#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jgl n ASP 5 N 0.00 3.39 0.00 4.31 4.64 -1.26 -4.86 116.55 122.76 2jgl n ASP 5 Ca 0.00 0.59 0.11 0.00 -1.38 0.00 0.00 54.79 54.12 2jgl n ASP 5 Cb 0.00 -1.46 0.56 0.00 -1.04 0.00 0.00 41.12 39.17 2jgl n ASP 5 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2jgl n PRO 6 N 7.87 0.21 0.20 -0.67 -0.04 -1.26 -1.69 135.00 139.61 2jgl n PRO 6 Ca 0.27 0.08 0.08 0.00 -0.04 0.00 0.00 63.50 63.89 2jgl n PRO 6 Cb 0.37 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.60 2jgl n PRO 6 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2jgl h GLN 7 N 0.00 0.00 -0.65 0.54 1.08 -2.03 -3.26 115.11 110.78 2jgl h GLN 7 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2jgl h GLN 7 Cb 0.29 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 2jgl h GLN 7 CO 0.00 0.27 0.00 1.28 -0.95 0.00 0.00 178.83 179.43 2jgl n LEU 8 N -3.27 4.81 -4.15 1.46 4.77 -0.68 -4.82 117.00 115.12 2jgl n LEU 8 Ca 0.01 -2.43 -0.33 0.00 -0.03 0.00 0.00 56.01 53.23 2jgl n LEU 8 Cb 0.55 -0.59 -0.16 0.00 -2.33 0.00 0.00 43.42 40.89 2jgl n LEU 8 CO 0.36 0.76 -0.50 -0.76 -1.33 0.00 0.00 177.39 175.92 2jgl s LEU 9 N -1.93 2.39 0.01 2.23 1.43 -1.23 -0.45 118.68 121.13 2jgl s LEU 9 Ca 0.50 -0.68 0.07 0.00 -1.03 0.00 0.00 54.13 52.99 2jgl s LEU 9 Cb 0.33 -1.53 -0.02 0.00 0.03 0.00 0.00 46.19 45.00 2jgl s LEU 9 CO 0.23 -0.02 -0.21 -0.69 0.23 0.00 0.00 176.35 175.88 2jgl s VAL 10 N 1.31 1.69 -0.37 -1.59 1.01 -0.74 -4.99 120.40 116.71 2jgl s VAL 10 Ca 0.04 -1.03 -0.10 0.00 0.00 0.00 0.00 61.98 60.89 2jgl s VAL 10 Cb -0.14 -1.43 0.03 0.00 0.00 0.00 0.00 36.38 34.85 2jgl s VAL 10 CO -0.11 0.38 0.19 -0.60 0.00 0.00 0.00 175.10 174.96 2jgl s ARG 11 N -0.76 2.76 0.55 2.72 3.52 -1.26 -0.78 118.95 125.69 2jgl s ARG 11 Ca 0.08 -1.14 0.09 0.00 -0.13 0.00 0.00 55.73 54.63 2jgl s ARG 11 Cb -0.08 -3.68 0.07 0.00 -1.56 0.00 0.00 34.95 29.69 2jgl s ARG 11 CO 0.00 -0.72 0.75 0.14 -0.81 0.00 0.00 175.30 174.67 2jgl s VAL 12 N 1.51 2.33 0.58 7.11 -7.23 -0.45 -4.91 120.40 119.34 2jgl s VAL 12 Ca 0.01 -0.98 0.27 0.00 -1.81 0.00 0.00 61.98 59.47 2jgl s VAL 12 Cb -0.20 -2.35 0.35 0.00 0.56 0.00 0.00 36.38 34.74 2jgl s VAL 12 CO 0.06 0.00 2.17 0.03 -0.31 0.00 0.00 175.10 177.04 2jgl h ARG 13 N 0.25 0.00 -0.17 4.82 3.08 -1.95 -2.10 114.38 118.31 2jgl h ARG 13 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.73 2jgl h ARG 13 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 2jgl h ARG 13 CO 0.42 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.73 2jgl n GLY 14 N -1.40 1.09 0.00 0.04 0.00 -1.26 -4.95 105.19 98.71 2jgl n GLY 14 Ca -0.01 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2jgl n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jgl n GLY 15 N 1.37 0.76 3.90 -0.02 0.00 -0.79 -0.92 105.19 109.50 2jgl n GLY 15 Ca 0.17 -2.06 -0.32 0.00 0.00 0.00 0.00 46.02 43.81 2jgl n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jgl s GLN 16 N -1.14 3.54 0.07 1.61 -0.21 -1.24 -1.34 119.66 120.94 2jgl s GLN 16 Ca 0.00 -0.23 0.05 0.00 0.02 0.00 0.00 55.36 55.20 2jgl s GLN 16 Cb 0.00 -2.97 -0.03 0.00 1.00 0.00 0.00 33.01 31.01 2jgl s GLN 16 CO 0.00 0.56 -0.14 -0.51 -2.12 0.00 0.00 175.29 173.08 2jgl s LEU 17 N -2.44 2.28 -0.12 2.90 1.43 0.04 -0.83 118.68 121.93 2jgl s LEU 17 Ca 0.36 -0.62 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2jgl s LEU 17 Cb -0.13 -0.51 0.02 0.00 0.03 0.00 0.00 46.19 45.60 2jgl s LEU 17 CO 0.24 -0.08 -0.15 -0.60 0.23 0.00 0.00 176.35 176.00 2jgl s ARG 18 N -1.75 2.24 0.00 1.70 3.52 -0.57 -1.79 118.95 122.29 2jgl s ARG 18 Ca -0.02 -0.56 0.00 0.00 -0.13 0.00 0.00 55.73 55.02 2jgl s ARG 18 Cb -0.10 -1.96 0.00 0.00 -1.56 0.00 0.00 34.95 31.33 2jgl s ARG 18 CO 0.02 -0.12 0.00 0.41 -0.81 0.00 0.00 175.30 174.80 2jgl n GLY 19 N 4.41 0.65 3.04 8.12 0.00 0.40 -1.12 105.19 120.69 2jgl n GLY 19 Ca -0.18 -1.92 -0.15 0.00 0.00 0.00 0.00 46.02 43.77 2jgl n GLY 19 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jgl s ILE 20 N 0.36 0.60 -0.30 -0.61 2.07 0.18 -4.76 121.20 118.73 2jgl s ILE 20 Ca 0.00 -0.80 -0.21 0.00 -1.41 0.00 0.00 60.65 58.22 2jgl s ILE 20 Cb 0.00 -0.60 -0.01 0.00 0.13 0.00 0.00 42.46 41.99 2jgl s ILE 20 CO 0.00 -0.16 0.68 -0.60 -1.91 0.00 0.00 174.94 172.95 2jgl s ARG 21 N -1.06 3.92 0.15 3.50 3.52 -1.26 -0.66 118.95 127.07 2jgl s ARG 21 Ca -0.04 0.40 0.04 0.00 -0.13 0.00 0.00 55.73 56.00 2jgl s ARG 21 Cb -0.07 -3.73 -0.04 0.00 -1.56 0.00 0.00 34.95 29.55 2jgl s ARG 21 CO 0.00 -0.61 0.14 -0.51 -0.81 0.00 0.00 175.30 173.52 2jgl s LEU 22 N 2.73 3.86 -0.21 -0.88 1.43 0.10 -4.96 118.68 120.75 2jgl s LEU 22 Ca 0.28 -0.08 -0.07 0.00 -1.03 0.00 0.00 54.13 53.23 2jgl s LEU 22 Cb -0.15 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 2jgl s LEU 22 CO 0.12 0.08 0.06 -1.59 0.23 0.00 0.00 176.35 175.26 2jgl s LYS 23 N -3.01 3.84 0.25 1.70 0.00 -1.26 -1.16 119.74 120.09 2jgl s LYS 23 Ca 0.31 -0.40 0.06 0.00 0.00 0.00 0.00 55.97 55.94 2jgl s LYS 23 Cb -0.10 -3.25 -0.03 0.00 0.00 0.00 0.00 37.83 34.44 2jgl s LYS 23 CO 0.24 0.09 0.30 0.00 0.00 0.00 0.00 175.35 175.98 2jgl s ALA 24 N 0.86 3.80 0.49 0.59 0.00 0.21 -4.97 121.76 122.74 2jgl s ALA 24 Ca 0.04 -1.31 0.14 0.00 0.00 0.00 0.00 51.96 50.82 2jgl s ALA 24 Cb -0.14 -1.55 1.16 0.00 0.00 0.00 0.00 23.12 22.59 2jgl s ALA 24 CO 0.02 0.24 2.12 -1.35 0.00 0.00 0.00 175.76 176.79 2jgl h PRO 25 N 1.29 0.15 -0.23 0.00 0.11 -1.97 -2.14 132.00 129.21 2jgl h PRO 25 Ca -0.50 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 2jgl h PRO 25 Cb 1.23 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2jgl h PRO 25 CO 0.61 0.10 -0.02 0.41 -0.21 0.00 0.00 178.00 178.89 2jgl n GLY 26 N -1.53 4.38 0.00 -0.55 0.00 -1.26 -5.05 105.19 101.18 2jgl n GLY 26 Ca -0.01 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2jgl n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jgl n GLY 27 N -0.81 1.26 3.88 -0.02 0.00 -0.80 -5.06 105.19 103.65 2jgl n GLY 27 Ca 0.23 -1.35 -0.30 0.00 0.00 0.00 0.00 46.02 44.60 2jgl n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jgl s PRO 28 N -1.90 3.72 0.08 1.61 0.04 -1.26 -0.62 135.00 136.67 2jgl s PRO 28 Ca 0.00 0.37 0.02 0.00 0.04 0.00 0.00 61.00 61.43 2jgl s PRO 28 Cb 0.00 -2.42 -0.03 0.00 0.04 0.00 0.00 34.50 32.09 2jgl s PRO 28 CO 0.00 -0.04 -0.08 0.14 0.04 0.00 0.00 177.00 177.07 2jgl s VAL 29 N -2.40 0.68 -0.27 -0.36 -7.23 -0.31 -3.42 120.40 107.09 2jgl s VAL 29 Ca 0.50 -1.59 -0.12 0.00 -1.81 0.00 0.00 61.98 58.96 2jgl s VAL 29 Cb -0.10 -1.26 -0.05 0.00 0.56 0.00 0.00 36.38 35.53 2jgl s VAL 29 CO 0.33 -0.65 0.23 -0.44 -0.31 0.00 0.00 175.10 174.26 2jgl s SER 30 N -2.44 6.08 -0.13 4.85 0.01 -0.72 -0.72 113.70 120.63 2jgl s SER 30 Ca 0.03 0.06 -0.03 0.00 1.31 0.00 0.00 55.95 57.33 2jgl s SER 30 Cb -0.01 -2.14 -0.03 0.00 0.21 0.00 0.00 66.02 64.05 2jgl s SER 30 CO -0.02 -0.07 -0.03 0.00 0.41 0.00 0.00 173.24 173.53 2jgl s ALA 31 N 1.78 3.08 -0.44 1.44 0.00 0.17 -1.60 121.76 126.21 2jgl s ALA 31 Ca 0.09 -0.82 0.04 0.00 0.00 0.00 0.00 51.96 51.26 2jgl s ALA 31 Cb -0.16 -1.50 0.12 0.00 0.00 0.00 0.00 23.12 21.57 2jgl s ALA 31 CO 0.10 0.36 0.16 -0.06 0.00 0.00 0.00 175.76 176.33 2jgl s PHE 32 N -0.11 3.47 -0.01 0.00 0.40 0.10 -0.65 117.98 121.18 2jgl s PHE 32 Ca 0.03 -3.07 0.01 0.00 -0.60 0.00 0.00 56.93 53.30 2jgl s PHE 32 Cb -0.13 -2.89 -0.04 0.00 0.51 0.00 0.00 43.02 40.48 2jgl s PHE 32 CO 0.02 -0.85 0.01 -0.51 0.70 0.00 0.00 175.22 174.60 2jgl s LEU 33 N 0.30 3.56 -0.14 -0.37 1.43 -0.70 -0.78 118.68 121.98 2jgl s LEU 33 Ca 0.14 0.02 -0.00 0.00 -1.03 0.00 0.00 54.13 53.26 2jgl s LEU 33 Cb -0.22 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 43.97 2jgl s LEU 33 CO -0.04 0.29 0.06 0.61 0.23 0.00 0.00 176.35 177.49 2jgl n GLY 34 N 1.45 0.57 3.67 -3.19 0.00 -1.13 -3.73 105.19 102.82 2jgl n GLY 34 Ca -0.15 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 2jgl n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jgl s ILE 35 N -2.58 4.90 0.09 -0.61 1.01 -0.15 -4.83 121.20 119.03 2jgl s ILE 35 Ca 0.03 1.61 -0.30 0.00 0.00 0.00 0.00 60.65 61.99 2jgl s ILE 35 Cb -0.01 -4.13 -0.05 0.00 0.01 0.00 0.00 42.46 38.28 2jgl s ILE 35 CO 0.03 0.05 1.02 -2.16 0.00 0.00 0.00 174.94 173.88 2jgl s PRO 36 N 2.03 4.61 0.00 2.79 0.04 -1.26 -0.48 135.00 142.73 2jgl s PRO 36 Ca 0.38 1.53 0.05 0.00 0.04 0.00 0.00 61.00 63.00 2jgl s PRO 36 Cb -0.17 -3.38 0.05 0.00 0.04 0.00 0.00 34.50 31.04 2jgl s PRO 36 CO 0.13 0.06 0.69 1.97 0.04 0.00 0.00 177.00 179.88 2jgl n PHE 37 N 3.16 0.01 -3.74 0.56 1.16 -1.07 -4.86 117.46 112.68 2jgl n PHE 37 Ca 0.04 -0.02 -0.13 0.00 -1.87 0.00 0.00 57.45 55.48 2jgl n PHE 37 Cb 0.49 -0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.28 2jgl n PHE 37 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2jgl s ALA 38 N -0.47 -0.81 0.22 1.98 0.00 -1.25 -3.36 121.76 118.08 2jgl s ALA 38 Ca 0.06 0.25 -0.32 0.00 0.00 0.00 0.00 51.96 51.96 2jgl s ALA 38 Cb 0.05 0.18 -0.13 0.00 0.00 0.00 0.00 23.12 23.22 2jgl s ALA 38 CO 0.07 -0.34 1.50 0.39 0.00 0.00 0.00 175.76 177.38 2jgl n GLU 39 N 0.94 2.20 -1.67 0.00 -0.58 -0.35 -4.54 120.64 116.64 2jgl n GLU 39 Ca -0.20 0.79 -0.47 0.00 -0.42 0.00 0.00 57.16 56.86 2jgl n GLU 39 Cb 0.58 -2.50 -0.04 0.00 -0.57 0.00 0.00 31.44 28.90 2jgl n GLU 39 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 2jgl n PRO 40 N 2.54 2.14 -1.34 3.49 -0.02 -1.26 -4.67 135.00 135.88 2jgl n PRO 40 Ca 0.13 0.78 -0.39 0.00 -2.02 0.00 0.00 63.50 61.99 2jgl n PRO 40 Cb 0.32 -2.57 -0.03 0.00 -0.02 0.00 0.00 33.50 31.20 2jgl n PRO 40 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2jgl n PRO 41 N 4.56 3.70 -4.25 0.52 -0.04 -1.26 -4.89 135.00 133.34 2jgl n PRO 41 Ca 0.19 -2.25 -0.26 0.00 -0.04 0.00 0.00 63.50 61.14 2jgl n PRO 41 Cb 0.29 -2.82 -0.08 0.00 -0.04 0.00 0.00 33.50 30.85 2jgl n PRO 41 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2jgl s VAL 42 N 2.13 3.45 0.00 0.52 -7.23 -1.26 -3.43 120.40 114.58 2jgl s VAL 42 Ca 0.69 -1.58 0.00 0.00 -1.81 0.00 0.00 61.98 59.27 2jgl s VAL 42 Cb 0.18 -2.74 0.00 0.00 0.56 0.00 0.00 36.38 34.38 2jgl s VAL 42 CO -0.06 -0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 2jgl n GLY 43 N -0.14 3.27 0.00 2.32 0.00 -1.26 -2.56 105.19 106.82 2jgl n GLY 43 Ca -0.10 -0.14 0.11 0.00 0.00 0.00 0.00 46.02 45.89 2jgl n GLY 43 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jgl n SER 44 N 9.08 0.00 0.03 1.61 3.41 -1.26 -2.38 113.62 124.12 2jgl n SER 44 Ca 0.00 0.36 0.12 0.00 -0.26 0.00 0.00 58.87 59.09 2jgl n SER 44 Cb 0.00 -0.45 0.22 0.00 -0.26 0.00 0.00 64.21 63.72 2jgl n SER 44 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2jgl n ARG 45 N -1.45 0.17 -1.61 4.33 5.12 -1.06 -4.82 116.66 117.35 2jgl n ARG 45 Ca 0.07 0.05 -0.47 0.00 -1.93 0.00 0.00 57.85 55.57 2jgl n ARG 45 Cb 0.24 -1.61 -0.03 0.00 -1.16 0.00 0.00 32.46 29.90 2jgl n ARG 45 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 2jgl n ARG 46 N -1.86 1.45 -0.81 5.56 0.63 -1.00 -1.28 116.66 119.36 2jgl n ARG 46 Ca 0.04 0.52 0.00 0.00 -0.92 0.00 0.00 57.85 57.49 2jgl n ARG 46 Cb 0.40 -2.03 0.00 0.00 0.45 0.00 0.00 32.46 31.27 2jgl n ARG 46 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 2jgl n PHE 47 N 1.35 0.00 -4.03 -0.14 3.72 -1.26 -4.95 117.46 112.15 2jgl n PHE 47 Ca 0.13 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.26 2jgl n PHE 47 Cb 0.28 -0.61 -0.05 0.00 -0.94 0.00 0.00 39.48 38.16 2jgl n PHE 47 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 2jgl s MET 48 N -0.42 3.07 0.39 -1.08 -1.94 -0.40 -4.27 119.30 114.65 2jgl s MET 48 Ca 0.00 -0.76 -0.25 0.00 -1.71 0.00 0.00 55.69 52.97 2jgl s MET 48 Cb 0.00 -2.76 -0.11 0.00 2.01 0.00 0.00 34.83 33.97 2jgl s MET 48 CO 0.00 0.51 1.03 -0.35 -0.01 0.00 0.00 175.02 176.20 2jgl n PRO 49 N -0.30 1.43 -2.24 2.03 -0.04 -1.26 -4.93 135.00 129.68 2jgl n PRO 49 Ca -0.08 0.51 -0.38 0.00 -0.04 0.00 0.00 63.50 63.51 2jgl n PRO 49 Cb 0.54 -2.03 -0.01 0.00 -0.04 0.00 0.00 33.50 31.96 2jgl n PRO 49 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2jgl s PRO 50 N -1.91 3.93 0.01 0.54 0.04 -1.26 -5.05 135.00 131.31 2jgl s PRO 50 Ca 0.61 1.86 0.02 0.00 0.04 0.00 0.00 61.00 63.54 2jgl s PRO 50 Cb -0.59 -2.59 -0.04 0.00 0.04 0.00 0.00 34.50 31.32 2jgl s PRO 50 CO 0.58 -0.43 -0.00 -1.21 0.04 0.00 0.00 177.00 175.98 2jgl s GLU 51 N -2.43 2.74 0.33 4.56 2.02 -1.26 -5.03 118.70 119.63 2jgl s GLU 51 Ca 0.59 -0.65 -0.28 0.00 0.02 0.00 0.00 54.97 54.65 2jgl s GLU 51 Cb -0.31 -2.64 -0.12 0.00 0.10 0.00 0.00 34.13 31.15 2jgl s GLU 51 CO 0.39 0.61 1.30 -0.35 0.02 0.00 0.00 175.26 177.23 2jgl n PRO 52 N 1.31 2.11 -1.98 0.39 -0.04 -1.26 -1.21 135.00 134.31 2jgl n PRO 52 Ca -0.14 0.74 -0.42 0.00 -0.04 0.00 0.00 63.50 63.64 2jgl n PRO 52 Cb 0.53 -2.33 -0.03 0.00 -0.04 0.00 0.00 33.50 31.63 2jgl n PRO 52 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2jgl s LYS 53 N -1.70 4.24 0.44 0.54 2.47 -1.21 -4.16 