76 109.63 2jx3 s ALA 4 Ca 0.00 0.06 -0.12 0.00 0.00 0.00 0.00 51.96 51.91 2jx3 s ALA 4 Cb 0.00 -2.84 0.25 0.00 0.00 0.00 0.00 23.12 20.53 2jx3 s ALA 4 CO 0.00 -2.36 0.94 -0.65 0.00 0.00 0.00 175.76 173.68 2jx3 s GLN 5 N 0.99 3.89 0.00 0.00 1.11 -1.26 -4.24 119.66 120.15 2jx3 s GLN 5 Ca 0.26 -2.82 0.00 0.00 0.01 0.00 0.00 55.36 52.82 2jx3 s GLN 5 Cb 0.05 -4.50 0.00 0.00 -1.01 0.00 0.00 33.01 27.55 2jx3 s GLN 5 CO -0.08 -1.27 0.00 0.41 0.01 0.00 0.00 175.29 174.36 2jx3 n GLY 6 N 3.38 1.43 2.22 3.09 0.00 -1.26 -5.03 105.19 109.03 2jx3 n GLY 6 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 2jx3 n GLY 6 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jx3 n LYS 7 N 0.00 2.33 0.00 1.61 4.76 -1.26 -4.97 118.16 120.63 2jx3 n LYS 7 Ca 0.00 -3.08 0.00 0.00 -2.87 0.00 0.00 58.31 52.36 2jx3 n LYS 7 Cb 0.00 -2.19 0.00 0.00 -1.84 0.00 0.00 35.03 31.00 2jx3 n LYS 7 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jx3 n GLY 8 N -1.10 1.62 0.00 0.72 0.00 -1.26 -2.52 105.19 102.65 2jx3 n GLY 8 Ca 0.60 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.92 2jx3 n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jx3 n GLN 9 N 0.00 1.59 -0.90 1.61 10.64 -1.26 -5.10 117.38 123.96 2jx3 n GLN 9 Ca 0.00 0.00 0.07 0.00 -1.83 0.00 0.00 57.00 55.24 2jx3 n GLN 9 Cb 0.00 -0.95 -0.04 0.00 -0.86 0.00 0.00 30.24 28.40 2jx3 n GLN 9 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 2jx3 n LYS 10 N -1.51 -2.20 0.00 2.61 4.81 -1.05 -2.45 118.16 118.37 2jx3 n LYS 10 Ca 0.00 1.77 0.04 0.00 -0.87 0.00 0.00 58.31 59.24 2jx3 n LYS 10 Cb 0.15 -2.39 0.18 0.00 0.02 0.00 0.00 35.03 32.99 2jx3 n LYS 10 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2jx3 n LEU 11 N -2.95 0.00 0.02 3.14 4.77 -1.22 -2.18 117.00 118.59 2jx3 n LEU 11 Ca -0.04 0.37 -0.17 0.00 -0.03 0.00 0.00 56.01 56.14 2jx3 n LEU 11 Cb 0.37 -0.37 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 2jx3 n LEU 11 CO 0.01 -0.27 -0.57 0.00 -1.33 0.00 0.00 177.39 175.23 2jx3 h GLU 13 N 0.05 0.00 -6.39 0.00 4.57 -1.10 -3.39 114.58 108.33 2jx3 h GLU 13 Ca -0.33 -0.00 -0.57 0.00 -1.18 0.00 0.00 59.36 57.28 2jx3 h GLU 13 Cb 2.03 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 30.58 2jx3 h GLU 13 CO 0.11 0.18 1.18 0.96 -1.18 0.00 0.00 179.01 180.26 2jx3 s ILE 14 N -5.50 3.67 0.26 2.32 -4.36 -1.23 -4.85 121.20 111.51 2jx3 s ILE 14 Ca -0.14 0.68 0.08 0.00 -0.26 0.00 0.00 60.65 61.01 2jx3 s ILE 14 Cb 0.04 -3.89 -0.03 0.00 1.25 0.00 0.00 42.46 39.84 2jx3 s ILE 14 CO 0.67 -0.56 1.60 -0.33 0.24 0.00 0.00 174.94 176.55 2jx3 h GLU 15 N 11.87 0.10 -0.46 0.37 4.39 -1.87 -3.29 114.58 125.68 2jx3 h GLU 15 Ca -0.31 -0.07 0.04 0.00 0.34 0.00 0.00 59.36 59.37 2jx3 h GLU 15 Cb 1.14 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.74 2jx3 h GLU 15 CO 1.05 0.67 -0.27 -2.13 -1.16 0.00 0.00 179.01 177.17 2jx3 n ARG 16 N -3.85 -0.20 -0.16 2.33 3.00 -1.26 0.39 116.66 116.90 2jx3 n ARG 16 Ca -0.02 1.12 -0.09 0.00 -0.00 0.00 0.00 57.85 58.86 2jx3 n ARG 16 Cb 0.61 -1.66 0.00 0.00 0.00 0.00 0.00 32.46 31.40 2jx3 n ARG 16 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.63 176.79 2jx3 h ILE 17 N 0.00 1.25 -0.76 5.15 3.07 -1.92 -2.65 117.51 121.65 2jx3 h ILE 17 Ca 0.07 -0.94 0.15 0.00 1.55 0.00 0.00 64.86 65.69 2jx3 h ILE 17 Cb 0.19 0.95 -0.05 0.00 -0.27 0.00 0.00 36.82 37.64 2jx3 h ILE 17 CO -0.44 0.33 0.51 -0.74 -1.05 0.00 0.00 178.15 176.76 2jx3 h HIS 18 N 0.65 0.51 0.30 0.16 2.76 -1.05 -2.79 115.15 115.68 2jx3 h HIS 18 Ca 0.14 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.31 2jx3 h HIS 18 Cb 0.41 