#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jg2 n ASP 23 N 0.00 0.00 0.27 0.55 5.68 -1.26 -5.01 116.55 116.78 2jg2 n ASP 23 Ca 0.00 -0.43 0.18 0.00 -0.50 0.00 0.00 54.79 54.04 2jg2 n ASP 23 Cb 0.00 0.00 0.86 0.00 -1.14 0.00 0.00 41.12 40.84 2jg2 n ASP 23 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 2jg2 h LEU 24 N 0.00 0.00 -0.80 -2.12 3.38 -2.09 -2.49 115.31 111.19 2jg2 h LEU 24 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2jg2 h LEU 24 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2jg2 h LEU 24 CO 0.00 0.00 -0.44 0.18 0.09 0.00 0.00 178.44 178.27 2jg2 n LEU 25 N -2.87 1.69 0.27 1.67 4.32 -1.26 -4.15 117.00 116.67 2jg2 n LEU 25 Ca -0.01 -0.60 0.09 0.00 -0.02 0.00 0.00 56.01 55.47 2jg2 n LEU 25 Cb 0.17 -0.04 0.69 0.00 -1.62 0.00 0.00 43.42 42.62 2jg2 n LEU 25 CO 0.21 0.32 1.08 0.28 -1.22 0.00 0.00 177.39 178.06 2jg2 h SER 26 N 1.96 0.00 0.16 -1.43 0.02 -1.84 -0.58 113.55 111.85 2jg2 h SER 26 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2jg2 h SER 26 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 2jg2 h SER 26 CO 0.00 0.00 0.00 2.29 -1.14 0.00 0.00 176.83 177.98 2jg2 n LYS 27 N -4.42 0.08 -0.02 3.45 2.85 -1.26 -1.80 118.16 117.05 2jg2 n LYS 27 Ca -0.03 0.52 0.13 0.00 -1.05 0.00 0.00 58.31 57.87 2jg2 n LYS 27 Cb 0.09 -1.74 0.25 0.00 -0.65 0.00 0.00 35.03 32.98 2jg2 n LYS 27 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 2jg2 n PHE 28 N -1.91 0.05 -0.37 5.58 3.72 -0.23 -4.42 117.46 119.89 2jg2 n PHE 28 Ca 0.00 -0.02 0.03 0.00 -0.05 0.00 0.00 57.45 57.40 2jg2 n PHE 28 Cb 0.07 0.00 0.17 0.00 -0.94 0.00 0.00 39.48 38.78 2jg2 n PHE 28 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2jg2 h ASP 29 N 3.86 1.03 -0.25 4.37 3.32 -1.50 -1.05 116.42 126.21 2jg2 h ASP 29 Ca 0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 2jg2 h ASP 29 Cb 0.82 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 2jg2 h ASP 29 CO 0.00 0.65 0.12 1.23 -1.72 0.00 0.00 179.24 179.53 2jg2 h GLY 30 N 1.17 0.38 1.27 2.75 0.00 -1.82 -0.80 103.07 106.02 2jg2 h GLY 30 Ca 0.43 -0.19 -0.09 0.00 0.00 0.00 0.00 47.33 47.48 2jg2 h GLY 30 CO -0.17 0.18 -0.03 1.41 0.00 0.00 0.00 176.54 177.92 2jg2 h LEU 31 N 0.27 0.86 -0.34 3.11 3.38 -1.73 0.48 115.31 121.35 2jg2 h LEU 31 Ca 0.09 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 2jg2 h LEU 31 Cb 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2jg2 h LEU 31 CO -0.01 0.94 0.11 0.40 0.09 0.00 0.00 178.44 179.97 2jg2 h ILE 32 N 0.81 1.20 -0.75 1.22 2.04 -1.07 -0.70 117.51 120.26 2jg2 h ILE 32 Ca 0.15 -0.64 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 2jg2 h ILE 32 Cb 0.53 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 2jg2 h ILE 32 CO 0.03 0.22 0.30 0.00 0.00 0.00 0.00 178.15 178.70 2jg2 h ALA 33 N 0.95 0.97 -0.48 1.87 0.00 -0.78 -1.95 119.26 119.84 2jg2 h ALA 33 Ca 0.11 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 2jg2 h ALA 33 Cb 0.23 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2jg2 h ALA 33 CO -0.01 0.59 0.09 0.93 0.00 0.00 0.00 179.25 180.86 2jg2 h GLU 34 N 1.08 0.79 -0.54 0.00 5.08 -0.72 -1.22 114.58 119.04 2jg2 h GLU 34 Ca 0.25 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2jg2 h GLU 34 Cb 0.21 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 2jg2 h GLU 34 CO -0.02 0.78 0.34 -0.09 -1.00 0.00 0.00 179.01 179.02 2jg2 h ARG 35 N 0.66 0.73 -0.53 2.33 2.43 -0.96 -2.02 114.38 117.03 2jg2 h ARG 35 Ca 0.15 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2jg2 h ARG 35 Cb 0.37 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 2jg2 h ARG 35 CO 0.01 0.51 0.12 0.37 -1.51 0.00 0.00 179.97 179.47 2jg2 h GLN 36 N 0.73 0.81 -0.44 0.20 5.75 -1.03 -1.19 115.11 119.95 2jg2 h GLN 36 Ca 0.20 -0.16 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 2jg2 h GLN 36 Cb -0.03 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.37 2jg2 h GLN 36 CO -0.04 0.73 0.26 -0.22 -2.65 0.00 0.00 178.83 176.91 2jg2 h LYS 37 N 0.78 0.60 -0.40 1.69 3.64 -0.90 0.72 116.57 122.70 2jg2 h LYS 37 Ca 0.17 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.52 2jg2 h LYS 37 Cb 0.29 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2jg2 h LYS 37 CO -0.00 0.45 0.22 1.25 -2.27 0.00 0.00 179.45 179.10 2jg2 h LEU 38 N 0.58 0.34 -1.44 5.20 5.85 -0.92 -2.30 115.31 122.62 2jg2 h LEU 38 Ca 0.16 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 2jg2 h LEU 38 Cb 0.01 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 2jg2 h LEU 38 CO -0.03 0.24 -0.22 -0.07 -0.34 0.00 0.00 178.44 178.03 2jg2 h LEU 39 N 0.44 0.08 -2.81 2.25 3.38 -0.87 -2.13 115.31 115.65 2jg2 h LEU 39 Ca 0.16 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 2jg2 h LEU 39 Cb 0.04 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2jg2 h LEU 39 CO -0.09 0.31 -0.00 0.44 0.09 0.00 0.00 178.44 179.18 2jg2 h ASP 40 N 0.08 0.00 1.07 -0.43 3.32 -0.26 -0.41 116.42 119.79 2jg2 h ASP 40 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2jg2 h ASP 40 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 2jg2 h ASP 40 CO 0.03 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.01 2jg2 n SER 41 N -3.21 0.48 0.00 6.45 3.41 -0.80 -4.91 113.62 115.04 2jg2 n SER 41 Ca -0.03 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 2jg2 n SER 41 Cb 0.09 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 2jg2 n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jg2 n GLY 42 N 0.91 0.67 3.79 5.00 0.00 -0.16 -5.06 105.19 110.33 2jg2 n GLY 42 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 2jg2 n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jg2 s VAL 43 N -2.28 3.86 0.37 1.61 0.11 -1.26 -5.02 120.40 117.79 2jg2 s VAL 43 Ca 0.00 1.31 -0.28 0.00 -2.93 0.00 0.00 61.98 60.08 2jg2 s VAL 43 Cb 0.00 -3.62 -0.11 0.00 -1.53 0.00 0.00 36.38 31.12 2jg2 s VAL 43 CO 0.00 -0.10 1.46 0.41 -3.33 0.00 0.00 175.10 173.54 2jg2 n THR 44 N -0.38 1.94 -1.99 5.04 -1.04 -1.26 -4.74 114.28 111.86 2jg2 n THR 44 Ca 0.06 -0.49 -0.43 0.00 -2.04 0.00 0.00 64.05 61.16 2jg2 n THR 44 Cb 0.51 -1.91 -0.03 0.00 -1.82 0.00 0.00 70.33 67.08 2jg2 n THR 44 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2jg2 s ASP 45 N -0.12 6.09 0.31 8.00 -1.08 -1.26 -4.85 116.67 123.76 2jg2 s ASP 45 Ca 0.54 1.57 0.26 0.00 -0.52 0.00 0.00 52.55 54.40 2jg2 s ASP 45 Cb -0.49 -2.53 1.03 0.00 -1.46 0.00 0.00 42.92 39.47 2jg2 s ASP 45 CO 0.63 -1.50 1.77 1.55 0.52 0.00 0.00 175.17 178.13 2jg2 h PRO 46 N 12.04 0.00 -0.40 4.34 0.13 -2.02 -2.66 132.00 143.43 2jg2 h PRO 46 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2jg2 h PRO 46 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2jg2 h PRO 46 CO 1.01 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.97 2jg2 n PHE 47 N -2.42 0.53 -1.70 1.56 3.72 -1.26 -4.18 117.46 113.72 2jg2 n PHE 47 Ca 0.02 -0.26 0.04 0.00 -0.05 0.00 0.00 57.45 57.20 2jg2 n PHE 47 Cb 0.27 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.87 2jg2 n PHE 47 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2jg2 n ALA 48 N 1.07 2.21 -1.89 4.37 0.00 -1.00 -5.07 120.51 120.21 2jg2 n ALA 48 Ca 0.18 -1.81 -0.41 0.00 0.00 0.00 0.00 53.44 51.40 2jg2 n ALA 48 Cb 0.49 -0.47 -0.02 0.00 0.00 0.00 0.00 19.45 19.44 2jg2 n ALA 48 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jg2 s ILE 49 N -1.18 2.68 -0.15 0.00 -1.09 -1.24 -5.01 121.20 115.19 2jg2 s ILE 49 Ca 0.16 0.56 0.02 0.00 -2.23 0.00 0.00 60.65 59.16 2jg2 s ILE 49 Cb 0.15 -3.36 0.01 0.00 -1.58 0.00 0.00 42.46 37.68 2jg2 s ILE 49 CO -0.01 0.09 -0.20 -0.69 -1.23 0.00 0.00 174.94 172.90 2jg2 s VAL 50 N 0.07 2.22 -0.82 2.92 1.01 -1.26 -5.07 120.40 119.47 2jg2 s VAL 50 Ca 0.60 -0.92 -0.25 0.00 0.00 0.00 0.00 61.98 61.42 2jg2 s VAL 50 Cb -0.42 -1.91 0.05 0.00 0.00 0.00 0.00 36.38 34.10 2jg2 s VAL 50 CO 0.42 0.54 1.27 -0.04 0.00 0.00 0.00 175.10 177.30 2jg2 s MET 51 N 0.91 3.32 0.17 2.72 1.00 -1.26 -4.45 119.30 121.71 2jg2 s MET 51 Ca -0.04 -0.67 -0.08 0.00 0.00 0.00 0.00 55.69 54.89 2jg2 s MET 51 Cb -0.15 -4.57 0.04 0.00 0.00 0.00 0.00 34.83 30.15 2jg2 s MET 51 CO -0.03 -2.10 1.54 0.93 0.00 0.00 0.00 175.02 175.36 2jg2 h GLU 52 N 9.82 0.90 -4.48 2.03 4.39 -1.35 -3.43 114.58 122.47 2jg2 h GLU 52 Ca -0.12 -0.42 -0.27 0.00 0.34 0.00 0.00 59.36 58.89 2jg2 h GLU 52 Cb 1.04 -0.01 -0.22 0.00 -0.10 0.00 0.00 28.75 29.45 2jg2 h GLU 52 CO 1.30 1.07 -0.73 -0.65 -1.16 0.00 0.00 179.01 178.83 2jg2 s GLN 53 N -4.53 0.49 -0.22 2.33 -0.21 -1.19 -4.98 119.66 111.35 2jg2 s GLN 53 Ca -0.10 -0.65 0.00 0.00 0.02 0.00 0.00 55.36 54.63 2jg2 s GLN 53 Cb 0.12 -0.28 0.06 0.00 1.00 0.00 0.00 33.01 33.91 2jg2 s GLN 53 CO 0.86 0.05 -0.04 0.08 -2.12 0.00 0.00 175.29 174.13 2jg2 s VAL 54 N -1.16 1.33 0.09 1.09 1.01 -1.26 -0.70 120.40 120.79 2jg2 s VAL 54 Ca -0.08 -1.08 0.07 0.00 0.00 0.00 0.00 61.98 60.89 2jg2 s VAL 54 Cb -0.09 -1.64 -0.22 0.00 0.00 0.00 0.00 36.38 34.44 2jg2 s VAL 54 CO 0.00 -0.11 1.15 0.11 0.00 0.00 0.00 175.10 176.26 2jg2 h LYS 55 N 8.01 0.03 -2.50 2.72 1.57 -1.31 -3.49 116.57 121.61 2jg2 h LYS 55 Ca -0.18 -0.05 0.17 0.00 -1.87 0.00 0.00 60.65 58.71 2jg2 h LYS 55 Cb 1.08 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.37 2jg2 h LYS 55 CO 0.40 0.94 0.58 -1.54 -0.57 0.00 0.00 179.45 179.26 2jg2 s SER 56 N -6.66 -0.01 0.67 0.86 1.04 -1.15 -4.96 113.70 103.49 2jg2 s SER 56 Ca -0.01 -0.64 0.44 0.00 0.48 0.00 0.00 55.95 56.22 2jg2 s SER 56 Cb 0.09 0.49 2.38 0.00 0.10 0.00 0.00 66.02 69.09 2jg2 s SER 56 CO 0.83 -0.97 2.34 -0.65 0.98 0.00 0.00 173.24 175.77 2jg2 h PRO 57 N 2.00 0.00 -0.03 4.02 0.11 -1.94 -2.88 132.00 133.28 2jg2 h PRO 57 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2jg2 h PRO 57 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2jg2 h PRO 57 CO 0.35 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.39 2jg2 n THR 58 N -3.06 0.37 -3.90 -1.15 -2.24 -1.26 -4.81 114.28 98.22 2jg2 n THR 58 Ca -0.03 -0.68 -0.15 0.00 -2.27 0.00 0.00 64.05 60.92 2jg2 n THR 58 Cb 0.10 0.85 -0.15 0.00 -2.10 0.00 0.00 70.33 69.03 2jg2 n THR 58 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2jg2 s GLU 59 N -0.51 0.13 0.21 -0.78 2.02 -1.09 -0.59 118.70 118.11 2jg2 s GLU 59 Ca 0.04 0.04 -0.04 0.00 0.02 0.00 0.00 54.97 55.03 2jg2 s GLU 59 Cb 0.02 -0.26 -0.03 0.00 0.10 0.00 0.00 34.13 33.97 2jg2 s GLU 59 CO 0.03 -0.07 0.23 0.00 0.02 0.00 0.00 175.26 175.48 2jg2 s ALA 60 N 0.55 0.75 -0.26 5.21 0.00 -0.19 -0.77 121.76 127.04 2jg2 s ALA 60 Ca -0.05 -1.45 -0.04 0.00 0.00 0.00 0.00 51.96 50.42 2jg2 s ALA 60 Cb -0.07 1.29 0.01 0.00 0.00 0.00 0.00 23.12 24.34 2jg2 s ALA 60 CO -0.01 -0.66 0.00 0.08 0.00 0.00 0.00 175.76 175.16 2jg2 s VAL 61 N -4.12 3.44 -0.11 0.00 1.01 0.12 -0.31 120.40 120.44 2jg2 s VAL 61 Ca 0.34 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.58 2jg2 s VAL 61 Cb 0.05 -2.72 0.01 0.00 0.00 0.00 0.00 36.38 33.72 2jg2 s VAL 61 CO 0.11 0.21 -0.16 -0.63 0.00 0.00 0.00 175.10 174.63 2jg2 s ILE 62 N 1.43 1.53 -1.46 2.22 1.01 -0.58 -0.73 121.20 124.63 2jg2 s ILE 62 Ca 0.02 -0.67 -0.09 0.00 0.00 0.00 0.00 60.65 59.92 2jg2 s ILE 62 Cb -0.16 -1.39 0.04 0.00 0.01 0.00 0.00 42.46 40.96 2jg2 s ILE 62 CO -0.01 0.45 0.77 0.54 0.00 0.00 0.00 174.94 176.68 2jg2 n ARG 63 N 4.13 -5.25 -0.95 2.79 1.74 -1.26 -1.06 116.66 116.80 2jg2 n ARG 63 Ca -0.19 0.72 0.00 0.00 -0.77 0.00 0.00 57.85 57.61 2jg2 n ARG 63 Cb 0.51 -5.60 0.00 0.00 -1.02 0.00 0.00 32.46 26.36 2jg2 n ARG 63 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jg2 n GLY 64 N -1.57 0.61 3.39 -0.13 0.00 -1.26 -5.00 105.19 101.22 2jg2 n GLY 64 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 2jg2 n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jg2 s LYS 65 N -0.29 3.10 0.19 1.61 1.02 -0.22 -5.08 119.74 120.06 2jg2 s LYS 65 Ca 0.00 -0.71 -0.32 0.00 0.02 0.00 0.00 55.97 54.97 2jg2 s LYS 65 Cb 0.00 -2.53 -0.11 0.00 -0.52 0.00 0.00 37.83 34.68 2jg2 s LYS 65 CO 0.00 0.33 1.61 -0.51 -0.92 0.00 0.00 175.35 175.86 2jg2 s ASP 66 N 0.04 6.52 -0.01 2.83 1.01 -1.26 -1.52 116.67 124.28 2jg2 s ASP 66 Ca -0.05 2.71 0.00 0.00 0.71 0.00 0.00 52.55 55.92 2jg2 s ASP 66 Cb -0.15 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.20 2jg2 s ASP 66 CO 0.04 -0.87 0.00 -0.89 0.21 0.00 0.00 175.17 173.67 2jg2 s THR 67 N 1.07 0.05 0.10 -1.27 2.01 0.58 -4.69 115.64 113.49 2jg2 s THR 67 Ca 0.71 0.05 -0.30 0.00 0.31 0.00 0.00 61.69 62.45 2jg2 s THR 67 Cb -0.46 -0.09 -0.06 0.00 0.01 0.00 0.00 72.50 71.90 2jg2 s THR 67 CO 0.32 0.05 1.09 -0.63 -0.69 0.00 0.00 174.62 174.77 2jg2 s ILE 68 N 0.39 4.19 -0.15 1.82 1.01 0.00 -1.02 121.20 127.44 2jg2 s ILE 68 Ca -0.03 1.71 -0.20 0.00 0.00 0.00 0.00 60.65 62.13 2jg2 s ILE 68 Cb -0.05 -4.10 -0.03 0.00 0.01 0.00 0.00 42.46 38.29 2jg2 s ILE 68 CO -0.01 0.21 0.58 -0.76 0.00 0.00 0.00 174.94 174.96 2jg2 s LEU 69 N 0.38 4.21 0.00 2.97 1.43 0.24 -0.77 118.68 127.15 2jg2 s LEU 69 Ca 0.52 0.86 0.11 0.00 -1.03 0.00 0.00 54.13 54.59 2jg2 s LEU 69 Cb -0.27 -2.83 0.18 0.00 0.03 0.00 0.00 46.19 43.30 2jg2 s LEU 69 CO 0.31 -0.15 1.02 -0.11 0.23 0.00 0.00 176.35 177.65 2jg2 n LEU 70 N 4.40 0.30 -2.78 1.79 7.94 0.02 -4.80 117.00 123.87 2jg2 n LEU 70 Ca -0.04 -1.55 -0.02 0.00 -1.11 0.00 0.00 56.01 53.30 2jg2 n LEU 70 Cb 0.51 0.00 0.05 0.00 0.53 0.00 0.00 43.42 44.50 2jg2 n LEU 70 CO 0.44 0.58 -0.00 0.61 -1.11 0.00 0.00 177.39 177.91 2jg2 n GLY 71 N 0.21 2.03 3.46 -3.96 0.00 -1.12 -1.04 105.19 104.79 2jg2 n GLY 71 Ca -0.01 -1.17 -0.24 0.00 0.00 0.00 0.00 46.02 44.61 2jg2 n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jg2 s THR 72 N -3.82 2.34 -0.45 2.61 -4.23 -1.26 -4.74 115.64 106.08 2jg2 s THR 72 Ca 0.28 -2.35 0.03 0.00 -1.18 0.00 0.00 61.69 58.47 2jg2 s THR 72 Cb 0.33 -2.32 0.62 0.00 1.34 0.00 0.00 72.50 72.47 2jg2 s THR 72 CO -0.03 -0.39 1.89 -1.22 -0.54 0.00 0.00 174.62 174.33 2jg2 n TYR 73 N -0.61 2.95 -1.49 3.99 4.01 -1.26 -4.64 117.16 120.10 2jg2 n TYR 73 Ca -0.05 -1.91 -0.31 0.00 -0.16 0.00 0.00 57.90 55.46 2jg2 n TYR 73 Cb 0.61 -0.97 -0.06 0.00 -0.31 0.00 0.00 39.34 38.61 2jg2 n TYR 73 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2jg2 n ASN 74 N -1.04 7.35 -0.22 7.72 5.15 -1.26 -3.36 115.26 129.60 2jg2 n ASN 74 Ca 0.57 -2.86 0.16 0.00 -0.60 0.00 0.00 54.58 51.85 2jg2 n ASN 74 Cb 1.52 -1.40 0.48 0.00 -0.53 0.00 0.00 39.78 39.84 2jg2 n ASN 74 CO 0.00 0.00 0.00 1.88 1.40 0.00 0.00 177.26 180.54 2jg2 h TYR 75 N 4.04 0.58 -0.36 1.20 0.05 -1.84 -0.61 116.97 120.04 2jg2 h TYR 75 Ca 0.58 0.02 0.00 0.00 0.05 0.00 0.00 58.73 59.38 2jg2 h TYR 75 Cb 0.63 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.19 2jg2 h TYR 75 CO 1.69 0.20 0.00 -1.33 -1.05 0.00 0.00 178.16 177.67 2jg2 n MET 76 N -4.51 2.98 -2.37 4.88 2.81 -1.26 -0.38 117.12 119.28 2jg2 n MET 76 Ca 0.17 -2.41 -0.17 0.00 -1.81 0.00 0.00 57.70 53.47 2jg2 n MET 76 Cb 0.57 -1.53 -0.01 0.00 -0.71 0.00 0.00 33.22 31.54 2jg2 n MET 76 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jg2 n GLY 77 N 0.26 -0.39 0.19 3.03 0.00 -0.24 -4.74 105.19 103.30 2jg2 n GLY 77 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.32 2jg2 n GLY 77 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2jg2 h MET 78 N 0.00 0.00 0.00 1.61 2.86 -1.81 -3.28 114.93 114.30 2jg2 h MET 78 Ca -0.41 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.23 2jg2 h MET 78 Cb 1.29 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.95 2jg2 h MET 78 CO 0.49 0.00 -0.02 1.79 1.06 0.00 0.00 176.91 180.23 2jg2 h THR 79 N 0.00 0.10 -0.13 2.22 1.35 -1.85 -1.75 112.91 112.85 2jg2 h THR 79 Ca 0.00 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 2jg2 h THR 79 Cb 0.60 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 2jg2 h THR 79 CO 0.00 0.02 0.00 0.49 -0.25 0.00 0.00 175.52 175.78 2jg2 n PHE 80 N -3.19 0.28 -1.79 4.73 3.72 -1.24 -4.84 117.46 115.13 2jg2 n PHE 80 Ca -0.02 -0.68 -0.42 0.00 -0.05 0.00 0.00 57.45 56.29 2jg2 n PHE 80 Cb 0.17 -0.11 -0.02 0.00 -0.94 0.00 0.00 39.48 38.58 2jg2 n PHE 80 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2jg2 s ASP 81 N -1.59 6.40 0.35 4.37 2.15 -0.66 -4.88 116.67 122.81 2jg2 s ASP 81 Ca 0.20 2.90 0.11 0.00 0.43 0.00 0.00 52.55 56.19 2jg2 s ASP 81 Cb 0.15 -2.62 0.65 0.00 -0.30 0.00 0.00 42.92 40.80 2jg2 s ASP 81 CO 0.06 -0.91 1.79 1.55 -0.17 0.00 0.00 175.17 177.49 2jg2 h PRO 82 N 5.42 0.06 -0.36 4.34 0.13 -1.96 -0.69 132.00 138.94 2jg2 h PRO 82 Ca -0.46 -0.02 -0.16 0.00 -0.87 0.00 0.00 66.00 64.49 2jg2 h PRO 82 Cb 1.21 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2jg2 h PRO 82 CO 0.84 0.43 -0.40 -0.44 -0.23 0.00 0.00 178.00 178.20 2jg2 h ASP 83 N 0.05 0.95 -0.10 1.44 3.32 -1.97 -1.34 116.42 118.77 2jg2 h ASP 83 Ca 0.00 -0.44 -0.01 0.00 0.02 0.00 0.00 57.03 56.61 2jg2 h ASP 83 Cb 0.70 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.98 2jg2 h ASP 83 CO 0.05 1.23 0.03 0.58 -1.72 0.00 0.00 179.24 179.41 2jg2 h VAL 84 N 0.72 1.17 -0.64 -1.35 2.07 -1.73 -1.01 116.25 115.49 2jg2 h VAL 84 Ca 0.06 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 2jg2 h VAL 84 Cb 0.98 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 32.06 2jg2 h VAL 84 CO 0.10 0.15 0.30 0.40 0.02 0.00 0.00 177.57 178.54 2jg2 h ILE 85 N -0.02 1.22 -0.66 4.57 1.08 -1.13 -1.80 117.51 120.76 2jg2 h ILE 85 Ca 0.03 -0.62 -0.06 0.00 -0.39 0.00 0.00 64.86 63.82 2jg2 h ILE 85 Cb 0.21 0.45 -0.03 0.00 -3.07 0.00 0.00 36.82 34.39 2jg2 h ILE 85 CO -0.00 0.26 0.18 0.00 -0.69 0.00 0.00 178.15 177.89 2jg2 h ALA 86 N 1.14 1.06 -0.73 1.87 0.00 -1.10 -1.06 119.26 120.43 2jg2 h ALA 86 Ca 0.22 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2jg2 h ALA 86 Cb 0.12 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2jg2 h ALA 86 CO -0.03 0.63 0.32 0.00 0.00 0.00 0.00 179.25 180.17 2jg2 h ALA 87 N 1.20 1.18 -0.32 0.00 0.00 -0.79 -0.44 119.26 120.09 2jg2 h ALA 87 Ca 0.21 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2jg2 h ALA 87 Cb 0.32 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2jg2 h ALA 87 CO -0.00 0.60 -0.02 0.78 0.00 0.00 0.00 179.25 180.61 2jg2 h GLY 88 N 1.10 0.63 0.98 0.00 0.00 -0.60 -1.37 103.07 103.80 2jg2 h GLY 88 Ca 0.25 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 2jg2 h GLY 88 CO -0.03 0.44 0.01 0.50 0.00 0.00 0.00 176.54 177.46 2jg2 h LYS 89 N 0.37 0.81 -0.68 4.80 1.57 -0.96 -1.43 116.57 121.05 2jg2 h LYS 89 Ca 0.09 -0.25 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 2jg2 h LYS 89 Cb 0.48 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 2jg2 h LYS 89 CO 0.02 0.85 0.34 1.49 -0.57 0.00 0.00 179.45 181.59 2jg2 h GLU 90 N 0.66 0.96 -0.39 3.15 4.81 -1.03 -1.90 114.58 120.84 2jg2 h GLU 90 Ca 0.13 -0.12 -0.15 0.00 -0.13 0.00 0.00 59.36 59.09 2jg2 h GLU 90 Cb 0.48 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2jg2 h GLU 90 CO 0.02 0.73 -0.36 0.00 -0.73 0.00 0.00 179.01 178.67 2jg2 h ALA 91 N 1.42 0.57 -0.50 2.92 0.00 -0.93 -0.24 119.26 122.50 2jg2 h ALA 91 Ca 0.24 -0.44 0.04 0.00 0.00 0.00 0.00 54.91 54.74 2jg2 h ALA 91 Cb 0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2jg2 h ALA 91 CO -0.03 0.66 0.27 -0.07 0.00 0.00 0.00 179.25 180.07 2jg2 h LEU 92 N 0.75 0.40 -0.48 0.00 3.38 -0.99 0.16 115.31 118.53 2jg2 h LEU 92 Ca 0.07 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 2jg2 h LEU 92 Cb 0.95 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 2jg2 h LEU 92 CO 0.09 0.27 0.05 -0.08 0.09 0.00 0.00 178.44 178.86 2jg2 h GLU 93 N 0.52 0.82 0.05 1.13 4.57 -1.03 -1.39 114.58 119.26 2jg2 h GLU 93 Ca 0.22 -0.24 -0.30 0.00 -1.18 0.00 0.00 59.36 57.86 2jg2 h GLU 93 Cb 0.10 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.58 2jg2 h GLU 93 CO -0.14 0.84 -1.65 0.87 -1.18 0.00 0.00 179.01 177.75 2jg2 h LYS 94 N 0.68 0.12 0.00 1.92 1.57 -0.88 -3.40 116.57 116.58 2jg2 h LYS 94 Ca 0.14 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2jg2 h LYS 94 Cb 0.44 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2jg2 h LYS 94 CO 0.02 0.84 0.00 1.19 -0.57 0.00 0.00 179.45 180.93 2jg2 n PHE 95 N -3.27 0.00 -1.17 -1.35 3.72 0.55 -5.08 117.46 110.87 2jg2 n PHE 95 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 2jg2 n PHE 95 Cb 1.04 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.58 2jg2 n PHE 95 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jg2 n GLY 96 N 0.49 -2.54 0.07 1.37 0.00 -0.52 -4.63 105.19 99.43 2jg2 n GLY 96 Ca 0.00 -1.70 0.13 0.00 0.00 0.00 0.00 46.02 44.45 2jg2 n GLY 96 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jg2 n SER 97 N -0.07 0.61 -3.56 1.61 3.41 -1.26 -4.37 113.62 109.98 2jg2 n SER 97 Ca 0.00 0.43 -0.04 0.00 -0.26 0.00 0.00 58.87 59.00 2jg2 n SER 97 Cb 0.00 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.45 2jg2 n SER 97 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2jg2 s GLY 98 N -3.44 -0.08 -0.05 5.00 0.00 -1.26 -4.64 107.32 102.85 2jg2 s GLY 98 Ca 0.11 -0.09 0.15 0.00 0.00 0.00 0.00 44.72 44.89 2jg2 s GLY 98 CO 0.61 0.82 0.26 -1.30 0.00 0.00 0.00 173.10 173.49 2jg2 n THR 99 N -0.56 0.25 -3.36 0.90 -2.24 -1.26 -4.78 114.28 103.23 2jg2 n THR 99 Ca -0.05 -0.41 -0.24 0.00 -2.27 0.00 0.00 64.05 61.07 2jg2 n THR 99 Cb 0.60 -0.05 0.03 0.00 -2.10 0.00 0.00 70.33 68.81 2jg2 n THR 99 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2jg2 n ASN 100 N -2.16 -5.18 -3.61 3.42 4.13 -1.26 -4.65 115.26 105.95 2jg2 n ASN 100 Ca -0.08 -0.44 -0.00 0.00 1.68 0.00 0.00 54.58 55.73 2jg2 n ASN 100 Cb 0.54 -4.18 -0.01 0.00 -1.54 0.00 0.00 39.78 34.59 2jg2 n ASN 100 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2jg2 s GLY 101 N -2.89 -0.32 0.70 7.41 0.00 -1.26 -4.90 107.32 106.06 2jg2 s GLY 101 Ca 0.44 1.50 -0.14 0.00 0.00 0.00 0.00 44.72 46.52 2jg2 s GLY 101 CO 0.54 0.45 1.13 -0.45 0.00 0.00 0.00 173.10 174.77 2jg2 s SER 102 N -2.40 4.77 0.63 1.64 0.15 -1.26 -1.03 113.70 116.21 2jg2 s SER 102 Ca 0.13 2.06 0.37 0.00 0.70 0.00 0.00 55.95 59.20 2jg2 s SER 102 Cb 0.02 -2.56 2.09 0.00 -1.71 0.00 0.00 66.02 63.86 2jg2 s SER 102 CO -0.04 -1.86 2.28 0.03 1.20 0.00 0.00 173.24 174.84 2jg2 h ARG 103 N -0.24 0.00 -0.01 5.44 2.47 -1.81 0.66 114.38 120.90 2jg2 h ARG 103 Ca -0.46 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.26 2jg2 h ARG 103 Cb 1.26 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.58 2jg2 h ARG 103 CO 0.52 0.00 -0.17 -1.33 0.56 0.00 0.00 179.97 179.56 2jg2 n MET 104 N -3.43 0.92 0.00 0.04 2.81 -1.26 -4.52 117.12 111.68 2jg2 n MET 104 Ca -0.02 -0.47 0.00 0.00 -1.81 0.00 0.00 57.70 55.39 2jg2 n MET 104 Cb 0.12 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.14 2jg2 n MET 104 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2jg2 n LEU 105 N -0.63 0.00 -1.06 4.03 4.77 -0.59 -5.01 117.00 118.51 2jg2 n LEU 105 Ca 0.14 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.23 2jg2 n LEU 105 Cb 0.32 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.62 2jg2 n LEU 105 CO 0.24 0.00 0.68 -0.46 -1.33 0.00 0.00 177.39 176.51 2jg2 n ASN 106 N 0.00 3.34 -1.33 -1.43 6.94 -1.16 -4.53 115.26 117.09 2jg2 n ASN 106 Ca 0.00 -1.95 0.10 0.00 -0.02 0.00 0.00 54.58 52.71 2jg2 n ASN 106 Cb 0.00 -0.25 0.31 0.00 -2.36 0.00 0.00 39.78 37.48 2jg2 n ASN 106 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2jg2 n GLY 107 N 1.34 2.28 3.39 4.83 0.00 0.12 -4.80 105.19 112.35 2jg2 n GLY 107 Ca 0.18 -0.75 -0.44 0.00 0.00 0.00 0.00 46.02 45.01 2jg2 n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jg2 s THR 108 N -1.29 5.10 0.57 2.61 2.01 -1.26 -4.64 115.64 118.74 2jg2 s THR 108 Ca 0.46 -1.01 0.09 0.00 0.31 0.00 0.00 61.69 61.55 2jg2 s THR 108 Cb 0.26 -4.00 0.08 0.00 0.01 0.00 0.00 72.50 68.85 2jg2 s THR 108 CO 0.29 -0.50 0.78 -0.36 -0.69 0.00 0.00 174.62 174.14 2jg2 s PHE 109 N 1.62 1.52 0.22 4.92 0.40 -1.26 -4.98 117.98 120.42 2jg2 s PHE 109 Ca 0.04 -0.69 -0.15 0.00 -0.60 0.00 0.00 56.93 55.53 2jg2 s PHE 109 Cb -0.23 -2.25 0.25 0.00 0.51 0.00 0.00 43.02 41.31 2jg2 s PHE 109 CO 0.07 -1.12 1.58 1.25 0.70 0.00 0.00 175.22 177.70 2jg2 h HIS 110 N 0.19 -0.73 0.00 0.36 -0.00 -2.01 -1.68 115.15 111.28 2jg2 h HIS 110 Ca -0.31 0.08 -0.03 0.00 -0.00 0.00 0.00 60.37 60.11 2jg2 h HIS 110 Cb 1.29 0.44 -0.00 0.00 -0.00 0.00 0.00 27.41 29.13 2jg2 h HIS 110 CO 0.41 -0.37 -0.14 -0.44 -0.00 0.00 0.00 177.93 177.39 2jg2 h ASP 111 N -0.05 0.00 -0.35 3.26 3.32 -1.95 -1.71 116.42 118.95 2jg2 h ASP 111 Ca 0.33 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.24 2jg2 h ASP 111 Cb 0.58 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 2jg2 h ASP 111 CO -0.82 0.14 -0.29 0.45 -1.72 0.00 0.00 179.24 177.00 2jg2 h HIS 112 N 0.00 1.01 -0.42 4.55 3.86 -1.66 -0.57 115.15 121.92 2jg2 h HIS 112 Ca -0.00 -0.26 -0.11 0.00 -1.16 0.00 0.00 60.37 58.83 2jg2 h HIS 112 Cb 0.62 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.84 2jg2 h HIS 112 CO 0.00 1.05 -0.19 0.52 0.86 0.00 0.00 177.93 180.17 2jg2 h MET 113 N 0.73 0.82 -0.50 2.45 2.86 -1.27 -2.55 114.93 117.48 2jg2 h MET 113 Ca 0.08 -0.32 -0.03 0.00 -2.06 0.00 0.00 59.70 57.38 2jg2 h MET 113 Cb 0.85 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.44 2jg2 h MET 113 CO 0.07 0.94 0.21 0.93 1.06 0.00 0.00 176.91 180.13 2jg2 h GLU 114 N 0.72 0.74 -0.12 1.72 4.39 -1.09 -1.82 114.58 119.12 2jg2 h GLU 114 Ca 0.11 -0.13 -0.14 0.00 0.34 0.00 0.00 59.36 59.54 2jg2 h GLU 114 Cb 0.70 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 2jg2 h GLU 114 CO 0.05 0.64 -0.52 -0.24 -1.16 0.00 0.00 179.01 177.79 2jg2 h VAL 115 N 0.67 1.34 -0.24 3.13 3.04 -0.90 0.20 116.25 123.49 2jg2 h VAL 115 Ca 0.17 -1.77 -0.12 0.00 -1.01 0.00 0.00 66.70 63.97 2jg2 h VAL 115 Cb 0.17 1.81 -0.01 0.00 -2.01 0.00 0.00 31.29 31.25 2jg2 h VAL 115 CO -0.02 0.53 -0.34 -0.33 -1.01 0.00 0.00 177.57 176.40 2jg2 h GLU 116 N 0.27 0.52 -0.34 4.17 5.08 -1.33 -1.89 114.58 121.06 2jg2 h GLU 116 Ca 0.01 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.02 2jg2 h GLU 116 Cb 1.