119.74 120.36 2jgl s LYS 53 Ca 0.57 2.31 -0.25 0.00 -1.56 0.00 0.00 55.97 57.04 2jgl s LYS 53 Cb -0.58 -3.15 -0.08 0.00 -1.46 0.00 0.00 37.83 32.56 2jgl s LYS 53 CO 0.61 -0.53 1.30 1.03 0.16 0.00 0.00 175.35 177.91 2jgl s ARG 54 N 0.72 3.77 0.71 4.03 0.52 -1.26 -4.90 118.95 122.53 2jgl s ARG 54 Ca 0.66 2.12 -0.16 0.00 -0.52 0.00 0.00 55.73 57.83 2jgl s ARG 54 Cb -0.42 -2.60 -0.04 0.00 0.52 0.00 0.00 34.95 32.41 2jgl s ARG 54 CO 0.34 -0.65 0.59 -2.30 0.02 0.00 0.00 175.30 173.31 2jgl n PRO 55 N -0.20 0.36 -4.34 3.54 -0.02 -1.26 -5.01 135.00 128.06 2jgl n PRO 55 Ca 0.06 0.16 -0.18 0.00 -2.02 0.00 0.00 63.50 61.52 2jgl n PRO 55 Cb 0.44 -1.87 -0.10 0.00 -0.02 0.00 0.00 33.50 31.95 2jgl n PRO 55 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 2jgl s TRP 56 N -1.87 1.61 0.11 6.00 -2.14 -0.10 -5.05 118.94 117.50 2jgl s TRP 56 Ca 0.67 -0.90 0.03 0.00 2.66 0.00 0.00 56.10 58.56 2jgl s TRP 56 Cb -0.36 -0.93 -0.04 0.00 -3.10 0.00 0.00 33.47 29.04 2jgl s TRP 56 CO 0.56 -0.01 0.14 -1.54 -2.66 0.00 0.00 176.95 173.45 2jgl s SER 57 N -3.32 5.77 0.48 -2.66 1.04 -1.26 -4.58 113.70 109.16 2jgl s SER 57 Ca 0.29 0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.74 2jgl s SER 57 Cb 0.06 -1.60 0.00 0.00 0.10 0.00 0.00 66.02 64.57 2jgl s SER 57 CO 0.09 0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.05 2jgl n GLY 58 N 0.08 0.42 3.08 7.32 0.00 -1.26 -4.63 105.19 110.20 2jgl n GLY 58 Ca -0.08 -0.85 -0.33 0.00 0.00 0.00 0.00 46.02 44.77 2jgl n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jgl s VAL 59 N 0.00 2.52 0.11 1.61 1.01 -1.26 -3.73 120.40 120.66 2jgl s VAL 59 Ca 0.00 -1.87 -0.31 0.00 0.00 0.00 0.00 61.98 59.80 2jgl s VAL 59 Cb 0.00 -2.63 -0.09 0.00 0.00 0.00 0.00 36.38 33.66 2jgl s VAL 59 CO 0.00 -0.31 1.55 -0.22 0.00 0.00 0.00 175.10 176.12 2jgl s LEU 60 N 1.07 4.36 -0.36 3.92 2.96 -0.01 -4.83 118.68 125.79 2jgl s LEU 60 Ca 0.00 2.48 -0.29 0.00 -0.22 0.00 0.00 54.13 56.11 2jgl s LEU 60 Cb -0.20 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 42.92 2jgl s LEU 60 CO -0.05 -0.81 1.27 -0.62 -1.32 0.00 0.00 176.35 174.82 2jgl s ASP 61 N 1.59 6.62 -0.49 3.68 3.68 -1.26 -1.52 116.67 128.98 2jgl s ASP 61 Ca 0.70 0.96 0.07 0.00 2.13 0.00 0.00 52.55 56.41 2jgl s ASP 61 Cb -0.40 -2.54 0.37 0.00 -1.45 0.00 0.00 42.92 38.90 2jgl s ASP 61 CO 0.31 -1.17 0.96 0.00 0.13 0.00 0.00 175.17 175.41 2jgl n ALA 62 N 7.84 4.30 0.09 3.66 0.00 -0.28 -4.75 120.51 131.38 2jgl n ALA 62 Ca 0.14 -4.28 0.01 0.00 0.00 0.00 0.00 53.44 49.31 2jgl n ALA 62 Cb 0.47 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.21 2jgl n ALA 62 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2jgl n THR 63 N -0.22 0.00 -3.97 0.00 -2.24 -1.24 -1.73 114.28 104.88 2jgl n THR 63 Ca 0.31 -0.49 -0.09 0.00 -2.27 0.00 0.00 64.05 61.50 2jgl n THR 63 Cb 0.54 1.04 -0.11 0.00 -2.10 0.00 0.00 70.33 69.70 2jgl n THR 63 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2jgl s THR 64 N -0.38 0.10 0.43 4.28 -1.32 -1.26 -4.86 115.64 112.65 2jgl s THR 64 Ca 0.02 -0.86 -0.25 0.00 -1.21 0.00 0.00 61.69 59.39 2jgl s THR 64 Cb 0.02 -0.26 -0.08 0.00 -1.51 0.00 0.00 72.50 70.67 2jgl s THR 64 CO 0.04 -0.47 1.30 -0.36 -2.21 0.00 0.00 174.62 172.92 2jgl s PHE 65 N -1.39 2.73 0.58 9.09 0.08 -1.26 -3.49 117.98 124.32 2jgl s PHE 65 Ca -0.15 1.41 -0.06 0.00 0.12 0.00 0.00 56.93 58.25 2jgl s PHE 65 Cb -0.09 -3.67 0.13 0.00 -0.57 0.00 0.00 43.02 38.82 2jgl s PHE 65 CO -0.01 -2.18 0.79 1.04 -0.10 0.00 0.00 175.22 174.76 2jgl n GLN 66 N -0.13 -0.41 -1.75 0.44 1.13 -1.26 -4.91 117.38 110.48 2jgl n GLN 66 Ca 0.05 -1.58 -0.37 0.00 -1.94 0.00 0.00 57.00 53.16 2jgl n GLN 66 Cb 0.44 -0.70 0.06 0.00 0.11 0.00 0.00 30.24 30.15 2jgl n GLN 66 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2jgl s ASN 67 N -4.02 4.79 0.11 1.08 0.01 -1.26 -4.79 114.94 110.87 2jgl s ASN 67 Ca 0.48 2.67 -0.28 0.00 -0.71 0.00 0.00 52.86 55.02 2jgl s ASN 67 Cb -0.02 -2.62 -0.06 0.00 0.41 0.00 0.00 41.25 38.95 2jgl s ASN 67 CO 0.33 -1.88 0.86 -0.69 -1.51 0.00 0.00 177.10 174.21 2jgl s VAL 68 N -1.37 4.50 0.34 1.60 1.01 -0.19 -4.69 120.40 121.60 2jgl s VAL 68 Ca 0.80 1.86 -0.28 0.00 0.00 0.00 0.00 61.98 64.36 2jgl s VAL 68 Cb -0.38 -4.22 -0.13 0.00 0.00 0.00 0.00 36.38 31.65 2jgl s VAL 68 CO 0.42 0.39 1.20 0.00 0.00 0.00 0.00 175.10 177.11 2jgl n TYR 70 N 0.25 2.49 -3.73 0.00 9.36 -0.81 -4.66 117.16 120.06 2jgl n TYR 70 Ca 0.06 -0.33 -0.12 0.00 3.32 0.00 0.00 57.90 60.84 2jgl n TYR 70 Cb 0.35 -2.79 -0.07 0.00 -0.63 0.00 0.00 39.34 36.21 2jgl n TYR 70 CO 0.00 0.00 0.00 1.14 0.22 0.00 0.00 176.86 178.22 2jgl s GLN 71 N 4.39 0.85 0.33 2.98 -2.07 -1.26 -4.68 119.66 120.20 2jgl s GLN 71 Ca 0.89 -0.52 -0.28 0.00 -1.82 0.00 0.00 55.36 53.64 2jgl s GLN 71 Cb -0.47 0.37 -0.13 0.00 -1.09 0.00 0.00 33.01 31.69 2jgl s GLN 71 CO 0.43 -0.28 1.26 0.98 -1.32 0.00 0.00 175.29 176.36 2jgl n TYR 72 N 0.47 2.16 -4.75 9.60 4.19 -1.26 -5.01 117.16 122.57 2jgl n TYR 72 Ca -0.18 0.57 -0.33 0.00 3.31 0.00 0.00 57.90 61.27 2jgl n TYR 72 Cb 0.60 -2.40 -0.13 0.00 0.49 0.00 0.00 39.34 37.90 2jgl n TYR 72 CO 0.00 0.00 0.00 0.08 0.91 0.00 0.00 176.86 177.85 2jgl s VAL 73 N -1.08 3.22 0.15 2.97 1.01 -1.26 -4.86 120.40 120.56 2jgl s VAL 73 Ca 0.56 -0.63 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 2jgl s VAL 73 Cb -0.59 -2.33 -0.07 0.00 0.00 0.00 0.00 36.38 33.39 2jgl s VAL 73 CO 0.62 0.55 1.16 -0.62 0.00 0.00 0.00 175.10 176.80 2jgl s ASP 74 N -0.11 7.16 0.00 3.32 -1.08 -1.26 -4.91 116.67 119.78 2jgl s ASP 74 Ca -0.01 2.11 0.00 0.00 -0.52 0.00 0.00 52.55 54.13 2jgl s ASP 74 Cb -0.14 -2.60 0.00 0.00 -1.46 0.00 0.00 42.92 38.73 2jgl s ASP 74 CO 0.03 -0.34 0.37 0.35 0.52 0.00 0.00 175.17 176.11 2jgl n THR 75 N 2.84 0.14 -0.33 1.71 -2.24 -1.26 -4.84 114.28 110.29 2jgl n THR 75 Ca 0.05 -0.27 0.18 0.00 -2.27 0.00 0.00 64.05 61.75 2jgl n THR 75 Cb 0.46 1.33 0.42 0.00 -2.10 0.00 0.00 70.33 70.44 2jgl n THR 75 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2jgl h LEU 76 N 0.00 0.60 -6.25 3.22 5.85 -2.02 -3.31 115.31 113.40 2jgl h LEU 76 Ca 0.00 0.10 -0.58 0.00 0.84 0.00 0.00 57.88 58.24 2jgl h LEU 76 Cb 0.47 0.00 -0.39 0.00 0.37 0.00 0.00 40.66 41.11 2jgl h LEU 76 CO 0.00 0.15 -0.94 -1.22 -0.34 0.00 0.00 178.44 176.09 2jgl n TYR 77 N -4.73 0.45 -1.68 1.25 4.01 -1.26 -5.12 117.16 110.08 2jgl n TYR 77 Ca 0.25 -3.65 -0.46 0.00 -0.16 0.00 0.00 57.90 53.88 2jgl n TYR 77 Cb 0.75 -0.22 -0.04 0.00 -0.31 0.00 0.00 39.34 39.51 2jgl n TYR 77 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2jgl n PRO 78 N 1.81 2.24 -0.98 -0.72 -0.02 -1.25 -2.45 135.00 133.63 2jgl n PRO 78 Ca 0.25 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.54 2jgl n PRO 78 Cb 0.48 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 2jgl n PRO 78 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgl n GLY 79 N 3.67 0.67 3.62 -1.23 0.00 -1.26 -5.02 105.19 105.63 2jgl n GLY 79 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 2jgl n GLY 79 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jgl s PHE 80 N -2.65 3.27 0.47 1.61 5.36 -1.03 -4.96 117.98 120.06 2jgl s PHE 80 Ca 0.00 0.72 0.19 0.00 -0.96 0.00 0.00 56.93 56.88 2jgl s PHE 80 Cb 0.00 -2.78 1.19 0.00 -0.34 0.00 0.00 43.02 41.09 2jgl s PHE 80 CO 0.00 -0.30 1.97 1.49 -1.46 0.00 0.00 175.22 176.92 2jgl h GLU 81 N 7.95 0.24 0.00 10.12 4.57 -1.95 -0.53 114.58 134.97 2jgl h GLU 81 Ca -0.28 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 57.87 2jgl h GLU 81 Cb 1.13 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 29.67 2jgl h GLU 81 CO 0.74 0.16 -0.08 0.78 -1.18 0.00 0.00 179.01 179.43 2jgl h GLY 82 N 0.24 0.00 0.00 1.92 0.00 -1.93 -2.07 103.07 101.24 2jgl h GLY 82 Ca 0.30 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.35 2jgl h GLY 82 CO -0.06 0.00 -2.04 -1.30 0.00 0.00 0.00 176.54 173.14 2jgl n THR 83 N -4.10 1.04 0.24 4.70 -2.24 -0.62 -4.60 114.28 108.71 2jgl n THR 83 Ca -0.03 -0.60 0.12 0.00 -2.27 0.00 0.00 64.05 61.27 2jgl n THR 83 Cb 0.16 -0.71 0.57 0.00 -2.10 0.00 0.00 70.33 68.26 2jgl n THR 83 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2jgl h GLU 84 N 0.00 0.00 0.00 -0.78 4.39 -1.07 -2.47 114.58 114.65 2jgl h GLU 84 Ca -0.41 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.29 2jgl h GLU 84 Cb 1.88 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.53 2jgl h GLU 84 CO 0.01 0.17 0.00 0.00 -1.16 0.00 0.00 179.01 178.03 2jgl h MET 85 N 0.00 0.00 0.00 2.33 -0.00 -1.62 -1.15 114.93 114.49 2jgl h MET 85 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2jgl h MET 85 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.19 2jgl h MET 85 CO 0.02 0.00 -1.05 0.91 -0.00 0.00 0.00 176.91 176.79 2jgl n TRP 86 N -2.82 0.00 -1.94 -0.10 7.02 -0.93 -4.78 117.44 113.88 2jgl n TRP 86 Ca -0.01 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.14 2jgl n TRP 86 Cb 0.14 -0.04 0.02 0.00 -2.42 0.00 0.00 31.31 29.02 2jgl n TRP 86 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 2jgl s ASN 87 N -3.06 5.53 0.29 -0.99 0.01 -0.44 -4.70 114.94 111.59 2jgl s ASN 87 Ca 0.07 1.89 -0.30 0.00 -0.71 0.00 0.00 52.86 53.81 2jgl s ASN 87 Cb 0.15 -2.54 -0.12 0.00 0.41 0.00 0.00 41.25 39.16 2jgl s ASN 87 CO 0.85 -1.34 1.60 -2.65 -1.51 0.00 0.00 177.10 174.05 2jgl n PRO 88 N -2.15 2.70 -0.37 -0.60 -0.02 -1.26 -4.90 135.00 128.40 2jgl n PRO 88 Ca 0.09 0.96 0.09 0.00 -2.02 0.00 0.00 63.50 62.62 2jgl n PRO 88 Cb 0.52 -2.75 0.23 0.00 -0.02 0.00 0.00 33.50 31.49 2jgl n PRO 88 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2jgl n ASN 89 N 2.22 3.57 -3.39 2.55 6.94 -1.26 -4.99 115.26 120.90 2jgl n ASN 89 Ca 0.09 -2.99 -0.15 0.00 -0.02 0.00 0.00 54.58 51.51 2jgl n ASN 89 Cb 0.37 -0.51 -0.05 0.00 -2.36 0.00 0.00 39.78 37.22 2jgl n ASN 89 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2jgl s ARG 90 N -2.77 1.81 0.27 -3.83 1.81 -1.26 -5.08 118.95 109.90 2jgl s ARG 90 Ca 0.39 -1.74 -0.29 0.00 -1.72 0.00 0.00 55.73 52.37 2jgl s ARG 90 Cb 0.32 0.42 -0.10 0.00 -0.45 0.00 0.00 34.95 35.14 2jgl s ARG 90 CO 0.08 -0.73 1.32 -1.21 -0.68 0.00 0.00 175.30 174.07 2jgl s GLU 91 N -3.26 4.37 0.42 3.54 0.41 -1.26 -4.53 118.70 118.38 2jgl s GLU 91 Ca 0.32 2.15 -0.24 0.00 -0.41 0.00 0.00 54.97 56.78 2jgl s GLU 91 Cb 0.00 -3.13 -0.08 0.00 -1.78 0.00 0.00 34.13 29.15 2jgl s GLU 91 CO 0.20 -0.22 1.14 -0.51 -0.49 0.00 0.00 175.26 175.37 2jgl s LEU 92 N -0.94 4.13 -0.11 1.80 1.43 -1.26 -1.02 118.68 122.70 2jgl s LEU 92 Ca 0.53 2.27 -0.30 0.00 -1.03 0.00 0.00 54.13 55.60 2jgl s LEU 92 Cb -0.39 -4.12 0.11 0.00 0.03 0.00 0.00 46.19 41.83 2jgl s LEU 92 CO 0.45 -0.71 0.91 -0.55 0.23 0.00 0.00 176.35 176.68 2jgl s SER 93 N -1.29 -0.44 0.40 2.29 0.15 -0.25 -4.87 113.70 109.70 2jgl s SER 93 Ca 0.59 0.43 0.27 0.00 0.70 0.00 0.00 55.95 57.94 2jgl s SER 93 Cb -0.28 0.37 0.90 0.00 -1.71 0.00 0.00 66.02 65.30 2jgl s SER 93 CO 0.35 -0.44 1.79 -0.33 1.20 0.00 0.00 173.24 175.81 2jgl h GLU 94 N 2.60 0.00 -5.34 5.44 5.08 -1.94 -2.16 114.58 118.26 2jgl h GLU 94 Ca -0.21 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.50 2jgl h GLU 94 Cb 1.17 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.26 2jgl h GLU 94 CO 0.33 0.00 0.87 0.34 -1.00 0.00 0.00 179.01 179.55 2jgl s ASP 95 N -5.37 6.47 0.00 1.42 -1.08 -1.26 -4.23 116.67 112.63 2jgl s ASP 95 Ca 0.05 -1.63 0.00 0.00 -0.52 0.00 0.00 52.55 50.45 2jgl s ASP 95 Cb 0.08 -2.44 0.00 0.00 -1.46 0.00 0.00 42.92 39.11 2jgl s ASP 95 CO 0.56 -1.26 0.20 0.00 0.52 0.00 0.00 175.17 175.19 2jgl s LEU 97 N 0.00 4.02 0.03 0.00 1.43 -1.26 -4.60 118.68 118.30 2jgl s LEU 97 Ca 0.00 -2.36 0.02 0.00 -1.03 0.00 0.00 54.13 50.76 2jgl s LEU 97 Cb 0.00 -2.54 -0.02 0.00 0.03 0.00 0.00 46.19 43.66 2jgl s LEU 97 CO 0.00 -1.15 -0.07 -0.31 0.23 0.00 0.00 176.35 175.05 2jgl s TYR 98 N 3.88 0.60 0.28 0.29 2.02 -1.26 -2.59 117.35 120.57 2jgl s TYR 98 Ca 0.50 -0.41 0.12 0.00 -0.37 0.00 0.00 57.07 56.91 2jgl s TYR 98 Cb 0.02 -0.37 -0.05 0.00 -0.40 0.00 0.00 41.96 41.16 2jgl s TYR 98 CO 0.03 -0.07 -0.20 -0.48 -1.57 0.00 0.00 175.55 173.26 2jgl s LEU 99 N -1.27 2.59 0.11 -1.29 0.05 0.37 -0.98 118.68 118.27 2jgl s LEU 99 Ca -0.08 -1.03 0.10 0.00 0.05 0.00 0.00 54.13 53.17 2jgl s LEU 99 Cb -0.08 -1.10 -0.04 0.00 -2.05 0.00 0.00 46.19 42.92 2jgl s LEU 99 CO 0.00 0.04 -0.27 0.20 -0.55 0.00 0.00 176.35 175.77 2jgl s ASN 100 N -3.51 3.30 -0.06 1.48 0.01 0.18 -0.98 114.94 115.36 2jgl s ASN 100 Ca 0.30 -0.70 -0.00 0.00 -0.71 0.00 0.00 52.86 51.75 2jgl s ASN 100 Cb -0.05 -0.25 0.03 0.00 0.41 0.00 0.00 41.25 41.39 2jgl s ASN 100 CO 0.15 0.20 -0.02 -0.69 -1.51 0.00 0.00 177.10 175.23 2jgl s VAL 101 N -0.99 0.46 -0.10 1.60 1.01 0.04 -1.00 120.40 121.42 2jgl s VAL 101 Ca 0.13 0.