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 29.21 2jx3 h HIS 18 CO 0.03 0.19 -0.14 0.35 -1.30 0.00 0.00 177.93 177.06 2jx3 h PHE 19 N 0.44 -0.37 -1.38 5.26 3.57 0.28 0.26 116.94 125.00 2jx3 h PHE 19 Ca 0.37 -0.01 0.40 0.00 3.53 0.00 0.00 57.97 62.26 2jx3 h PHE 19 Cb 0.83 0.12 -0.06 0.00 2.79 0.00 0.00 35.95 39.64 2jx3 h PHE 19 CO -0.00 -0.23 1.29 0.34 -2.23 0.00 0.00 178.31 177.48 2jx3 n PHE 20 N -4.09 0.00 -0.09 0.41 -0.00 -1.08 0.12 117.46 112.72 2jx3 n PHE 20 Ca -0.05 0.00 -0.09 0.00 -0.00 0.00 0.00 57.45 57.31 2jx3 n PHE 20 Cb 0.16 -0.34 -0.16 0.00 -0.00 0.00 0.00 39.48 39.14 2jx3 n PHE 20 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 2jx3 n LEU 21 N -3.47 0.00 -0.26 -2.13 4.77 -1.07 -4.31 117.00 110.52 2jx3 n LEU 21 Ca 0.31 0.00 0.32 0.00 -0.03 0.00 0.00 56.01 56.61 2jx3 n LEU 21 Cb 1.70 0.47 0.57 0.00 -2.33 0.00 0.00 43.42 43.83 2jx3 n LEU 21 CO 0.31 0.47 1.29 0.28 -1.33 0.00 0.00 177.39 178.41 2jx3 h SER 22 N 0.00 0.00 -1.20 -1.43 0.02 0.45 0.13 113.55 111.53 2jx3 h SER 22 Ca -0.51 0.00 0.35 0.00 -0.84 0.00 0.00 61.79 60.79 2jx3 h SER 22 Cb 2.16 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 64.66 2jx3 h SER 22 CO 0.03 0.00 1.05 0.11 -1.14 0.00 0.00 176.83 176.88 2jx3 h LYS 23 N 0.00 0.00 -3.42 3.45 1.57 -1.74 -3.46 116.57 112.96 2jx3 h LYS 23 Ca 0.53 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.31 2jx3 h LYS 23 Cb 2.77 0.00 0.00 0.00 0.08 0.00 0.00 32.23 35.08 2jx3 h LYS 23 CO -0.01 0.00 -0.61 1.17 -0.57 0.00 0.00 179.45 179.43 2jx3 n LYS 24 N -3.73 -3.41 0.00 3.15 3.00 0.47 -5.10 118.16 112.54 2jx3 n LYS 24 Ca 0.26 2.63 0.00 0.00 -0.00 0.00 0.00 58.31 61.21 2jx3 n LYS 24 Cb 1.43 -2.94 0.00 0.00 0.00 0.00 0.00 35.03 33.51 2jx3 n LYS 24 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2jx3 n LYS 25 N 1.18 0.00 0.05 1.64 4.76 -1.26 -5.11 118.16 119.42 2jx3 n LYS 25 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2jx3 n LYS 25 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2jx3 n LYS 25 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 2jx3 n THR 26 N 0.00 0.34 0.08 -0.18 -1.04 -1.26 -4.50 114.28 107.73 2jx3 n THR 26 Ca 0.00 0.11 -0.12 0.00 -2.04 0.00 0.00 64.05 62.00 2jx3 n THR 26 Cb 0.00 -1.05 -0.05 0.00 -1.82 0.00 0.00 70.33 67.40 2jx3 n THR 26 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 2jx3 h ASP 27 N 0.00 -0.83 0.10 8.00 1.82 -1.99 0.55 116.42 124.08 2jx3 h ASP 27 Ca 0.00 0.10 -0.01 0.00 -0.39 0.00 0.00 57.03 56.74 2jx3 h ASP 27 Cb 0.26 0.33 0.00 0.00 0.68 0.00 0.00 39.33 40.60 2jx3 h ASP 27 CO 0.00 -0.36 -0.05 -0.33 -1.61 0.00 0.00 179.24 176.89 2jx3 h GLU 28 N -0.46 -0.13 0.00 0.28 4.39 -1.92 -0.71 114.58 116.03 2jx3 h GLU 28 Ca 0.05 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2jx3 h GLU 28 Cb 0.52 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2jx3 h GLU 28 CO -0.21 -0.08 0.00 1.25 -1.16 0.00 0.00 179.01 178.81 2jx3 h LEU 29 N -0.14 0.00 0.00 1.33 7.12 -1.68 -2.34 115.31 119.60 2jx3 h LEU 29 Ca -0.01 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.00 2jx3 h LEU 29 Cb 0.11 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.24 2jx3 h LEU 29 CO 0.02 0.00 0.00 0.54 -0.13 0.00 0.00 178.44 178.87 2jx3 n ARG 30 N -2.57 0.00 -0.48 1.25 5.12 0.19 -2.25 116.66 117.92 2jx3 n ARG 30 Ca -0.02 0.00 0.41 0.00 -1.93 0.00 0.00 57.85 56.31 2jx3 n ARG 30 Cb 0.05 -0.15 0.73 0.00 -1.16 0.00 0.00 32.46 31.93 2jx3 n ARG 30 CO 0.00 0.00 0.00 -2.95 -1.93 0.00 0.00 177.63 172.75 2jx3 h ASN 31 N 0.00 0.10 0.00 0.55 7.08 -1.58 0.46 115.58 122.18 2jx3 h ASN 31 Ca 0.00 0.04 0.00 0.00 -3.08 0.00 