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 2jg2 h GLU 116 CO 0.09 0.80 -0.25 0.37 -1.00 0.00 0.00 179.01 179.01 2jg2 h GLN 117 N 0.44 0.67 -0.93 2.33 5.75 -0.96 -1.33 115.11 121.08 2jg2 h GLN 117 Ca 0.05 -0.27 -0.00 0.00 -0.15 0.00 0.00 58.65 58.27 2jg2 h GLN 117 Cb 0.81 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 29.28 2jg2 h GLN 117 CO 0.07 0.86 0.57 0.00 -2.65 0.00 0.00 178.83 177.67 2jg2 h ALA 118 N 1.14 1.24 -0.53 3.38 0.00 -0.58 -0.26 119.26 123.65 2jg2 h ALA 118 Ca 0.08 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2jg2 h ALA 118 Cb 0.73 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2jg2 h ALA 118 CO 0.06 0.65 -0.05 -0.07 0.00 0.00 0.00 179.25 179.84 2jg2 h LEU 119 N 1.29 0.97 -0.55 0.00 3.38 -1.00 0.13 115.31 119.53 2jg2 h LEU 119 Ca 0.34 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 58.03 2jg2 h LEU 119 Cb -0.06 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.37 2jg2 h LEU 119 CO -0.06 1.07 0.27 0.03 0.09 0.00 0.00 178.44 179.84 2jg2 h ARG 120 N 0.85 0.50 -0.40 1.13 3.08 -0.69 -0.22 114.38 118.64 2jg2 h ARG 120 Ca 0.14 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 60.03 2jg2 h ARG 120 Cb 0.61 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 2jg2 h ARG 120 CO 0.04 0.33 -0.29 -0.44 -1.07 0.00 0.00 179.97 178.54 2jg2 h ASP 121 N 0.52 0.89 -0.40 7.04 3.32 -0.79 0.24 116.42 127.25 2jg2 h ASP 121 Ca 0.25 -0.36 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 2jg2 h ASP 121 Cb 0.17 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2jg2 h ASP 121 CO -0.18 1.12 0.09 0.15 -1.72 0.00 0.00 179.24 178.70 2jg2 h PHE 122 N 0.73 0.67 -0.01 4.55 3.57 -0.29 -3.23 116.94 122.93 2jg2 h PHE 122 Ca 0.08 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2jg2 h PHE 122 Cb 0.84 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.40 2jg2 h PHE 122 CO 0.05 0.65 -0.59 0.66 -2.23 0.00 0.00 178.31 176.85 2jg2 n TYR 123 N -4.56 0.00 -3.28 0.41 4.01 -0.13 -4.85 117.16 108.76 2jg2 n TYR 123 Ca -0.01 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.57 2jg2 n TYR 123 Cb 0.21 -0.04 0.07 0.00 -0.31 0.00 0.00 39.34 39.27 2jg2 n TYR 123 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jg2 n GLY 124 N 1.44 -0.22 3.45 2.72 0.00 0.76 -5.04 105.19 108.30 2jg2 n GLY 124 Ca 0.08 0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 2jg2 n GLY 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jg2 s THR 125 N -3.27 2.44 -0.22 2.61 -4.23 -0.71 -4.99 115.64 107.27 2jg2 s THR 125 Ca 0.27 -2.20 0.18 0.00 -1.18 0.00 0.00 61.69 58.76 2jg2 s THR 125 Cb -0.12 -2.22 0.08 0.00 1.34 0.00 0.00 72.50 71.57 2jg2 s THR 125 CO 0.58 -0.25 1.33 0.71 -0.54 0.00 0.00 174.62 176.45 2jg2 h THR 126 N 2.74 0.54 -3.90 3.99 1.35 -1.88 -3.42 112.91 112.33 2jg2 h THR 126 Ca -0.43 -1.81 -0.68 0.00 -0.55 0.00 0.00 66.41 62.93 2jg2 h THR 126 Cb 1.23 2.18 -0.21 0.00 -1.73 0.00 0.00 68.15 69.62 2jg2 h THR 126 CO 0.54 0.31 -0.77 -0.83 -0.25 0.00 0.00 175.52 174.52 2jg2 s GLY 127 N -4.46 1.61 -0.24 5.82 0.00 0.32 -5.03 107.32 105.34 2jg2 s GLY 127 Ca 0.03 -1.08 -0.11 0.00 0.00 0.00 0.00 44.72 43.55 2jg2 s GLY 127 CO 0.75 -0.94 0.56 0.00 0.00 0.00 0.00 173.10 173.46 2jg2 s ALA 128 N -0.89 -1.57 -0.14 3.20 0.00 -1.26 -2.21 121.76 118.90 2jg2 s ALA 128 Ca 0.14 2.00 0.00 0.00 0.00 0.00 0.00 51.96 54.11 2jg2 s ALA 128 Cb -0.11 -1.36 0.02 0.00 0.00 0.00 0.00 23.12 21.67 2jg2 s ALA 128 CO 0.04 -0.55 -0.13 0.42 0.00 0.00 0.00 175.76 175.54 2jg2 s ILE 129 N 2.06 1.46 -0.08 0.00 1.01 0.05 -4.92 121.20 120.78 2jg2 s ILE 129 Ca -0.07 -0.57 -0.10 0.00 0.00 0.00 0.00 60.65 59.90 2jg2 s ILE 129 Cb -0.09 -1.38 -0.05 0.00 0.01 0.00 0.00 42.46 40.95 2jg2 s ILE 129 CO -0.17 0.44 0.24 -0.69 0.00 0.00 0.00 174.94 174.77 2jg2 s VAL 130 N 1.45 5.32 0.39 2.92 1.01 -1.26 -1.01 120.40 129.22 2jg2 s VAL 130 Ca 0.03 0.45 0.08 0.00 0.00 0.00 0.00 61.98 62.54 2jg2 s VAL 130 Cb -0.13 -3.53 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 2jg2 s VAL 130 CO -0.09 0.58 0.08 -0.36 0.00 0.00 0.00 175.10 175.31 2jg2 s PHE 131 N -0.90 2.56 -0.34 5.22 0.08 0.60 -4.97 117.98 120.23 2jg2 s PHE 131 Ca 0.18 -0.58 0.26 0.00 0.12 0.00 0.00 56.93 56.91 2jg2 s PHE 131 Cb -0.14 -1.78 0.72 0.00 -0.57 0.00 0.00 43.02 41.26 2jg2 s PHE 131 CO 0.07 0.35 1.74 0.77 -0.10 0.00 0.00 175.22 178.05 2jg2 h SER 132 N 1.65 0.00 -5.14 1.36 0.02 -1.85 -0.48 113.55 109.10 2jg2 h SER 132 Ca -0.43 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.43 2jg2 h SER 132 Cb 1.25 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.65 2jg2 h SER 132 CO 0.73 0.00 -0.35 0.42 -1.14 0.00 0.00 176.83 176.49 2jg2 s THR 133 N -3.32 0.13 0.23 -2.27 -4.23 -1.26 -3.40 115.64 101.52 2jg2 s THR 133 Ca 0.06 -1.11 -0.07 0.00 -1.18 0.00 0.00 61.69 59.38 2jg2 s THR 133 Cb 0.07 -1.29 0.20 0.00 1.34 0.00 0.00 72.50 72.83 2jg2 s THR 133 CO 0.61 -0.61 1.86 1.23 -0.54 0.00 0.00 174.62 177.16 2jg2 h GLY 134 N 2.79 1.31 0.20 3.99 0.00 -1.76 -1.13 103.07 108.47 2jg2 h GLY 134 Ca -0.34 -0.59 0.08 0.00 0.00 0.00 0.00 47.33 46.48 2jg2 h GLY 134 CO 0.55 0.56 -0.12 -1.82 0.00 0.00 0.00 176.54 175.71 2jg2 h TYR 135 N 1.23 -0.28 -0.09 5.60 3.20 -1.93 -1.42 116.97 123.28 2jg2 h TYR 135 Ca 0.31 0.04 -0.07 0.00 3.14 0.00 0.00 58.73 62.15 2jg2 h TYR 135 Cb 0.01 0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 2jg2 h TYR 135 CO 0.01 -0.19 -0.27 0.52 -1.64 0.00 0.00 178.16 176.58 2jg2 h MET 136 N -0.04 0.17 -0.38 1.82 2.86 -1.87 -0.14 114.93 117.34 2jg2 h MET 136 Ca 0.18 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.74 2jg2 h MET 136 Cb 0.32 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 2jg2 h MET 136 CO -0.40 0.43 0.14 0.00 1.06 0.00 0.00 176.91 178.13 2jg2 h ALA 137 N 1.58 0.50 -0.22 6.32 0.00 -0.47 0.20 119.26 127.17 2jg2 h ALA 137 Ca 0.02 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 2jg2 h ALA 137 Cb 0.56 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2jg2 h ALA 137 CO 0.04 0.13 -0.10 -0.91 0.00 0.00 0.00 179.25 178.41 2jg2 h ASN 138 N 0.48 0.47 -0.21 0.00 2.35 -1.06 0.37 115.58 117.96 2jg2 h ASN 138 Ca 0.13 -0.40 0.05 0.00 -0.55 0.00 0.00 56.30 55.52 2jg2 h ASN 138 Cb 0.22 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.41 2jg2 h ASN 138 CO -0.01 0.77 -0.13 0.25 -1.65 0.00 0.00 177.43 176.66 2jg2 h LEU 139 N 0.17 -0.42 -0.09 1.61 5.85 -0.92 -2.39 115.31 119.12 2jg2 h LEU 139 Ca 0.05 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 2jg2 h LEU 139 Cb 0.59 0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.84 2jg2 h LEU 139 CO 0.03 -0.16 -0.20 1.23 -0.34 0.00 0.00 178.44 179.00 2jg2 h GLY 140 N -0.11 0.32 1.51 3.75 0.00 -0.56 -2.88 103.07 105.09 2jg2 h GLY 140 Ca 0.12 -0.38 -0.12 0.00 0.00 0.00 0.00 47.33 46.94 2jg2 h GLY 140 CO -0.29 0.34 -0.36 1.19 0.00 0.00 0.00 176.54 177.43 2jg2 h ILE 141 N -0.18 1.29 -0.12 2.60 6.09 -0.88 -0.94 117.51 125.37 2jg2 h ILE 141 Ca 0.00 -1.50 -0.12 0.00 -1.37 0.00 0.00 64.86 61.87 2jg2 h ILE 141 Cb 0.79 1.50 0.00 0.00 0.47 0.00 0.00 36.82 39.58 2jg2 h ILE 141 CO 0.04 0.47 -0.41 0.40 -3.07 0.00 0.00 178.15 175.59 2jg2 h ILE 142 N 0.46 1.37 0.00 2.19 2.04 -1.54 -0.87 117.51 121.16 2jg2 h ILE 142 Ca 0.05 -1.71 0.00 0.00 1.00 0.00 0.00 64.86 64.19 2jg2 h ILE 142 Cb 0.84 2.12 0.00 0.00 -0.74 0.00 0.00 36.82 39.04 2jg2 h ILE 142 CO 0.07 0.51 0.00 0.77 0.00 0.00 0.00 178.15 179.50 2jg2 h SER 143 N 0.09 0.00 0.08 1.72 4.64 -1.40 -3.01 113.55 115.67 2jg2 h SER 143 Ca -0.02 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.93 2jg2 h SER 143 Cb 1.03 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.08 2jg2 h SER 143 CO 0.09 0.00 -2.22 0.41 -0.87 0.00 0.00 176.83 174.23 2jg2 n THR 144 N -2.77 1.63 -0.06 2.95 -1.04 -0.37 -4.51 114.28 110.11 2jg2 n THR 144 Ca 0.03 -0.63 -0.13 0.00 -2.04 0.00 0.00 64.05 61.28 2jg2 n THR 144 Cb 0.37 -1.52 -0.01 0.00 -1.82 0.00 0.00 70.33 67.36 2jg2 n THR 144 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2jg2 h LEU 145 N 0.03 0.88 -8.44 -4.42 3.38 -1.18 -3.42 115.31 102.15 2jg2 h LEU 145 Ca -0.50 -0.46 -0.67 0.00 0.09 0.00 0.00 57.88 56.35 2jg2 h LEU 145 Cb 1.98 -0.25 -0.26 0.00 0.09 0.00 0.00 40.66 42.22 2jg2 h LEU 145 CO 0.00 1.23 -0.63 0.00 0.09 0.00 0.00 178.44 179.14 2jg2 s ALA 146 N -4.14 3.07 0.00 1.53 0.00 -1.14 -5.07 121.76 116.01 2jg2 s ALA 146 Ca -0.10 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.49 2jg2 s ALA 146 Cb 0.11 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 21.12 2jg2 s ALA 146 CO 0.87 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 176.24 2jg2 n GLY 147 N 4.87 2.40 3.63 0.00 0.00 -1.26 -4.17 105.19 110.67 2jg2 n GLY 147 Ca -0.15 -2.13 -0.47 0.00 0.00 0.00 0.00 46.02 43.27 2jg2 n GLY 147 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jg2 n LYS 148 N -0.70 1.69 -0.60 1.61 4.76 -1.25 -1.21 118.16 122.46 2jg2 n LYS 148 Ca 0.00 0.61 0.00 0.00 -2.87 0.00 0.00 58.31 56.05 2jg2 n LYS 148 Cb 0.00 -2.26 0.00 0.00 -1.84 0.00 0.00 35.03 30.93 2jg2 n LYS 148 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jg2 n GLY 149 N 2.55 1.29 3.92 0.72 0.00 -1.26 -5.00 105.19 107.41 2jg2 n GLY 149 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 2jg2 n GLY 149 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jg2 s GLU 150 N -0.19 2.43 -0.02 1.61 2.02 -0.35 -4.77 118.70 119.43 2jg2 s GLU 150 Ca 0.00 -1.68 0.04 0.00 0.02 0.00 0.00 54.97 53.35 2jg2 s GLU 150 Cb 0.00 -2.37 -0.01 0.00 0.10 0.00 0.00 34.13 31.85 2jg2 s GLU 150 CO 0.00 -0.44 -0.13 0.71 0.02 0.00 0.00 175.26 175.41 2jg2 s TYR 151 N -2.59 1.24 -0.18 1.61 2.02 -1.08 -0.71 117.35 117.67 2jg2 s TYR 151 Ca 0.47 -0.27 -0.01 0.00 -0.37 0.00 0.00 57.07 56.89 2jg2 s TYR 151 Cb -0.04 -0.82 -0.01 0.00 -0.40 0.00 0.00 41.96 40.70 2jg2 s TYR 151 CO 0.28 -0.06 -0.11 0.08 -1.57 0.00 0.00 175.55 174.17 2jg2 s VAL 152 N -0.16 2.97 -0.19 0.71 1.01 -0.11 -0.88 120.40 123.75 2jg2 s VAL 152 Ca 0.02 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 2jg2 s VAL 152 Cb -0.07 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 34.03 2jg2 s VAL 152 CO 0.00 0.49 -0.14 -0.63 0.00 0.00 0.00 175.10 174.82 2jg2 s ILE 153 N 0.99 2.64 0.04 2.22 1.09 0.28 -0.70 121.20 127.77 2jg2 s ILE 153 Ca -0.01 -0.75 -0.04 0.00 -1.10 0.00 0.00 60.65 58.75 2jg2 s ILE 153 Cb -0.15 -2.14 -0.02 0.00 -1.06 0.00 0.00 42.46 39.09 2jg2 s ILE 153 CO -0.01 0.50 0.05 -1.48 -0.10 0.00 0.00 174.94 173.89 2jg2 s LEU 154 N 1.21 2.05 0.32 2.97 2.34 -0.53 -0.63 118.68 126.41 2jg2 s LEU 154 Ca 0.02 -0.69 -0.29 0.00 0.06 0.00 0.00 54.13 53.23 2jg2 s LEU 154 Cb -0.14 0.44 -0.10 0.00 -0.56 0.00 0.00 46.19 45.83 2jg2 s LEU 154 CO -0.06 -0.53 1.37 -0.62 -1.06 0.00 0.00 176.35 175.45 2jg2 s ASP 155 N -2.37 6.67 0.42 1.48 -1.08 -1.26 -1.22 116.67 119.31 2jg2 s ASP 155 Ca -0.02 2.74 0.23 0.00 -0.52 0.00 0.00 52.55 54.98 2jg2 s ASP 155 Cb 0.01 -2.65 1.22 0.00 -1.46 0.00 0.00 42.92 40.05 2jg2 s ASP 155 CO -0.07 -0.63 1.72 0.00 0.52 0.00 0.00 175.17 176.71 2jg2 h ALA 156 N 3.77 2.42 -0.69 3.66 0.00 -1.00 -1.77 119.26 125.65 2jg2 h ALA 156 Ca -0.48 0.08 -0.27 0.00 0.00 0.00 0.00 54.91 54.23 2jg2 h ALA 156 Cb 1.23 0.09 -0.16 0.00 0.00 0.00 0.00 17.79 18.94 2jg2 h ALA 156 CO 0.69 -0.90 0.28 -0.25 0.00 0.00 0.00 179.25 179.07 2jg2 n ASP 157 N -4.64 3.97 -4.64 0.00 8.00 -1.26 -5.01 116.55 112.97 2jg2 n ASP 157 Ca 0.29 -3.42 -0.34 0.00 0.71 0.00 0.00 54.79 52.03 2jg2 n ASP 157 Cb 1.07 -0.73 0.12 0.00 -0.02 0.00 0.00 41.12 41.56 2jg2 n ASP 157 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2jg2 n SER 158 N -0.67 0.49 -4.61 -2.24 7.64 -0.67 -4.94 113.62 108.64 2jg2 n SER 158 Ca 0.43 0.56 -0.39 0.00 1.01 0.00 0.00 58.87 60.48 2jg2 n SER 158 Cb 1.35 -1.45 0.04 0.00 -1.01 0.00 0.00 64.21 63.14 2jg2 n SER 158 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2jg2 n HIS 159 N -3.24 0.88 -0.35 1.43 -0.00 -1.26 -4.76 115.22 107.92 2jg2 n HIS 159 Ca 0.13 0.47 0.13 0.00 0.46 0.00 0.00 57.72 58.90 2jg2 n HIS 159 Cb 0.51 -2.16 0.33 0.00 -0.12 0.00 0.00 29.99 28.54 2jg2 n HIS 159 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2jg2 h ALA 160 N 0.83 1.70 0.00 1.57 0.00 -2.00 -0.67 119.26 120.69 2jg2 h ALA 160 Ca -0.47 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 2jg2 h ALA 160 Cb 1.36 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2jg2 h ALA 160 CO 0.53 -0.05 -0.25 0.66 0.00 0.00 0.00 179.25 180.14 2jg2 h SER 161 N 0.77 0.00 -0.12 0.00 4.64 -1.91 0.24 113.55 117.17 2jg2 h SER 161 Ca 0.56 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.80 2jg2 h SER 161 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2jg2 h SER 161 CO -0.35 0.25 -0.24 0.40 -0.87 0.00 0.00 176.83 176.03 2jg2 h ILE 162 N 0.00 1.38 -0.75 0.95 2.04 -1.46 0.02 117.51 119.68 2jg2 h ILE 162 Ca -0.00 -1.51 -0.01 0.00 1.00 0.00 0.00 64.86 64.33 2jg2 h ILE 162 Cb 0.47 2.07 -0.04 0.00 -0.74 0.00 0.00 36.82 38.59 2jg2 h ILE 162 CO 0.03 0.44 0.42 1.88 0.00 0.00 0.00 178.15 180.92 2jg2 h TYR 163 N -0.05 1.02 -0.21 1.37 -1.99 -1.11 -1.34 116.97 114.66 2jg2 h TYR 163 Ca 0.00 -0.02 -0.11 0.00 2.00 0.00 0.00 58.73 60.61 2jg2 h TYR 163 Cb 0.83 -0.33 -0.01 0.00 2.00 0.00 0.00 36.73 39.21 2jg2 h TYR 163 CO 0.10 0.70 -0.34 -0.44 -0.00 0.00 0.00 178.16 178.18 2jg2 h ASP 164 N 1.05 0.46 -0.80 3.88 3.32 -0.35 -1.06 116.42 122.92 2jg2 h ASP 164 Ca 0.27 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 2jg2 h ASP 164 Cb 0.01 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.40 2jg2 h ASP 164 CO -0.04 0.78 0.47 1.23 -1.72 0.00 0.00 179.24 179.95 2jg2 h GLY 165 N 1.09 1.18 0.99 2.75 0.00 -0.41 0.36 103.07 109.02 2jg2 h GLY 165 Ca 0.04 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 2jg2 h GLY 165 CO 0.06 0.49 0.29 0.00 0.00 0.00 0.00 176.54 177.38 2jg2 h GLN 167 N 0.62 0.51 0.00 0.00 5.75 -0.84 -2.87 115.11 118.28 2jg2 h GLN 167 Ca 0.17 -0.13 -0.13 0.00 -0.15 0.00 0.00 58.65 58.41 2jg2 h GLN 167 Cb -0.02 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2jg2 h GLN 167 CO -0.03 0.59 -0.61 0.37 -2.65 0.00 0.00 178.83 176.50 2jg2 h GLN 168 N 0.48 0.00 0.00 1.69 5.75 -0.58 -3.46 115.11 118.99 2jg2 h GLN 168 Ca 0.10 0.00 -0.33 0.00 -0.15 0.00 0.00 58.65 58.27 2jg2 h GLN 168 Cb 0.42 0.00 0.08 0.00 1.07 0.00 0.00 27.48 29.05 2jg2 h GLN 168 CO 0.02 0.61 0.15 0.41 -2.65 0.00 0.00 178.83 177.37 2jg2 n GLY 169 N 0.29 0.08 0.49 2.39 0.00 -0.79 -4.99 105.19 102.66 2jg2 n GLY 169 Ca -0.01 -1.92 0.07 0.00 0.00 0.00 0.00 46.02 44.16 2jg2 n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jg2 n ASN 170 N -3.13 3.02 -4.92 1.61 5.03 -1.26 -4.99 115.26 110.63 2jg2 n ASN 170 Ca 0.12 -2.73 -0.27 0.00 0.87 0.00 0.00 54.58 52.56 2jg2 n ASN 170 Cb 0.42 -0.39 0.06 0.00 -1.02 0.00 0.00 39.78 38.85 2jg2 n ASN 170 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2jg2 s ALA 171 N -2.29 3.10 -0.01 5.41 0.00 -1.25 -3.77 121.76 122.94 2jg2 s ALA 171 Ca 0.30 -0.73 -0.28 0.00 0.00 0.00 0.00 51.96 51.25 2jg2 s ALA 171 Cb 0.24 -2.71 -0.04 0.00 0.00 0.00 0.00 23.12 20.62 2jg2 s ALA 171 CO 0.07 -1.17 0.88 -1.21 0.00 0.00 0.00 