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 2jgl s VAL 101 Cb -0.10 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 2jgl s VAL 101 CO 0.05 0.25 -0.02 0.26 0.00 0.00 0.00 175.10 175.64 2jgl s TRP 102 N 1.52 3.10 0.21 5.22 0.51 -0.30 0.03 118.94 129.23 2jgl s TRP 102 Ca -0.02 0.06 0.03 0.00 -2.12 0.00 0.00 56.10 54.05 2jgl s TRP 102 Cb -0.13 -1.82 -0.05 0.00 -0.81 0.00 0.00 33.47 30.66 2jgl s TRP 102 CO -0.03 0.33 -0.00 0.95 -0.51 0.00 0.00 176.95 177.68 2jgl s THR 103 N -0.55 0.91 0.84 2.01 -4.23 -0.63 -1.07 115.64 112.93 2jgl s THR 103 Ca 0.09 -2.02 -0.11 0.00 -1.18 0.00 0.00 61.69 58.48 2jgl s THR 103 Cb -0.12 -2.25 0.10 0.00 1.34 0.00 0.00 72.50 71.57 2jgl s THR 103 CO 0.02 -0.38 1.13 -2.16 -0.54 0.00 0.00 174.62 172.69 2jgl s PRO 104 N -3.88 1.58 -0.22 3.99 0.04 -1.26 -1.75 135.00 133.50 2jgl s PRO 104 Ca 0.27 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.73 2jgl s PRO 104 Cb 0.06 -1.80 0.03 0.00 0.04 0.00 0.00 34.50 32.82 2jgl s PRO 104 CO 0.07 -2.19 -0.13 -0.47 0.04 0.00 0.00 177.00 174.32 2jgl s TYR 105 N -2.70 2.97 0.92 0.56 5.04 -1.22 -2.83 117.35 120.09 2jgl s TYR 105 Ca 0.65 -1.67 -0.12 0.00 -2.44 0.00 0.00 57.07 53.49 2jgl s TYR 105 Cb -0.21 -1.98 0.14 0.00 0.35 0.00 0.00 41.96 40.26 2jgl s TYR 105 CO 0.56 -0.77 1.10 -1.25 -1.34 0.00 0.00 175.55 173.85 2jgl s PRO 106 N 1.28 1.09 0.45 4.97 0.04 -1.26 -4.78 135.00 136.79 2jgl s PRO 106 Ca 0.01 0.55 -0.23 0.00 0.04 0.00 0.00 61.00 61.37 2jgl s PRO 106 Cb -0.15 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.50 2jgl s PRO 106 CO -0.08 -2.29 1.20 -0.98 0.04 0.00 0.00 177.00 174.89 2jgl s ARG 107 N -5.07 3.76 0.15 4.56 1.70 -1.13 -4.87 118.95 118.05 2jgl s ARG 107 Ca 0.64 1.86 -0.34 0.00 -0.47 0.00 0.00 55.73 57.42 2jgl s ARG 107 Cb -0.17 -2.46 -0.16 0.00 -0.57 0.00 0.00 34.95 31.59 2jgl s ARG 107 CO 0.56 -0.57 1.27 -2.30 -1.08 0.00 0.00 175.30 173.17 2jgl n PRO 108 N -0.40 1.31 -0.17 3.89 -0.02 -1.26 -4.91 135.00 133.44 2jgl n PRO 108 Ca 0.07 0.47 -0.09 0.00 -2.02 0.00 0.00 63.50 61.92 2jgl n PRO 108 Cb 0.47 -2.04 0.04 0.00 -0.02 0.00 0.00 33.50 31.94 2jgl n PRO 108 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jgl h ALA 109 N 3.96 0.81 -2.82 3.55 0.00 -1.93 -3.45 119.26 119.38 2jgl h ALA 109 Ca -0.45 -0.34 -0.61 0.00 0.00 0.00 0.00 54.91 53.51 2jgl h ALA 109 Cb 1.33 -0.20 -0.13 0.00 0.00 0.00 0.00 17.79 18.79 2jgl h ALA 109 CO 0.74 0.66 -0.71 -1.54 0.00 0.00 0.00 179.25 178.40 2jgl s SER 110 N -6.65 4.27 -0.44 0.00 1.04 -1.26 -5.09 113.70 105.57 2jgl s SER 110 Ca -0.11 -0.61 -0.43 0.00 0.48 0.00 0.00 55.95 55.27 2jgl s SER 110 Cb 0.13 -0.72 -0.18 0.00 0.10 0.00 0.00 66.02 65.35 2jgl s SER 110 CO 0.86 0.08 1.88 -2.65 0.98 0.00 0.00 173.24 174.39 2jgl n PRO 111 N -0.16 0.34 -4.34 4.02 -0.02 -1.26 -4.90 135.00 128.67 2jgl n PRO 111 Ca -0.10 0.11 -0.34 0.00 -2.02 0.00 0.00 63.50 61.15 2jgl n PRO 111 Cb 0.56 -1.72 -0.11 0.00 -0.02 0.00 0.00 33.50 32.21 2jgl n PRO 111 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2jgl s THR 112 N 4.64 4.18 0.08 3.45 2.01 -0.10 -4.66 115.64 125.24 2jgl s THR 112 Ca 1.09 -0.27 -0.36 0.00 0.31 0.00 0.00 61.69 62.47 2jgl s THR 112 Cb -1.35 -2.81 -0.19 0.00 0.01 0.00 0.00 72.50 68.17 2jgl s THR 112 CO 0.70 0.54 0.92 -2.65 -0.69 0.00 0.00 174.62 173.43 2jgl n PRO 113 N 2.90 0.13 -4.02 4.92 -0.02 -1.26 -0.26 135.00 137.38 2jgl n PRO 113 Ca -0.18 0.04 -0.36 0.00 -2.02 0.00 0.00 63.50 60.99 2jgl n PRO 113 Cb 0.53 -1.39 -0.08 0.00 -0.02 0.00 0.00 33.50 32.53 2jgl n PRO 113 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2jgl s VAL 114 N -0.31 5.00 -0.17 -1.45 1.01 -0.07 -3.08 120.40 121.33 2jgl s VAL 114 Ca 0.81 0.03 -0.03 0.00 0.00 0.00 0.00 61.98 62.79 2jgl s VAL 114 Cb -1.12 -3.19 -0.02 0.00 0.00 0.00 0.00 36.38 32.05 2jgl s VAL 114 CO 0.56 0.56 -0.06 -0.76 0.00 0.00 0.00 175.10 175.40 2jgl s LEU 115 N -0.48 3.03 -0.26 3.92 1.02 -0.17 -1.08 118.68 124.65 2jgl s LEU 115 Ca 0.11 -0.26 -0.07 0.00 0.02 0.00 0.00 54.13 53.93 2jgl s LEU 115 Cb -0.12 -1.73 -0.01 0.00 0.02 0.00 0.00 46.19 44.35 2jgl s LEU 115 CO 0.02 0.10 0.05 -0.63 0.02 0.00 0.00 176.35 175.92 2jgl s ILE 116 N 0.74 4.03 -0.04 -0.59 1.01 0.12 0.04 121.20 126.49 2jgl s ILE 116 Ca -0.03 -0.42 -0.19 0.00 0.00 0.00 0.00 60.65 60.02 2jgl s ILE 116 Cb -0.15 -2.95 -0.05 0.00 0.01 0.00 0.00 42.46 39.33 2jgl s ILE 116 CO 0.02 0.26 0.52 0.86 0.00 0.00 0.00 174.94 176.60 2jgl s TRP 117 N 1.55 3.63 -0.24 3.97 -0.11 0.51 -1.09 118.94 127.16 2jgl s TRP 117 Ca 0.05 1.05 0.02 0.00 1.22 0.00 0.00 56.10 58.44 2jgl s TRP 117 Cb -0.16 -2.53 0.05 0.00 -1.50 0.00 0.00 33.47 29.33 2jgl s TRP 117 CO 0.02 0.33 -0.11 0.42 -4.62 0.00 0.00 176.95 172.99 2jgl s ILE 118 N -0.05 1.99 0.96 5.86 1.01 -0.78 -3.79 121.20 126.41 2jgl s ILE 118 Ca 0.28 -1.41 -0.11 0.00 0.00 0.00 0.00 60.65 59.40 2jgl s ILE 118 Cb -0.17 -2.08 0.17 0.00 0.01 0.00 0.00 42.46 40.38 2jgl s ILE 118 CO 0.14 0.06 1.09 -0.72 0.00 0.00 0.00 174.94 175.50 2jgl s TYR 119 N 1.20 1.95 0.00 3.97 -0.85 -1.26 -3.57 117.35 118.80 2jgl s TYR 119 Ca -0.06 1.35 0.00 0.00 -0.52 0.00 0.00 57.07 57.84 2jgl s TYR 119 Cb -0.18 -3.18 0.00 0.00 0.38 0.00 0.00 41.96 38.97 2jgl s TYR 119 CO -0.07 -2.82 0.00 0.41 -1.52 0.00 0.00 175.55 171.56 2jgl n GLY 120 N -0.41 2.34 0.00 5.49 0.00 -1.17 -2.55 105.19 108.88 2jgl n GLY 120 Ca 0.07 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.99 2jgl n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jgl n GLY 121 N 5.00 1.52 2.49 -0.02 0.00 -1.26 -4.11 105.19 108.81 2jgl n GLY 121 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2jgl n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jgl n GLY 122 N 0.00 1.10 2.76 -0.02 0.00 -1.26 -0.74 105.19 107.03 2jgl n GLY 122 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2jgl n GLY 122 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jgl n PHE 123 N -2.97 0.00 0.05 1.61 3.72 -1.26 -4.78 117.46 113.83 2jgl n PHE 123 Ca -0.20 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.20 2jgl n PHE 123 Cb 0.65 -1.51 -0.01 0.00 -0.94 0.00 0.00 39.48 37.67 2jgl n PHE 123 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 2jgl n TYR 124 N -2.24 0.00 -4.03 1.38 0.18 0.08 -0.56 117.16 111.97 2jgl n TYR 124 Ca 0.00 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.65 2jgl n TYR 124 Cb 0.38 -0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.30 2jgl n TYR 124 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 2jgl s SER 125 N -1.25 0.73 0.00 9.48 1.04 -0.17 -4.05 113.70 119.49 2jgl s SER 125 Ca 0.00 -1.42 0.00 0.00 0.48 0.00 0.00 55.95 55.02 2jgl s SER 125 Cb 0.01 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.84 2jgl s SER 125 CO 0.05 -1.39 0.00 0.61 0.98 0.00 0.00 173.24 173.50 2jgl n GLY 126 N -0.56 3.21 3.54 7.32 0.00 -1.26 -4.16 105.19 113.29 2jgl n GLY 126 Ca -0.01 -1.94 -0.16 0.00 0.00 0.00 0.00 46.02 43.90 2jgl n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jgl s ALA 127 N -2.50 -1.80 -2.02 4.61 0.00 -1.26 -4.68 121.76 114.11 2jgl s ALA 127 Ca 0.00 1.45 0.20 0.00 0.00 0.00 0.00 51.96 53.61 2jgl s ALA 127 Cb 0.00 -0.26 1.19 0.00 0.00 0.00 0.00 23.12 24.05 2jgl s ALA 127 CO 0.00 -0.36 1.77 0.00 0.00 0.00 0.00 175.76 177.17 2jgl n ALA 128 N 1.13 2.62 0.71 0.00 0.00 -1.26 -3.55 120.51 120.15 2jgl n ALA 128 Ca -0.17 -0.15 0.08 0.00 0.00 0.00 0.00 53.44 53.21 2jgl n ALA 128 Cb 0.57 -1.32 0.06 0.00 0.00 0.00 0.00 19.45 18.76 2jgl n ALA 128 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2jgl n SER 129 N -0.76 2.28 -4.75 0.00 3.41 -1.26 -4.88 113.62 107.66 2jgl n SER 129 Ca 0.15 -1.64 -0.38 0.00 -0.26 0.00 0.00 58.87 56.75 2jgl n SER 129 Cb 0.08 0.08 0.04 0.00 -0.26 0.00 0.00 64.21 64.16 2jgl n SER 129 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2jgl s LEU 130 N -1.52 3.78 0.42 1.04 1.43 -1.23 -4.90 118.68 117.70 2jgl s LEU 130 Ca 0.19 2.65 0.11 0.00 -1.03 0.00 0.00 54.13 56.05 2jgl s LEU 130 Cb 0.14 -4.39 0.96 0.00 0.03 0.00 0.00 46.19 42.94 2jgl s LEU 130 CO 0.25 -1.62 2.01 0.44 0.23 0.00 0.00 176.35 177.66 2jgl h ASP 131 N 1.24 0.41 0.53 2.29 3.32 -1.94 -2.33 116.42 119.93 2jgl h ASP 131 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 2jgl h ASP 131 Cb 1.30 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2jgl h ASP 131 CO 0.56 0.27 0.00 1.33 -1.72 0.00 0.00 179.24 179.68 2jgl n VAL 132 N -4.47 1.00 -0.94 -1.35 0.24 -1.26 -2.32 118.33 109.22 2jgl n VAL 132 Ca 0.07 0.27 0.08 0.00 -2.04 0.00 0.00 64.34 62.72 2jgl n VAL 132 Cb 0.25 -1.09 0.29 0.00 -1.47 0.00 0.00 33.84 31.83 2jgl n VAL 132 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2jgl n TYR 133 N -1.75 1.21 -2.01 6.34 4.01 -0.88 -4.46 117.16 119.63 2jgl n TYR 133 Ca 0.03 -0.82 -0.43 0.00 -0.16 0.00 0.00 57.90 56.52 2jgl n TYR 133 Cb 0.18 -0.35 -0.03 0.00 -0.31 0.00 0.00 39.34 38.83 2jgl n TYR 133 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2jgl s ASP 134 N -1.61 6.26 0.00 7.72 -1.08 -0.98 -4.89 116.67 122.09 2jgl s ASP 134 Ca 0.45 1.75 0.23 0.00 -0.52 0.00 0.00 52.55 54.45 2jgl s ASP 134 Cb 0.35 -2.53 1.27 0.00 -1.46 0.00 0.00 42.92 40.55 2jgl s ASP 134 CO 0.11 -1.34 1.83 0.61 0.52 0.00 0.00 175.17 176.90 2jgl n GLY 135 N 4.81 -0.82 0.26 2.66 0.00 -1.26 -4.25 105.19 106.58 2jgl n GLY 135 Ca 0.20 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 2jgl n GLY 135 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2jgl h ARG 136 N 0.33 0.87 -0.09 1.61 0.11 -1.90 -2.48 114.38 112.84 2jgl h ARG 136 Ca 0.00 -0.20 -0.01 0.00 0.10 0.00 0.00 59.98 59.88 2jgl h ARG 136 Cb 0.07 -0.12 -0.00 0.00 1.11 0.00 0.00 29.97 31.03 2jgl h ARG 136 CO 0.00 0.80 0.03 0.74 0.10 0.00 0.00 179.97 181.64 2jgl h PHE 137 N 0.78 0.14 -0.38 4.08 0.04 -1.78 -0.13 116.94 119.68 2jgl h PHE 137 Ca 0.18 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.90 2jgl h PHE 137 Cb 0.30 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 2jgl h PHE 137 CO 0.02 0.28 0.09 -0.07 -0.60 0.00 0.00 178.31 178.04 2jgl h LEU 138 N -0.05 0.50 -0.22 1.54 3.38 -1.70 0.16 115.31 118.92 2jgl h LEU 138 Ca 0.03 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2jgl h LEU 138 Cb 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2jgl h LEU 138 CO -0.00 0.51 -0.08 0.00 0.09 0.00 0.00 178.44 178.96 2jgl h ALA 139 N 1.57 0.30 0.30 1.53 0.00 -1.16 -2.33 119.26 119.47 2jgl h ALA 139 Ca 0.13 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2jgl h ALA 139 Cb 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2jgl h ALA 139 CO -0.00 0.11 -0.14 0.37 0.00 0.00 0.00 179.25 179.58 2jgl h GLN 140 N 0.15 -0.39 -0.33 0.00 -0.00 -0.54 -1.54 115.11 112.47 2jgl h GLN 140 Ca 0.05 0.03 -0.13 0.00 -0.00 0.00 0.00 58.65 58.60 2jgl h GLN 140 Cb 0.55 0.09 -0.01 0.00 0.00 0.00 0.00 27.48 28.11 2jgl h GLN 140 CO 0.03 -0.12 -0.31 0.28 0.00 0.00 0.00 178.83 178.70 2jgl h VAL 141 N -1.02 1.28 -0.01 2.39 2.07 -0.85 -3.31 116.25 116.80 2jgl h VAL 141 Ca -0.04 -1.45 0.00 0.00 0.82 0.00 0.00 66.70 66.03 2jgl h VAL 141 Cb 0.45 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 2jgl h VAL 141 CO 0.07 0.47 -0.20 -0.62 0.02 0.00 0.00 177.57 177.31 2jgl n GLU 142 N -4.07 2.48 -1.75 1.57 -0.58 -0.90 -5.00 120.64 112.39 2jgl n GLU 142 Ca -0.01 -0.47 -0.12 0.00 -0.42 0.00 0.00 57.16 56.14 2jgl n GLU 142 Cb 0.48 -1.01 -0.03 0.00 -0.57 0.00 0.00 31.44 30.31 2jgl n GLU 142 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jgl n GLY 143 N 0.86 0.65 3.76 0.62 0.00 -0.58 -4.99 105.19 105.51 2jgl n GLY 143 Ca 0.03 -0.43 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 2jgl n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jgl s ALA 144 N -2.51 3.32 -0.31 4.61 0.00 -1.05 -4.80 121.76 121.01 2jgl s ALA 144 Ca 0.00 0.57 -0.25 0.00 0.00 0.00 0.00 51.96 52.28 2jgl s ALA 144 Cb 0.00 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.95 2jgl s ALA 144 CO 0.00 0.21 0.85 0.08 0.00 0.00 0.00 175.76 176.90 2jgl s VAL 145 N -1.29 4.73 -0.19 0.00 1.01 -1.18 -4.04 120.40 119.44 2jgl s VAL 145 Ca 0.43 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.73 2jgl s VAL 145 Cb -0.24 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 31.95 2jgl s VAL 145 CO 0.29 -0.29 -0.16 -0.22 0.00 0.00 0.00 175.10 174.72 2jgl s LEU 146 N 3.10 2.36 -0.06 3.92 0.20 -0.23 -1.00 118.68 126.96 2jgl s LEU 146 Ca 0.35 -0.63 -0.00 0.00 0.69 0.00 0.00 54.13 54.54 2jgl s LEU 146 Cb -0.14 -1.54 -0.03 0.00 -0.43 0.00 0.00 46.19 44.05 2jgl s LEU 146 CO 0.13 -0.01 -0.03 -0.69 -0.29 0.00 0.00 176.35 175.45 2jgl s VAL 147 N 1.32 4.02 -0.00 1.68 1.01 0.11 -1.15 120.40 127.39 2jgl s VAL 147 Ca 0.05 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 2jgl s VAL 147 Cb -0.14 -2.69 -0.00 0.00 0.00 0.00 0.00 36.38 33.55 2jgl s VAL 147 CO -0.11 0.57 0.02 -0.94 0.00 0.00 0.00 175.10 174.64 2jgl s SER 148 N -0.96 0.01 0.23 3.32 1.04 -0.17 -0.36 113.70 116.81 2jgl s SER 148 Ca 0.14 -0.03 0.12 0.00 0.48 0.00 0.00 55.95 56.65 2jgl s SER 148 Cb -0.11 0.05 -0.05 0.00 0.10 0.00 0.00 66.02 66.01 2jgl s SER 148 CO 0.03 -0.05 -0.22 0.00 0.98 0.00 0.00 173.24 173.98 2jgl s MET 149 N -0.20 1.61 0.25 4.02 0.23 -1.25 0.48 119.30 124.44 2jgl s MET 149 Ca -0.02 -1.62 -0.15 0.00 -1.03 0.00 0.00 55.69 52.86 2jgl s MET 149 Cb -0.01 -1.82 -0.08 0.00 -1.53 0.00 0.00 34.83 31.38 2jgl s MET 149 CO -0.00 0.37 0.68 -0.80 -2.03 0.00 0.00 175.02 173.24 2jgl s ASN 150 N -3.04 6.85 0.01 -1.18 0.01 -0.15 -4.50 114.94 112.94 2jgl s ASN 150 Ca 0.25 1.24 -0.01 0.00 -0.71 0.00 0.00 52.86 53.62 2jgl s ASN 150 Cb -0.07 -2.35 -0.01 0.00 0.41 0.00 0.00 41.25 39.23 2jgl s ASN 150 CO 0.12 -0.07 0.01 -0.72 -1.51 0.00 0.00 177.10 174.93 2jgl s TYR 151 N -1.74 0.17 0.23 2.20 1.13 -1.26 -4.50 117.35 113.58 2jgl s TYR 151 Ca 0.47 -0.35 -0.31 0.00 -1.41 0.00 0.00 57.07 55.48 2jgl s TYR 151 Cb -0.13 -0.13 -0.10 0.00 -1.10 0.00 0.00 41.96 40.50 2jgl s TYR 151 CO 0.19 -0.17 1.53 1.03 -2.51 0.00 0.00 175.55 175.62 2jgl s ARG 152 N -1.17 4.21 0.51 -3.49 0.52 -1.26 -4.87 118.95 113.39 2jgl s ARG 152 Ca -0.13 2.40 0.04 0.00 -0.52 0.00 0.00 55.73 57.52 2jgl s ARG 152 Cb -0.08 -3.10 0.00 0.00 0.52 0.00 0.00 34.95 32.30 2jgl s ARG 152 CO -0.00 -0.54 0.21 0.14 0.02 0.00 0.00 175.30 175.12 2jgl s VAL 153 N 0.37 1.55 0.00 3.52 -7.23 -1.26 -3.88 120.40 113.47 2jgl s VAL 153 Ca 0.64 -1.