0.00 56.30 53.26 2jx3 h ASN 31 Cb 0.00 0.03 0.00 0.00 -2.08 0.00 0.00 38.32 36.27 2jx3 h ASN 31 CO 0.00 -0.03 -0.07 0.25 -2.08 0.00 0.00 177.43 175.49 2jx3 h LEU 32 N 0.06 0.00 -2.53 6.14 6.46 -1.61 -2.74 115.31 121.09 2jx3 h LEU 32 Ca 0.75 0.00 0.01 0.00 -0.12 0.00 0.00 57.88 58.52 2jx3 h LEU 32 Cb 2.77 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 42.70 2jx3 h LEU 32 CO -0.13 0.30 0.07 -0.74 -0.62 0.00 0.00 178.44 177.32 2jx3 h HIS 33 N -0.52 0.00 0.00 1.25 2.76 -1.05 0.43 115.15 118.02 2jx3 h HIS 33 Ca 0.00 0.00 -0.23 0.00 -2.20 0.00 0.00 60.37 57.94 2jx3 h HIS 33 Cb 0.07 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.00 2jx3 h HIS 33 CO -0.03 0.00 -1.27 1.57 -1.30 0.00 0.00 177.93 176.90 2jx3 h LYS 34 N 0.00 0.00 0.00 5.26 5.09 0.17 0.92 116.57 128.01 2jx3 h LYS 34 Ca 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 60.65 60.72 2jx3 h LYS 34 Cb 0.17 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.49 2jx3 h LYS 34 CO -0.00 0.73 -1.09 -0.11 -2.09 0.00 0.00 179.45 176.89 2jx3 n LEU 35 N -3.20 1.89 0.31 7.07 7.94 -0.47 -3.11 117.00 127.44 2jx3 n LEU 35 Ca -0.07 0.32 -0.17 0.00 -1.11 0.00 0.00 56.01 54.98 2jx3 n LEU 35 Cb 0.97 -0.72 -0.08 0.00 0.53 0.00 0.00 43.42 44.11 2jx3 n LEU 35 CO 0.46 -0.22 0.67 0.25 -1.11 0.00 0.00 177.39 177.44 2jx3 h LEU 36 N -0.95 -0.74 -0.88 -1.96 5.85 -0.39 -3.00 115.31 113.24 2jx3 h LEU 36 Ca -0.06 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2jx3 h LEU 36 Cb 1.01 0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2jx3 h LEU 36 CO -0.04 -0.49 -0.16 -1.22 -0.34 0.00 0.00 178.44 176.19 2jx3 n TYR 37 N -5.44 0.00 -4.04 1.25 4.01 -1.18 -4.95 117.16 106.82 2jx3 n TYR 37 Ca -0.12 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.32 2jx3 n TYR 37 Cb 0.34 -0.05 -0.01 0.00 -0.31 0.00 0.00 39.34 39.30 2jx3 n TYR 37 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2jx3 n ASN 38 N -0.05 -2.16 -3.90 7.72 3.02 -0.73 -4.91 115.26 114.26 2jx3 n ASN 38 Ca 0.15 -0.96 -0.09 0.00 -0.03 0.00 0.00 54.58 53.64 2jx3 n ASN 38 Cb 0.39 -3.13 -0.06 0.00 -0.61 0.00 0.00 39.78 36.37 2jx3 n ASN 38 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2jx3 s ARG 39 N -6.68 1.13 0.19 3.52 6.06 0.31 -4.93 118.95 118.55 2jx3 s ARG 39 Ca 0.38 -1.07 -0.03 0.00 -2.50 0.00 0.00 55.73 52.50 2jx3 s ARG 39 Cb -0.20 0.40 0.11 0.00 0.06 0.00 0.00 34.95 35.31 2jx3 s ARG 39 CO 0.89 -0.42 1.50 -1.00 -2.50 0.00 0.00 175.30 173.77 2jx3 h PRO 40 N 2.52 0.57 -2.39 5.12 0.13 -1.92 -2.85 132.00 133.18 2jx3 h PRO 40 Ca -0.32 -0.36 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 2jx3 h PRO 40 Cb 1.23 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2jx3 h PRO 40 CO 0.48 0.97 -0.52 0.41 -0.23 0.00 0.00 178.00 179.11 2jx3 n GLY 41 N 0.25 -4.36 0.00 1.56 0.00 -1.26 -4.83 105.19 96.55 2jx3 n GLY 41 Ca -0.03 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2jx3 n GLY 41 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jx3 n THR 42 N 0.32 0.00 0.02 2.61 -1.04 -1.26 -4.75 114.28 110.17 2jx3 n THR 42 Ca 0.00 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2jx3 n THR 42 Cb 0.00 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2jx3 n THR 42 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2jx3 n VAL 43 N 0.00 0.45 0.52 12.58 0.31 -1.26 -4.31 118.33 126.61 2jx3 n VAL 43 Ca 0.00 0.15 0.08 0.00 -0.01 0.00 0.00 64.34 64.57 2jx3 n VAL 43 Cb 0.00 -1.23 0.36 0.00 -0.91 0.00 0.00 33.84 32.06 2jx3 n VAL 43 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2jx3 n SER 44 N -2.87 0.11 -0.07 4.52 2.88 -1.26 -2.72 113.62 