175.76 174.33 2jg2 s GLU 172 N -5.22 4.53 -0.18 0.00 0.41 0.11 -4.92 118.70 113.43 2jg2 s GLU 172 Ca 0.58 1.23 -0.08 0.00 -0.41 0.00 0.00 54.97 56.29 2jg2 s GLU 172 Cb -0.11 -3.44 -0.04 0.00 -1.78 0.00 0.00 34.13 28.76 2jg2 s GLU 172 CO 0.46 0.03 0.08 0.42 -0.49 0.00 0.00 175.26 175.76 2jg2 s ILE 173 N 0.78 4.93 -0.32 -1.63 -1.09 -1.26 -0.94 121.20 121.67 2jg2 s ILE 173 Ca 0.46 0.01 0.01 0.00 -2.23 0.00 0.00 60.65 58.90 2jg2 s ILE 173 Cb -0.20 -3.21 0.10 0.00 -1.58 0.00 0.00 42.46 37.56 2jg2 s ILE 173 CO 0.25 0.47 0.08 -0.69 -1.23 0.00 0.00 174.94 173.82 2jg2 s VAL 174 N 0.22 1.30 0.25 2.92 1.01 0.12 -4.97 120.40 121.26 2jg2 s VAL 174 Ca 0.05 -1.69 -0.26 0.00 0.00 0.00 0.00 61.98 60.08 2jg2 s VAL 174 Cb -0.12 -1.98 -0.09 0.00 0.00 0.00 0.00 36.38 34.19 2jg2 s VAL 174 CO -0.00 -0.66 0.87 -0.13 0.00 0.00 0.00 175.10 175.19 2jg2 s ARG 175 N 1.39 4.60 0.18 2.72 0.52 -1.26 -1.45 118.95 125.66 2jg2 s ARG 175 Ca 0.10 1.26 0.11 0.00 -0.52 0.00 0.00 55.73 56.68 2jg2 s ARG 175 Cb -0.18 -3.03 -0.04 0.00 0.52 0.00 0.00 34.95 32.22 2jg2 s ARG 175 CO -0.20 0.42 -0.23 -0.59 0.02 0.00 0.00 175.30 174.72 2jg2 s PHE 176 N -1.39 2.20 0.32 -0.53 -0.12 -0.35 -4.91 117.98 113.19 2jg2 s PHE 176 Ca 0.44 -0.38 -0.29 0.00 -0.05 0.00 0.00 56.93 56.65 2jg2 s PHE 176 Cb -0.21 -1.10 -0.12 0.00 -0.63 0.00 0.00 43.02 40.96 2jg2 s PHE 176 CO 0.26 0.46 1.41 -2.13 -0.05 0.00 0.00 175.22 175.16 2jg2 n ARG 177 N 0.32 2.32 -1.63 1.99 0.63 -1.26 -0.40 116.66 118.64 2jg2 n ARG 177 Ca -0.13 0.82 -0.48 0.00 -0.92 0.00 0.00 57.85 57.14 2jg2 n ARG 177 Cb 0.56 -2.48 -0.04 0.00 0.45 0.00 0.00 32.46 30.95 2jg2 n ARG 177 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 2jg2 n HIS 178 N 1.01 1.83 -2.17 -0.14 -0.00 -1.26 -1.78 115.22 112.71 2jg2 n HIS 178 Ca 0.06 0.50 -0.19 0.00 -0.00 0.00 0.00 57.72 58.09 2jg2 n HIS 178 Cb 0.36 -2.41 -0.03 0.00 -0.00 0.00 0.00 29.99 27.91 2jg2 n HIS 178 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 2jg2 n ASN 179 N 2.54 -5.27 -4.17 0.26 5.15 -1.26 -4.95 115.26 107.56 2jg2 n ASN 179 Ca 0.15 0.15 -0.38 0.00 -0.60 0.00 0.00 54.58 53.91 2jg2 n ASN 179 Cb 0.26 -4.48 -0.11 0.00 -0.53 0.00 0.00 39.78 34.92 2jg2 n ASN 179 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2jg2 s SER 180 N -2.19 5.38 0.24 1.20 0.15 -0.73 -4.93 113.70 112.82 2jg2 s SER 180 Ca 0.00 -1.83 -0.06 0.00 0.70 0.00 0.00 55.95 54.76 2jg2 s SER 180 Cb 0.00 -1.88 0.30 0.00 -1.71 0.00 0.00 66.02 62.73 2jg2 s SER 180 CO 0.00 -0.54 1.87 0.58 1.20 0.00 0.00 173.24 176.35 2jg2 h VAL 181 N 6.27 1.11 -0.53 4.45 2.07 -1.92 -1.55 116.25 126.15 2jg2 h VAL 181 Ca -0.17 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 2jg2 h VAL 181 Cb 1.06 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 2jg2 h VAL 181 CO 0.72 0.20 0.29 -0.08 0.02 0.00 0.00 177.57 178.72 2jg2 h GLU 182 N 1.07 0.74 -0.10 1.57 4.81 -1.97 -1.18 114.58 119.53 2jg2 h GLU 182 Ca 0.37 -0.09 -0.16 0.00 -0.13 0.00 0.00 59.36 59.35 2jg2 h GLU 182 Cb 0.07 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 2jg2 h GLU 182 CO -0.14 0.58 -0.63 0.22 -0.73 0.00 0.00 179.01 178.30 2jg2 h ASP 183 N 0.71 0.43 -0.37 1.04 3.58 -1.84 -0.36 116.42 119.62 2jg2 h ASP 183 Ca 0.19 -0.26 0.04 0.00 0.42 0.00 0.00 57.03 57.42 2jg2 h ASP 183 Cb 0.05 -0.13 -0.04 0.00 1.72 0.00 0.00 39.33 40.93 2jg2 h ASP 183 CO -0.03 0.95 0.14 0.25 -2.88 0.00 0.00 179.24 177.67 2jg2 h LEU 184 N 0.27 0.16 -0.32 2.28 5.85 -1.10 0.87 115.31 123.33 2jg2 h LEU 184 Ca -0.01 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 2jg2 h LEU 184 Cb 1.17 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 2jg2 h LEU 184 CO 0.11 0.13 0.10 -0.78 -0.34 0.00 0.00 178.44 177.65 2jg2 h ASP 185 N 0.30 0.46 -0.42 1.25 1.82 -0.90 -0.23 116.42 118.70 2jg2 h ASP 185 Ca 0.16 -0.21 -0.08 0.00 -0.39 0.00 0.00 57.03 56.52 2jg2 h ASP 185 Cb 0.13 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.00 2jg2 h ASP 185 CO -0.16 0.54 -0.05 0.11 -1.61 0.00 0.00 179.24 178.07 2jg2 h LYS 186 N 0.35 0.78 -0.27 0.28 1.79 -0.83 -0.64 116.57 118.04 2jg2 h LYS 186 Ca 0.10 -0.28 -0.09 0.00 -2.18 0.00 0.00 60.65 58.21 2jg2 h LYS 186 Cb 0.25 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 2jg2 h LYS 186 CO -0.00 0.88 -0.19 0.00 -1.08 0.00 0.00 179.45 179.06 2jg2 h ARG 187 N 0.61 0.60 -0.76 3.15 2.47 -0.75 -2.76 114.38 116.95 2jg2 h ARG 187 Ca 0.11 -0.29 0.01 0.00 -1.26 0.00 0.00 59.98 58.55 2jg2 h ARG 187 Cb 0.56 -0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.84 2jg2 h ARG 187 CO 0.03 0.87 0.50 -0.07 0.56 0.00 0.00 179.97 181.87 2jg2 h LEU 188 N 0.33 0.88 -1.99 3.04 3.38 -0.95 -2.79 115.31 117.21 2jg2 h LEU 188 Ca 0.05 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2jg2 h LEU 188 Cb 0.73 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 2jg2 h LEU 188 CO 0.05 0.64 -0.10 1.23 0.09 0.00 0.00 178.44 180.34 2jg2 h GLY 189 N 1.03 0.00 1.35 0.83 0.00 -0.89 -2.18 103.07 103.22 2jg2 h GLY 189 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2jg2 h GLY 189 CO -0.06 0.00 -0.15 0.54 0.00 0.00 0.00 176.54 176.87 2jg2 n ARG 190 N -3.75 0.29 -2.75 4.80 1.74 -1.05 -4.89 116.66 111.05 2jg2 n ARG 190 Ca -0.02 -0.08 -0.32 0.00 -0.77 0.00 0.00 57.85 56.66 2jg2 n ARG 190 Cb 0.21 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.10 2jg2 n ARG 190 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2jg2 s LEU 191 N -2.77 3.83 0.52 0.55 1.43 -0.82 -5.01 118.68 116.40 2jg2 s LEU 191 Ca 0.20 1.44 -0.23 0.00 -1.03 0.00 0.00 54.13 54.51 2jg2 s LEU 191 Cb 0.19 -4.32 -0.06 0.00 0.03 0.00 0.00 46.19 42.03 2jg2 s LEU 191 CO 0.54 -0.42 1.32 -2.65 0.23 0.00 0.00 176.35 175.37 2jg2 n PRO 192 N -1.06 1.74 -0.04 1.29 -0.02 -1.26 -4.92 135.00 130.72 2jg2 n PRO 192 Ca 0.05 0.63 -0.13 0.00 -2.02 0.00 0.00 63.50 62.03 2jg2 n PRO 192 Cb 0.54 -2.52 -0.01 0.00 -0.02 0.00 0.00 33.50 31.49 2jg2 n PRO 192 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2jg2 h LYS 193 N 1.58 0.76 -0.16 -0.52 1.79 -1.95 -3.36 116.57 114.71 2jg2 h LYS 193 Ca -0.50 -0.50 -0.07 0.00 -2.18 0.00 0.00 60.65 57.40 2jg2 h LYS 193 Cb 1.30 0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 32.02 2jg2 h LYS 193 CO 0.58 1.13 -0.16 1.49 -1.08 0.00 0.00 179.45 181.41 2jg2 h GLU 194 N 0.57 0.38 -7.00 3.15 4.81 -1.99 -3.45 114.58 111.06 2jg2 h GLU 194 Ca 0.00 -0.20 -0.55 0.00 -0.13 0.00 0.00 59.36 58.48 2jg2 h GLU 194 Cb 1.18 0.01 0.13 0.00 0.63 0.00 0.00 28.75 30.70 2jg2 h GLU 194 CO 0.12 0.76 0.65 -2.30 -0.73 0.00 0.00 179.01 177.52 2jg2 n PRO 195 N -4.53 2.01 -1.94 0.92 -0.02 -1.26 -4.95 135.00 125.23 2jg2 n PRO 195 Ca -0.06 0.72 -0.35 0.00 -2.02 0.00 0.00 63.50 61.79 2jg2 n PRO 195 Cb 0.37 -2.60 0.04 0.00 -0.02 0.00 0.00 33.50 31.29 2jg2 n PRO 195 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jg2 s ALA 196 N -1.23 2.50 0.01 3.55 0.00 -1.26 -4.91 121.76 120.42 2jg2 s ALA 196 Ca 0.66 0.87 0.00 0.00 0.00 0.00 0.00 51.96 53.49 2jg2 s ALA 196 Cb -0.44 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.26 2jg2 s ALA 196 CO 0.54 -1.20 -0.02 0.15 0.00 0.00 0.00 175.76 175.23 2jg2 s LYS 197 N -3.54 0.18 -0.21 0.00 1.02 -1.26 -2.63 119.74 113.31 2jg2 s LYS 197 Ca 0.74 -0.25 0.02 0.00 0.02 0.00 0.00 55.97 56.50 2jg2 s LYS 197 Cb -0.27 -0.04 0.04 0.00 -0.52 0.00 0.00 37.83 37.03 2jg2 s LYS 197 CO 0.35 0.00 -0.16 -1.17 -0.92 0.00 0.00 175.35 173.46 2jg2 s LEU 198 N -0.54 2.55 -0.20 3.17 2.96 -0.05 -0.85 118.68 125.72 2jg2 s LEU 198 Ca -0.05 -0.91 -0.18 0.00 -0.22 0.00 0.00 54.13 52.76 2jg2 s LEU 198 Cb -0.04 -1.46 -0.03 0.00 0.50 0.00 0.00 46.19 45.16 2jg2 s LEU 198 CO -0.00 -0.08 0.51 -0.69 -1.32 0.00 0.00 176.35 174.77 2jg2 s VAL 199 N 1.25 5.11 -0.21 1.68 1.01 0.20 -0.56 120.40 128.88 2jg2 s VAL 199 Ca -0.00 0.93 -0.05 0.00 0.00 0.00 0.00 61.98 62.86 2jg2 s VAL 199 Cb -0.16 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 2jg2 s VAL 199 CO -0.10 0.18 -0.01 -0.69 0.00 0.00 0.00 175.10 174.48 2jg2 s VAL 200 N 1.65 3.78 0.12 2.92 1.01 0.20 -0.72 120.40 129.36 2jg2 s VAL 200 Ca 0.24 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 61.91 2jg2 s VAL 200 Cb -0.15 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 2jg2 s VAL 200 CO 0.09 0.42 -0.15 -0.76 0.00 0.00 0.00 175.10 174.71 2jg2 s LEU 201 N 1.14 2.39 -0.08 3.92 1.43 0.21 -4.07 118.68 123.60 2jg2 s LEU 201 Ca 0.02 -0.79 0.00 0.00 -1.03 0.00 0.00 54.13 52.34 2jg2 s LEU 201 Cb -0.14 -0.58 -0.03 0.00 0.03 0.00 0.00 46.19 45.46 2jg2 s LEU 201 CO 0.01 -0.12 -0.07 -1.61 0.23 0.00 0.00 176.35 174.78 2jg2 s GLU 202 N -2.55 2.89 0.04 1.70 2.02 -1.26 -0.41 118.70 121.13 2jg2 s GLU 202 Ca 0.08 -0.56 -0.22 0.00 0.02 0.00 0.00 54.97 54.29 2jg2 s GLU 202 Cb -0.06 -2.62 -0.14 0.00 0.10 0.00 0.00 34.13 31.41 2jg2 s GLU 202 CO 0.03 0.58 1.44 0.78 0.02 0.00 0.00 175.26 178.11 2jg2 h GLY 203 N 5.53 0.23 -5.97 -1.39 0.00 -1.69 -3.40 103.07 96.38 2jg2 h GLY 203 Ca -0.45 -0.18 -0.65 0.00 0.00 0.00 0.00 47.33 46.04 2jg2 h GLY 203 CO 0.54 0.17 -0.74 0.14 0.00 0.00 0.00 176.54 176.65 2jg2 s VAL 204 N -4.81 3.26 -0.57 4.60 1.01 -1.26 -1.05 120.40 121.58 2jg2 s VAL 204 Ca -0.14 -0.57 -0.28 0.00 0.00 0.00 0.00 61.98 60.98 2jg2 s VAL 204 Cb 0.05 -2.41 0.03 0.00 0.00 0.00 0.00 36.38 34.05 2jg2 s VAL 204 CO 0.71 0.49 1.17 -0.31 0.00 0.00 0.00 175.10 177.17 2jg2 s TYR 205 N 0.66 2.64 0.30 5.22 2.02 0.45 -4.93 117.35 123.71 2jg2 s TYR 205 Ca -0.05 0.42 0.23 0.00 -0.37 0.00 0.00 57.07 57.30 2jg2 s TYR 205 Cb -0.15 -4.48 1.11 0.00 -0.40 0.00 0.00 41.96 38.04 2jg2 s TYR 205 CO 0.02 -1.54 1.93 0.66 -1.57 0.00 0.00 175.55 175.05 2jg2 h SER 206 N 9.50 0.00 0.49 2.29 4.64 -1.95 0.15 113.55 128.66 2jg2 h SER 206 Ca -0.25 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.05 2jg2 h SER 206 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2jg2 h SER 206 CO 1.17 0.21 -0.26 -0.03 -0.87 0.00 0.00 176.83 177.06 2jg2 h MET 207 N 0.00 -0.66 0.00 4.77 -1.53 -1.96 -3.29 114.93 112.26 2jg2 h MET 207 Ca -0.00 0.05 0.00 0.00 -3.44 0.00 0.00 59.70 56.30 2jg2 h MET 207 Cb 0.56 0.15 0.00 0.00 -0.55 0.00 0.00 31.60 31.76 2jg2 h MET 207 CO 0.03 -0.44 -1.20 1.28 0.14 0.00 0.00 176.91 176.71 2jg2 n LEU 208 N -5.40 0.73 0.00 3.39 4.77 -1.22 -4.81 117.00 114.47 2jg2 n LEU 208 Ca -0.12 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 2jg2 n LEU 208 Cb 0.30 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 2jg2 n LEU 208 CO 0.36 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 2jg2 n GLY 209 N 1.44 0.41 3.94 -0.72 0.00 0.51 -4.12 105.19 106.65 2jg2 n GLY 209 Ca 0.02 -0.96 -0.25 0.00 0.00 0.00 0.00 46.02 44.83 2jg2 n GLY 209 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2jg2 s ASP 210 N -2.87 4.82 -0.07 1.61 -4.77 -1.16 -3.82 116.67 110.41 2jg2 s ASP 210 Ca 0.00 0.34 0.02 0.00 -3.30 0.00 0.00 52.55 49.61 2jg2 s ASP 210 Cb 0.00 -1.00 -0.02 0.00 -1.09 0.00 0.00 42.92 40.81 2jg2 s ASP 210 CO 0.00 -1.56 -0.14 -0.63 0.70 0.00 0.00 175.17 173.54 2jg2 s ILE 211 N -3.18 3.09 0.45 2.11 -1.09 -1.26 -0.41 121.20 120.91 2jg2 s ILE 211 Ca 0.60 -0.70 -0.23 0.00 -2.23 0.00 0.00 60.65 58.10 2jg2 s ILE 211 Cb -0.10 -2.23 -0.08 0.00 -1.58 0.00 0.00 42.46 38.47 2jg2 s ILE 211 CO 0.44 0.57 1.12 0.00 -1.23 0.00 0.00 174.94 175.84 2jg2 s ALA 212 N -0.45 2.97 -1.53 9.38 0.00 -0.22 -4.91 121.76 127.01 2jg2 s ALA 212 Ca 0.06 0.83 -0.12 0.00 0.00 0.00 0.00 51.96 52.73 2jg2 s ALA 212 Cb -0.12 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.64 2jg2 s ALA 212 CO 0.02 -0.52 2.57 -0.35 0.00 0.00 0.00 175.76 177.48 2jg2 n PRO 213 N -0.48 3.32 -0.34 0.00 -0.04 -1.26 -4.74 135.00 131.45 2jg2 n PRO 213 Ca 0.07 -2.46 0.01 0.00 -0.04 0.00 0.00 63.50 61.08 2jg2 n PRO 213 Cb 0.49 -3.03 0.14 0.00 -0.04 0.00 0.00 33.50 31.06 2jg2 n PRO 213 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2jg2 h LEU 214 N 8.42 0.95 -0.43 1.53 3.38 -1.93 -1.13 115.31 126.11 2jg2 h LEU 214 Ca 0.71 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.75 2jg2 h LEU 214 Cb 0.46 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 2jg2 h LEU 214 CO 1.83 0.62 0.14 0.50 0.09 0.00 0.00 178.44 181.62 2jg2 h LYS 215 N 1.10 0.28 -0.25 1.13 3.64 -1.86 0.14 116.57 120.75 2jg2 h LYS 215 Ca 0.39 -0.02 -0.20 0.00 -1.27 0.00 0.00 60.65 59.55 2jg2 h LYS 215 Cb 0.11 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2jg2 h LYS 215 CO -0.15 0.19 -0.62 0.93 -2.27 0.00 0.00 179.45 177.53 2jg2 h GLU 216 N 0.29 0.86 -0.38 1.90 3.07 -1.88 -2.40 114.58 116.05 2jg2 h GLU 216 Ca 0.20 -0.59 -0.13 0.00 -0.50 0.00 0.00 59.36 58.35 2jg2 h GLU 216 Cb 0.21 0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 2jg2 h GLU 216 CO -0.22 1.22 -0.27 0.52 -1.40 0.00 0.00 179.01 178.86 2jg2 h MET 217 N 0.64 0.80 -0.43 2.33 2.86 -0.82 -1.84 114.93 118.46 2jg2 h MET 217 Ca -0.01 -0.35 -0.13 0.00 -2.06 0.00 0.00 59.70 57.15 2jg2 h MET 217 Cb 1.23 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.86 2jg2 h MET 217 CO 0.13 0.97 -0.25 0.28 1.06 0.00 0.00 176.91 179.11 2jg2 h VAL 218 N 0.68 1.27 -0.84 -2.22 2.07 -0.77 0.46 116.25 116.91 2jg2 h VAL 218 Ca 0.08 -1.40 0.02 0.00 0.82 0.00 0.00 66.70 66.22 2jg2 h VAL 218 Cb 0.80 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 2jg2 h VAL 218 CO 0.07 0.48 0.55 0.00 0.02 0.00 0.00 177.57 178.68 2jg2 h ALA 219 N 0.93 1.09 -0.38 1.67 0.00 -1.27 0.37 119.26 121.67 2jg2 h ALA 219 Ca 0.10 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2jg2 h ALA 219 Cb 0.81 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2jg2 h ALA 219 CO 0.07 0.41 0.07 0.28 0.00 0.00 0.00 179.25 180.09 2jg2 h VAL 220 N 1.09 1.23 -0.58 0.00 2.07 -0.94 -0.82 116.25 118.30 2jg2 h VAL 220 Ca 