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.08 2jgl s VAL 153 Cb -0.44 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.21 2jgl s VAL 153 CO 0.40 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.80 2jgl n GLY 154 N -1.48 1.57 0.36 2.32 0.00 0.27 -1.57 105.19 106.67 2jgl n GLY 154 Ca -0.09 -0.48 0.04 0.00 0.00 0.00 0.00 46.02 45.50 2jgl n GLY 154 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2jgl h THR 155 N 0.00 1.07 -0.61 2.61 1.35 -1.90 0.14 112.91 115.58 2jgl h THR 155 Ca 0.00 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 2jgl h THR 155 Cb 0.00 0.01 -0.03 0.00 -1.73 0.00 0.00 68.15 66.40 2jgl h THR 155 CO 0.00 0.18 0.39 -0.26 -0.25 0.00 0.00 175.52 175.58 2jgl h PHE 156 N 0.98 0.79 0.00 4.73 0.04 -1.85 -2.00 116.94 119.63 2jgl h PHE 156 Ca 0.36 0.01 -0.26 0.00 2.80 0.00 0.00 57.97 60.88 2jgl h PHE 156 Cb 0.17 -0.26 -0.04 0.00 2.20 0.00 0.00 35.95 38.01 2jgl h PHE 156 CO -0.00 0.51 -1.42 0.78 -0.60 0.00 0.00 178.31 177.58 2jgl h GLY 157 N 0.83 0.00 0.00 -1.45 0.00 -0.70 -3.37 103.07 98.38 2jgl h GLY 157 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2jgl h GLY 157 CO -0.05 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.18 2jgl n PHE 158 N -3.16 0.00 -1.78 5.60 3.72 0.45 -1.79 117.46 120.50 2jgl n PHE 158 Ca -0.10 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.88 2jgl n PHE 158 Cb 1.00 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.51 2jgl n PHE 158 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2jgl s LEU 159 N -0.19 4.11 -0.02 4.37 0.20 -0.76 -4.47 118.68 121.91 2jgl s LEU 159 Ca 0.00 2.26 0.05 0.00 0.69 0.00 0.00 54.13 57.13 2jgl s LEU 159 Cb 0.00 -3.53 -0.01 0.00 -0.43 0.00 0.00 46.19 42.22 2jgl s LEU 159 CO 0.00 -1.28 -0.18 0.00 -0.29 0.00 0.00 176.35 174.61 2jgl s ALA 160 N 5.39 1.50 -0.65 5.97 0.00 -1.26 -4.34 121.76 128.38 2jgl s ALA 160 Ca 0.86 -0.75 -0.01 0.00 0.00 0.00 0.00 51.96 52.06 2jgl s ALA 160 Cb -0.36 -0.41 0.16 0.00 0.00 0.00 0.00 23.12 22.51 2jgl s ALA 160 CO 0.36 0.35 0.46 -0.51 0.00 0.00 0.00 175.76 176.41 2jgl s LEU 161 N -0.32 5.08 0.33 0.00 1.43 0.40 -3.81 118.68 121.79 2jgl s LEU 161 Ca 0.04 -3.07 -0.29 0.00 -1.03 0.00 0.00 54.13 49.79 2jgl s LEU 161 Cb -0.08 -1.81 -0.12 0.00 0.03 0.00 0.00 46.19 44.21 2jgl s LEU 161 CO -0.00 -0.30 1.49 -2.65 0.23 0.00 0.00 176.35 175.12 2jgl n PRO 162 N 3.16 2.54 0.00 1.29 -0.02 -1.26 -1.37 135.00 139.34 2jgl n PRO 162 Ca 0.10 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 2jgl n PRO 162 Cb 0.36 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 2jgl n PRO 162 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgl n GLY 163 N 1.27 3.25 3.78 -1.23 0.00 -1.26 -5.06 105.19 105.94 2jgl n GLY 163 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2jgl n GLY 163 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jgl s SER 164 N -0.49 3.78 -0.04 1.61 1.04 -0.47 -4.99 113.70 114.13 2jgl s SER 164 Ca 0.00 1.12 0.08 0.00 0.48 0.00 0.00 55.95 57.63 2jgl s SER 164 Cb 0.00 -1.76 -0.24 0.00 0.10 0.00 0.00 66.02 64.13 2jgl s SER 164 CO 0.00 -2.40 0.68 -0.09 0.98 0.00 0.00 173.24 172.41 2jgl h ARG 165 N -1.39 0.05 -0.02 4.02 2.43 -1.97 -3.38 114.38 114.12 2jgl h ARG 165 Ca -0.50 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 58.58 2jgl h ARG 165 Cb 1.31 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 2jgl h ARG 165 CO 0.60 0.67 -0.32 -0.85 -1.51 0.00 0.00 179.97 178.57 2jgl n GLU 166 N -3.16 1.57 -2.88 0.20 0.00 -1.26 -4.50 120.64 110.61 2jgl n GLU 166 Ca -0.18 -1.27 -0.13 0.00 0.00 0.00 0.00 57.16 55.58 2jgl n GLU 166 Cb 1.04 -1.46 0.03 0.00 0.00 0.00 0.00 31.44 31.05 2jgl n GLU 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2jgl n ALA 167 N 0.40 -0.09 1.17 -1.84 0.00 -1.26 -4.41 120.51 114.48 2jgl n ALA 167 Ca 0.10 -2.05 0.11 0.00 0.00 0.00 0.00 53.44 51.61 2jgl n ALA 167 Cb 0.50 -1.14 0.60 0.00 0.00 0.00 0.00 19.45 19.41 2jgl n ALA 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jgl n PRO 168 N 1.10 0.44 0.00 0.00 -0.04 -1.26 -0.46 135.00 134.77 2jgl n PRO 168 Ca 0.12 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 2jgl n PRO 168 Cb 0.63 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 2jgl n PRO 168 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2jgl n GLY 169 N 0.56 -2.28 2.52 0.55 0.00 -1.26 -4.77 105.19 100.52 2jgl n GLY 169 Ca 0.13 -1.48 -0.10 0.00 0.00 0.00 0.00 46.02 44.56 2jgl n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jgl n ASN 170 N -2.21 -4.92 -0.14 1.61 3.02 -1.26 -4.91 115.26 106.45 2jgl n ASN 170 Ca 0.00 0.26 -0.07 0.00 -0.03 0.00 0.00 54.58 54.74 2jgl n ASN 170 Cb 0.00 -3.33 0.09 0.00 -0.61 0.00 0.00 39.78 35.93 2jgl n ASN 170 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2jgl h VAL 171 N 0.00 1.26 -0.79 2.41 -1.51 -1.80 -0.60 116.25 115.22 2jgl h VAL 171 Ca -0.21 -1.15 0.15 0.00 -1.23 0.00 0.00 66.70 64.26 2jgl h VAL 171 Cb 0.90 0.93 -0.05 0.00 -2.13 0.00 0.00 31.29 30.93 2jgl h VAL 171 CO 0.31 0.40 0.52 1.23 -1.23 0.00 0.00 177.57 178.81 2jgl h GLY 172 N 0.98 0.78 1.66 5.19 0.00 -1.55 0.52 103.07 110.65 2jgl h GLY 172 Ca 0.14 -0.19 -0.18 0.00 0.00 0.00 0.00 47.33 47.09 2jgl h GLY 172 CO 0.03 0.06 -0.76 1.41 0.00 0.00 0.00 176.54 177.28 2jgl h LEU 173 N 0.45 0.40 -1.06 3.11 3.38 -1.43 -2.71 115.31 117.45 2jgl h LEU 173 Ca 0.39 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 2jgl h LEU 173 Cb 0.87 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2jgl h LEU 173 CO -0.13 1.02 -0.38 -0.07 0.09 0.00 0.00 178.44 178.96 2jgl h LEU 174 N 0.21 0.00 0.09 1.67 3.38 0.08 -0.52 115.31 120.22 2jgl h LEU 174 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2jgl h LEU 174 Cb 1.35 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.09 2jgl h LEU 174 CO 0.13 0.38 -0.06 0.44 0.09 0.00 0.00 178.44 179.42 2jgl h ASP 175 N 0.00 -0.16 -0.18 -0.43 3.32 0.07 -0.60 116.42 118.45 2jgl h ASP 175 Ca -0.00 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.10 2jgl h ASP 175 Cb 0.83 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.40 2jgl h ASP 175 CO 0.05 -0.10 -0.06 1.56 -1.72 0.00 0.00 179.24 178.97 2jgl h GLN 176 N -0.16 -0.03 -0.79 3.56 4.20 -1.14 -2.05 115.11 118.70 2jgl h GLN 176 Ca -0.00 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.81 2jgl h GLN 176 Cb 0.14 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 27.85 2jgl h GLN 176 CO -0.00 -0.02 0.43 -0.09 -0.67 0.00 0.00 178.83 178.48 2jgl h ARG 177 N -0.03 0.67 -0.17 1.46 2.43 -0.92 -0.31 114.38 117.51 2jgl h ARG 177 Ca 0.09 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2jgl h ARG 177 Cb 0.16 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2jgl h ARG 177 CO -0.20 0.44 0.09 1.25 -1.51 0.00 0.00 179.97 180.04 2jgl h LEU 178 N 0.69 0.14 -1.01 3.80 5.85 -0.63 0.58 115.31 124.72 2jgl h LEU 178 Ca 0.40 0.00 0.08 0.00 0.84 0.00 0.00 57.88 59.21 2jgl h LEU 178 Cb 0.43 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.37 2jgl h LEU 178 CO -0.28 0.10 0.64 0.00 -0.34 0.00 0.00 178.44 178.57 2jgl h ALA 179 N 1.08 1.44 -0.77 1.25 0.00 -0.68 0.23 119.26 121.82 2jgl h ALA 179 Ca 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2jgl h ALA 179 Cb 0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 2jgl h ALA 179 CO -0.04 0.38 0.39 -0.07 0.00 0.00 0.00 179.25 179.91 2jgl h LEU 180 N 1.12 0.98 -0.54 0.00 4.07 -0.46 -1.13 115.31 119.36 2jgl h LEU 180 Ca 0.45 -0.10 -0.10 0.00 0.08 0.00 0.00 57.88 58.22 2jgl h LEU 180 Cb 0.27 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.74 2jgl h LEU 180 CO -0.20 0.81 -0.04 1.56 -1.08 0.00 0.00 178.44 179.50 2jgl h GLN 181 N 1.09 0.98 -0.70 1.13 4.20 0.65 -2.62 115.11 119.84 2jgl h GLN 181 Ca 0.27 -0.33 0.01 0.00 0.06 0.00 0.00 58.65 58.66 2jgl h GLN 181 Cb 0.08 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.74 2jgl h GLN 181 CO -0.04 1.00 0.46 2.35 -0.67 0.00 0.00 178.83 181.93 2jgl h TRP 182 N 0.85 0.86 -0.34 2.96 7.01 -0.25 -1.77 115.95 125.27 2jgl h TRP 182 Ca 0.15 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.18 2jgl h TRP 182 Cb 0.59 -0.29 -0.02 0.00 -2.10 0.00 0.00 29.16 27.33 2jgl h TRP 182 CO 0.04 0.53 0.20 0.28 -2.79 0.00 0.00 178.44 176.70 2jgl h VAL 183 N 0.92 1.03 -0.79 2.65 2.07 -1.09 -0.07 116.25 120.97 2jgl h VAL 183 Ca 0.26 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 67.71 2jgl h VAL 183 Cb -0.07 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 2jgl h VAL 183 CO -0.07 0.07 0.52 1.56 0.02 0.00 0.00 177.57 179.67 2jgl h GLN 184 N 0.40 0.85 0.00 1.57 1.08 -1.03 -0.20 115.11 117.77 2jgl h GLN 184 Ca 0.14 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.25 2jgl h GLN 184 Cb 0.01 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.24 2jgl h GLN 184 CO -0.07 0.56 -1.02 0.93 -0.95 0.00 0.00 178.83 178.28 2jgl h GLU 185 N 0.87 0.00 0.00 1.46 5.08 -0.94 -3.42 114.58 117.63 2jgl h GLU 185 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 2jgl h GLU 185 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2jgl h GLU 185 CO -0.12 0.06 -0.65 0.09 -1.00 0.00 0.00 179.01 177.40 2jgl n ASN 186 N -2.75 3.23 0.25 1.42 3.02 -0.08 -4.83 115.26 115.52 2jgl n ASN 186 Ca -0.02 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.62 2jgl n ASN 186 Cb 0.60 0.51 0.64 0.00 -0.61 0.00 0.00 39.78 40.92 2jgl n ASN 186 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2jgl h ILE 187 N 0.00 0.88 -0.67 2.41 6.09 -1.19 -1.00 117.51 124.03 2jgl h ILE 187 Ca 0.00 -0.44 0.15 0.00 -1.37 0.00 0.00 64.86 63.19 2jgl h ILE 187 Cb 0.27 1.25 -0.04 0.00 0.47 0.00 0.00 36.82 38.78 2jgl h ILE 187 CO 0.00 0.12 0.46 0.00 -3.07 0.00 0.00 178.15 175.66 2jgl h ALA 188 N 1.88 2.23 0.00 0.18 0.00 -1.79 -0.37 119.26 121.40 2jgl h ALA 188 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jgl h ALA 188 Cb 0.24 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2jgl h ALA 188 CO 0.02 -0.41 -0.01 0.00 0.00 0.00 0.00 179.25 178.84 2jgl h ALA 189 N 1.68 1.01 -0.02 0.00 0.00 -1.48 -1.92 119.26 118.53 2jgl h ALA 189 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2jgl h ALA 189 Cb 0.88 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2jgl h ALA 189 CO -0.08 0.01 -0.47 1.19 0.00 0.00 0.00 179.25 179.91 2jgl n PHE 190 N -3.11 0.00 -0.40 0.00 3.01 -0.29 -4.89 117.46 111.77 2jgl n PHE 190 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 2jgl n PHE 190 Cb 0.22 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.69 2jgl n PHE 190 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jgl n GLY 191 N 1.42 0.79 3.82 1.37 0.00 -0.72 -4.49 105.19 107.38 2jgl n GLY 191 Ca 0.09 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2jgl n GLY 191 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jgl s GLY 192 N -2.07 1.88 -0.43 -0.02 0.00 -0.35 -0.93 107.32 105.40 2jgl s GLY 192 Ca 0.00 0.20 -0.11 0.00 0.00 0.00 0.00 44.72 44.81 2jgl s GLY 192 CO 0.00 0.51 0.29 -0.35 0.00 0.00 0.00 173.10 173.54 2jgl s ASP 193 N -3.36 5.77 0.08 1.64 -1.08 0.65 -3.57 116.67 116.79 2jgl s ASP 193 Ca 0.60 -1.40 0.16 0.00 -0.52 0.00 0.00 52.55 51.39 2jgl s ASP 193 Cb -0.14 -2.04 0.69 0.00 -1.46 0.00 0.00 42.92 39.97 2jgl s ASP 193 CO 0.46 -0.55 1.51 -0.81 0.52 0.00 0.00 175.17 176.30 2jgl n PRO 194 N 5.00 0.06 -0.08 4.34 -0.04 -1.26 -1.29 135.00 141.72 2jgl n PRO 194 Ca -0.11 0.33 0.11 0.00 -0.04 0.00 0.00 63.50 63.79 2jgl n PRO 194 Cb 0.43 -1.62 0.38 0.00 -0.04 0.00 0.00 33.50 32.66 2jgl n PRO 194 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2jgl n MET 195 N -1.73 1.72 -3.43 0.54 2.81 -1.26 -4.43 117.12 111.34 2jgl n MET 195 Ca 0.03 -1.08 -0.26 0.00 -1.81 0.00 0.00 57.70 54.57 2jgl n MET 195 Cb 0.17 -1.40 -0.11 0.00 -0.71 0.00 0.00 33.22 31.17 2jgl n MET 195 