114.21 2jx3 n SER 44 Ca -0.00 0.53 -0.06 0.00 -1.33 0.00 0.00 58.87 58.01 2jx3 n SER 44 Cb 0.00 -0.55 -0.02 0.00 -0.75 0.00 0.00 64.21 62.90 2jx3 n SER 44 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2jx3 n SER 45 N -1.62 1.79 -0.40 -3.46 3.41 -1.26 -2.65 113.62 109.43 2jx3 n SER 45 Ca 0.04 0.55 0.37 0.00 -0.26 0.00 0.00 58.87 59.57 2jx3 n SER 45 Cb 0.19 -0.83 0.72 0.00 -0.26 0.00 0.00 64.21 64.03 2jx3 n SER 45 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 2jx3 h LEU 46 N -0.98 0.09 0.00 1.04 8.10 -1.75 0.54 115.31 122.36 2jx3 h LEU 46 Ca 0.00 0.03 0.00 0.00 0.11 0.00 0.00 57.88 58.02 2jx3 h LEU 46 Cb 0.61 0.02 0.00 0.00 -0.44 0.00 0.00 40.66 40.85 2jx3 h LEU 46 CO 0.00 -0.01 0.00 1.17 -4.11 0.00 0.00 178.44 175.49 2jx3 n LYS 47 N -4.26 0.00 0.20 0.17 4.81 -1.10 -1.96 118.16 116.01 2jx3 n LYS 47 Ca 0.30 0.43 0.17 0.00 -0.87 0.00 0.00 58.31 58.35 2jx3 n LYS 47 Cb 1.35 -0.93 0.72 0.00 0.02 0.00 0.00 35.03 36.19 2jx3 n LYS 47 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 2jx3 h LYS 48 N 0.00 0.00 0.00 1.64 1.63 -1.25 -2.78 116.57 115.81 2jx3 h LYS 48 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2jx3 h LYS 48 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 2jx3 h LYS 48 CO 0.00 0.00 -0.20 -0.91 -3.45 0.00 0.00 179.45 174.89 2jx3 h ASN 49 N 0.00 0.00 -1.34 4.20 4.21 -0.05 -3.01 115.58 119.59 2jx3 h ASN 49 Ca 0.11 0.00 0.45 0.00 1.21 0.00 0.00 56.30 58.07 2jx3 h ASN 49 Cb 1.04 0.00 -0.12 0.00 -1.12 0.00 0.00 38.32 38.12 2jx3 h ASN 49 CO -0.00 0.37 0.88 0.52 -1.29 0.00 0.00 177.43 177.90 2jx3 n VAL 50 N -3.49 -0.19 -1.18 2.81 0.31 -0.83 0.27 118.33 116.02 2jx3 n VAL 50 Ca -0.03 1.60 0.00 0.00 -0.01 0.00 0.00 64.34 65.90 2jx3 n VAL 50 Cb 0.11 -2.62 0.24 0.00 -0.91 0.00 0.00 33.84 30.66 2jx3 n VAL 50 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jx3 n GLY 51 N -1.53 4.31 2.71 2.92 0.00 -1.07 -4.71 105.19 107.83 2jx3 n GLY 51 Ca 0.37 -1.10 -0.07 0.00 0.00 0.00 0.00 46.02 45.22 2jx3 n GLY 51 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2jx3 n GLN 52 N -0.71 0.53 0.00 1.61 7.27 0.75 0.25 117.38 127.08 2jx3 n GLN 52 Ca 0.30 -1.31 0.00 0.00 0.07 0.00 0.00 57.00 56.06 2jx3 n GLN 52 Cb 1.06 -0.89 0.00 0.00 2.41 0.00 0.00 30.24 32.81 2jx3 n GLN 52 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2jx3 n PHE 53 N 1.38 0.00 0.00 3.69 7.35 -1.16 -4.56 117.46 124.16 2jx3 n PHE 53 Ca 0.05 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.74 2jx3 n PHE 53 Cb 0.67 -0.07 0.00 0.00 0.35 0.00 0.00 39.48 40.44 2jx3 n PHE 53 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2jx3 n SER 54 N -1.08 3.57 0.00 -2.13 2.88 -1.22 -4.52 113.62 111.12 2jx3 n SER 54 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2jx3 n SER 54 Cb 0.00 0.64 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 2jx3 n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jx3 n GLY 55 N 1.89 0.49 0.39 0.46 0.00 -1.25 -4.22 105.19 102.95 2jx3 n GLY 55 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 2jx3 n GLY 55 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2jx3 h PHE 56 N 0.00 -1.30 0.00 1.61 -1.00 -1.92 -0.58 116.94 113.75 2jx3 h PHE 56 Ca 0.00 0.11 -0.23 0.00 2.81 0.00 0.00 57.97 60.66 2jx3 h PHE 56 Cb 0.00 0.71 -0.01 0.00 3.61 0.00 0.00 35.95 40.26 2jx3 h PHE 56 CO 0.00 -0.40 1.22 -0.35 -1.61 0.00 0.00 178.31 177.17 2jx3 n PRO 57 N -5.42 1.58 0.00 1.51 -0.04 -1.26 -3.87 135.00 127.51 2jx3 n PRO 57 Ca 0.08 -0.98 0.00 0.00 -0.04 0.00 0.00 63.50 62.56 2jx3 n PRO 57 Cb 0.36 -2.09 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 