0.32 -0.82 0.02 0.00 0.82 0.00 0.00 66.70 67.05 2jg2 h VAL 220 Cb -0.05 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2jg2 h VAL 220 CO -0.10 0.28 0.36 0.00 0.02 0.00 0.00 177.57 178.13 2jg2 h ALA 221 N 0.92 0.75 -0.33 1.67 0.00 -0.19 -2.40 119.26 119.68 2jg2 h ALA 221 Ca 0.12 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2jg2 h ALA 221 Cb 0.34 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2jg2 h ALA 221 CO 0.00 0.10 -0.21 0.87 0.00 0.00 0.00 179.25 180.01 2jg2 h LYS 222 N 0.72 0.63 -0.51 0.00 1.57 -0.76 -0.72 116.57 117.50 2jg2 h LYS 222 Ca 0.23 -0.24 0.04 0.00 -1.87 0.00 0.00 60.65 58.81 2jg2 h LYS 222 Cb 0.00 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 2jg2 h LYS 222 CO -0.09 0.80 0.34 -0.22 -0.57 0.00 0.00 179.45 179.71 2jg2 h LYS 223 N 0.56 0.53 -0.44 3.15 3.64 -0.66 -1.00 116.57 122.35 2jg2 h LYS 223 Ca 0.08 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2jg2 h LYS 223 Cb 0.67 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2jg2 h LYS 223 CO 0.05 0.35 0.00 0.72 -2.27 0.00 0.00 179.45 178.30 2jg2 n HIS 224 N -4.47 0.57 -1.35 1.91 8.25 -0.90 -4.95 115.22 114.29 2jg2 n HIS 224 Ca 0.06 -0.29 -0.08 0.00 -0.26 0.00 0.00 57.72 57.15 2jg2 n HIS 224 Cb 0.16 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.24 2jg2 n HIS 224 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jg2 n GLY 225 N 1.37 0.92 3.85 -1.41 0.00 -0.38 -5.02 105.19 104.52 2jg2 n GLY 225 Ca 0.18 -0.65 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 2jg2 n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jg2 s ALA 226 N -2.32 3.25 0.49 4.61 0.00 -0.33 -4.74 121.76 122.71 2jg2 s ALA 226 Ca 0.00 0.06 -0.16 0.00 0.00 0.00 0.00 51.96 51.86 2jg2 s ALA 226 Cb 0.00 -2.86 -0.08 0.00 0.00 0.00 0.00 23.12 20.18 2jg2 s ALA 226 CO 0.00 0.14 0.95 -1.64 0.00 0.00 0.00 175.76 175.21 2jg2 s MET 227 N -3.36 3.94 -0.06 0.00 -1.94 -0.03 -4.44 119.30 113.40 2jg2 s MET 227 Ca 0.55 0.89 0.05 0.00 -1.71 0.00 0.00 55.69 55.47 2jg2 s MET 227 Cb -0.10 -2.18 -0.00 0.00 2.01 0.00 0.00 34.83 34.56 2jg2 s MET 227 CO 0.22 -0.22 -0.21 0.08 -0.01 0.00 0.00 175.02 174.88 2jg2 s VAL 228 N -2.56 1.74 -0.17 -6.03 1.01 -1.26 -0.63 120.40 112.51 2jg2 s VAL 228 Ca 0.58 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.69 2jg2 s VAL 228 Cb -0.10 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.79 2jg2 s VAL 228 CO 0.30 0.49 -0.18 -0.22 0.00 0.00 0.00 175.10 175.50 2jg2 s LEU 229 N 0.12 2.29 -0.12 3.92 2.96 0.10 -1.54 118.68 126.41 2jg2 s LEU 229 Ca -0.09 -0.57 0.01 0.00 -0.22 0.00 0.00 54.13 53.27 2jg2 s LEU 229 Cb -0.14 -1.52 -0.01 0.00 0.50 0.00 0.00 46.19 45.02 2jg2 s LEU 229 CO 0.04 0.04 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.27 2jg2 s VAL 230 N 1.06 2.80 -0.26 1.68 1.01 -0.47 -0.62 120.40 125.59 2jg2 s VAL 230 Ca -0.01 -0.76 -0.21 0.00 0.00 0.00 0.00 61.98 61.00 2jg2 s VAL 230 Cb -0.14 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.07 2jg2 s VAL 230 CO -0.06 0.54 0.66 -0.62 0.00 0.00 0.00 175.10 175.62 2jg2 s ASP 231 N 0.29 6.60 -0.39 3.32 -1.08 0.45 -1.06 116.67 124.80 2jg2 s ASP 231 Ca -0.12 0.71 0.06 0.00 -0.52 0.00 0.00 52.55 52.68 2jg2 s ASP 231 Cb -0.16 -2.35 0.43 0.00 -1.46 0.00 0.00 42.92 39.38 2jg2 s ASP 231 CO 0.06 -0.42 1.14 -0.62 0.52 0.00 0.00 175.17 175.86 2jg2 n GLU 232 N 5.80 3.49 -0.01 4.34 -0.58 -0.40 -1.65 120.64 131.63 2jg2 n GLU 232 Ca 0.00 -4.38 -0.08 0.00 -0.42 0.00 0.00 57.16 52.28 2jg2 n GLU 232 Cb 0.49 -2.26 0.09 0.00 -0.57 0.00 0.00 31.44 29.18 2jg2 n GLU 232 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jg2 h ALA 233 N 2.44 0.80 -0.58 0.62 0.00 -1.94 -3.26 119.26 117.35 2jg2 h ALA 233 Ca 0.33 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2jg2 h ALA 233 Cb 1.13 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2jg2 h ALA 233 CO 0.82 0.66 0.00 0.72 0.00 0.00 0.00 179.25 181.45 2jg2 n HIS 234 N -4.02 2.00 -0.44 0.00 8.25 -1.26 -4.32 115.22 115.43 2jg2 n HIS 234 Ca -0.02 -0.72 0.00 0.00 -0.26 0.00 0.00 57.72 56.72 2jg2 n HIS 234 Cb 0.54 -0.48 0.00 0.00 1.12 0.00 0.00 29.99 31.16 2jg2 n HIS 234 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2jg2 n SER 235 N 0.65 0.13 -4.67 0.41 3.41 -1.23 -4.79 113.62 107.52 2jg2 n SER 235 Ca 0.28 -0.62 -0.42 0.00 -0.26 0.00 0.00 58.87 57.84 2jg2 n SER 235 Cb 1.16 0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 65.19 2jg2 n SER 235 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2jg2 s MET 236 N -0.10 4.21 0.00 4.33 1.75 -1.24 -2.11 119.30 126.15 2jg2 s MET 236 Ca 0.00 2.12 0.00 0.00 -1.25 0.00 0.00 55.69 56.56 2jg2 s MET 236 Cb 0.00 -3.78 0.00 0.00 2.84 0.00 0.00 34.83 33.89 2jg2 s MET 236 CO 0.00 -0.74 0.00 0.41 -0.65 0.00 0.00 175.02 174.04 2jg2 n GLY 237 N 3.94 0.97 0.00 2.11 0.00 0.10 -4.72 105.19 107.58 2jg2 n GLY 237 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2jg2 n GLY 237 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2jg2 n PHE 238 N -2.00 0.00 -5.12 1.61 1.16 -0.90 -4.71 117.46 107.51 2jg2 n PHE 238 Ca 0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.29 2jg2 n PHE 238 Cb 0.00 0.01 -0.16 0.00 -1.61 0.00 0.00 39.48 37.72 2jg2 n PHE 238 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 2jg2 s PHE 239 N 0.00 2.08 0.00 2.97 0.08 -1.00 -5.00 117.98 117.11 2jg2 s PHE 239 Ca 0.00 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.66 2jg2 s PHE 239 Cb 0.00 -1.33 0.00 0.00 -0.57 0.00 0.00 43.02 41.12 2jg2 s PHE 239 CO 0.00 -0.02 0.00 0.41 -0.10 0.00 0.00 175.22 175.51 2jg2 n GLY 240 N 2.44 -1.91 0.36 4.36 0.00 -1.25 -1.69 105.19 107.50 2jg2 n GLY 240 Ca -0.16 -1.49 0.11 0.00 0.00 0.00 0.00 46.02 44.48 2jg2 n GLY 240 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2jg2 h PRO 241 N 0.00 0.52 -0.39 1.61 0.11 -1.93 -1.23 132.00 130.69 2jg2 h PRO 241 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2jg2 h PRO 241 Cb 0.00 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 30.99 2jg2 h PRO 241 CO 0.00 0.34 0.00 0.09 -0.21 0.00 0.00 178.00 178.22 2jg2 n ASN 242 N -4.48 3.42 -0.57 -2.05 3.02 -1.26 -4.95 115.26 108.39 2jg2 n ASN 242 Ca 0.11 -1.97 -0.07 0.00 -0.03 0.00 0.00 54.58 52.61 2jg2 n ASN 242 Cb 0.35 -0.25 -0.03 0.00 -0.61 0.00 0.00 39.78 39.24 2jg2 n ASN 242 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jg2 n GLY 243 N 1.43 0.92 0.18 7.41 0.00 -0.47 -4.82 105.19 109.85 2jg2 n GLY 243 Ca 0.19 -0.71 0.06 0.00 0.00 0.00 0.00 46.02 45.55 2jg2 n GLY 243 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2jg2 h ARG 244 N 0.00 0.00 0.00 1.61 3.08 -1.66 0.29 114.38 117.70 2jg2 h ARG 244 Ca -0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2jg2 h ARG 244 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2jg2 h ARG 244 CO 0.22 0.37 0.00 0.41 -1.07 0.00 0.00 179.97 179.90 2jg2 n GLY 245 N 0.63 0.43 0.33 0.04 0.00 -0.68 -4.79 105.19 101.15 2jg2 n GLY 245 Ca 0.01 -1.82 0.04 0.00 0.00 0.00 0.00 46.02 44.24 2jg2 n GLY 245 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2jg2 h VAL 246 N 0.00 0.95 -0.56 1.61 2.07 -1.87 -1.38 116.25 117.08 2jg2 h VAL 246 Ca 0.00 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.21 2jg2 h VAL 246 Cb 0.00 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 29.69 2jg2 h VAL 246 CO 0.00 0.17 0.37 0.10 0.02 0.00 0.00 177.57 178.23 2jg2 h TYR 247 N 0.93 0.71 -0.17 1.57 -0.00 -1.95 0.27 116.97 118.33 2jg2 h TYR 247 Ca 0.43 0.02 -0.15 0.00 0.00 0.00 0.00 58.73 59.03 2jg2 h TYR 247 Cb 0.35 -0.24 0.00 0.00 0.00 0.00 0.00 36.73 36.84 2jg2 h TYR 247 CO -0.03 0.44 -0.47 1.49 -0.00 0.00 0.00 178.16 179.60 2jg2 h GLU 248 N 0.76 0.61 -0.39 0.10 4.81 -1.62 0.15 114.58 119.00 2jg2 h GLU 248 Ca 0.21 -0.43 0.02 0.00 -0.13 0.00 0.00 59.36 59.03 2jg2 h GLU 248 Cb -0.08 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 2jg2 h GLU 248 CO -0.05 1.05 0.26 0.00 -0.73 0.00 0.00 179.01 179.55 2jg2 h ALA 249 N 0.56 1.81 -0.40 2.92 0.00 -0.48 -1.77 119.26 121.88 2jg2 h ALA 249 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2jg2 h ALA 249 Cb 1.08 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2jg2 h ALA 249 CO 0.10 0.15 0.00 1.04 0.00 0.00 0.00 179.25 180.54 2jg2 n GLN 250 N -4.48 2.22 -1.37 0.00 6.02 0.01 -4.92 117.38 114.86 2jg2 n GLN 250 Ca 0.04 -1.57 0.00 0.00 -0.01 0.00 0.00 57.00 55.46 2jg2 n GLN 250 Cb 0.12 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 29.94 2jg2 n GLN 250 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jg2 n GLY 251 N 1.01 0.42 1.35 1.08 0.00 -0.67 -4.79 105.19 103.60 2jg2 n GLY 251 Ca 0.14 -0.97 0.11 0.00 0.00 0.00 0.00 46.02 45.30 2jg2 n GLY 251 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jg2 n LEU 252 N 0.00 4.03 -4.60 0.99 4.77 0.02 -4.96 117.00 117.24 2jg2 n LEU 252 Ca 0.00 -2.07 -0.52 0.00 -0.03 0.00 0.00 56.01 53.39 2jg2 n LEU 252 Cb 0.20 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.74 2jg2 n LEU 252 CO 0.00 0.95 0.94 1.21 -1.33 0.00 0.00 177.39 179.16 2jg2 n GLU 253 N 1.50 1.24 -0.13 3.23 4.07 -1.26 -0.72 120.64 128.57 2jg2 n GLU 253 Ca 0.24 0.45 0.00 0.00 -0.06 0.00 0.00 57.16 57.79 2jg2 n GLU 253 Cb 0.65 -2.10 0.00 0.00 -0.06 0.00 0.00 31.44 29.93 2jg2 n GLU 253 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2jg2 n GLY 254 N 2.66 1.67 0.13 8.31 0.00 -1.26 -4.87 105.19 111.84 2jg2 n GLY 254 Ca 0.19 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.28 2jg2 n GLY 254 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jg2 n GLN 255 N -2.00 1.92 -3.57 1.61 6.02 0.10 -4.94 117.38 116.52 2jg2 n GLN 255 Ca 0.00 -0.30 -0.38 0.00 -0.01 0.00 0.00 57.00 56.32 2jg2 n GLN 255 Cb 0.00 -1.23 -0.10 0.00 1.02 0.00 0.00 30.24 29.93 2jg2 n GLN 255 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2jg2 s ILE 256 N -2.21 5.30 0.13 5.09 -1.09 -1.25 -4.88 121.20 122.29 2jg2 s ILE 256 Ca 0.08 0.25 -0.14 0.00 -2.23 0.00 0.00 60.65 58.62 2jg2 s ILE 256 Cb 0.12 -3.55 -0.01 0.00 -1.58 0.00 0.00 42.46 37.44 2jg2 s ILE 256 CO 0.53 0.26 1.58 0.44 -1.23 0.00 0.00 174.94 176.53 2jg2 h ASP 257 N 8.06 0.75 -3.70 3.58 3.32 -1.80 -3.45 116.42 123.17 2jg2 h ASP 257 Ca -0.35 -0.30 -0.22 0.00 0.02 0.00 0.00 57.03 56.17 2jg2 h ASP 257 Cb 1.18 -0.20 -0.28 0.00 0.22 0.00 0.00 39.33 40.25 2jg2 h ASP 257 CO 0.60 0.87 -0.65 -0.36 -1.72 0.00 0.00 179.24 177.98 2jg2 s PHE 258 N -5.02 -0.07 -0.12 4.55 0.08 -0.59 -4.24 117.98 112.57 2jg2 s PHE 258 Ca -0.13 0.20 0.03 0.00 0.12 0.00 0.00 56.93 57.15 2jg2 s PHE 258 Cb 0.11 -0.01 0.01 0.00 -0.57 0.00 0.00 43.02 42.55 2jg2 s PHE 258 CO 0.80 -0.05 -0.23 0.08 -0.10 0.00 0.00 175.22 175.72 2jg2 s VAL 259 N 0.24 2.07 -0.03 -0.44 1.01 -0.44 -1.36 120.40 121.44 2jg2 s VAL 259 Ca -0.02 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 2jg2 s VAL 259 Cb -0.03 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 2jg2 s VAL 259 CO -0.01 0.55 0.07 0.54 0.00 0.00 0.00 175.10 176.26 2jg2 s VAL 260 N 0.59 4.71 0.01 2.92 0.11 -0.23 -0.54 120.40 127.99 2jg2 s VAL 260 Ca -0.13 -0.34 -0.00 0.00 -2.93 0.00 0.00 61.98 58.59 2jg2 s VAL 260 Cb -0.17 -3.12 0.00 0.00 -1.53 0.00 0.00 36.38 31.57 2jg2 s VAL 260 CO 0.03 0.41 0.02 0.61 -3.33 0.00 0.00 175.10 172.85 2jg2 n GLY 261 N 1.41 2.68 3.14 6.54 0.00 -0.38 -1.27 105.19 117.30 2jg2 n GLY 261 Ca -0.15 -1.25 -0.09 0.00 0.00 0.00 0.00 46.02 44.53 2jg2 n GLY 261 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2jg2 s THR 262 N -2.64 0.51 -2.52 2.61 -1.32 -1.26 -1.65 115.64 109.37 2jg2 s THR 262 Ca 0.01 -1.87 0.25 0.00 -1.21 0.00 0.00 61.69 58.87 2jg2 s THR 262 Cb -0.00 -1.60 0.22 0.00 -1.51 0.00 0.00 72.50 69.61 2jg2 s THR 262 CO 0.01 -0.91 1.34 0.49 -2.21 0.00 0.00 174.62 173.34 2jg2 n PHE 263 N 0.05 0.00 -0.03 9.09 3.72 0.51 -4.69 117.46 126.12 2jg2 n PHE 263 Ca -0.13 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.30 2jg2 n PHE 263 Cb 0.61 -0.01 0.21 0.00 -0.94 0.00 0.00 39.48 39.35 2jg2 n PHE 263 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2jg2 n SER 264 N 0.56 3.55 -0.09 4.37 3.41 -1.25 -0.26 113.62 123.90 2jg2 n SER 264 Ca 0.14 -2.52 0.08 0.00 -0.26 0.00 0.00 58.87 56.31 2jg2 n SER 264 Cb 0.49 -0.60 0.14 0.00 -0.26 0.00 0.00 64.21 63.98 2jg2 n SER 264 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2jg2 n SER 266 N 0.30 0.06 -0.07 4.04 7.64 -1.21 -4.48 113.62 119.91 2jg2 n SER 266 Ca 0.16 0.34 -0.06 0.00 1.01 0.00 0.00 58.87 60.31 2jg2 n SER 266 Cb 0.78 -0.17 0.13 0.00 -1.01 0.00 0.00 64.21 63.94 2jg2 n SER 266 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2jg2 h VAL 267 N 0.00 1.26 -0.03 0.44 2.07 -1.84 -3.40 116.25 114.75 2jg2 h VAL 267 Ca 0.20 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.46 2jg2 h VAL 267 Cb 0.58 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2jg2 h VAL 267 CO -0.13 0.42 0.00 0.61 0.02 0.00 0.00 177.57 178.49 2jg2 n GLY 268 N -0.34 1.01 0.00 2.17 0.00 -0.63 -4.74 105.19 102.65 2jg2 n GLY 268 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2jg2 n GLY 268 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2jg2 n THR 269 N -2.76 0.00 -3.91 2.61 5.66 0.64 -4.69 114.28 111.84 2jg2 n THR 269 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 2jg2 n THR 269 Cb 0.30 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 68.98 2jg2 n THR 269 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2jg2 s VAL 270 N 3.98 0.09 0.00 1.08 0.11 -1.25 -3.90 120.40 120.50 2jg2 s VAL 270 Ca 0.00 -0.72 0.00 0.00 -2.93 0.00 0.00 61.98 58.33 2jg2 s VAL 270 Cb 0.00 -0.35 0.00 0.00 -1.53 0.00 0.00 36.38 34.50 2jg2 s VAL 270 CO 0.00 -0.39 0.00 0.61 -3.33 0.00 0.00 175.10 171.99 2jg2 n GLY 271 N 1.62 3.46 3.29 6.54 0.00 -1.22 -4.74 