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2jgl s SER 196 N -1.58 2.52 -0.19 7.83 0.15 -0.41 -4.95 113.70 117.07 2jgl s SER 196 Ca 0.32 -2.09 0.01 0.00 0.70 0.00 0.00 55.95 54.89 2jgl s SER 196 Cb 0.17 -0.19 0.03 0.00 -1.71 0.00 0.00 66.02 64.33 2jgl s SER 196 CO 0.26 -0.29 -0.14 -0.69 1.20 0.00 0.00 173.24 173.58 2jgl s VAL 197 N 1.11 1.80 -0.22 4.45 1.01 -1.26 -0.89 120.40 126.39 2jgl s VAL 197 Ca 0.18 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 61.14 2jgl s VAL 197 Cb -0.20 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2jgl s VAL 197 CO -0.00 0.33 0.06 -0.89 0.00 0.00 0.00 175.10 174.60 2jgl s THR 198 N 1.36 4.38 0.30 3.92 2.01 -0.24 -0.87 115.64 126.50 2jgl s THR 198 Ca 0.01 -0.16 -0.25 0.00 0.31 0.00 0.00 61.69 61.61 2jgl s THR 198 Cb -0.15 -3.02 -0.09 0.00 0.01 0.00 0.00 72.50 69.25 2jgl s THR 198 CO -0.10 0.38 0.90 -0.76 -0.69 0.00 0.00 174.62 174.35 2jgl s LEU 199 N 1.21 4.36 -0.00 4.42 1.43 -0.30 -0.71 118.68 129.09 2jgl s LEU 199 Ca 0.04 1.76 -0.14 0.00 -1.03 0.00 0.00 54.13 54.76 2jgl s LEU 199 Cb -0.14 -3.90 0.02 0.00 0.03 0.00 0.00 46.19 42.19 2jgl s LEU 199 CO 0.03 -0.03 0.30 0.72 0.23 0.00 0.00 176.35 177.60 2jgl s PHE 200 N -1.57 -0.15 0.01 0.29 -0.71 -0.25 -0.81 117.98 114.79 2jgl s PHE 200 Ca 0.48 0.18 -0.29 0.00 -1.04 0.00 0.00 56.93 56.26 2jgl s PHE 200 Cb -0.19 0.09 0.10 0.00 -1.21 0.00 0.00 43.02 41.81 2jgl s PHE 200 CO 0.24 -0.41 0.96 0.20 -1.34 0.00 0.00 175.22 174.87 2jgl s GLY 201 N -1.49 -0.39 -0.31 1.99 0.00 -1.06 -1.87 107.32 104.19 2jgl s GLY 201 Ca -0.12 0.84 0.11 0.00 0.00 0.00 0.00 44.72 45.55 2jgl s GLY 201 CO 0.03 0.26 1.14 -2.21 0.00 0.00 0.00 173.10 172.31 2jgl n GLU 202 N -0.30 2.97 0.00 2.90 0.00 -1.23 -1.40 120.64 123.58 2jgl n GLU 202 Ca -0.07 -4.02 0.00 0.00 0.00 0.00 0.00 57.16 53.07 2jgl n GLU 202 Cb 0.61 -2.05 0.00 0.00 0.00 0.00 0.00 31.44 30.01 2jgl n GLU 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2jgl n ALA 204 N -0.59 0.00 -0.29 4.31 0.00 -1.26 -3.05 120.51 119.62 2jgl n ALA 204 Ca 0.32 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.78 2jgl n ALA 204 Cb 0.86 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.47 2jgl n ALA 204 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2jgl h GLY 205 N 0.00 1.26 0.87 0.00 0.00 -1.67 0.65 103.07 104.19 2jgl h GLY 205 Ca 0.00 -0.33 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 2jgl h GLY 205 CO 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 176.54 176.68 2jgl h ALA 206 N 1.43 0.38 -0.52 3.60 0.00 -1.60 -0.78 119.26 121.78 2jgl h ALA 206 Ca 0.38 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 55.10 2jgl h ALA 206 Cb 0.29 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2jgl h ALA 206 CO -0.22 0.16 0.34 0.00 0.00 0.00 0.00 179.25 179.53 2jgl h ALA 207 N 0.81 1.89 0.02 0.00 0.00 -1.63 0.85 119.26 121.19 2jgl h ALA 207 Ca 0.08 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2jgl h ALA 207 Cb 0.48 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2jgl h ALA 207 CO 0.02 0.03 -0.01 0.77 0.00 0.00 0.00 179.25 180.06 2jgl h SER 208 N 0.47 -0.02 -0.57 0.00 0.02 -0.54 0.69 113.55 113.60 2jgl h SER 208 Ca 0.22 -0.32 0.10 0.00 -0.84 0.00 0.00 61.79 60.96 2jgl h SER 208 Cb 0.29 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.75 2jgl h SER 208 CO -0.06 0.31 0.11 0.58 -1.14 0.00 0.00 176.83 176.63 2jgl h VAL 209 N -0.35 0.65 -0.93 2.27 2.07 -0.49 0.20 116.25 119.67 2jgl h VAL 209 Ca -0.00 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.49 2jgl h VAL 209 Cb 0.33 0.39 -0.06 0.00 -1.52 0.00 0.00 31.29 30.43 2jgl h VAL 209 CO 0.00 0.04 0.59 1.23 0.02 0.00 0.00 177.57 179.46 2jgl h GLY 210 N 0.24 1.40 1.77 2.17 0.00 -0.64 -1.67 103.07 106.33 2jgl h GLY 210 Ca 0.29 -0.44 -0.09 0.00 0.00 0.00 0.00 47.33 47.09 2jgl h GLY 210 CO -0.39 0.32 -0.33 -0.33 0.00 0.00 0.00 176.54 175.81 2jgl h MET 211 N 1.10 0.26 -0.18 4.80 2.86 0.69 -1.37 114.93 123.09 2jgl h MET 211 Ca 0.40 -0.11 -0.13 0.00 -2.06 0.00 0.00 59.70 57.80 2jgl h MET 211 Cb 0.13 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 2jgl h MET 211 CO -0.16 0.57 -0.44 0.45 1.06 0.00 0.00 176.91 178.39 2jgl h HIS 212 N 0.23 0.54 -0.85 -0.22 3.86 -0.43 -1.05 115.15 117.23 2jgl h HIS 212 Ca 0.03 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 59.07 2jgl h HIS 212 Cb 0.70 -0.11 -0.04 0.00 1.06 0.00 0.00 27.41 29.02 2jgl h HIS 212 CO 0.01 0.81 0.50 0.82 0.86 0.00 0.00 177.93 180.94 2jgl h ILE 213 N 0.36 1.24 -0.14 2.45 2.04 -0.74 -2.90 117.51 119.83 2jgl h ILE 213 Ca 0.03 -0.55 0.00 0.00 1.00 0.00 0.00 64.86 65.34 2jgl h ILE 213 Cb 0.92 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 2jgl h ILE 213 CO 0.08 0.26 0.00 0.18 0.00 0.00 0.00 178.15 178.67 2jgl n LEU 214 N -4.41 1.56 -4.14 1.44 4.77 -0.57 -4.75 117.00 110.90 2jgl n LEU 214 Ca 0.09 -0.64 -0.33 0.00 -0.03 0.00 0.00 56.01 55.10 2jgl n LEU 214 Cb 0.07 -0.09 -0.16 0.00 -2.33 0.00 0.00 43.42 40.91 2jgl n LEU 214 CO 0.38 0.32 -0.53 -0.55 -1.33 0.00 0.00 177.39 175.68 2jgl s SER 215 N -1.62 3.19 0.11 -1.43 0.15 -0.43 -4.77 113.70 108.89 2jgl s SER 215 Ca 0.33 -0.63 -0.18 0.00 0.70 0.00 0.00 55.95 56.17 2jgl s SER 215 Cb 0.18 -1.49 -0.05 0.00 -1.71 0.00 0.00 66.02 62.95 2jgl s SER 215 CO 0.27 0.02 1.66 0.25 1.20 0.00 0.00 173.24 176.64 2jgl h LEU 216 N 7.82 0.39 -2.05 3.45 5.85 -1.85 -1.80 115.31 127.12 2jgl h LEU 216 Ca -0.43 -0.16 0.11 0.00 0.84 0.00 0.00 57.88 58.24 2jgl h LEU 216 Cb 1.15 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 2jgl h LEU 216 CO 0.62 0.44 0.36 -0.65 -0.34 0.00 0.00 178.44 178.87 2jgl h PRO 217 N 0.31 0.00 0.00 5.25 0.11 -1.95 -0.50 132.00 135.22 2jgl h PRO 217 Ca 0.10 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.06 2jgl h PRO 217 Cb 0.17 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 2jgl h PRO 217 CO -0.01 0.00 -0.67 0.77 -0.21 0.00 0.00 178.00 177.88 2jgl h SER 218 N 0.00 0.00 0.06 -2.05 0.02 -1.58 -3.36 113.55 106.64 2jgl h SER 218 Ca 0.18 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2jgl h SER 218 Cb 0.90 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.44 2jgl h SER 218 CO -0.00 0.67 -0.00 0.03 -1.14 0.00 0.00 176.83 176.38 2jgl h ARG 219 N 0.00 0.00 -0.42 3.45 2.47 -0.91 -0.79 114.38 118.18 2jgl h ARG 219 Ca -0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 2jgl h ARG 219 Cb 1.34 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.66 2jgl h ARG 219 CO 0.09 0.00 0.00 -1.13 0.56 0.00 0.00 179.97 179.49 2jgl n SER 220 N -3.21 2.35 -0.21 7.04 3.41 -1.26 -4.08 113.62 117.66 2jgl n SER 220 Ca -0.03 -1.98 0.07 0.00 -0.26 0.00 0.00 58.87 56.68 2jgl n SER 220 Cb 0.09 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.72 2jgl n SER 220 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jgl n LEU 221 N 0.78 1.23 -3.92 1.04 4.77 -0.30 -5.01 117.00 115.58 2jgl n LEU 221 Ca 0.15 -0.66 -0.09 0.00 -0.03 0.00 0.00 56.01 55.37 2jgl n LEU 221 Cb 0.38 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 2jgl n LEU 221 CO 0.10 0.25 0.18 0.72 -1.33 0.00 0.00 177.39 177.31 2jgl s PHE 222 N -2.02 0.23 0.00 -1.77 -0.71 -1.26 -4.88 117.98 107.57 2jgl s PHE 222 Ca 0.10 -0.59 0.00 0.00 -1.04 0.00 0.00 56.93 55.40 2jgl s PHE 222 Cb 0.12 0.22 0.00 0.00 -1.21 0.00 0.00 43.02 42.14 2jgl s PHE 222 CO 0.46 -0.94 0.00 0.72 -1.34 0.00 0.00 175.22 174.12 2jgl n HIS 223 N -0.35 0.00 -3.87 3.49 8.25 -0.05 -4.95 115.22 117.75 2jgl n HIS 223 Ca -0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.33 2jgl n HIS 223 Cb 0.62 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.66 2jgl n HIS 223 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2jgl s ARG 224 N -1.93 0.83 -0.00 -0.41 0.52 -1.16 -4.37 118.95 112.42 2jgl s ARG 224 Ca 0.00 -0.96 -0.03 0.00 -0.52 0.00 0.00 55.73 54.21 2jgl s ARG 224 Cb 0.00 0.33 -0.00 0.00 0.52 0.00 0.00 34.95 35.80 2jgl s ARG 224 CO 0.00 -0.26 0.06 0.00 0.02 0.00 0.00 175.30 175.12 2jgl s ALA 225 N -3.84 -0.13 -0.06 2.13 0.00 -0.99 -1.15 121.76 117.72 2jgl s ALA 225 Ca 0.05 -0.16 0.01 0.00 0.00 0.00 0.00 51.96 51.85 2jgl s ALA 225 Cb 0.05 0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.23 2jgl s ALA 225 CO -0.11 -0.13 -0.05 0.08 0.00 0.00 0.00 175.76 175.55 2jgl s VAL 226 N -0.91 0.66 -0.26 0.00 1.01 0.01 -1.70 120.40 119.21 2jgl s VAL 226 Ca -0.10 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.76 2jgl s VAL 226 Cb -0.06 -0.70 0.06 0.00 0.00 0.00 0.00 36.38 35.68 2jgl s VAL 226 CO 0.00 0.27 -0.10 -0.76 0.00 0.00 0.00 175.10 174.52 2jgl s LEU 227 N 1.22 3.50 -0.25 3.92 1.02 0.19 -2.55 118.68 125.73 2jgl s LEU 227 Ca -0.06 -1.44 -0.09 0.00 0.02 0.00 0.00 54.13 52.56 2jgl s LEU 227 Cb -0.14 -1.54 -0.04 0.00 0.02 0.00 0.00 46.19 44.49 2jgl s LEU 227 CO -0.02 -0.20 0.12 -1.10 0.02 0.00 0.00 176.35 175.17 2jgl s GLN 228 N 1.10 3.86 -1.60 1.70 -0.21 -0.49 -2.71 119.66 121.32 2jgl s GLN 228 Ca -0.08 -0.37 -0.12 0.00 0.02 0.00 0.00 55.36 54.81 2jgl s GLN 228 Cb -0.20 -3.44 0.10 0.00 1.00 0.00 0.00 33.01 30.47 2jgl s GLN 228 CO -0.05 -0.07 0.67 0.43 -2.12 0.00 0.00 175.29 174.15 2jgl n SER 229 N 4.63 -2.43 -3.64 5.90 7.64 0.05 -4.16 113.62 121.61 2jgl n SER 229 Ca -0.15 -1.00 -0.03 0.00 1.01 0.00 0.00 58.87 58.70 2jgl n SER 229 Cb 0.52 -2.91 -0.02 0.00 -1.01 0.00 0.00 64.21 60.78 2jgl n SER 229 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2jgl s GLY 230 N -3.64 -0.16 0.03 0.23 0.00 -1.26 -4.82 107.32 97.70 2jgl s GLY 230 Ca 0.50 2.03 -0.17 0.00 0.00 0.00 0.00 44.72 47.08 2jgl s GLY 230 CO 0.91 0.71 0.39 -0.51 0.00 0.00 0.00 173.10 174.60 2jgl s THR 231 N -1.91 0.06 0.23 0.90 -4.23 -1.26 -4.25 115.64 105.18 2jgl s THR 231 Ca 0.11 -0.48 0.01 0.00 -1.18 0.00 0.00 61.69 60.15 2jgl s THR 231 Cb -0.01 -0.91 -0.02 0.00 1.34 0.00 0.00 72.50 72.91 2jgl s THR 231 CO -0.04 -0.26 1.58 1.55 -0.54 0.00 0.00 174.62 176.91 2jgl h PRO 232 N 3.16 0.42 -7.46 3.99 0.13 -1.82 -3.39 132.00 127.04 2jgl h PRO 232 Ca -0.31 -0.24 -0.44 0.00 -0.87 0.00 0.00 66.00 64.14 2jgl h PRO 232 Cb 1.20 0.02 0.16 0.00 0.13 0.00 0.00 31.00 32.50 2jgl h PRO 232 CO 0.43 0.82 0.23 0.54 -0.23 0.00 0.00 178.00 179.79 2jgl s ASN 233 N -6.89 2.47 0.00 1.44 4.22 -1.26 -4.54 114.94 110.39 2jgl s ASN 233 Ca -0.06 0.87 0.00 0.00 -2.14 0.00 0.00 52.86 51.53 2jgl s ASN 233 Cb 0.12 -1.33 0.00 0.00 1.28 0.00 0.00 41.25 41.32 2jgl s ASN 233 CO 0.81 -3.19 0.00 0.61 -2.04 0.00 0.00 177.10 173.30 2jgl n GLY 234 N -1.68 0.65 0.22 0.45 0.00 -1.26 -4.71 105.19 98.86 2jgl n GLY 234 Ca 0.09 -2.15 0.14 0.00 0.00 0.00 0.00 46.02 44.09 2jgl n GLY 234 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jgl h PRO 235 N 0.00 0.00 0.00 1.61 0.13 -1.88 -3.37 132.00 128.49 2jgl h PRO 235 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2jgl h PRO 235 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2jgl h PRO 235 CO 0.00 0.00 -0.77 -2.67 -0.23 0.00 0.00 178.00 174.33 2jgl n TRP 236 N -2.96 0.00 0.11 1.56 4.27 -1.26 -4.78 117.44 114.38 2jgl n TRP 236 Ca 0.03 0.00 0.06 0.00 -3.89 0.00 0.00 57.50 53.70 2jgl n TRP 236 Cb 0.44 -0.03 0.00 0.00 -1.36 0.00 0.00 31.31 30.35 2jgl n TRP 236 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2jgl h ALA 237 N 0.24 0.67 -2.21 -1.67 0.00 -1.84 -3.43 119.26 111.01 2jgl h ALA 237 Ca 0.00 -0.39 -0.38 0.00 0.00 0.00 0.00 54.91 54.14 2jgl h ALA 237 Cb 0.09 0.07 -0.14 0.00 0.00 0.00 0.00 17.79 17.81 2jgl h ALA 237 CO 0.00 0.45 -0.71 0.95 0.00 0.00 0.00 179.25 179.95 2jgl s THR 238 N -3.10 1.36 0.18 0.00 -4.23 -1.26 -3.65 115.64 104.95 2jgl s THR 238 Ca 0.01 -2.11 0.03 0.00 -1.18 0.00 0.00 61.69 58.44 2jgl s THR 238 Cb 0.08 -2.03 -0.05 0.00 1.34 0.00 0.00 72.50 71.85 2jgl s THR 238 CO 0.77 -0.60 -0.04 0.68 -0.54 0.00 0.00 174.62 174.89 2jgl s VAL 239 N -3.21 0.99 0.63 2.29 -7.23 -0.78 -4.99 120.40 108.11 2jgl s VAL 239 Ca 0.21 -2.03 -0.10 0.00 -1.81 0.00 0.00 61.98 58.25 2jgl s VAL 239 Cb 0.02 -2.10 -0.02 0.00 0.56 0.00 0.00 36.38 34.84 2jgl s VAL 239 CO 0.05 -0.52 1.02 -0.94 -0.31 0.00 0.00 175.10 174.39 2jgl s SER 240 N -3.22 5.91 0.18 4.85 1.04 -1.26 -1.21 113.70 119.99 2jgl s SER 240 Ca 0.23 1.21 -0.15 0.00 0.48 0.00 0.00 55.95 57.71 2jgl s SER 240 Cb 0.05 -2.19 0.15 0.00 0.10 0.00 0.00 66.02 64.13 2jgl s SER 240 CO 0.04 -1.02 1.66 0.00 0.98 0.00 0.00 173.24 174.91 2jgl h ALA 241 N -0.37 0.36 -0.76 5.32 0.00 -1.93 -1.75 119.26 120.15 2jgl h ALA 241 Ca -0.45 0.17 0.12 0.00 0.00 0.00 0.00 54.91 54.76 2jgl h ALA 241 Cb 1.22 0.32 -0.09 0.00 0.00 0.00 0.00 17.79 19.24 2jgl h ALA 241 CO 0.62 -0.43 0.35 0.78 0.00 0.00 0.00 179.25 180.57 2jgl h GLY 242 N 0.04 1.16 1.75 0.00 0.00 -1.93 -1.99 103.07 102.09 2jgl h GLY 242 Ca 0.23 -0.19 -0.10 0.00 0.00 0.00 0.00 47.33 47.27 2jgl h GLY 242 CO -0.46 -0.03 -0.66 -2.09 0.00 0.00 0.00 176.54 173.30 2jgl h GLU 243 N 0.54 0.00 -0.18 4.80 4.57 -1.82 -2.70 114.58 119.78 2jgl h GLU 243 Ca 0.40 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.49 