2jx3 n PRO 57 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2jx3 n PHE 58 N 3.40 0.00 -3.08 0.54 1.16 -0.23 -4.19 117.46 115.07 2jx3 n PHE 58 Ca 0.34 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.92 2jx3 n PHE 58 Cb 0.34 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.21 2jx3 n PHE 58 CO 0.00 0.00 0.00 -1.91 -1.87 0.00 0.00 176.76 172.98 2jx3 n GLU 59 N 0.00 2.82 -3.59 3.97 2.13 -1.26 -4.90 120.64 119.81 2jx3 n GLU 59 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 2jx3 n GLU 59 Cb 0.00 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.66 2jx3 n GLU 59 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2jx3 s LYS 60 N 0.14 1.02 0.00 5.31 2.20 -1.26 -4.90 119.74 122.25 2jx3 s LYS 60 Ca 0.00 -0.31 0.00 0.00 -0.36 0.00 0.00 55.97 55.30 2jx3 s LYS 60 Cb 0.00 0.46 0.00 0.00 -1.51 0.00 0.00 37.83 36.78 2jx3 s LYS 60 CO 0.00 -0.37 0.00 0.41 -0.36 0.00 0.00 175.35 175.03 2jx3 n GLY 61 N 0.35 0.63 3.50 5.54 0.00 -1.26 -5.03 105.19 108.92 2jx3 n GLY 61 Ca -0.18 -0.66 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 2jx3 n GLY 61 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jx3 s SER 62 N -2.60 3.17 0.28 1.61 0.15 -1.26 -4.98 113.70 110.07 2jx3 s SER 62 Ca 0.00 -1.27 0.01 0.00 0.70 0.00 0.00 55.95 55.39 2jx3 s SER 62 Cb 0.00 -0.25 0.68 0.00 -1.71 0.00 0.00 66.02 64.74 2jx3 s SER 62 CO 0.00 -0.38 1.64 0.58 1.20 0.00 0.00 173.24 176.28 2jx3 h VAL 63 N 2.07 0.31 -0.65 4.45 2.07 -2.00 0.58 116.25 123.08 2jx3 h VAL 63 Ca -0.41 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.06 2jx3 h VAL 63 Cb 1.24 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 2jx3 h VAL 63 CO 0.71 0.03 0.43 0.06 0.02 0.00 0.00 177.57 178.83 2jx3 h GLN 64 N 0.19 0.82 0.00 1.57 3.07 -1.98 -0.26 115.11 118.51 2jx3 h GLN 64 Ca 0.54 -0.05 0.00 0.00 0.09 0.00 0.00 58.65 59.23 2jx3 h GLN 64 Cb 1.07 -0.18 0.00 0.00 0.08 0.00 0.00 27.48 28.44 2jx3 h GLN 64 CO -0.67 0.54 0.00 0.98 0.09 0.00 0.00 178.83 179.77 2jx3 n TYR 65 N -4.45 0.00 -0.30 0.06 9.36 0.20 -1.28 117.16 120.75 2jx3 n TYR 65 Ca 0.07 0.00 0.11 0.00 3.32 0.00 0.00 57.90 61.41 2jx3 n TYR 65 Cb 0.08 -0.39 0.25 0.00 -0.63 0.00 0.00 39.34 38.65 2jx3 n TYR 65 CO 0.00 0.00 0.00 -0.22 0.22 0.00 0.00 176.86 176.86 2jx3 h LYS 66 N 0.00 0.10 -0.06 2.98 3.11 -1.48 0.11 116.57 121.34 2jx3 h LYS 66 Ca 0.00 -0.01 0.02 0.00 -2.81 0.00 0.00 60.65 57.86 2jx3 h LYS 66 Cb 0.00 -0.02 -0.05 0.00 -1.00 0.00 0.00 32.23 31.15 2jx3 h LYS 66 CO 0.00 0.07 -0.50 0.87 -2.81 0.00 0.00 179.45 177.08 2jx3 h LYS 67 N 0.11 -0.56 -0.90 1.90 1.79 -1.01 -1.52 116.57 116.38 2jx3 h LYS 67 Ca 0.53 0.04 0.13 0.00 -2.18 0.00 0.00 60.65 59.17 2jx3 h LYS 67 Cb 1.05 0.13 -0.14 0.00 -1.58 0.00 0.00 32.23 31.69 2jx3 h LYS 67 CO -0.75 -0.37 -0.43 0.87 -1.08 0.00 0.00 179.45 177.68 2jx3 h LYS 68 N -0.58 -0.05 -0.99 3.15 1.57 0.59 0.46 116.57 120.72 2jx3 h LYS 68 Ca 0.02 0.00 0.33 0.00 -1.87 0.00 0.00 60.65 59.13 2jx3 h LYS 68 Cb 0.65 0.01 -0.18 0.00 0.08 0.00 0.00 32.23 32.79 2jx3 h LYS 68 CO -0.36 -0.03 0.22 -1.91 -0.57 0.00 0.00 179.45 176.80 2jx3 n GLU 69 N -5.41 -0.07 0.08 3.15 2.13 -0.59 0.71 120.64 120.63 2jx3 n GLU 69 Ca 0.07 1.44 -0.03 0.00 0.66 0.00 0.00 57.16 59.29 2jx3 n GLU 69 Cb 0.36 -2.40 -0.02 0.00 0.27 0.00 0.00 31.44 29.66 2jx3 n GLU 69 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2jx3 h GLU 70 N 0.00 -0.21 -1.01 5.31 4.57 0.09 -1.11 114.58 122.22 2jx3 h GLU 70 Ca 0.70 0.01 0.14 0.00 -1.18 0.00 0.00 59.36 59.04 2jx3 h GLU 70 Cb 1.63 0.05 -0.09 0.00 -0.16 0.00 0.00 28.75 30.18 2jx3 h GLU 70 CO -0.87 -0.14 