105.19 114.14 2jg2 n GLY 271 Ca -0.22 -1.71 -0.16 0.00 0.00 0.00 0.00 46.02 43.93 2jg2 n GLY 271 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jg2 s GLY 272 N 0.00 1.62 0.17 -0.02 0.00 -0.19 -0.37 107.32 108.53 2jg2 s GLY 272 Ca 0.00 -1.80 -0.22 0.00 0.00 0.00 0.00 44.72 42.69 2jg2 s GLY 272 CO 0.00 -1.57 0.59 -0.11 0.00 0.00 0.00 173.10 172.01 2jg2 s PHE 273 N -3.76 -0.47 -0.02 1.90 -0.12 -0.66 -0.29 117.98 114.55 2jg2 s PHE 273 Ca 0.35 0.23 0.02 0.00 -0.05 0.00 0.00 56.93 57.48 2jg2 s PHE 273 Cb 0.07 0.55 0.01 0.00 -0.63 0.00 0.00 43.02 43.02 2jg2 s PHE 273 CO 0.12 -0.87 -0.05 0.08 -0.05 0.00 0.00 175.22 174.44 2jg2 s VAL 274 N -3.77 0.51 0.23 -2.49 1.01 -0.18 -1.25 120.40 114.46 2jg2 s VAL 274 Ca 0.02 -0.19 0.11 0.00 0.00 0.00 0.00 61.98 61.93 2jg2 s VAL 274 Cb -0.01 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.83 2jg2 s VAL 274 CO -0.11 0.19 -0.19 0.68 0.00 0.00 0.00 175.10 175.66 2jg2 s VAL 275 N 0.42 2.57 -0.08 2.92 -7.23 0.30 -0.77 120.40 118.52 2jg2 s VAL 275 Ca -0.05 -2.12 -0.30 0.00 -1.81 0.00 0.00 61.98 57.69 2jg2 s VAL 275 Cb -0.09 -2.29 0.12 0.00 0.56 0.00 0.00 36.38 34.68 2jg2 s VAL 275 CO -0.00 -0.24 0.98 -0.55 -0.31 0.00 0.00 175.10 174.98 2jg2 s SER 276 N -3.07 -0.32 0.00 4.85 0.15 -0.94 -1.33 113.70 113.04 2jg2 s SER 276 Ca 0.25 0.11 0.20 0.00 0.70 0.00 0.00 55.95 57.21 2jg2 s SER 276 Cb -0.07 0.32 0.36 0.00 -1.71 0.00 0.00 66.02 64.92 2jg2 s SER 276 CO 0.13 -0.47 1.30 0.59 1.20 0.00 0.00 173.24 175.99 2jg2 n ASN 277 N 0.07 3.19 -4.72 5.45 3.02 -1.26 -0.53 115.26 120.48 2jg2 n ASN 277 Ca -0.07 -1.92 -0.42 0.00 -0.03 0.00 0.00 54.58 52.14 2jg2 n ASN 277 Cb 0.60 -0.22 -0.03 0.00 -0.61 0.00 0.00 39.78 39.52 2jg2 n ASN 277 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2jg2 s HIS 278 N -1.32 3.08 0.61 3.10 2.46 -1.26 -4.87 115.29 117.08 2jg2 s HIS 278 Ca 0.33 0.75 0.33 0.00 0.47 0.00 0.00 55.06 56.94 2jg2 s HIS 278 Cb 0.19 -3.88 1.94 0.00 -0.13 0.00 0.00 32.58 30.70 2jg2 s HIS 278 CO 0.27 -3.14 2.26 -1.35 -2.47 0.00 0.00 174.74 170.31 2jg2 h PRO 279 N 6.42 0.00 -0.30 2.88 0.11 -2.01 -1.68 132.00 137.42 2jg2 h PRO 279 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2jg2 h PRO 279 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2jg2 h PRO 279 CO 0.88 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.30 2jg2 n LYS 280 N -3.67 2.47 -0.13 1.05 5.02 -1.26 -4.67 118.16 116.96 2jg2 n LYS 280 Ca -0.03 -2.21 -0.04 0.00 -2.02 0.00 0.00 58.31 54.01 2jg2 n LYS 280 Cb 0.11 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.63 2jg2 n LYS 280 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2jg2 h PHE 281 N 4.55 -0.24 0.00 2.13 3.57 -1.68 -0.75 116.94 124.51 2jg2 h PHE 281 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2jg2 h PHE 281 Cb 0.99 0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.91 2jg2 h PHE 281 CO 0.19 -0.19 0.00 0.39 -2.23 0.00 0.00 178.31 176.47 2jg2 n GLU 282 N -5.32 0.53 0.20 1.11 1.02 -1.26 -0.86 120.64 116.05 2jg2 n GLU 282 Ca 0.03 0.04 0.15 0.00 -0.02 0.00 0.00 57.16 57.35 2jg2 n GLU 282 Cb 0.23 -1.50 0.60 0.00 -0.02 0.00 0.00 31.44 30.75 2jg2 n GLU 282 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jg2 h ALA 283 N 3.24 1.00 -0.65 0.62 0.00 -1.48 -2.55 119.26 119.44 2jg2 h ALA 283 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.07 2jg2 h ALA 283 Cb 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2jg2 h ALA 283 CO 0.00 0.00 0.45 0.28 0.00 0.00 0.00 179.25 179.98 2jg2 h VAL 284 N 0.00 0.75 -0.21 0.00 2.07 -1.15 -0.22 116.25 117.49 2jg2 h VAL 284 Ca 0.00 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.50 2jg2 h VAL 284 Cb 0.41 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 2jg2 h VAL 284 CO 0.00 0.03 0.15 0.03 0.02 0.00 0.00 177.57 177.80 2jg2 h ARG 285 N 0.17 0.10 0.00 1.57 3.08 -1.68 -0.65 114.38 116.98 2jg2 h ARG 285 Ca 0.31 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.36 2jg2 h ARG 285 Cb 0.99 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.02 2jg2 h ARG 285 CO -0.05 0.07 0.00 -0.07 -1.07 0.00 0.00 179.97 178.85 2jg2 h LEU 286 N 0.10 0.00 0.00 3.04 3.38 -1.23 -3.35 115.31 117.25 2jg2 h LEU 286 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2jg2 h LEU 286 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2jg2 h LEU 286 CO -0.01 0.00 -1.07 0.00 0.09 0.00 0.00 178.44 177.45 2jg2 n ALA 287 N -2.03 2.06 -2.63 1.53 0.00 -0.70 -5.03 120.51 113.70 2jg2 n ALA 287 Ca 0.03 -0.04 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2jg2 n ALA 287 Cb 0.43 -0.05 -0.04 0.00 0.00 0.00 0.00 19.45 19.79 2jg2 n ALA 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jg2 h ARG 289 N 9.39 1.21 0.00 0.00 3.08 -1.90 -0.90 114.38 125.26 2jg2 h ARG 289 Ca -0.26 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.72 2jg2 h ARG 289 Cb 1.07 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.85 2jg2 h ARG 289 CO 1.12 0.80 0.00 -2.30 -1.07 0.00 0.00 179.97 178.52 2jg2 n PRO 290 N -4.45 0.15 0.01 0.04 -0.02 -1.26 -1.17 135.00 128.30 2jg2 n PRO 290 Ca 0.11 0.35 -0.20 0.00 -2.02 0.00 0.00 63.50 61.75 2jg2 n PRO 290 Cb 0.04 -1.78 -0.14 0.00 -0.02 0.00 0.00 33.50 31.60 2jg2 n PRO 290 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2jg2 h TYR 291 N 0.00 0.40 -0.08 6.00 3.20 -1.58 -3.41 116.97 121.49 2jg2 h TYR 291 Ca 0.00 -0.29 -0.13 0.00 3.14 0.00 0.00 58.73 61.44 2jg2 h TYR 291 Cb 0.38 -0.02 0.01 0.00 1.54 0.00 0.00 36.73 38.64 2jg2 h TYR 291 CO 0.00 1.39 -0.47 0.82 -1.64 0.00 0.00 178.16 178.27 2jg2 h ILE 292 N -0.46 1.39 -1.40 1.81 2.04 -0.81 -3.39 117.51 116.68 2jg2 h ILE 292 Ca -0.21 -1.83 -0.71 0.00 1.00 0.00 0.00 64.86 63.10 2jg2 h ILE 292 Cb 1.60 2.28 -0.28 0.00 -0.74 0.00 0.00 36.82 39.67 2jg2 h ILE 292 CO 0.07 0.54 0.93 0.49 0.00 0.00 0.00 178.15 180.18 2jg2 n PHE 293 N -4.28 3.13 -3.62 1.37 3.72 -0.32 -4.72 117.46 112.75 2jg2 n PHE 293 Ca -0.08 -2.74 -0.13 0.00 -0.05 0.00 0.00 57.45 54.45 2jg2 n PHE 293 Cb 0.58 -1.33 -0.05 0.00 -0.94 0.00 0.00 39.48 37.74 2jg2 n PHE 293 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 2jg2 s THR 294 N -4.93 0.05 0.49 4.37 -1.32 -1.26 -4.99 115.64 108.04 2jg2 s THR 294 Ca 0.60 -0.40 -0.21 0.00 -1.21 0.00 0.00 61.69 60.46 2jg2 s THR 294 Cb 0.48 -1.01 -0.07 0.00 -1.51 0.00 0.00 72.50 70.39 2jg2 s THR 294 CO -0.18 -0.22 1.13 0.00 -2.21 0.00 0.00 174.62 173.14 2jg2 s ALA 295 N -2.84 2.87 0.94 11.08 0.00 -1.26 -4.04 121.76 128.51 2jg2 s ALA 295 Ca -0.03 0.84 -0.12 0.00 0.00 0.00 0.00 51.96 52.65 2jg2 s ALA 295 Cb -0.00 -3.35 0.15 0.00 0.00 0.00 0.00 23.12 19.92 2jg2 s ALA 295 CO -0.05 -0.62 1.09 -1.54 0.00 0.00 0.00 175.76 174.64 2jg2 s SER 296 N -1.59 3.06 0.66 0.00 1.04 -0.19 -4.82 113.70 111.86 2jg2 s SER 296 Ca 0.67 1.48 -0.15 0.00 0.48 0.00 0.00 55.95 58.43 2jg2 s SER 296 Cb -0.25 -2.15 0.00 0.00 0.10 0.00 0.00 66.02 63.72 2jg2 s SER 296 CO 0.30 -2.90 1.11 -0.76 0.98 0.00 0.00 173.24 171.97 2jg2 s LEU 297 N -6.38 3.38 0.66 2.42 1.43 -1.26 -4.63 118.68 114.29 2jg2 s LEU 297 Ca 0.64 2.01 -0.17 0.00 -1.03 0.00 0.00 54.13 55.58 2jg2 s LEU 297 Cb -0.19 -4.55 -0.00 0.00 0.03 0.00 0.00 46.19 41.48 2jg2 s LEU 297 CO 0.58 -1.67 1.25 -2.84 0.23 0.00 0.00 176.35 173.91 2jg2 s PRO 298 N -4.11 2.52 0.26 1.29 0.02 -1.26 -4.64 135.00 129.09 2jg2 s PRO 298 Ca 0.67 1.94 -0.02 0.00 0.02 0.00 0.00 61.00 63.61 2jg2 s PRO 298 Cb -0.21 -1.86 0.55 0.00 0.02 0.00 0.00 34.50 33.00 2jg2 s PRO 298 CO 0.42 -1.58 1.72 -1.35 -0.33 0.00 0.00 177.00 175.87 2jg2 h PRO 299 N 0.39 0.42 -0.38 5.54 0.11 -1.82 -0.20 132.00 136.06 2jg2 h PRO 299 Ca -0.50 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.54 2jg2 h PRO 299 Cb 1.32 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 2jg2 h PRO 299 CO 0.53 0.28 0.04 0.66 -0.21 0.00 0.00 178.00 179.29 2jg2 h SER 300 N 0.43 0.53 -0.14 -2.05 4.64 -1.83 0.61 113.55 115.75 2jg2 h SER 300 Ca 0.46 -0.09 -0.04 0.00 -0.47 0.00 0.00 61.79 61.65 2jg2 h SER 300 Cb 0.77 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2jg2 h SER 300 CO -0.45 0.58 -0.07 0.58 -0.87 0.00 0.00 176.83 176.59 2jg2 h VAL 301 N 0.55 1.32 0.00 0.95 2.07 -1.40 0.01 116.25 119.75 2jg2 h VAL 301 Ca 0.12 -1.12 -0.10 0.00 0.82 0.00 0.00 66.70 66.42 2jg2 h VAL 301 Cb 0.30 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 2jg2 h VAL 301 CO 0.01 0.33 -0.46 -0.37 0.02 0.00 0.00 177.57 177.09 2jg2 h VAL 302 N -0.06 1.15 -0.15 2.57 -1.51 -1.22 -0.77 116.25 116.27 2jg2 h VAL 302 Ca 0.03 -1.69 -0.09 0.00 -1.23 0.00 0.00 66.70 63.72 2jg2 h VAL 302 Cb 0.55 1.96 -0.00 0.00 -2.13 0.00 0.00 31.29 31.67 2jg2 h VAL 302 CO 0.02 0.45 -0.25 0.00 -1.23 0.00 0.00 177.57 176.56 2jg2 h ALA 303 N 1.54 0.23 -0.78 5.19 0.00 -0.82 -0.37 119.26 124.25 2jg2 h ALA 303 Ca -0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 2jg2 h ALA 303 Cb 0.92 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2jg2 h ALA 303 CO 0.06 0.21 0.29 1.79 0.00 0.00 0.00 179.25 181.60 2jg2 h THR 304 N 0.04 1.26 -0.47 0.00 1.35 -0.89 -2.15 112.91 112.06 2jg2 h THR 304 Ca 0.01 -0.84 -0.01 0.00 -0.55 0.00 0.00 66.41 65.01 2jg2 h THR 304 Cb 0.83 0.35 -0.02 0.00 -1.73 0.00 0.00 68.15 67.58 2jg2 h THR 304 CO 0.06 0.34 0.24 0.00 -0.25 0.00 0.00 175.52 175.91 2jg2 h ALA 305 N 1.18 0.60 -0.20 6.62 0.00 -1.04 -0.42 119.26 126.00 2jg2 h ALA 305 Ca 0.26 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.09 2jg2 h ALA 305 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2jg2 h ALA 305 CO -0.02 0.14 0.05 1.15 0.00 0.00 0.00 179.25 180.58 2jg2 h THR 306 N 0.61 0.93 -0.32 0.00 2.02 -0.78 0.57 112.91 115.94 2jg2 h THR 306 Ca 0.16 -0.05 -0.03 0.00 0.77 0.00 0.00 66.41 67.27 2jg2 h THR 306 Cb 0.09 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2jg2 h THR 306 CO -0.02 0.03 0.10 0.74 0.37 0.00 0.00 175.52 176.73 2jg2 h THR 307 N 0.14 1.21 -0.08 3.16 2.02 -1.18 -1.55 112.91 116.63 2jg2 h THR 307 Ca 0.09 -0.67 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 2jg2 h THR 307 Cb 0.07 1.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.53 2jg2 h THR 307 CO -0.10 0.23 0.04 -1.28 0.37 0.00 0.00 175.52 174.78 2jg2 h SER 308 N 0.36 0.10 -0.53 4.18 0.87 -0.81 -1.25 113.55 116.46 2jg2 h SER 308 Ca 0.10 -0.09 0.07 0.00 -1.23 0.00 0.00 61.79 60.64 2jg2 h SER 308 Cb 0.26 -0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 62.13 2jg2 h SER 308 CO -0.00 0.16 0.22 0.40 -0.53 0.00 0.00 176.83 177.08 2jg2 h ILE 309 N 0.03 0.86 -0.72 2.23 2.04 -0.78 0.95 117.51 122.11 2jg2 h ILE 309 Ca 0.03 -0.15 -0.07 0.00 1.00 0.00 0.00 64.86 65.67 2jg2 h ILE 309 Cb 0.08 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 2jg2 h ILE 309 CO -0.00 0.08 0.18 0.03 0.00 0.00 0.00 178.15 178.44 2jg2 h ARG 310 N 0.42 1.15 -0.31 2.37 3.08 -1.13 -2.36 114.38 117.60 2jg2 h ARG 310 Ca 0.25 -0.27 -0.10 0.00 0.07 0.00 0.00 59.98 59.93 2jg2 h ARG 310 Cb 0.24 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2jg2 h ARG 310 CO -0.23 1.01 -0.22 0.87 -1.07 0.00 0.00 179.97 180.33 2jg2 h LYS 311 N 1.09 0.59 0.00 0.04 1.57 -0.70 -2.54 116.57 116.62 2jg2 h LYS 311 Ca 0.23 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2jg2 h LYS 311 Cb 0.37 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 2jg2 h LYS 311 CO 0.00 0.77 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.57 2jg2 h LEU 312 N 0.52 0.00 -1.81 2.94 3.38 -0.30 -2.03 115.31 118.01 2jg2 h LEU 312 Ca 0.08 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2jg2 h LEU 312 Cb 0.67 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2jg2 h LEU 312 CO 0.05 0.01 -0.11 0.24 0.09 0.00 0.00 178.44 178.71 2jg2 h MET 313 N 0.00 0.00 0.00 1.13 2.86 -1.21 -3.28 114.93 114.43 2jg2 h MET 313 Ca -0.00 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 2jg2 h MET 313 Cb 0.09 0.00 -0.28 0.00 0.06 0.00 0.00 31.60 31.46 2jg2 h MET 313 CO 0.00 0.11 -0.88 0.25 1.06 0.00 0.00 176.91 177.45 2jg2 n THR 314 N -4.30 0.38 -1.53 2.22 -2.24 -0.81 -4.86 114.28 103.14 2jg2 n THR 314 Ca -0.03 -1.28 -0.40 0.00 -2.27 0.00 0.00 64.05 60.08 2jg2 n THR 314 Cb 0.19 0.74 -0.02 0.00 -2.10 0.00 0.00 70.33 69.13 2jg2 n THR 314 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jg2 n ALA 315 N 0.16 7.21 -0.22 6.98 0.00 -0.95 -4.70 120.51 128.99 2jg2 n ALA 315 Ca 0.08 -3.71 -0.08 0.00 0.00 0.00 0.00 53.44 49.72 2jg2 n ALA 315 Cb 1.03 -3.23 0.03 0.00 0.00 0.00 0.00 19.45 17.28 2jg2 n ALA 315 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jg2 h HIS 316 N 4.98 1.13 -0.47 0.00 3.86 -1.91 -1.04 115.15 121.70 2jg2 h HIS 316 Ca 0.80 -0.17 -0.01 0.00 -1.16 0.00 0.00 60.37 59.84 2jg2 h HIS 316 Cb 0.32 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.46 2jg2 h HIS 316 CO 1.77 0.97 0.25 1.49 0.86 0.00 0.00 177.93 183.27 2jg2 h GLU 317 N 0.97 0.66 -0.15 2.45 4.81 -2.00 -0.80 114.58 120.52 2jg2 h GLU 317 Ca 0.19 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2jg2 h GLU 317 Cb 0.46 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 2jg2 h GLU 317 CO 0.02 0.54 0.07 0.87 -0.73 0.00 0.00 179.01 179.77 2jg2 h LYS 318 N 0.62 0.21 -0.39 1.92 1.57 -1.87 -1.73 116.57 116.89 2jg2 h LYS 318 Ca 0.16 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 59.00 2jg2 h LYS 318 Cb 0.07 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.26 2jg2 h LYS 318 CO -0.02 0.25 -0.26 -0.09 -0.57 0.00 0.00 179.45 178.76 2jg2 h ARG 319 N 0.12 -0.19 -0.73 3.15 2.43 -0.95 0.83 114.38 119.04 2jg2 h ARG 319 Ca 0.05 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2jg2 h ARG 319 Cb 0.11 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 2jg2 h ARG 319 CO -0.01 -0.13 0.40 0.93 -1.51 0.00 0.00 179.97 179.66 