0.63 0.52 -1.18 0.00 0.00 179.01 177.97 2jx3 h MET 71 N -0.37 0.89 0.00 1.92 2.86 -1.15 0.42 114.93 119.50 2jx3 h MET 71 Ca -0.02 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 2jx3 h MET 71 Cb 0.17 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.62 2jx3 h MET 71 CO 0.04 0.59 -0.11 -0.07 1.06 0.00 0.00 176.91 178.42 2jx3 h LEU 72 N 0.92 0.00 0.08 1.22 3.38 0.20 -2.67 115.31 118.44 2jx3 h LEU 72 Ca 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.49 2jx3 h LEU 72 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2jx3 h LEU 72 CO -0.31 0.11 -0.04 0.50 0.09 0.00 0.00 178.44 178.80 2jx3 h LYS 73 N 0.00 -0.10 -0.71 1.13 3.64 0.12 2.34 116.57 122.98 2jx3 h LYS 73 Ca -0.00 0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.54 2jx3 h LYS 73 Cb 0.55 0.02 -0.13 0.00 -0.41 0.00 0.00 32.23 32.26 2jx3 h LYS 73 CO 0.01 -0.07 -0.11 -0.22 -2.27 0.00 0.00 179.45 176.80 2jx3 h LYS 74 N -0.15 0.03 0.00 1.90 3.64 -1.58 1.91 116.57 122.32 2jx3 h LYS 74 Ca -0.01 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 2jx3 h LYS 74 Cb 0.08 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2jx3 h LYS 74 CO 0.02 0.02 -0.20 0.74 -2.27 0.00 0.00 179.45 177.76 2jx3 h PHE 75 N 0.04 0.00 -0.63 1.91 0.04 -1.49 -2.92 116.94 113.88 2jx3 h PHE 75 Ca 0.36 0.00 0.12 0.00 2.80 0.00 0.00 57.97 61.25 2jx3 h PHE 75 Cb 0.58 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 38.61 2jx3 h PHE 75 CO -0.51 0.20 -0.19 0.07 -0.60 0.00 0.00 178.31 177.29 2jx3 h ARG 76 N 0.00 -0.03 0.06 1.51 0.11 1.80 2.46 114.38 120.29 2jx3 h ARG 76 Ca -0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 2jx3 h ARG 76 Cb 0.56 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.64 2jx3 h ARG 76 CO 0.03 -0.02 -0.03 -0.91 0.10 0.00 0.00 179.97 179.13 2jx3 h ASN 77 N -0.03 -0.07 0.00 0.08 -0.26 -1.37 -2.84 115.58 111.08 2jx3 h ASN 77 Ca 0.30 -0.41 0.00 0.00 -0.56 0.00 0.00 56.30 55.62 2jx3 h ASN 77 Cb 0.49 0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.77 2jx3 h ASN 77 CO -0.66 0.39 0.00 0.00 -1.06 0.00 0.00 177.43 176.10 2jx3 n ALA 78 N -2.38 -0.10 -0.34 -0.83 0.00 -0.36 -2.95 120.51 113.55 2jx3 n ALA 78 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.25 2jx3 n ALA 78 Cb 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.62 2jx3 n ALA 78 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 2jx3 h MET 79 N 0.00 -0.10 -0.60 0.00 1.85 0.39 0.18 114.93 116.65 2jx3 h MET 79 Ca 0.00 0.01 0.12 0.00 -0.61 0.00 0.00 59.70 59.22 2jx3 h MET 79 Cb 0.00 0.02 -0.11 0.00 0.43 0.00 0.00 31.60 31.94 2jx3 h MET 79 CO 0.00 -0.07 -0.14 -0.07 -0.40 0.00 0.00 176.91 176.23 2jx3 h LEU 80 N -0.10 -0.54 -0.67 3.39 3.38 -1.12 1.40 115.31 121.05 2jx3 h LEU 80 Ca 0.17 0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.38 2jx3 h LEU 80 Cb 0.48 0.37 -0.08 0.00 0.09 0.00 0.00 40.66 41.52 2jx3 h LEU 80 CO -0.85 -0.19 -0.40 1.17 0.09 0.00 0.00 178.44 178.26 2jx3 n LYS 81 N -5.41 -0.30 -0.02 1.13 3.00 0.61 0.16 118.16 117.33 2jx3 n LYS 81 Ca 0.07 1.28 -0.01 0.00 -0.00 0.00 0.00 58.31 59.65 2jx3 n LYS 81 Cb 0.32 -1.89 -0.00 0.00 0.00 0.00 0.00 35.03 33.46 2jx3 n LYS 81 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2jx3 h SER 82 N 0.00 -0.04 0.13 3.14 0.87 -1.07 -2.97 113.55 113.61 2jx3 h SER 82 Ca 0.11 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.67 2jx3 h SER 82 Cb 0.27 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.22 2jx3 h SER 82 CO -0.63 0.39 -0.36 0.40 -0.53 0.00 0.00 176.83 176.10 2jx3 h ILE 83 N -0.88 0.00 -0.82 2.23 5.03 0.20 -1.61 117.51 121.66 2jx3 h ILE 83 Ca -0.00 0.00 0.20 0.00 -0.12 0.00 0.00 64.86 64.94 2jx3 h ILE 83 Cb 0.04 0.00 -0.14 0.00 -3.03 0.00 0.00 36.82 33.69 2jx3 h ILE 83 CO 0.01 0.00 0.12 0.00 -0.68 0.00 0.00 178.15 177.60 2jx3 h GLU 85 N 0.16 0.04 -1.36 0.00 5.08 -0.86 -2.66 114.58 114.98 2jx3 h GLU 85 Ca 0.48 -0.00 -0.40 0.00 -1.00 0.00 0.00 59.36 58.44 2jx3 h GLU 85 Cb 0.91 -0.01 -0.35 0.00 0.50 0.00 0.00 28.75 29.79 2jx3 h GLU 85 CO -0.66 0.03 -1.05 0.28 -1.00 0.00 0.00 179.01 176.61 2jx3 n VAL 86 N -4.21 0.17 -2.74 3.13 0.31 0.51 -4.92 118.33 110.57 2jx3 n VAL 86 Ca 0.29 -3.61 -0.04 0.00 -0.01 0.00 0.00 64.34 60.97 2jx3 n VAL 86 Cb 1.36 0.28 0.04 0.00 -0.91 0.00 0.00 33.84 34.61 2jx3 n VAL 86 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2jx3 n LEU 87 N 0.15 1.76 -3.24 7.52 7.94 0.59 -4.50 117.00 127.21 2jx3 n LEU 87 Ca 0.17 -3.35 -0.19 0.00 -1.11 0.00 0.00 56.01 51.52 2jx3 n LEU 87 Cb 0.72 0.41 0.07 0.00 0.53 0.00 0.00 43.42 45.15 2jx3 n LEU 87 CO 0.19 1.26 0.18 -0.67 -1.11 0.00 0.00 177.39 177.24 2jx3 n ASP 88 N -0.44 -4.52 -0.79 1.96 2.03 -1.26 -4.90 116.55 108.62 2jx3 n ASP 88 Ca 0.10 -0.51 0.00 0.00 0.52 0.00 0.00 54.79 54.90 2jx3 n ASP 88 Cb 0.81 -4.59 0.00 0.00 -0.72 0.00 0.00 41.12 36.62 2jx3 n ASP 88 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2jx3 n LEU 89 N -4.27 0.00 -0.58 -2.67 4.77 -1.26 -5.03 117.00 107.96 2jx3 n LEU 89 Ca -0.09 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.89 2jx3 n LEU 89 Cb 0.59 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2jx3 n LEU 89 CO 0.57 0.00 0.25 1.21 -1.33 0.00 0.00 177.39 178.09 2jx3 n GLU 90 N 0.00 0.00 0.00 3.23 2.13 -1.26 -4.94 120.64 119.80 2jx3 n GLU 90 Ca 0.00 -0.51 0.00 0.00 0.66 0.00 0.00 57.16 57.31 2jx3 n GLU 90 Cb 0.00 -0.14 0.00 0.00 0.27 0.00 0.00 31.44 31.57 2jx3 n GLU 90 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2jx3 n ARG 91 N 0.02 0.00 -2.01 5.31 0.63 -1.26 -5.03 116.66 114.32 2jx3 n ARG 91 Ca -0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 2jx3 n ARG 91 Cb 0.61 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.52 2jx3 n ARG 91 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2jx3 n SER 92 N -0.32 -8.89 0.00 6.15 2.88 -1.26 -5.08 113.62 107.11 2jx3 n SER 92 Ca 0.00 1.35 0.00 0.00 -1.33 0.00 0.00 58.87 58.89 2jx3 n SER 92 Cb 0.00 -4.99 0.00 0.00 -0.75 0.00 0.00 64.21 58.47 2jx3 n SER 92 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jx3 n GLY 93 N 1.71 4.68 3.96 0.46 0.00 -1.26 -4.97 105.19 109.77 2jx3 n GLY 93 Ca 0.00 -1.00 -0.26 0.00 0.00 0.00 0.00 46.02 44.77 2jx3 n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jx3 s VAL 94 N -1.56 2.17 0.18 1.61 0.11 -1.26 -4.75 120.40 116.90 2jx3 s VAL 94 Ca 0.00 -0.36 -0.20 0.00 -2.93 0.00 0.00 61.98 58.49 2jx3 s VAL 94 Cb 0.00 -2.81 0.11 0.00 -1.53 0.00 0.00 36.38 32.15 2jx3 s VAL 94 CO 0.00 0.00 1.60 0.78 -3.33 0.00 0.00 175.10 174.15 2jx3 h ASN 95 N -0.80 -0.95 0.40 3.54 4.21 -2.01 0.16 115.58 120.14 2jx3 h ASN 95 Ca -0.41 0.19 -0.02 0.00 1.21 0.00 0.00 56.30 57.28 2jx3 h ASN 95 Cb 1.27 0.48 0.00 0.00 -1.12 0.00 0.00 38.32 38.96 2jx3 h ASN 95 CO 0.46 -0.28 -0.19 0.28 -1.29 0.00 0.00 177.43 176.40 2jx3 h SER 96 N -0.17 -0.46 -1.41 5.81 0.02 -2.00 -2.23 113.55 113.11 2jx3 h SER 96 Ca 0.21 0.02 0.41 0.00 -0.84 0.00 0.00 61.79 61.59 2jx3 h SER 96 Cb 0.51 0.12 -0.06 0.00 0.14 0.00 0.00 62.40 63.12 2jx3 h SER 96 CO -0.58 -0.31 1.12 -0.08 -1.14 0.00 0.00 176.83 175.84 2jx3 h GLU 97 N -0.59 0.00 0.35 3.45 4.57 -1.87 -0.25 114.58 120.25 2jx3 h GLU 97 Ca -0.06 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 2jx3 h GLU 97 