2jg2 h GLU 320 N -0.19 1.02 -0.46 0.20 4.39 -0.96 -2.08 114.58 116.50 2jg2 h GLU 320 Ca 0.19 -0.12 -0.06 0.00 0.34 0.00 0.00 59.36 59.70 2jg2 h GLU 320 Cb 0.49 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 2jg2 h GLU 320 CO -0.51 0.76 0.05 0.00 -1.16 0.00 0.00 179.01 178.16 2jg2 h ARG 321 N 1.01 0.78 -0.12 2.33 3.08 -0.92 -0.77 114.38 119.78 2jg2 h ARG 321 Ca 0.26 -0.22 0.04 0.00 0.07 0.00 0.00 59.98 60.12 2jg2 h ARG 321 Cb 0.04 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 29.96 2jg2 h ARG 321 CO -0.04 0.81 -0.12 1.25 -1.07 0.00 0.00 179.97 180.80 2jg2 h LEU 322 N 0.65 -0.38 -0.69 3.04 5.85 -0.59 0.21 115.31 123.39 2jg2 h LEU 322 Ca 0.14 0.07 -0.13 0.00 0.84 0.00 0.00 57.88 58.81 2jg2 h LEU 322 Cb 0.42 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2jg2 h LEU 322 CO 0.01 -0.16 -0.35 -0.50 -0.34 0.00 0.00 178.44 177.10 2jg2 h TRP 323 N -0.15 0.73 -0.26 1.25 4.06 -1.29 -0.41 115.95 119.87 2jg2 h TRP 323 Ca 0.09 -0.20 -0.00 0.00 2.06 0.00 0.00 58.89 60.84 2jg2 h TRP 323 Cb 0.27 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 28.26 2jg2 h TRP 323 CO -0.24 0.89 0.16 1.03 -3.56 0.00 0.00 178.44 176.72 2jg2 h SER 324 N 0.53 0.31 -0.34 -3.49 0.87 -0.79 -0.54 113.55 110.10 2jg2 h SER 324 Ca 0.06 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2jg2 h SER 324 Cb 0.85 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.71 2jg2 h SER 324 CO 0.07 0.25 0.22 0.78 -0.53 0.00 0.00 176.83 177.63 2jg2 h ASN 325 N 0.34 0.38 -0.62 6.23 2.35 -0.33 -1.71 115.58 122.22 2jg2 h ASN 325 Ca 0.10 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2jg2 h ASN 325 Cb -0.00 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 2jg2 h ASN 325 CO -0.02 0.28 0.39 0.00 -1.65 0.00 0.00 177.43 176.42 2jg2 h ALA 326 N 1.13 0.79 -0.79 -0.83 0.00 -0.84 -0.86 119.26 117.85 2jg2 h ALA 326 Ca 0.12 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2jg2 h ALA 326 Cb -0.05 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 2jg2 h ALA 326 CO -0.03 0.25 0.31 0.00 0.00 0.00 0.00 179.25 179.78 2jg2 h ARG 327 N 0.84 1.19 -0.44 0.00 3.08 -0.94 0.62 114.38 118.72 2jg2 h ARG 327 Ca 0.22 -0.22 -0.08 0.00 0.07 0.00 0.00 59.98 59.98 2jg2 h ARG 327 Cb -0.05 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.79 2jg2 h ARG 327 CO -0.04 0.96 -0.04 0.00 -1.07 0.00 0.00 179.97 179.78 2jg2 h ALA 328 N 1.18 0.60 -0.04 0.04 0.00 -1.03 0.43 119.26 120.44 2jg2 h ALA 328 Ca 0.26 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2jg2 h ALA 328 Cb 0.22 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2jg2 h ALA 328 CO -0.02 0.42 -0.02 1.25 0.00 0.00 0.00 179.25 180.89 2jg2 h LEU 329 N 0.64 0.09 -0.15 0.00 5.85 -0.93 -0.79 115.31 120.01 2jg2 h LEU 329 Ca 0.12 -0.40 0.01 0.00 0.84 0.00 0.00 57.88 58.45 2jg2 h LEU 329 Cb 0.55 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2jg2 h LEU 329 CO 0.03 0.46 0.08 -0.74 -0.34 0.00 0.00 178.44 177.93 2jg2 h HIS 330 N -0.29 0.14 -0.76 1.25 2.76 -0.87 -0.88 115.15 116.50 2jg2 h HIS 330 Ca 0.01 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.14 2jg2 h HIS 330 Cb 0.43 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 29.31 2jg2 h HIS 330 CO 0.06 0.08 0.31 0.78 -1.30 0.00 0.00 177.93 177.87 2jg2 h GLY 331 N 0.17 1.21 1.06 5.26 0.00 -0.93 -2.14 103.07 107.69 2jg2 h GLY 331 Ca 0.06 -0.64 -0.17 0.00 0.00 0.00 0.00 47.33 46.58 2jg2 h GLY 331 CO -0.04 0.60 -0.53 -1.33 0.00 0.00 0.00 176.54 175.25 2jg2 h GLY 332 N 1.13 0.83 1.10 4.60 0.00 -0.88 -1.90 103.07 107.96 2jg2 h GLY 332 Ca 0.26 -1.02 -0.13 0.00 0.00 0.00 0.00 47.33 46.44 2jg2 h GLY 332 CO -0.02 0.91 -0.20 1.41 0.00 0.00 0.00 176.54 178.64 2jg2 h LEU 333 N 0.49 1.02 -0.45 3.11 3.38 -1.01 -2.27 115.31 119.59 2jg2 h LEU 333 Ca -0.00 -0.39 -0.05 0.00 0.09 0.00 0.00 57.88 57.53 2jg2 h LEU 333 Cb 1.14 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 2jg2 h LEU 333 CO 0.12 1.18 0.10 0.50 0.09 0.00 0.00 178.44 180.42 2jg2 h LYS 334 N 0.85 0.73 -0.33 1.13 3.64 -1.38 -2.15 116.57 119.05 2jg2 h LYS 334 Ca 0.11 -0.18 -0.03 0.00 -1.27 0.00 0.00 60.65 59.28 2jg2 h LYS 334 Cb 0.78 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2jg2 h LYS 334 CO 0.06 0.74 0.06 0.00 -2.27 0.00 0.00 179.45 178.04 2jg2 h ALA 335 N 0.96 1.49 0.00 5.00 0.00 -1.19 -0.39 119.26 125.13 2jg2 h ALA 335 Ca 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jg2 h ALA 335 Cb 0.34 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2jg2 h ALA 335 CO 0.00 0.38 0.00 0.52 0.00 0.00 0.00 179.25 180.15 2jg2 h MET 336 N 0.48 0.00 0.00 0.00 2.86 -1.23 -3.47 114.93 113.57 2jg2 h MET 336 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2jg2 h MET 336 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 2jg2 h MET 336 CO -0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 2jg2 n GLY 337 N -0.03 0.96 3.77 8.32 0.00 -0.16 -4.75 105.19 113.30 2jg2 n GLY 337 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 2jg2 n GLY 337 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jg2 s PHE 338 N -2.00 3.08 -0.23 1.61 0.08 -0.83 -4.88 117.98 114.81 2jg2 s PHE 338 Ca 0.00 1.54 -0.25 0.00 0.12 0.00 0.00 56.93 58.34 2jg2 s PHE 338 Cb 0.00 -3.44 -0.01 0.00 -0.57 0.00 0.00 43.02 39.00 2jg2 s PHE 338 CO 0.00 -1.39 0.83 0.50 -0.10 0.00 0.00 175.22 175.07 2jg2 s ARG 339 N -2.18 4.20 0.26 0.44 3.52 -1.26 -4.40 118.95 119.53 2jg2 s ARG 339 Ca 0.55 0.96 0.07 0.00 -0.13 0.00 0.00 55.73 57.18 2jg2 s ARG 339 Cb -0.32 -3.63 -0.03 0.00 -1.56 0.00 0.00 34.95 29.40 2jg2 s ARG 339 CO 0.41 -0.49 0.25 -0.51 -0.81 0.00 0.00 175.30 174.14 2jg2 s LEU 340 N 2.75 3.91 0.39 -0.88 1.43 -1.26 -0.07 118.68 124.94 2jg2 s LEU 340 Ca 0.35 -0.20 0.28 0.00 -1.03 0.00 0.00 54.13 53.53 2jg2 s LEU 340 Cb -0.15 -2.45 1.12 0.00 0.03 0.00 0.00 46.19 44.74 2jg2 s LEU 340 CO 0.08 -0.08 1.83 1.23 0.23 0.00 0.00 176.35 179.64 2jg2 h GLY 341 N 1.39 0.00 -5.18 -3.19 0.00 -1.29 -3.44 103.07 91.35 2jg2 h GLY 341 Ca -0.49 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.52 2jg2 h GLY 341 CO 0.60 0.00 -0.75 -0.51 0.00 0.00 0.00 176.54 175.88 2jg2 s THR 342 N -3.46 0.49 0.23 4.70 -4.23 -1.26 -4.87 115.64 107.25 2jg2 s THR 342 Ca 0.03 -0.47 0.05 0.00 -1.18 0.00 0.00 61.69 60.12 2jg2 s THR 342 Cb 0.09 -0.46 -0.05 0.00 1.34 0.00 0.00 72.50 73.42 2jg2 s THR 342 CO 0.48 -0.00 1.54 -0.33 -0.54 0.00 0.00 174.62 175.77 2jg2 h GLU 343 N 5.60 0.21 -5.72 3.99 4.39 -2.00 -3.45 114.58 117.61 2jg2 h GLU 343 Ca -0.30 -0.16 -0.49 0.00 0.34 0.00 0.00 59.36 58.75 2jg2 h GLU 343 Cb 1.19 0.03 -0.14 0.00 -0.10 0.00 0.00 28.75 29.73 2jg2 h GLU 343 CO 0.48 0.78 -0.74 0.95 -1.16 0.00 0.00 179.01 179.32 2jg2 s THR 344 N -3.68 1.91 -0.74 1.13 -4.23 -1.26 -5.08 115.64 103.70 2jg2 s THR 344 Ca -0.04 -2.25 -0.27 0.00 -1.18 0.00 0.00 61.69 57.95 2jg2 s THR 344 Cb 0.12 -2.14 0.02 0.00 1.34 0.00 0.00 72.50 71.84 2jg2 s THR 344 CO 0.80 -0.53 1.37 0.00 -0.54 0.00 0.00 174.62 175.72 2jg2 n ASP 346 N 9.83 0.73 -1.66 0.00 8.00 -1.26 -4.99 116.55 127.20 2jg2 n ASP 346 Ca 0.07 -0.77 -0.04 0.00 0.71 0.00 0.00 54.79 54.75 2jg2 n ASP 346 Cb 0.49 1.04 0.00 0.00 -0.02 0.00 0.00 41.12 42.64 2jg2 n ASP 346 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2jg2 n SER 347 N -1.37 -0.66 -1.10 -2.24 3.41 -1.25 -4.85 113.62 105.56 2jg2 n SER 347 Ca 0.02 -1.61 0.08 0.00 -0.26 0.00 0.00 58.87 57.11 2jg2 n SER 347 Cb 0.23 1.14 0.25 0.00 -0.26 0.00 0.00 64.21 65.57 2jg2 n SER 347 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jg2 n ALA 348 N -2.17 2.65 -3.05 7.33 0.00 -1.26 -4.78 120.51 119.24 2jg2 n ALA 348 Ca -0.05 -1.04 -0.35 0.00 0.00 0.00 0.00 53.44 52.00 2jg2 n ALA 348 Cb 0.21 -0.99 -0.12 0.00 0.00 0.00 0.00 19.45 18.55 2jg2 n ALA 348 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jg2 s ILE 349 N -1.50 4.01 -0.22 0.00 1.01 -1.26 -1.24 121.20 122.00 2jg2 s ILE 349 Ca 0.37 -0.30 -0.01 0.00 0.00 0.00 0.00 60.65 60.71 2jg2 s ILE 349 Cb 0.21 -2.80 0.02 0.00 0.01 0.00 0.00 42.46 39.90 2jg2 s ILE 349 CO 0.22 0.44 -0.11 -0.69 0.00 0.00 0.00 174.94 174.80 2jg2 s VAL 350 N 0.84 2.60 -0.25 2.92 1.01 0.32 -4.50 120.40 123.34 2jg2 s VAL 350 Ca 0.01 -1.00 -0.07 0.00 0.00 0.00 0.00 61.98 60.91 2jg2 s VAL 350 Cb -0.14 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 2jg2 s VAL 350 CO 0.02 0.31 0.08 0.00 0.00 0.00 0.00 175.10 175.50 2jg2 s ALA 351 N 1.31 3.20 -0.23 5.51 0.00 -1.26 -0.34 121.76 129.94 2jg2 s ALA 351 Ca 0.01 -1.10 -0.16 0.00 0.00 0.00 0.00 51.96 50.72 2jg2 s ALA 351 Cb -0.16 -2.09 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 2jg2 s ALA 351 CO -0.07 -0.44 0.40 0.08 0.00 0.00 0.00 175.76 175.73 2jg2 s VAL 352 N 1.53 5.18 -0.20 0.00 1.01 0.59 -0.94 120.40 127.56 2jg2 s VAL 352 Ca 0.06 0.68 -0.13 0.00 0.00 0.00 0.00 61.98 62.59 2jg2 s VAL 352 Cb -0.15 -3.73 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 2jg2 s VAL 352 CO 0.04 0.21 0.26 -0.04 0.00 0.00 0.00 175.10 175.57 2jg2 s MET 353 N 1.64 4.16 0.33 2.72 1.00 0.90 -1.00 119.30 129.04 2jg2 s MET 353 Ca 0.18 -0.04 0.09 0.00 0.00 0.00 0.00 55.69 55.92 2jg2 s MET 353 Cb -0.15 -3.50 -0.05 0.00 0.00 0.00 0.00 34.83 31.14 2jg2 s MET 353 CO 0.09 0.10 0.08 -0.51 0.00 0.00 0.00 175.02 174.78 2jg2 s LEU 354 N 0.91 3.17 0.13 -0.03 1.43 0.25 -4.38 118.68 120.16 2jg2 s LEU 354 Ca 0.13 -0.82 -0.04 0.00 -1.03 0.00 0.00 54.13 52.37 2jg2 s LEU 354 Cb -0.13 -1.62 -0.09 0.00 0.03 0.00 0.00 46.19 44.37 2jg2 s LEU 354 CO 0.05 -0.24 1.31 -0.33 0.23 0.00 0.00 176.35 177.37 2jg2 h GLU 355 N 1.67 0.40 -3.63 1.70 5.08 -1.94 -3.36 114.58 114.50 2jg2 h GLU 355 Ca -0.43 -0.43 -0.10 0.00 -1.00 0.00 0.00 59.36 57.40 2jg2 h GLU 355 Cb 1.25 0.12 -0.07 0.00 0.50 0.00 0.00 28.75 30.55 2jg2 h GLU 355 CO 0.64 1.10 -0.05 0.16 -1.00 0.00 0.00 179.01 179.85 2jg2 s ASP 356 N -7.07 0.17 0.23 1.42 1.47 -1.26 -4.94 116.67 106.69 2jg2 s ASP 356 Ca -0.06 -1.08 -0.07 0.00 1.18 0.00 0.00 52.55 52.52 2jg2 s ASP 356 Cb 0.09 0.66 0.21 0.00 -0.34 0.00 0.00 42.92 43.53 2jg2 s ASP 356 CO 0.86 -1.28 1.87 -0.61 0.68 0.00 0.00 175.17 176.70 2jg2 h GLN 357 N 2.16 1.22 -0.55 2.11 4.15 -1.96 -2.23 115.11 120.02 2jg2 h GLN 357 Ca -0.27 -0.12 -0.03 0.00 0.77 0.00 0.00 58.65 59.00 2jg2 h GLN 357 Cb 1.25 -0.25 -0.02 0.00 0.21 0.00 0.00 27.48 28.66 2jg2 h GLN 357 CO 0.36 0.87 0.24 1.49 -1.93 0.00 0.00 178.83 179.86 2jg2 h GLU 358 N 1.24 0.81 -0.57 1.69 4.81 -1.99 -1.02 114.58 119.54 2jg2 h GLU 358 Ca 0.32 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 2jg2 h GLU 358 Cb -0.03 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 2jg2 h GLU 358 CO -0.06 0.69 0.26 0.37 -0.73 0.00 0.00 179.01 179.54 2jg2 h GLN 359 N 0.75 0.83 -0.33 1.92 4.15 -1.90 -0.27 115.11 120.26 2jg2 h GLN 359 Ca 0.19 -0.13 -0.02 0.00 0.77 0.00 0.00 58.65 59.45 2jg2 h GLN 359 Cb 0.16 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 2jg2 h GLN 359 CO -0.02 0.69 0.13 0.00 -1.93 0.00 0.00 178.83 177.70 2jg2 h ALA 360 N 1.10 0.43 -0.54 3.38 0.00 -1.12 -1.17 119.26 121.34 2jg2 h ALA 360 Ca 0.19 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2jg2 h ALA 360 Cb 0.15 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2jg2 h ALA 360 CO -0.02 0.04 0.11 0.00 0.00 0.00 0.00 179.25 179.38 2jg2 h ALA 361 N 0.97 0.72 -0.50 0.00 0.00 -0.99 0.78 119.26 120.24 2jg2 h ALA 361 Ca 0.11 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2jg2 h ALA 361 Cb 0.20 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2jg2 h ALA 361 CO -0.01 0.44 0.22 0.52 0.00 0.00 0.00 179.25 180.42 2jg2 h MET 362 N 0.78 0.74 0.09 0.00 2.07 -0.99 0.06 114.93 117.68 2jg2 h MET 362 Ca 0.17 -0.12 -0.00 0.00 -2.07 0.00 0.00 59.70 57.67 2jg2 h MET 362 Cb 0.37 -0.12 0.00 0.00 -1.87 0.00 0.00 31.60 29.98 2jg2 h MET 362 CO 0.01 0.64 -0.04 0.52 1.07 0.00 0.00 176.91 179.11 2jg2 h MET 363 N 0.67 -0.11 -0.49 1.72 2.86 -0.99 -1.37 114.93 117.21 2jg2 h MET 363 Ca 0.17 0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.86 2jg2 h MET 363 Cb 0.17 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.81 2jg2 h MET 363 CO -0.02 -0.05 0.25 2.35 1.06 0.00 0.00 176.91 180.50 2jg2 h TRP 364 N -0.14 0.45 -0.64 -0.22 7.01 -0.67 -0.85 115.95 120.89 2jg2 h TRP 364 Ca -0.01 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 60.93 2jg2 h TRP 364 Cb 0.11 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.02 2jg2 h TRP 364 CO -0.07 0.23 0.09 0.37 -2.79 0.00 0.00 178.44 176.27 2jg2 h GLN 365 N 0.49 1.06 -0.58 2.65 5.75 -0.92 -0.82 115.11 122.73 2jg2 h GLN 365 Ca 0.21 -0.29 -0.09 0.00 -0.15 0.00 0.00 58.65 58.33 2jg2 h GLN 365 Cb 0.12 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.53 2jg2 h GLN 365 CO -0.15 0.99 0.02 0.00 -2.65 0.00 0.00 178.83 177.05 2jg2 h ALA 366 N 1.03 0.78 -0.10 3.38 0.00 -0.86 0.78 119.26 124.27 2jg2 h ALA 366 Ca 0.19 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2jg2 h ALA 366 Cb 0.45 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2jg2 h ALA 366 CO 0.02 0.59 0.05 -0.07 0.00 0.00 0.00 179.25 179.83 2jg2 h LEU 367 N 0.90 0.13 0.01 0.00 3.38 -0.98 -1.14 115.31 117.62 2jg2 h LEU 367 Ca 0.17 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2jg2 h LEU 367 Cb 0.52 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2jg2 h LEU 367 CO 0.02 0.23 -0.09 0.25 0.09 0.00 0.00 178.44 178.94 2jg2 h LEU 368 N 0.03 -0.25 -2.07 1.67 5.85 -0.60 0.62 115.31 120.57 2jg2 h LEU 368 Ca 0.03 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.81 2jg2 h LEU 368 Cb 0.13 0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 2jg2 h LEU 368 CO -0.00 -0.13 0.06 0.44 -0.34 0.00 0.00 178.44 178.46 2jg2 h ASP 369 N -0.15 0.00 0.19 1.25 3.32 -0.77 -1.26 