Cb 0.42 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 2jx3 h GLU 97 CO 0.09 0.00 -0.17 -0.07 -1.18 0.00 0.00 179.01 177.68 2jx3 h LEU 98 N 0.00 -0.40 0.25 1.64 3.38 -0.26 -2.62 115.31 117.30 2jx3 h LEU 98 Ca 0.67 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.66 2jx3 h LEU 98 Cb 2.91 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 43.73 2jx3 h LEU 98 CO -0.01 -0.08 -0.50 0.58 0.09 0.00 0.00 178.44 178.53 2jx3 h VAL 99 N -0.89 0.00 -1.68 1.22 2.07 -0.51 0.16 116.25 116.61 2jx3 h VAL 99 Ca -0.05 0.00 0.50 0.00 0.82 0.00 0.00 66.70 67.97 2jx3 h VAL 99 Cb 0.36 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.05 2jx3 h VAL 99 CO 0.08 0.00 1.19 0.50 0.02 0.00 0.00 177.57 179.36 2jx3 h LYS 100 N -0.81 0.02 -0.05 1.57 3.64 -1.35 0.55 116.57 120.14 2jx3 h LYS 100 Ca -0.03 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2jx3 h LYS 100 Cb 0.77 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.58 2jx3 h LYS 100 CO -0.19 0.01 0.01 -0.09 -2.27 0.00 0.00 179.45 176.91 2jx3 h ARG 101 N 0.02 0.08 -0.62 1.90 2.43 -0.28 -2.45 114.38 115.45 2jx3 h ARG 101 Ca 0.84 -0.02 0.18 0.00 -0.81 0.00 0.00 59.98 60.16 2jx3 h ARG 101 Cb 3.22 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 32.74 2jx3 h ARG 101 CO -0.09 0.33 0.44 -0.84 -1.51 0.00 0.00 179.97 178.30 2jx3 h ILE 102 N -0.18 0.70 0.00 1.20 -0.00 0.37 0.78 117.51 120.37 2jx3 h ILE 102 Ca 0.01 -0.01 -0.09 0.00 -0.00 0.00 0.00 64.86 64.78 2jx3 h ILE 102 Cb 0.29 0.67 -0.01 0.00 -0.00 0.00 0.00 36.82 37.77 2jx3 h ILE 102 CO 0.00 0.00 -0.41 -0.07 -0.00 0.00 0.00 178.15 177.68 2jx3 h LEU 103 N 0.03 0.00 0.00 0.16 3.38 -1.26 1.29 115.31 118.91 2jx3 h LEU 103 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2jx3 h LEU 103 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2jx3 h LEU 103 CO -0.01 0.41 -1.53 0.59 0.09 0.00 0.00 178.44 177.99 2jx3 n ASN 104 N -3.47 0.41 0.04 -0.43 3.02 0.20 -4.13 115.26 110.90 2jx3 n ASN 104 Ca 0.00 -0.28 -0.00 0.00 -0.03 0.00 0.00 54.58 54.26 2jx3 n ASN 104 Cb 0.56 1.46 -0.00 0.00 -0.61 0.00 0.00 39.78 41.19 2jx3 n ASN 104 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2jx3 n PHE 105 N -2.03 0.00 -0.21 3.10 7.35 0.21 -4.20 117.46 121.69 2jx3 n PHE 105 Ca -0.01 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.60 2jx3 n PHE 105 Cb 0.48 -0.02 0.02 0.00 0.35 0.00 0.00 39.48 40.32 2jx3 n PHE 105 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2jx3 h LEU 106 N -0.04 0.89 -0.30 -2.13 -0.00 -0.96 0.60 115.31 113.37 2jx3 h LEU 106 Ca -0.00 -0.24 0.00 0.00 -0.00 0.00 0.00 57.88 57.64 2jx3 h LEU 106 Cb 0.13 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.55 2jx3 h LEU 106 CO -0.00 0.90 0.00 -0.03 -0.00 0.00 0.00 178.44 179.31 2jx3 h MET 107 N 0.84 0.00 -0.26 1.13 4.05 0.14 -3.36 114.93 117.47 2jx3 h MET 107 Ca 0.18 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.63 2jx3 h MET 107 Cb 0.37 0.00 -0.16 0.00 -0.80 0.00 0.00 31.60 31.01 2jx3 h MET 107 CO 0.00 0.00 -0.15 -1.58 0.23 0.00 0.00 176.91 175.42 2jx3 s HIS 108 N -3.22 -0.43 0.00 1.39 2.46 -0.86 -3.63 115.29 111.00 2jx3 s HIS 108 Ca 0.08 -0.09 0.00 0.00 0.47 0.00 0.00 55.06 55.52 2jx3 s HIS 108 Cb 0.10 0.08 0.00 0.00 -0.13 0.00 0.00 32.58 32.64 2jx3 s HIS 108 CO 0.55 -0.32 0.02 -0.35 -2.47 0.00 0.00 174.74 172.17 2jx3 n PRO 109 N 2.93 0.00 -0.46 2.88 -0.04 0.20 -4.04 135.00 136.47 2jx3 n PRO 109 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2jx3 n PRO 109 Cb 0.64 -0.29 0.00 0.00 -0.04 0.00 0.00 33.50 33.81 2jx3 n PRO 109 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63