116.42 119.00 2jg2 h ASP 369 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2jg2 h ASP 369 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2jg2 h ASP 369 CO -0.09 0.00 -0.10 0.61 -1.72 0.00 0.00 179.24 177.95 2jg2 n GLY 370 N -1.52 -0.62 0.00 2.75 0.00 -0.44 -4.92 105.19 100.44 2jg2 n GLY 370 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2jg2 n GLY 370 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jg2 n GLY 371 N 1.23 1.85 2.77 -0.02 0.00 -0.47 -5.04 105.19 105.50 2jg2 n GLY 371 Ca 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.03 2jg2 n GLY 371 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jg2 s LEU 372 N 0.00 1.09 -0.23 0.99 2.96 0.14 -0.82 118.68 122.81 2jg2 s LEU 372 Ca 0.00 0.04 -0.07 0.00 -0.22 0.00 0.00 54.13 53.88 2jg2 s LEU 372 Cb 0.00 -0.07 -0.03 0.00 0.50 0.00 0.00 46.19 46.59 2jg2 s LEU 372 CO 0.00 -0.13 0.05 -0.47 -1.32 0.00 0.00 176.35 174.49 2jg2 s TYR 373 N 1.06 3.09 0.28 5.38 5.04 0.05 -2.11 117.35 130.14 2jg2 s TYR 373 Ca -0.09 -0.40 0.06 0.00 -2.44 0.00 0.00 57.07 54.20 2jg2 s TYR 373 Cb -0.13 -2.19 -0.06 0.00 0.35 0.00 0.00 41.96 39.93 2jg2 s TYR 373 CO -0.03 -0.30 -0.03 0.14 -1.34 0.00 0.00 175.55 173.99 2jg2 s VAL 374 N 1.40 1.49 0.06 3.14 -7.23 -1.26 -0.80 120.40 117.20 2jg2 s VAL 374 Ca 0.05 -2.09 -0.26 0.00 -1.81 0.00 0.00 61.98 57.88 2jg2 s VAL 374 Cb -0.15 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.24 2jg2 s VAL 374 CO 0.03 -0.26 0.79 0.21 -0.31 0.00 0.00 175.10 175.57 2jg2 s ASN 375 N -3.43 7.26 -0.07 4.85 3.04 -0.88 -4.87 114.94 120.83 2jg2 s ASN 375 Ca 0.30 1.51 -0.03 0.00 0.04 0.00 0.00 52.86 54.68 2jg2 s ASN 375 Cb 0.05 -2.49 -0.04 0.00 -1.54 0.00 0.00 41.25 37.24 2jg2 s ASN 375 CO 0.12 0.01 0.08 -0.32 -3.04 0.00 0.00 177.10 173.96 2jg2 s MET 376 N -0.11 3.20 -0.07 0.43 -2.45 -1.26 0.11 119.30 119.14 2jg2 s MET 376 Ca 0.39 -0.32 0.00 0.00 -1.25 0.00 0.00 55.69 54.52 2jg2 s MET 376 Cb -0.21 -2.97 0.02 0.00 1.25 0.00 0.00 34.83 32.92 2jg2 s MET 376 CO 0.24 0.72 -0.05 0.00 1.05 0.00 0.00 175.02 176.98 2jg2 s ALA 377 N -1.04 0.94 0.22 4.11 0.00 -0.12 -4.94 121.76 120.94 2jg2 s ALA 377 Ca 0.17 -0.26 0.02 0.00 0.00 0.00 0.00 51.96 51.88 2jg2 s ALA 377 Cb -0.12 -0.68 -0.05 0.00 0.00 0.00 0.00 23.12 22.28 2jg2 s ALA 377 CO 0.07 -0.25 0.05 1.03 0.00 0.00 0.00 175.76 176.66 2jg2 s ARG 378 N 1.43 1.28 0.38 0.00 0.52 -1.26 -0.51 118.95 120.78 2jg2 s ARG 378 Ca -0.02 -1.66 -0.28 0.00 -0.52 0.00 0.00 55.73 53.25 2jg2 s ARG 378 Cb -0.13 -0.29 -0.11 0.00 0.52 0.00 0.00 34.95 34.93 2jg2 s ARG 378 CO -0.03 -0.21 1.48 -2.30 0.02 0.00 0.00 175.30 174.25 2jg2 n PRO 379 N -0.37 2.64 -0.34 3.54 -0.02 -1.26 -0.61 135.00 138.58 2jg2 n PRO 379 Ca -0.03 0.92 0.08 0.00 -2.02 0.00 0.00 63.50 62.46 2jg2 n PRO 379 Cb 0.65 -2.65 0.25 0.00 -0.02 0.00 0.00 33.50 31.73 2jg2 n PRO 379 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2jg2 n PRO 380 N 0.42 2.52 -0.29 0.52 -0.04 -1.26 -4.86 135.00 132.01 2jg2 n PRO 380 Ca 0.02 -2.04 -0.06 0.00 -0.04 0.00 0.00 63.50 61.38 2jg2 n PRO 380 Cb 0.39 -1.53 0.06 0.00 -0.04 0.00 0.00 33.50 32.39 2jg2 n PRO 380 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jg2 h ALA 381 N 3.93 1.02 -1.60 0.55 0.00 -1.27 -3.43 119.26 118.46 2jg2 h ALA 381 Ca 0.00 -0.18 -0.51 0.00 0.00 0.00 0.00 54.91 54.22 2jg2 h ALA 381 Cb 0.87 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2jg2 h ALA 381 CO 0.06 0.61 -0.42 0.95 0.00 0.00 0.00 179.25 180.45 2jg2 s THR 382 N -5.62 2.71 0.62 0.00 -4.23 -0.98 -4.95 115.64 103.19 2jg2 s THR 382 Ca -0.13 -1.44 -0.18 0.00 -1.18 0.00 0.00 61.69 58.76 2jg2 s THR 382 Cb 0.15 -3.02 -0.02 0.00 1.34 0.00 0.00 72.50 70.96 2jg2 s THR 382 CO 0.83 -0.03 1.19 -2.16 -0.54 0.00 0.00 174.62 173.90 2jg2 s PRO 383 N -4.05 2.82 0.17 3.99 0.04 -1.26 -3.99 135.00 132.72 2jg2 s PRO 383 Ca 0.45 1.74 -0.33 0.00 0.04 0.00 0.00 61.00 62.90 2jg2 s PRO 383 Cb -0.02 -1.92 -0.15 0.00 0.04 0.00 0.00 34.50 32.45 2jg2 s PRO 383 CO 0.26 -1.30 1.36 0.00 0.04 0.00 0.00 177.00 177.36 2jg2 n ALA 384 N -1.89 0.24 -0.03 8.56 0.00 -1.26 -1.22 120.51 124.91 2jg2 n ALA 384 Ca 0.13 0.45 0.00 0.00 0.00 0.00 0.00 53.44 54.02 2jg2 n ALA 384 Cb 0.50 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.77 2jg2 n ALA 384 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jg2 n GLY 385 N 2.46 0.54 3.35 0.00 0.00 -1.26 -5.04 105.19 105.24 2jg2 n GLY 385 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2jg2 n GLY 385 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jg2 s THR 386 N -2.21 3.42 -0.08 2.61 2.01 -0.36 -4.93 115.64 116.10 2jg2 s THR 386 Ca 0.00 -0.49 -0.01 0.00 0.31 0.00 0.00 61.69 61.50 2jg2 s THR 386 Cb 0.00 -2.53 0.03 0.00 0.01 0.00 0.00 72.50 70.01 2jg2 s THR 386 CO 0.00 0.45 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.00 2jg2 s PHE 387 N 1.15 0.88 0.08 4.92 0.08 -1.26 -4.12 117.98 119.71 2jg2 s PHE 387 Ca 0.02 -0.31 0.07 0.00 0.12 0.00 0.00 56.93 56.82 2jg2 s PHE 387 Cb -0.14 -0.91 -0.03 0.00 -0.57 0.00 0.00 43.02 41.36 2jg2 s PHE 387 CO -0.01 -0.37 -0.18 -0.51 -0.10 0.00 0.00 175.22 174.04 2jg2 s LEU 388 N 1.90 2.28 -0.23 -0.37 1.43 0.33 -0.59 118.68 123.42 2jg2 s LEU 388 Ca 0.05 -0.64 -0.05 0.00 -1.03 0.00 0.00 54.13 52.46 2jg2 s LEU 388 Cb -0.12 -0.75 -0.01 0.00 0.03 0.00 0.00 46.19 45.33 2jg2 s LEU 388 CO -0.06 0.02 -0.01 -0.76 0.23 0.00 0.00 176.35 175.77 2jg2 s LEU 389 N -1.76 3.07 -0.28 1.79 1.43 -0.17 -0.95 118.68 121.81 2jg2 s LEU 389 Ca 0.03 -0.36 -0.08 0.00 -1.03 0.00 0.00 54.13 52.69 2jg2 s LEU 389 Cb -0.10 -1.79 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 2jg2 s LEU 389 CO 0.03 -0.03 0.09 -0.13 0.23 0.00 0.00 176.35 176.54 2jg2 s ARG 390 N 1.51 3.39 -0.18 1.70 0.52 0.12 -0.30 118.95 125.71 2jg2 s ARG 390 Ca 0.06 -0.66 -0.09 0.00 -0.52 0.00 0.00 55.73 54.52 2jg2 s ARG 390 Cb -0.15 -3.38 -0.05 0.00 0.52 0.00 0.00 34.95 31.90 2jg2 s ARG 390 CO -0.01 -0.32 0.11 0.00 0.02 0.00 0.00 175.30 175.09 2jg2 s SER 392 N 0.15 2.79 0.41 0.00 1.04 -0.20 -0.52 113.70 117.37 2jg2 s SER 392 Ca 0.08 -0.52 -0.11 0.00 0.48 0.00 0.00 55.95 55.88 2jg2 s SER 392 Cb -0.12 -1.27 -0.06 0.00 0.10 0.00 0.00 66.02 64.67 2jg2 s SER 392 CO -0.01 0.05 0.78 -0.63 0.98 0.00 0.00 173.24 174.41 2jg2 s ILE 393 N 0.89 4.78 -0.02 -1.02 1.09 -0.37 -4.25 121.20 122.30 2jg2 s ILE 393 Ca -0.07 0.63 0.05 0.00 -1.10 0.00 0.00 60.65 60.16 2jg2 s ILE 393 Cb -0.15 -3.74 -0.01 0.00 -1.06 0.00 0.00 42.46 37.50 2jg2 s ILE 393 CO -0.02 -0.54 -0.17 0.00 -0.10 0.00 0.00 174.94 174.12 2jg2 h ALA 395 N 5.81 2.85 -0.01 0.00 0.00 -0.95 -1.93 119.26 125.03 2jg2 h ALA 395 Ca -0.36 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2jg2 h ALA 395 Cb 1.15 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2jg2 h ALA 395 CO 0.48 -1.16 -0.13 0.39 0.00 0.00 0.00 179.25 178.83 2jg2 n GLU 396 N -4.17 1.44 -1.84 0.00 -0.58 -1.26 -4.46 120.64 109.77 2jg2 n GLU 396 Ca 0.19 -0.95 -0.41 0.00 -0.42 0.00 0.00 57.16 55.57 2jg2 n GLU 396 Cb 1.01 -1.48 -0.01 0.00 -0.57 0.00 0.00 31.44 30.39 2jg2 n GLU 396 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2jg2 s HIS 397 N -2.21 2.71 0.35 -0.32 3.76 -0.73 -4.91 115.29 113.94 2jg2 s HIS 397 Ca 0.30 1.07 -0.08 0.00 -0.15 0.00 0.00 55.06 56.20 2jg2 s HIS 397 Cb 0.20 -3.99 -0.06 0.00 1.11 0.00 0.00 32.58 29.84 2jg2 s HIS 397 CO 0.42 -3.04 0.66 0.95 -0.85 0.00 0.00 174.74 172.88 2jg2 s THR 398 N -0.71 4.91 0.38 1.30 -4.23 -1.26 -4.97 115.64 111.06 2jg2 s THR 398 Ca 0.56 0.32 0.14 0.00 -1.18 0.00 0.00 61.69 61.54 2jg2 s THR 398 Cb -0.46 -3.74 0.36 0.00 1.34 0.00 0.00 72.50 70.01 2jg2 s THR 398 CO 0.56 -0.43 1.82 -0.65 -0.54 0.00 0.00 174.62 175.38 2jg2 h PRO 399 N 1.44 0.50 -0.32 3.99 0.11 -1.99 -0.90 132.00 134.83 2jg2 h PRO 399 Ca -0.47 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 2jg2 h PRO 399 Cb 1.19 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 2jg2 h PRO 399 CO 0.65 0.33 0.19 0.00 -0.21 0.00 0.00 178.00 178.96 2jg2 h ALA 400 N 1.62 0.41 -0.74 -0.75 0.00 -2.00 -1.55 119.26 116.25 2jg2 h ALA 400 Ca 0.53 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2jg2 h ALA 400 Cb 1.16 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 2jg2 h ALA 400 CO -0.26 -0.10 0.48 1.96 0.00 0.00 0.00 179.25 181.33 2jg2 h GLN 401 N 0.41 0.98 -0.81 0.00 4.20 -1.59 -0.54 115.11 117.75 2jg2 h GLN 401 Ca 0.11 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 2jg2 h GLN 401 Cb 0.00 -0.22 -0.04 0.00 0.30 0.00 0.00 27.48 27.53 2jg2 h GLN 401 CO -0.02 0.66 0.41 0.82 -0.67 0.00 0.00 178.83 180.02 2jg2 h ILE 402 N 1.00 1.25 -0.56 2.54 1.08 -0.95 0.17 117.51 122.04 2jg2 h ILE 402 Ca 0.27 -0.67 -0.10 0.00 -0.39 0.00 0.00 64.86 63.97 2jg2 h ILE 402 Cb -0.10 0.20 -0.02 0.00 -3.07 0.00 0.00 36.82 33.83 2jg2 h ILE 402 CO -0.06 0.29 -0.03 1.56 -0.69 0.00 0.00 178.15 179.22 2jg2 h GLN 403 N 1.14 0.99 -0.45 2.37 1.08 -1.02 -0.10 115.11 119.12 2jg2 h GLN 403 Ca 0.28 -0.32 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 2jg2 h GLN 403 Cb 0.09 -0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.40 2jg2 h GLN 403 CO -0.04 0.99 0.26 1.15 -0.95 0.00 0.00 178.83 180.24 2jg2 h THR 404 N 0.90 1.03 -0.41 -0.54 2.02 -0.52 -0.31 112.91 115.08 2jg2 h THR 404 Ca 0.16 -0.18 0.03 0.00 0.77 0.00 0.00 66.41 67.19 2jg2 h THR 404 Cb 0.57 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 67.41 2jg2 h THR 404 CO 0.03 0.09 0.20 0.58 0.37 0.00 0.00 175.52 176.80 2jg2 h VAL 405 N 0.52 0.96 -0.65 3.16 2.07 -0.30 -0.14 116.25 121.88 2jg2 h VAL 405 Ca 0.18 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 2jg2 h VAL 405 Cb 0.03 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 2jg2 h VAL 405 CO -0.09 0.07 0.38 -0.07 0.02 0.00 0.00 177.57 177.88 2jg2 h LEU 406 N 0.41 0.78 -0.94 2.57 3.38 -0.57 0.34 115.31 121.28 2jg2 h LEU 406 Ca 0.18 -0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.17 2jg2 h LEU 406 Cb 0.09 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.57 2jg2 h LEU 406 CO -0.13 0.63 0.59 1.23 0.09 0.00 0.00 178.44 180.84 2jg2 h GLY 407 N 0.88 1.49 1.07 0.83 0.00 -0.67 0.17 103.07 106.84 2jg2 h GLY 407 Ca 0.23 -0.41 -0.11 0.00 0.00 0.00 0.00 47.33 47.04 2jg2 h GLY 407 CO -0.04 0.21 -0.14 -0.33 0.00 0.00 0.00 176.54 176.24 2jg2 h MET 408 N 0.99 0.96 -0.69 4.80 2.86 -0.18 -0.99 114.93 122.68 2jg2 h MET 408 Ca 0.44 -0.38 -0.05 0.00 -2.06 0.00 0.00 59.70 57.65 2jg2 h MET 408 Cb 0.34 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.92 2jg2 h MET 408 CO -0.23 1.05 0.24 0.74 1.06 0.00 0.00 176.91 179.77 2jg2 h PHE 409 N 0.82 1.08 -0.34 -0.22 -1.00 -0.46 -1.08 116.94 115.74 2jg2 h PHE 409 Ca 0.12 -0.09 -0.03 0.00 2.81 0.00 0.00 57.97 60.78 2jg2 h PHE 409 Cb 0.71 -0.32 -0.01 0.00 3.61 0.00 0.00 35.95 39.94 2jg2 h PHE 409 CO 0.05 0.84 0.11 0.37 -1.61 0.00 0.00 178.31 178.07 2jg2 h GLN 410 N 1.02 0.53 -0.40 1.51 5.75 -0.71 0.10 115.11 122.91 2jg2 h GLN 410 Ca 0.23 -0.12 -0.03 0.00 -0.15 0.00 0.00 58.65 58.58 2jg2 h GLN 410 Cb 0.25 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 2jg2 h GLN 410 CO -0.01 0.56 0.11 0.00 -2.65 0.00 0.00 178.83 176.85 2jg2 h ALA 411 N 0.94 0.53 -0.22 3.38 0.00 -0.99 -2.37 119.26 120.53 2jg2 h ALA 411 Ca 0.11 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 2jg2 h ALA 411 Cb 0.25 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2jg2 h ALA 411 CO -0.00 0.18 -0.33 0.00 0.00 0.00 0.00 179.25 179.10 2jg2 h ALA 412 N 0.96 0.33 -0.59 0.00 0.00 -1.17 -2.12 119.26 116.68 2jg2 h ALA 412 Ca 0.13 -0.42 0.13 0.00 0.00 0.00 0.00 54.91 54.74 2jg2 h ALA 412 Cb 0.28 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2jg2 h ALA 412 CO -0.00 0.38 0.40 0.78 0.00 0.00 0.00 179.25 180.81 2jg2 h GLY 413 N 0.30 0.38 0.08 0.00 0.00 -0.74 -1.44 103.07 101.65 2jg2 h GLY 413 Ca 0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 2jg2 h GLY 413 CO 0.08 0.05 -0.01 3.21 0.00 0.00 0.00 176.54 179.87 2jg2 h ARG 414 N 0.25 -0.01 -0.44 4.80 3.08 -1.20 0.47 114.38 121.33 2jg2 h ARG 414 Ca 0.28 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.41 2jg2 h ARG 414 Cb 0.76 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.78 2jg2 h ARG 414 CO -0.06 0.79 0.30 0.00 -1.07 0.00 0.00 179.97 179.94 2jg2 h ALA 415 N -0.05 2.12 0.02 0.04 0.00 -1.14 -2.24 119.26 118.00 2jg2 h ALA 415 Ca -0.00 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.60 2jg2 h ALA 415 Cb 0.81 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 2jg2 h ALA 415 CO 0.00 -0.22 -1.70 0.28 0.00 0.00 0.00 179.25 177.62 2jg2 h VAL 416 N 0.23 0.87 -0.45 0.00 2.07 -1.35 -3.49 116.25 114.13 2jg2 h VAL 416 Ca 0.20 -2.70 0.00 0.00 0.82 0.00 0.00 66.70 65.02 2jg2 h VAL 416 Cb 0.50 2.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.73 2jg2 h VAL 416 CO -0.04 0.56 0.00 0.61 0.02 0.00 0.00 177.57 178.73 2jg2 n GLY 417 N 1.60 0.95 0.13 2.17 0.00 -0.02 -5.04 105.19 104.97 2jg2 n GLY 417 Ca -0.18 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.45 2jg2 n GLY 417 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2jg2 h VAL 418 N 0.00 1.23 0.00 1.61 2.07 -0.44 -3.46 116.25 117.27 2jg2 h VAL 418 Ca 0.00 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.75 2jg2 h VAL 418 Cb 0.42 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 2jg2 h VAL 418 CO 0.00 0.24 0.00 2.30 0.02 0.00 0.00 177.57 180.13 2jg2 n ILE 419 N -4.73 0.00 0.00 4.57 -5.35 -1.26 -5.02 119.36 107.57 2jg2 n ILE 419 Ca -0.04 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.44 2jg2 n ILE 419 Cb 0.20 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.10 2jg2 n ILE 419 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40