2jgl h GLU 243 Cb 0.54 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.13 2jgl h GLU 243 CO -0.35 0.38 -0.25 0.00 -1.18 0.00 0.00 179.01 177.62 2jgl h ALA 244 N 1.56 0.27 -1.00 2.92 0.00 -1.01 -2.26 119.26 119.74 2jgl h ALA 244 Ca -0.03 -0.38 0.09 0.00 0.00 0.00 0.00 54.91 54.59 2jgl h ALA 244 Cb 1.37 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 19.03 2jgl h ALA 244 CO 0.05 0.25 0.64 -0.09 0.00 0.00 0.00 179.25 180.10 2jgl h ARG 245 N 0.14 1.05 -0.20 0.00 2.43 -1.39 0.79 114.38 117.19 2jgl h ARG 245 Ca 0.02 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.05 2jgl h ARG 245 Cb 0.81 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2jgl h ARG 245 CO 0.06 0.70 -0.17 -0.09 -1.51 0.00 0.00 179.97 178.96 2jgl h ARG 246 N 1.08 0.47 -0.42 0.20 2.43 -1.39 -1.08 114.38 115.68 2jgl h ARG 246 Ca 0.46 -0.24 -0.10 0.00 -0.81 0.00 0.00 59.98 59.29 2jgl h ARG 246 Cb 0.33 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 2jgl h ARG 246 CO -0.22 0.80 -0.16 0.00 -1.51 0.00 0.00 179.97 178.88 2jgl h ARG 247 N 0.16 0.79 0.37 0.20 3.08 -1.15 -0.68 114.38 117.14 2jgl h ARG 247 Ca 0.04 -0.29 -0.02 0.00 0.07 0.00 0.00 59.98 59.78 2jgl h ARG 247 Cb 0.70 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.70 2jgl h ARG 247 CO 0.04 0.90 -0.18 0.00 -1.07 0.00 0.00 179.97 179.67 2jgl h ALA 248 N 1.11 -0.49 0.00 0.04 0.00 -0.66 -0.31 119.26 118.95 2jgl h ALA 248 Ca 0.11 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2jgl h ALA 248 Cb 0.66 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 2jgl h ALA 248 CO 0.05 -0.68 -0.13 1.79 0.00 0.00 0.00 179.25 180.28 2jgl h THR 249 N -0.70 0.47 0.03 0.00 1.35 -1.19 -1.23 112.91 111.63 2jgl h THR 249 Ca -0.05 -0.69 -0.23 0.00 -0.55 0.00 0.00 66.41 64.89 2jgl h THR 249 Cb 0.49 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 2jgl h THR 249 CO 0.08 0.13 -1.00 0.25 -0.25 0.00 0.00 175.52 174.74 2jgl h LEU 250 N 0.00 0.47 -0.44 3.87 5.85 -0.86 -1.17 115.31 123.02 2jgl h LEU 250 Ca -0.00 -0.40 -0.11 0.00 0.84 0.00 0.00 57.88 58.21 2jgl h LEU 250 Cb 0.47 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 2jgl h LEU 250 CO 0.02 1.22 -0.13 0.25 -0.34 0.00 0.00 178.44 179.45 2jgl h LEU 251 N 0.18 0.89 -0.93 2.25 5.85 -0.59 -1.80 115.31 121.15 2jgl h LEU 251 Ca -0.09 -0.37 -0.02 0.00 0.84 0.00 0.00 57.88 58.24 2jgl h LEU 251 Cb 1.65 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 42.39 2jgl h LEU 251 CO 0.17 1.06 0.49 0.00 -0.34 0.00 0.00 178.44 179.82 2jgl h ALA 252 N 0.86 1.18 -0.31 1.25 0.00 -1.23 -1.75 119.26 119.27 2jgl h ALA 252 Ca 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2jgl h ALA 252 Cb 0.68 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2jgl h ALA 252 CO 0.05 0.66 0.15 -0.09 0.00 0.00 0.00 179.25 180.02 2jgl h ARG 253 N 1.25 0.44 0.00 0.00 2.43 -1.06 0.31 114.38 117.75 2jgl h ARG 253 Ca 0.31 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2jgl h ARG 253 Cb 0.02 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2jgl h ARG 253 CO -0.05 0.41 0.00 -0.07 -1.51 0.00 0.00 179.97 178.75 2jgl h LEU 254 N 0.36 0.00 -1.55 3.80 3.38 -0.57 -2.52 115.31 118.22 2jgl h LEU 254 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2jgl h LEU 254 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2jgl h LEU 254 CO -0.01 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.85 2jgl n VAL 255 N -2.68 0.13 0.00 1.22 0.24 -0.73 -4.99 118.33 111.52 2jgl n VAL 255 Ca -0.02 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 2jgl n VAL 255 Cb 0.09 1.10 0.00 0.00 -1.47 0.00 0.00 33.84 33.56 2jgl n VAL 255 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jgl n GLY 256 N 0.47 1.09 2.18 7.63 0.00 -0.91 -5.08 105.19 110.57 2jgl n GLY 256 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 2jgl n GLY 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jgl n ASN 265 N -1.98 0.00 0.15 0.00 2.85 -1.26 -4.83 115.26 110.19 2jgl n ASN 265 Ca -0.00 0.93 -0.14 0.00 -0.11 0.00 0.00 54.58 55.26 2jgl n ASN 265 Cb 0.36 -1.39 -0.06 0.00 1.24 0.00 0.00 39.78 39.92 2jgl n ASN 265 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 2jgl h ASP 266 N 3.54 -0.66 -0.62 1.20 3.32 -2.00 -2.56 116.42 118.64 2jgl h ASP 266 Ca 0.00 0.06 0.12 0.00 0.02 0.00 0.00 57.03 57.24 2jgl h ASP 266 Cb 0.00 0.23 -0.12 0.00 0.22 0.00 0.00 39.33 39.66 2jgl h ASP 266 CO 0.00 -0.35 -0.20 0.74 -1.72 0.00 0.00 179.24 177.71 2jgl h THR 267 N -0.50 0.32 -0.08 0.35 2.02 -2.01 0.09 112.91 113.09 2jgl h THR 267 Ca 0.00 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.04 2jgl h THR 267 Cb 0.48 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 2jgl h THR 267 CO -0.07 0.00 -0.57 -0.33 0.37 0.00 0.00 175.52 174.91 2jgl h GLU 268 N -0.04 0.24 -0.20 6.66 5.08 -1.98 -0.85 114.58 123.48 2jgl h GLU 268 Ca 0.29 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 2jgl h GLU 268 Cb 0.49 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2jgl h GLU 268 CO -0.66 0.74 0.07 1.25 -1.00 0.00 0.00 179.01 179.41 2jgl h LEU 269 N 0.18 0.28 -0.32 1.33 6.46 -0.71 -2.40 115.31 120.13 2jgl h LEU 269 Ca -0.00 -0.20 -0.08 0.00 -0.12 0.00 0.00 57.88 57.48 2jgl h LEU 269 Cb 1.06 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.91 2jgl h LEU 269 CO 0.09 0.40 -0.13 0.40 -0.62 0.00 0.00 178.44 178.58 2jgl h ILE 270 N 0.15 1.29 -0.54 4.05 2.04 -0.93 -2.15 117.51 121.43 2jgl h ILE 270 Ca 0.06 -1.22 0.09 0.00 1.00 0.00 0.00 64.86 64.79 2jgl h ILE 270 Cb 0.22 1.41 -0.07 0.00 -0.74 0.00 0.00 36.82 37.64 2jgl h ILE 270 CO -0.00 0.40 0.16 0.00 0.00 0.00 0.00 178.15 178.70 2jgl h ALA 271 N 0.78 0.65 -0.66 1.87 0.00 -1.15 0.14 119.26 120.89 2jgl h ALA 271 Ca 0.07 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2jgl h ALA 271 Cb 0.65 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2jgl h ALA 271 CO 0.04 -0.25 0.28 0.00 0.00 0.00 0.00 179.25 179.32 2jgl h LEU 273 N 0.94 1.13 -2.71 0.00 3.38 -0.46 -2.51 115.31 115.09 2jgl h LEU 273 Ca 0.22 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2jgl h LEU 273 Cb 0.16 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2jgl h LEU 273 CO -0.02 0.90 -0.01 0.03 0.09 0.00 0.00 178.44 179.43 2jgl h ARG 274 N 1.26 0.00 -0.00 1.13 3.08 -0.23 -1.25 114.38 118.37 2jgl h ARG 274 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 2jgl h ARG 274 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 2jgl h ARG 274 CO -0.05 0.01 -0.23 0.25 -1.07 0.00 0.00 179.97 178.88 2jgl n THR 275 N -3.24 0.00 -3.04 2.04 -2.24 -0.95 -4.86 114.28 102.00 2jgl n THR 275 Ca -0.03 -0.01 -0.40 0.00 -2.27 0.00 0.00 64.05 61.34 2jgl n THR 275 Cb 0.10 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 2jgl n THR 275 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2jgl s ARG 276 N -2.89 4.40 0.46 -0.78 1.81 -0.47 -5.03 118.95 116.45 2jgl s ARG 276 Ca 0.16 0.87 -0.20 0.00 -1.72 0.00 0.00 55.73 54.84 2jgl s ARG 276 Cb 0.19 -3.47 -0.14 0.00 -0.45 0.00 0.00 34.95 31.08 2jgl s ARG 276 CO 0.59 0.00 0.16 -2.30 -0.68 0.00 0.00 175.30 173.07 2jgl n PRO 277 N 4.03 0.17 -0.21 3.54 -0.01 -1.26 -4.89 135.00 136.37 2jgl n PRO 277 Ca -0.01 0.07 -0.02 0.00 -0.01 0.00 0.00 63.50 63.52 2jgl n PRO 277 Cb 0.51 -1.19 0.08 0.00 -0.01 0.00 0.00 33.50 32.89 2jgl n PRO 277 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 2jgl h ALA 278 N 0.28 0.81 0.00 3.55 0.00 -1.97 -2.70 119.26 119.23 2jgl h ALA 278 Ca -0.40 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 2jgl h ALA 278 Cb 1.43 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 2jgl h ALA 278 CO 0.46 -0.01 -0.08 0.37 0.00 0.00 0.00 179.25 179.99 2jgl h GLN 279 N 0.61 0.00 -0.50 0.00 5.75 -1.99 -2.19 115.11 116.78 2jgl h GLN 279 Ca 0.27 0.00 -0.08 0.00 -0.15 0.00 0.00 58.65 58.69 2jgl h GLN 279 Cb 0.18 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 2jgl h GLN 279 CO -0.18 0.08 -0.02 -0.44 -2.65 0.00 0.00 178.83 175.62 2jgl h ASP 280 N 0.00 0.83 -0.15 -0.69 5.19 -1.84 0.24 116.42 120.01 2jgl h ASP 280 Ca -0.00 -0.22 -0.07 0.00 -0.62 0.00 0.00 57.03 56.12 2jgl h ASP 280 Cb 0.70 -0.22 -0.00 0.00 0.18 0.00 0.00 39.33 39.99 2jgl h ASP 280 CO 0.01 0.91 -0.18 -0.07 -3.12 0.00 0.00 179.24 176.79 2jgl h LEU 281 N 0.79 0.42 -1.05 1.55 4.07 -1.44 -3.22 115.31 116.44 2jgl h LEU 281 Ca 0.15 -0.50 -0.06 0.00 0.08 0.00 0.00 57.88 57.55 2jgl h LEU 281 Cb 0.50 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 42.10 2jgl h LEU 281 CO 0.03 0.84 0.06 0.58 -1.08 0.00 0.00 178.44 178.86 2jgl h VAL 282 N 0.01 1.22 -0.86 1.22 2.07 -1.36 -2.28 116.25 116.27 2jgl h VAL 282 Ca 0.02 -0.86 0.24 0.00 0.82 0.00 0.00 66.70 66.92 2jgl h VAL 282 Cb 0.73 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 2jgl h VAL 282 CO 0.04 0.31 0.61 0.44 0.02 0.00 0.00 177.57 179.00 2jgl h ASP 283 N 0.71 0.06 -0.13 0.57 3.32 -0.53 -2.30 116.42 118.12 2jgl h ASP 283 Ca 0.15 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2jgl h ASP 283 Cb 0.35 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2jgl h ASP 283 CO 0.01 0.02 0.00 1.41 -1.72 0.00 0.00 179.24 178.96 2jgl n HIS 284 N -4.32 0.21 -0.24 4.55 8.25 -0.90 -4.71 115.22 118.07 2jgl n HIS 284 Ca 0.18 -0.56 0.01 0.00 -0.26 0.00 0.00 57.72 57.08 2jgl n HIS 284 Cb 0.89 -0.06 0.13 0.00 1.12 0.00 0.00 29.99 32.06 2jgl n HIS 284 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2jgl h GLU 285 N 0.80 0.59 -0.60 -0.41 4.81 -0.97 -2.49 114.58 116.31 2jgl h GLU 285 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2jgl h GLU 285 Cb 0.67 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.92 2jgl h GLU 285 CO 0.01 0.39 0.00 0.91 -0.73 0.00 0.00 179.01 179.59 2jgl n TRP 286 N -4.85 0.73 0.24 0.92 7.02 -1.26 -3.94 117.44 116.30 2jgl n TRP 286 Ca 0.10 -0.28 0.08 0.00 -1.02 0.00 0.00 57.50 56.38 2jgl n TRP 286 Cb 0.25 -0.16 0.13 0.00 -2.42 0.00 0.00 31.31 29.11 2jgl n TRP 286 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 2jgl n HIS 287 N 0.38 0.29 0.85 -5.99 8.25 -0.94 -4.56 115.22 113.49 2jgl n HIS 287 Ca 0.12 -0.22 0.10 0.00 -0.26 0.00 0.00 57.72 57.45 2jgl n HIS 287 Cb 0.51 -0.01 0.04 0.00 1.12 0.00 0.00 29.99 31.64 2jgl n HIS 287 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2jgl n VAL 288 N 0.88 0.00 -2.32 1.59 0.24 -1.25 -4.99 118.33 112.48 2jgl n VAL 288 Ca 0.12 -0.39 -0.41 0.00 -2.04 0.00 0.00 64.34 61.62 2jgl n VAL 288 Cb 0.43 1.32 -0.03 0.00 -1.47 0.00 0.00 33.84 34.09 2jgl n VAL 288 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2jgl s LEU 289 N -2.00 4.46 0.50 1.34 1.43 -1.26 -4.83 118.68 118.33 2jgl s LEU 289 Ca 0.19 2.36 0.20 0.00 -1.03 0.00 0.00 54.13 55.86 2jgl s LEU 289 Cb 0.16 -3.62 1.27 0.00 0.03 0.00 0.00 46.19 44.03 2jgl s LEU 289 CO 0.38 -0.38 2.08 1.55 0.23 0.00 0.00 176.35 180.21 2jgl h PRO 290 N 4.56 0.00 -4.13 1.29 0.13 -2.00 -3.44 132.00 128.41 2jgl h PRO 290 Ca -0.46 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.54 2jgl h PRO 290 Cb 1.22 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.18 2jgl h PRO 290 CO 0.71 0.11 -0.67 -0.65 -0.23 0.00 0.00 178.00 177.27 2jgl s GLN 291 N -4.62 0.52 0.17 0.86 1.11 -1.26 -5.12 119.66 111.32 2jgl s GLN 291 Ca -0.04 -1.00 -0.32 0.00 0.01 0.00 0.00 55.36 54.01 2jgl s GLN 291 Cb 0.15 0.18 -0.12 0.00 -1.01 0.00 0.00 33.01 32.22 2jgl s GLN 291 CO 0.64 -0.10 1.77 -1.91 0.01 0.00 0.00 175.29 175.71 2jgl n GLU 292 N 0.59 2.75 -3.77 2.91 2.13 -1.26 -4.95 120.64 119.05 2jgl n GLU 292 Ca -0.17 1.00 -0.09 0.00 0.66 0.00 0.00 57.16 58.56 2jgl n GLU 292 Cb 0.59 -2.86 -0.03 0.00 0.27 0.00 0.00 31.44 29.41 2jgl n GLU 292 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2jgl s SER 293 N 1.86 -0.29 0.34 4.31 1.04 -1.26 -4.67 113.70 115.03 2jgl s SER 293 Ca 0.78 -0.51 0.06 0.00 0.48 0.00 0.00 55.95 56.77 2jgl s SER 293 Cb -0.50 0.65 -0.07 0.00 0.10 0.00 0.00 66.02 66.19 2jgl s SER 293 CO 0.35 -1.17 0.00 0.27 0.98 0.00 0.00 173.24 173.67 2jgl s ILE 294 N -3.89 1.61 -1.53 -1.02 -4.36 -0.92 -4.84 121.20 106.25 2jgl s ILE 294 Ca 0.10 -2.05 -0.09 0.00 -0.26 0.00 0.00 60.65 58.35 2jgl s ILE 294 Cb -0.03 -2.74 0.07 0.00 1.25 0.00 0.00 42.46 41.01 2jgl s ILE 294 CO 0.01 -0.10 0.69 0.33 0.24 0.00 0.00 174.94 176.11 2jgl n PHE 295 N -0.74 -1.84 -3.79 1.37 -0.00 -1.26 -4.83 117.46 106.38 2jgl n PHE 295 Ca -0.04 0.81 -0.13 0.00 -0.00 0.00 0.00 57.45 58.09 2jgl n PHE 295 Cb 0.66 -3.56 -0.12 0.00 -0.00 0.00 0.00 39.48 36.46 2jgl n PHE 295 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.76 177.26 2jgl s ARG 296 N -6.66 0.27 -0.00 -4.13 6.06 -1.26 -4.77 118.95 108.46 2jgl s ARG 296 Ca 0.40 0.34 0.03 0.00 -2.50 0.00 0.00 55.73 54.00 2jgl s ARG 296 Cb -0.21 0.11 -0.01 0.00 0.06 0.00 0.00 34.95 34.90 2jgl s ARG 296 CO 0.89 -0.04 -0.08 -0.06 -2.50 0.00 0.00 175.30 173.50 2jgl s PHE 297 N 0.22 0.74 0.09 5.12 0.08 -1.26 -5.06 117.98 117.92 2jgl s PHE 297 Ca -0.01 -0.15 -0.17 0.00 0.12 0.00 0.00 56.93 56.72 2jgl s PHE 297 Cb -0.02 -0.47 -0.07 0.00 -0.57 0.00 0.00 43.02 41.88 2jgl s PHE 297 CO -0.00 -0.01 1.50 0.77 -0.10 0.00 0.00 175.22 177.37 2jgl h SER 298 N 5.87 0.56 -3.60 1.36 0.02 -1.90 -3.41 113.55 112.45 2jgl h SER 298 Ca -0.30 -0.35 -0.62 0.00 -0.84 0.00 0.00 61.79 59.67 2jgl h SER 298 Cb 1.18 -0.15 -0.39 0.00 0.14 0.00 0.00 62.40 63.18 2jgl h SER 298 CO 0.49 0.78 -0.77 -0.36 -1.14 0.00 0.00 176.83 175.83 2jgl s PHE 299 N -4.81 2.60 0.20 3.45 0.08 -1.26 -5.03 117.98 113.21 2jgl s PHE 299 Ca -0.13 -2.01 -0.00 0.00 0.12 0.00 0.00 56.93 54.91 2jgl s PHE 299 Cb 0.08 -1.85 -0.04 0.00 -0.57 0.00 0.00 43.02 40.64 2jgl s PHE 299 CO 0.77 -0.83 0.09 0.14 -0.10 0.00 0.00 175.22 175.30 2jgl s VAL 300 N 1.32 0.23 0.48 -0.44 -7.23 -1.26 -4.48 120.40 109.02 2jgl s VAL 300 Ca -0.01 -1.98 -0.21 0.00 -1.81 0.00 0.00 61.98 57.96 2jgl s VAL 300 Cb -0.19 -2.41 -0.10 0.00 0.56 0.00 0.00 36.38 34.24 2jgl s VAL 300 CO -0.09 -0.14 0.76 -2.65 -0.31 0.00 0.00 175.10 172.67 2jgl n PRO 301 N -0.28 0.86 -5.26 4.82 -0.02 -1.24 -4.72 135.00 129.16 2jgl n PRO 301 Ca -0.01 0.32 -0.31 0.00 -2.02 0.00 0.00 63.50 61.47 2jgl n PRO 301 Cb 0.65 -1.83 -0.17 0.00 -0.02 0.00 0.00 33.50 32.14 2jgl n PRO 301 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2jgl s VAL 302 N -1.47 2.04 -0.60 -1.45 0.11 -1.26 -1.87 120.40 115.90 2jgl s VAL 302 Ca 0.66 -1.06 -0.27 0.00 -2.93 0.00 0.00 61.98 58.39 2jgl s VAL 302 Cb -0.52 -1.73 -0.02 0.00 -1.53 0.00 0.00 36.38 32.58 2jgl s VAL 302 CO 0.55 0.57 1.83 -0.69 -3.33 0.00 0.00 175.10 174.03 2jgl s VAL 303 N -0.11 3.38 -1.00 2.04 1.01 -0.35 -4.66 120.40 120.71 2jgl s VAL 303 Ca -0.05 0.23 0.16 0.00 0.00 0.00 0.00 61.98 62.32 2jgl s VAL 303 Cb -0.14 -3.97 -0.12 0.00 0.00 0.00 0.00 36.38 32.15 2jgl s VAL 303 CO 0.04 -0.92 0.74 -0.90 0.00 0.00 0.00 175.10 174.06 2jgl n ASP 304 N 12.47 1.04 0.00 3.32 5.75 -1.21 -3.48 116.55 134.43 2jgl n ASP 304 Ca 0.20 -1.02 0.00 0.00 -0.01 0.00 0.00 54.79 53.96 2jgl n ASP 304 Cb 0.52 0.84 0.00 0.00 -1.03 0.00 0.00 41.12 41.44 2jgl n ASP 304 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jgl n GLY 305 N 1.32 0.93 0.00 6.12 0.00 -0.43 -4.88 105.19 108.25 2jgl n GLY 305 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2jgl n GLY 305 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jgl n ASP 306 N -0.00 0.00 0.02 1.61 2.03 -1.26 -4.41 116.55 114.54 2jgl n ASP 306 Ca 0.00 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.21 2jgl n ASP 306 Cb 0.00 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.36 2jgl n ASP 306 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2jgl h PHE 307 N 0.00 -0.18 -3.45 -0.67 3.04 -1.92 -3.33 116.94 110.44 2jgl h PHE 307 Ca 0.00 0.01 -0.71 0.00 3.98 0.00 0.00 57.97 61.25 2jgl h PHE 307 Cb 0.00 0.09 -0.29 0.00 2.56 0.00 0.00 35.95 38.31 2jgl h PHE 307 CO 0.00 -0.11 -0.48 -0.51 -2.02 0.00 0.00 178.31 175.19 2jgl s LEU 308 N -10.32 5.17 0.49 0.59 1.43 -1.26 -4.54 118.68 110.24 2jgl s LEU 308 Ca -0.14 -1.62 0.26 0.00 -1.03 0.00 0.00 54.13 51.60 2jgl s LEU 308 Cb 0.08 -1.95 1.24 0.00 0.03 0.00 0.00 46.19 45.59 2jgl s LEU 308 CO 0.67 -0.54 1.98 0.77 0.23 0.00 0.00 176.35 179.45 2jgl h SER 309 N 8.34 0.00 -2.80 2.29 4.64 -1.77 -1.13 113.55 123.12 2jgl h SER 309 Ca -0.21 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.97 2jgl h SER 309 Cb 1.08 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.13 2jgl h SER 309 CO 0.75 0.17 -0.08 -0.67 -0.87 0.00 0.00 176.83 176.13 2jgl n ASP 310 N -3.55 -0.68 -4.75 4.97 -0.08 -1.26 -4.50 116.55 106.70 2jgl n ASP 310 Ca -0.01 -1.96 -0.36 0.00 -1.51 0.00 0.00 54.79 50.95 2jgl n ASP 310 Cb 0.31 1.28 0.05 0.00 2.34 0.00 0.00 41.12 45.10 2jgl n ASP 310 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 2jgl s THR 311 N -2.62 2.49 0.37 5.18 -4.23 -1.26 -4.81 115.64 110.75 2jgl s THR 311 Ca 0.15 0.30 0.12 0.00 -1.18 0.00 0.00 61.69 61.07 2jgl s THR 311 Cb -0.00 -3.09 0.34 0.00 1.34 0.00 0.00 72.50 71.09 2jgl s THR 311 CO 0.11 -0.07 1.83 -0.65 -0.54 0.00 0.00 174.62 175.30 2jgl h PRO 312 N 0.70 0.57 0.25 3.99 0.11 -1.98 -0.23 132.00 135.41 2jgl h PRO 312 Ca -0.50 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.58 2jgl h PRO 312 Cb 1.30 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2jgl h PRO 312 CO 0.54 0.38 -0.35 1.49 -0.21 0.00 0.00 178.00 179.85 2jgl h GLU 313 N 0.59 -0.64 -0.41 1.05 4.81 -1.90 0.61 114.58 118.68 2jgl h GLU 313 Ca 0.50 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.84 2jgl h GLU 313 Cb 0.98 0.15 -0.06 0.00 0.63 0.00 0.00 28.75 30.45 2jgl h GLU 313 CO -0.24 -0.43 0.05 0.00 -0.73 0.00 0.00 179.01 177.66 2jgl h ALA 314 N -0.14 0.43 -0.01 2.92 0.00 -1.76 -1.38 119.26 119.32 2jgl h ALA 314 Ca -0.00 0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 2jgl h ALA 314 Cb 0.64 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2jgl h ALA 314 CO -0.13 -0.35 -0.54 -0.07 0.00 0.00 0.00 179.25 178.17 2jgl h LEU 315 N 0.17 0.03 0.03 0.00 3.38 -0.54 -2.39 115.31 115.99 2jgl h LEU 315 Ca 0.20 -0.02 -0.25 0.00 0.09 0.00 0.00 57.88 57.91 2jgl h LEU 315 Cb 0.26 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 2jgl h LEU 315 CO -0.29 0.57 -1.24 0.16 0.09 0.00 0.00 178.44 177.72 2jgl h ILE 316 N 0.02 1.44 0.00 1.22 3.07 -0.73 -1.66 117.51 120.88 2jgl h ILE 316 Ca -0.00 -3.16 -0.04 0.00 1.55 0.00 0.00 64.86 63.20 2jgl h ILE 316 Cb 0.96 2.76 -0.01 0.00 -0.27 0.00 0.00 36.82 40.27 2jgl h ILE 316 CO 0.07 0.85 -0.21 0.78 -1.05 0.00 0.00 178.15 178.59 2jgl h ASN 317 N 0.02 0.00 0.00 2.16 2.35 -1.00 -3.32 115.58 115.78 2jgl h ASN 317 Ca -0.11 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2jgl h ASN 317 Cb 1.87 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.24 2jgl h ASN 317 CO 0.13 0.21 0.00 0.35 -1.65 0.00 0.00 177.43 176.47 2jgl n THR 318 N -4.24 0.14 -1.70 2.81 -2.24 -0.92 -5.06 114.28 103.07 2jgl n THR 318 Ca -0.02 -0.53 -0.30 0.00 -2.27 0.00 0.00 64.05 60.93 2jgl n THR 318 Cb 0.27 1.00 0.07 0.00 -2.10 0.00 0.00 70.33 69.57 2jgl n THR 318 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jgl s GLY 319 N -0.14 1.63 -0.19 3.38 0.00 -0.62 -5.05 107.32 106.33 2jgl s GLY 319 Ca 0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 44.72 44.47 2jgl s GLY 319 CO 0.00 0.15 -0.14 -0.35 0.00 0.00 0.00 173.10 172.75 2jgl s ASP 320 N -4.10 3.58 -0.32 1.64 2.15 -1.26 -4.90 116.67 113.45 2jgl s ASP 320 Ca 0.59 -0.54 0.10 0.00 0.43 0.00 0.00 52.55 53.13 2jgl s ASP 320 Cb -0.13 -1.57 0.46 0.00 -0.30 0.00 0.00 42.92 41.38 2jgl s ASP 320 CO 0.53 0.01 1.15 0.49 -0.17 0.00 0.00 175.17 177.18 2jgl n PHE 321 N 4.57 2.56 0.14 -5.34 3.72 -0.42 -4.92 117.46 117.76 2jgl n PHE 321 Ca -0.20 -2.43 -0.14 0.00 -0.05 0.00 0.00 57.45 54.64 2jgl n PHE 321 Cb 0.51 -0.27 -0.08 0.00 -0.94 0.00 0.00 39.48 38.69 2jgl n PHE 321 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 2jgl h GLN 322 N 2.38 -0.32 -1.31 -1.08 1.08 -1.75 -1.71 115.11 112.40 2jgl h GLN 322 Ca 0.25 0.02 -0.43 0.00 -1.45 0.00 0.00 58.65 57.04 2jgl h GLN 322 Cb 1.35 0.07 -0.19 0.00 -0.05 0.00 0.00 27.48 28.66 2jgl h GLN 322 CO 0.67 -0.04 0.55 -0.25 -0.95 0.00 0.00 178.83 178.81 2jgl n ASP 323 N -5.13 6.45 -4.18 1.46 8.00 -1.26 -4.54 116.55 117.34 2jgl n ASP 323 Ca -0.09 -3.27 -0.30 0.00 0.71 0.00 0.00 54.79 51.83 2jgl n ASP 323 Cb 0.23 -0.99 -0.17 0.00 -0.02 0.00 0.00 41.12 40.17 2jgl n ASP 323 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2jgl s LEU 324 N -2.43 2.00 -0.12 0.64 2.96 -1.20 -5.01 118.68 115.52 2jgl s LEU 324 Ca 0.41 -0.50 -0.01 0.00 -0.22 0.00 0.00 54.13 53.81 2jgl s LEU 324 Cb 0.33 -1.29 -0.03 0.00 0.50 0.00 0.00 46.19 45.71 2jgl s LEU 324 CO 0.00 0.14 -0.07 -1.10 -1.32 0.00 0.00 176.35 174.01 2jgl s GLN 325 N 0.35 3.28 -0.02 1.98 1.11 -1.26 -0.67 119.66 124.44 2jgl s GLN 325 Ca -0.17 -0.57 0.01 0.00 0.01 0.00 0.00 55.36 54.65 2jgl s GLN 325 Cb -0.17 -2.74 0.01 0.00 -1.01 0.00 0.00 33.01 29.10 2jgl s GLN 325 CO 0.07 0.39 -0.02 0.08 0.01 0.00 0.00 175.29 175.82 2jgl s VAL 326 N -0.06 0.26 -0.16 1.09 1.01 0.52 -2.35 120.40 120.72 2jgl s VAL 326 Ca 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 61.98 61.93 2jgl s VAL 326 Cb -0.13 -0.28 -0.01 0.00 0.00 0.00 0.00 36.38 35.96 2jgl s VAL 326 CO 0.03 0.12 -0.13 -0.22 0.00 0.00 0.00 175.10 174.90 2jgl s LEU 327 N 0.47 2.62 0.04 3.92 2.96 -0.69 -1.11 118.68 126.90 2jgl s LEU 327 Ca -0.05 -0.41 0.02 0.00 -0.22 0.00 0.00 54.13 53.47 2jgl s LEU 327 Cb -0.08 -1.60 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 2jgl s LEU 327 CO -0.01 0.10 -0.07 0.68 -1.32 0.00 0.00 176.35 175.73 2jgl s VAL 328 N 0.75 0.47 0.05 1.68 -7.23 0.56 -0.64 120.40 116.04 2jgl s VAL 328 Ca -0.05 -1.10 -0.27 0.00 -1.81 0.00 0.00 61.98 58.75 2jgl s VAL 328 Cb -0.15 -0.62 0.09 0.00 0.56 0.00 0.00 36.38 36.26 2jgl s VAL 328 CO 0.01 -0.43 1.21 -0.83 -0.31 0.00 0.00 175.10 174.75 2jgl s GLY 329 N -1.65 -0.06 0.19 2.32 0.00 -1.10 -1.24 107.32 105.77 2jgl s GLY 329 Ca -0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 44.72 44.55 2jgl s GLY 329 CO -0.00 4.49 0.11 -1.34 0.00 0.00 0.00 173.10 176.36 2jgl s VAL 330 N -2.08 0.04 0.30 1.40 -7.23 -1.02 -0.77 120.40 111.05 2jgl s VAL 330 Ca 0.27 -1.98 0.06 0.00 -1.81 0.00 0.00 61.98 58.52 2jgl s VAL 330 Cb -0.01 -2.40 -0.02 0.00 0.56 0.00 0.00 36.38 34.51 2jgl s VAL 330 CO 0.01 -0.11 0.37 0.68 -0.31 0.00 0.00 175.10 175.74 2jgl s VAL 331 N -4.12 4.26 0.49 1.32 -7.23 -1.26 0.08 120.40 113.94 2jgl s VAL 331 Ca 0.35 -1.13 0.16 0.00 -1.81 0.00 0.00 61.98 59.56 2jgl s VAL 331 Cb 0.07 -3.46 0.24 0.00 0.56 0.00 0.00 36.38 33.79 2jgl s VAL 331 CO 0.10 -0.22 2.09 0.50 -0.31 0.00 0.00 175.10 177.25 2jgl h LYS 332 N 1.11 0.00 -2.14 4.82 3.64 -1.29 -3.27 116.57 119.44 2jgl h LYS 332 Ca -0.47 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.36 2jgl h LYS 332 Cb 1.25 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.66 2jgl h LYS 332 CO 0.57 0.08 -0.90 -0.25 -2.27 0.00 0.00 179.45 176.68 2jgl n ASP 333 N -4.40 2.53 -0.08 4.20 9.92 -0.47 -4.92 116.55 123.34 2jgl n ASP 333 Ca -0.03 -3.29 0.13 0.00 -0.53 0.00 0.00 54.79 51.07 2jgl n ASP 333 Cb 0.16 -0.61 0.52 0.00 -0.64 0.00 0.00 41.12 40.55 2jgl n ASP 333 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2jgl h GLU 334 N 3.26 0.35 -0.00 -1.24 4.39 -1.75 -3.13 114.58 116.44 2jgl h GLU 334 Ca 0.12 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2jgl h GLU 334 Cb 0.74 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 2jgl h GLU 334 CO 0.66 0.23 -0.85 0.41 -1.16 0.00 0.00 179.01 178.30 2jgl n GLY 335 N -1.53 -0.79 0.21 -3.84 0.00 -1.25 -4.26 105.19 93.72 2jgl n GLY 335 Ca 0.10 -0.59 -0.15 0.00 0.00 0.00 0.00 46.02 45.38 2jgl n GLY 335 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jgl h SER 336 N 0.53 -0.39 -0.90 1.61 4.64 -1.76 -2.91 113.55 114.35 2jgl h SER 336 Ca 0.00 -0.06 0.23 0.00 -0.47 0.00 0.00 61.79 61.49 2jgl h SER 336 Cb 0.55 0.10 -0.17 0.00 -0.31 0.00 0.00 62.40 62.58 2jgl h SER 336 CO 0.00 -0.18 -0.05 0.00 -0.87 0.00 0.00 176.83 175.73 2jgl n TYR 337 N -5.24 0.50 0.41 4.77 9.36 -1.26 -1.19 117.16 124.51 2jgl n TYR 337 Ca -0.10 1.09 0.13 0.00 3.32 0.00 0.00 57.90 62.34 2jgl n TYR 337 Cb 0.24 -1.13 0.49 0.00 -0.63 0.00 0.00 39.34 38.30 2jgl n TYR 337 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 2jgl h PHE 338 N 0.00 0.00 -0.23 2.98 -1.00 -1.81 -3.29 116.94 113.59 2jgl h PHE 338 Ca 0.51 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 61.12 2jgl h PHE 338 Cb 0.99 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.55 2jgl h PHE 338 CO -0.53 0.00 -0.52 -0.07 -1.61 0.00 0.00 178.31 175.58 2jgl h LEU 339 N 0.00 0.85 -0.17 1.54 3.38 -1.23 -2.78 115.31 116.90 2jgl h LEU 339 Ca 0.00 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.41 2jgl h LEU 339 Cb 0.53 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2jgl h LEU 339 CO 0.00 1.25 0.00 1.33 0.09 0.00 0.00 178.44 181.11 2jgl n VAL 340 N -4.10 1.73 -1.25 1.22 0.24 -1.24 -1.54 118.33 113.39 2jgl n VAL 340 Ca -0.06 0.48 -0.26 0.00 -2.04 0.00 0.00 64.34 62.47 2jgl n VAL 340 Cb 0.61 -1.45 0.16 0.00 -1.47 0.00 0.00 33.84 31.70 2jgl n VAL 340 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2jgl n TYR 341 N -1.60 3.09 0.00 6.34 4.02 -1.05 -4.72 117.16 123.24 2jgl n TYR 341 Ca 0.00 -2.04 0.00 0.00 -0.01 0.00 0.00 57.90 55.86 2jgl n TYR 341 Cb 0.03 -1.03 0.00 0.00 -0.02 0.00 0.00 39.34 38.33 2jgl n TYR 341 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jgl n GLY 342 N -1.11 -0.92 3.43 2.72 0.00 -1.13 -4.90 105.19 103.27 2jgl n GLY 342 Ca 0.60 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.21 2jgl n GLY 342 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jgl s VAL 343 N 0.00 4.90 0.14 1.61 1.01 -0.59 -4.99 120.40 122.48 2jgl s VAL 343 Ca 0.00 -0.69 -0.35 0.00 0.00 0.00 0.00 61.98 60.95 2jgl s VAL 343 Cb 0.00 -3.69 -0.15 0.00 0.00 0.00 0.00 36.38 32.54 2jgl s VAL 343 CO 0.00 -0.22 1.39 -2.65 0.00 0.00 0.00 175.10 173.62 2jgl n PRO 344 N 5.07 1.53 0.00 2.72 -0.02 -1.26 -2.01 135.00 141.03 2jgl n PRO 344 Ca -0.12 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2jgl n PRO 344 Cb 0.47 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2jgl n PRO 344 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgl n GLY 345 N 2.65 0.35 3.49 -1.23 0.00 -1.26 -4.95 105.19 104.24 2jgl n GLY 345 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2jgl n GLY 345 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jgl s PHE 346 N -2.00 3.00 0.03 1.61 0.40 -0.85 -4.50 117.98 115.68 2jgl s PHE 346 Ca 0.00 -0.32 -0.18 0.00 -0.60 0.00 0.00 56.93 55.83 2jgl s PHE 346 Cb 0.00 -1.94 0.04 0.00 0.51 0.00 0.00 43.02 41.63 2jgl s PHE 346 CO 0.00 -0.04 0.41 0.45 0.70 0.00 0.00 175.22 176.74 2jgl s SER 347 N 0.31 -0.29 0.15 1.36 0.15 -1.26 -4.52 113.70 109.61 2jgl s SER 347 Ca -0.04 0.04 0.26 0.00 0.70 0.00 0.00 55.95 56.91 2jgl s SER 347 Cb -0.14 0.41 0.93 0.00 -1.71 0.00 0.00 66.02 65.51 2jgl s SER 347 CO 0.03 -0.63 1.79 2.29 1.20 0.00 0.00 173.24 177.92 2jgl n LYS 348 N 0.62 0.18 0.06 5.44 2.85 -1.26 -3.90 118.16 122.16 2jgl n LYS 348 Ca -0.19 0.19 0.11 0.00 -1.05 0.00 0.00 58.31 57.38 2jgl n LYS 348 Cb 0.59 -1.72 0.00 0.00 -0.65 0.00 0.00 35.03 33.25 2jgl n LYS 348 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2jgl n ASP 349 N -2.03 0.65 -0.24 -5.58 8.00 -1.26 -4.42 116.55 111.67 2jgl n ASP 349 Ca 0.05 0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.67 2jgl n ASP 349 Cb 0.37 0.71 0.00 0.00 -0.02 0.00 0.00 41.12 42.18 2jgl n ASP 349 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2jgl n ASN 350 N -2.36 1.57 -0.52 -2.24 0.23 -1.25 -5.05 115.26 105.64 2jgl n ASN 350 Ca 0.00 -0.13 0.13 0.00 -0.53 0.00 0.00 54.58 54.05 2jgl n ASN 350 Cb 0.51 0.00 0.41 0.00 -2.08 0.00 0.00 39.78 38.62 2jgl n ASN 350 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2jgl n GLU 351 N 0.00 1.61 -4.01 -3.83 1.02 -1.26 -4.86 120.64 109.30 2jgl n GLU 351 Ca 0.00 -1.04 -0.28 0.00 -0.02 0.00 0.00 57.16 55.82 2jgl n GLU 351 Cb 0.00 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 29.92 2jgl n GLU 351 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2jgl n SER 352 N 0.21 -1.15 -4.59 1.62 7.64 -1.26 -4.87 113.62 111.21 2jgl n SER 352 Ca 0.17 -1.00 -0.43 0.00 1.01 0.00 0.00 58.87 58.62 2jgl n SER 352 Cb 0.40 -3.02 -0.03 0.00 -1.01 0.00 0.00 64.21 60.55 2jgl n SER 352 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jgl s LEU 353 N -7.05 3.78 0.52 -3.43 1.43 -1.26 -4.76 118.68 107.91 2jgl s LEU 353 Ca 0.19 0.39 0.01 0.00 -1.03 0.00 0.00 54.13 53.70 2jgl s LEU 353 Cb -0.10 -3.43 0.02 0.00 0.03 0.00 0.00 46.19 42.71 2jgl s LEU 353 CO 0.90 -1.16 0.75 0.27 0.23 0.00 0.00 176.35 177.33 2jgl s ILE 354 N 4.16 3.03 0.45 -0.59 -4.36 -1.25 -4.99 121.20 117.64 2jgl s ILE 354 Ca 0.44 -0.62 0.03 0.00 -0.26 0.00 0.00 60.65 60.24 2jgl s ILE 354 Cb -0.08 -3.13 0.01 0.00 1.25 0.00 0.00 42.46 40.50 2jgl s ILE 354 CO 0.29 -0.09 0.64 -0.94 0.24 0.00 0.00 174.94 175.07 2jgl s SER 355 N -4.37 5.69 0.29 4.36 1.04 -1.26 -4.18 113.70 115.28 2jgl s SER 355 Ca 0.55 0.00 -0.02 0.00 0.48 0.00 0.00 55.95 56.96 2jgl s SER 355 Cb -0.10 -1.17 0.45 0.00 0.10 0.00 0.00 66.02 65.30 2jgl s SER 355 CO 0.38 -0.76 1.93 -0.09 0.98 0.00 0.00 173.24 175.68 2jgl h ARG 356 N 0.46 1.09 -0.35 4.02 2.43 -1.91 -1.00 114.38 119.12 2jgl h ARG 356 Ca -0.44 -0.07 -0.14 0.00 -0.81 0.00 0.00 59.98 58.52 2jgl h ARG 356 Cb 1.27 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 30.56 2jgl h ARG 356 CO 0.53 0.72 -0.36 0.00 -1.51 0.00 0.00 179.97 179.36 2jgl h ALA 357 N 1.48 0.71 -0.21 2.80 0.00 -2.00 -1.26 119.26 120.78 2jgl h ALA 357 Ca 0.36 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2jgl h ALA 357 Cb 0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2jgl h ALA 357 CO -0.11 0.66 -0.12 1.96 0.00 0.00 0.00 179.25 181.64 2jgl h GLN 358 N 0.67 0.34 -0.27 0.00 4.20 -1.86 -2.56 115.11 115.63 2jgl h GLN 358 Ca 0.06 -0.09 -0.10 0.00 0.06 0.00 0.00 58.65 58.58 2jgl h GLN 358 Cb 0.91 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 2jgl h GLN 358 CO 0.08 0.47 -0.23 0.35 -0.67 0.00 0.00 178.83 178.83 2jgl h PHE 359 N 0.32 0.76 -0.65 2.96 3.04 -0.80 -0.82 116.94 121.75 2jgl h PHE 359 Ca 0.06 -0.22 -0.07 0.00 3.98 0.00 0.00 57.97 61.72 2jgl h PHE 359 Cb 0.42 -0.16 -0.03 0.00 2.56 0.00 0.00 35.95 38.74 2jgl h PHE 359 CO 0.01 0.93 0.11 -0.07 -2.02 0.00 0.00 178.31 177.27 2jgl h LEU 360 N 0.37 1.02 0.05 0.59 3.38 -0.89 -2.11 115.31 117.71 2jgl h LEU 360 Ca 0.05 -0.23 -0.24 0.00 0.09 0.00 0.00 57.88 57.54 2jgl h LEU 360 Cb 0.79 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2jgl h LEU 360 CO 0.06 1.01 -1.12 0.00 0.09 0.00 0.00 178.44 178.48 2jgl h ALA 361 N 1.11 0.23 -0.89 1.53 0.00 -1.54 -3.11 119.26 116.60 2jgl h ALA 361 Ca 0.20 -0.88 0.12 0.00 0.00 0.00 0.00 54.91 54.34 2jgl h ALA 361 Cb 0.42 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 2jgl h ALA 361 CO 0.01 1.08 0.57 0.78 0.00 0.00 0.00 179.25 181.70 2jgl h GLY 362 N 2.20 1.25 1.18 0.00 0.00 -0.94 -2.49 103.07 104.26 2jgl h GLY 362 Ca -0.08 -0.34 -0.09 0.00 0.00 0.00 0.00 47.33 46.83 2jgl h GLY 362 CO 0.17 0.15 0.02 -2.08 0.00 0.00 0.00 176.54 174.80 2jgl h VAL 363 N 0.80 1.26 0.00 4.60 2.07 -1.32 -0.77 116.25 122.89 2jgl h VAL 363 Ca 0.43 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.86 2jgl h VAL 363 Cb 0.54 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2jgl h VAL 363 CO -0.19 0.40 0.00 0.03 0.02 0.00 0.00 177.57 177.82 2jgl h ARG 364 N 0.92 0.00 0.04 1.57 2.47 -1.41 0.84 114.38 118.80 2jgl h ARG 364 Ca 0.17 0.00 -0.34 0.00 -1.26 0.00 0.00 59.98 58.55 2jgl h ARG 364 Cb 0.50 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.78 2jgl h ARG 364 CO 0.02 0.00 -2.01 -0.89 0.56 0.00 0.00 179.97 177.65 2jgl n ILE 365 N -2.67 1.60 0.09 2.04 5.41 -0.96 -3.55 119.36 121.33 2jgl n ILE 365 Ca 0.00 -0.74 -0.06 0.00 1.00 0.00 0.00 62.75 62.95 2jgl n ILE 365 Cb 0.21 -1.17 -0.01 0.00 -0.71 0.00 0.00 39.64 37.95 2jgl n ILE 365 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2jgl h GLY 366 N 2.74 0.06 -6.17 7.39 0.00 -0.91 -2.44 103.07 103.73 2jgl h GLY 366 Ca -0.41 -0.12 -0.60 0.00 0.00 0.00 0.00 47.33 46.21 2jgl h GLY 366 CO 0.05 0.10 -0.65 -0.62 0.00 0.00 0.00 176.54 175.43 2jgl n VAL 367 N -3.55 2.05 0.30 4.60 0.31 0.27 -4.85 118.33 117.45 2jgl n VAL 367 Ca -0.01 -5.10 0.18 0.00 -0.01 0.00 0.00 64.34 59.40 2jgl n VAL 367 Cb 0.82 -2.08 0.85 0.00 -0.91 0.00 0.00 33.84 32.52 2jgl n VAL 367 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2jgl h PRO 368 N 4.15 0.00 -0.00 5.55 0.13 -1.70 -1.67 132.00 138.46 2jgl h PRO 368 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2jgl h PRO 368 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 2jgl h PRO 368 CO 0.80 0.00 -0.18 1.04 -0.23 0.00 0.00 178.00 179.43 2jgl n GLN 369 N -2.90 0.33 -2.75 0.86 3.00 -1.26 -4.92 117.38 109.73 2jgl n GLN 369 Ca -0.01 -0.11 -0.42 0.00 -0.01 0.00 0.00 57.00 56.45 2jgl n GLN 369 Cb 0.18 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 28.89 2jgl n GLN 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2jgl s ALA 370 N -2.75 3.21 0.94 -1.58 0.00 -0.63 -5.05 121.76 115.89 2jgl s ALA 370 Ca 0.20 0.47 -0.11 0.00 0.00 0.00 0.00 51.96 52.52 2jgl s ALA 370 Cb 0.19 -3.30 0.16 0.00 0.00 0.00 0.00 23.12 20.17 2jgl s ALA 370 CO 0.55 -0.25 1.10 -1.54 0.00 0.00 0.00 175.76 175.62 2jgl s SER 371 N 0.99 2.88 0.20 0.00 1.04 -1.26 -4.71 113.70 112.84 2jgl s SER 371 Ca 0.50 1.88 -0.14 0.00 0.48 0.00 0.00 55.95 58.66 2jgl s SER 371 Cb -0.20 -2.44 0.21 0.00 0.10 0.00 0.00 66.02 63.69 2jgl s SER 371 CO 0.26 -3.08 1.63 0.44 0.98 0.00 0.00 173.24 173.47 2jgl h ASP 372 N -1.85 -0.57 -0.05 7.02 5.19 -1.99 0.48 116.42 124.65 2jgl h ASP 372 Ca -0.48 0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.11 2jgl h ASP 372 Cb 1.28 0.37 -0.00 0.00 0.18 0.00 0.00 39.33 41.16 2jgl h ASP 372 CO 0.47 -0.20 0.02 0.25 -3.12 0.00 0.00 179.24 176.66 2jgl h LEU 373 N -0.00 0.03 -0.73 1.55 5.85 -1.99 -0.39 115.31 119.63 2jgl h LEU 373 Ca 0.29 0.00 0.06 0.00 0.84 0.00 0.00 57.88 59.07 2jgl h LEU 373 Cb 0.44 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 2jgl h LEU 373 CO -0.62 0.03 0.42 0.00 -0.34 0.00 0.00 178.44 177.93 2jgl h ALA 374 N 1.03 0.98 -0.44 1.25 0.00 -1.73 0.11 119.26 120.46 2jgl h ALA 374 Ca 0.02 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2jgl h ALA 374 Cb 0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2jgl h ALA 374 CO -0.02 0.11 0.13 0.00 0.00 0.00 0.00 179.25 179.47 2jgl h ALA 375 N 1.37 0.58 -0.25 0.00 0.00 -0.72 -1.32 119.26 118.93 2jgl h ALA 375 Ca 0.32 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.10 2jgl h ALA 375 Cb 0.19 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2jgl h ALA 375 CO -0.18 0.24 -0.03 1.49 0.00 0.00 0.00 179.25 180.77 2jgl h GLU 376 N 0.58 0.04 -0.90 0.00 4.57 -0.45 -0.17 114.58 118.24 2jgl h GLU 376 Ca 0.14 -0.00 0.13 0.00 -1.18 0.00 0.00 59.36 58.45 2jgl h GLU 376 Cb 0.28 -0.01 -0.09 0.00 -0.16 0.00 0.00 28.75 28.78 2jgl h GLU 376 CO -0.00 0.03 0.52 0.00 -1.18 0.00 0.00 179.01 178.37 2jgl h ALA 377 N 1.23 1.36 0.11 2.92 0.00 -0.56 0.89 119.26 125.20 2jgl h ALA 377 Ca 0.12 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2jgl h ALA 377 Cb 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2jgl h ALA 377 CO -0.23 0.04 -0.05 0.28 0.00 0.00 0.00 179.25 179.30 2jgl h VAL 378 N 0.78 1.06 -0.54 0.00 2.07 -0.31 -1.55 116.25 117.75 2jgl h VAL 378 Ca 0.47 -0.66 0.09 0.00 0.82 0.00 0.00 66.70 67.42 2jgl h VAL 378 Cb 0.57 1.47 -0.07 0.00 -1.52 0.00 0.00 31.29 31.74 2jgl h VAL 378 CO -0.31 0.16 0.16 0.58 0.02 0.00 0.00 177.57 178.18 2jgl h VAL 379 N -0.45 0.75 -0.22 2.57 2.07 -0.25 -0.98 116.25 119.75 2jgl h VAL 379 Ca -0.01 -0.11 -0.09 0.00 0.82 0.00 0.00 66.70 67.31 2jgl h VAL 379 Cb 0.37 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 2jgl h VAL 379 CO 0.02 0.06 -0.24 -0.07 0.02 0.00 0.00 177.57 177.36 2jgl h LEU 380 N 0.32 0.40 -0.66 2.57 3.38 -0.75 0.73 115.31 121.29 2jgl h LEU 380 Ca 0.27 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 58.00 2jgl h LEU 380 Cb 0.35 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2jgl h LEU 380 CO -0.31 0.64 -0.26 -0.74 0.09 0.00 0.00 178.44 177.86 2jgl h HIS 381 N 0.36 0.88 0.00 1.13 2.76 -0.61 -3.34 115.15 116.33 2jgl h HIS 381 Ca 0.06 -0.21 0.00 0.00 -2.20 0.00 0.00 60.37 58.01 2jgl h HIS 381 Cb 0.62 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.37 2jgl h HIS 381 CO 0.02 0.94 -1.50 0.66 -1.30 0.00 0.00 177.93 176.75 2jgl n TYR 382 N -4.10 0.24 -1.79 5.26 4.02 -0.43 -4.88 117.16 115.48 2jgl n TYR 382 Ca -0.00 0.07 -0.42 0.00 -0.01 0.00 0.00 57.90 57.54 2jgl n TYR 382 Cb 0.45 -0.52 -0.02 0.00 -0.02 0.00 0.00 39.34 39.24 2jgl n TYR 382 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2jgl s THR 383 N -3.37 2.11 -0.55 -0.72 2.01 0.21 -4.89 115.64 110.44 2jgl s THR 383 Ca -0.02 0.09 -0.23 0.00 0.31 0.00 0.00 61.69 61.83 2jgl s THR 383 Cb 0.13 -3.06 0.05 0.00 0.01 0.00 0.00 72.50 69.63 2jgl s THR 383 CO 0.86 0.01 0.88 -0.62 -0.69 0.00 0.00 174.62 175.07 2jgl s ASP 384 N 0.57 6.31 0.02 3.53 -1.08 -1.26 -4.94 116.67 119.83 2jgl s ASP 384 Ca 0.64 -0.48 0.14 0.00 -0.52 0.00 0.00 52.55 52.33 2jgl s ASP 384 Cb -0.48 -2.41 0.61 0.00 -1.46 0.00 0.00 42.92 39.19 2jgl s ASP 384 CO 0.46 -1.17 1.46 0.79 0.52 0.00 0.00 175.17 177.22 2jgl n TRP 385 N 7.23 0.07 0.07 -5.34 7.02 -1.26 -0.69 117.44 124.54 2jgl n TRP 385 Ca -0.00 0.03 -0.13 0.00 -1.02 0.00 0.00 57.50 56.38 2jgl n TRP 385 Cb 0.47 -0.54 -0.05 0.00 -2.42 0.00 0.00 31.31 28.77 2jgl n TRP 385 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 2jgl h LEU 386 N 0.00 0.50 -5.34 -0.99 3.38 -2.04 -3.37 115.31 107.45 2jgl h LEU 386 Ca 0.00 -0.41 -0.55 0.00 0.09 0.00 0.00 57.88 57.01 2jgl h LEU 386 Cb 0.24 -0.15 -0.41 0.00 0.09 0.00 0.00 40.66 40.42 2jgl h LEU 386 CO 0.00 1.21 -0.82 1.41 0.09 0.00 0.00 178.44 180.33 2jgl n HIS 387 N -3.73 2.86 0.28 1.13 8.25 0.14 -4.97 115.22 119.18 2jgl n HIS 387 Ca -0.06 -3.77 0.13 0.00 -0.26 0.00 0.00 57.72 53.76 2jgl n HIS 387 Cb 0.84 -0.41 0.79 0.00 1.12 0.00 0.00 29.99 32.33 2jgl n HIS 387 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2jgl h PRO 388 N 2.93 0.00 -0.02 -0.41 0.13 -1.34 -2.97 132.00 130.32 2jgl h PRO 388 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2jgl h PRO 388 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2jgl h PRO 388 CO 0.73 0.07 0.00 0.39 -0.23 0.00 0.00 178.00 178.95 2jgl n GLU 389 N -3.82 -0.05 -1.80 0.86 1.02 -1.26 -4.86 120.64 110.72 2jgl n GLU 389 Ca -0.02 -0.88 -0.42 0.00 -0.02 0.00 0.00 57.16 55.81 2jgl n GLU 389 Cb 0.16 -1.11 -0.03 0.00 -0.02 0.00 0.00 31.44 30.45 2jgl n GLU 389 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2jgl s ASP 390 N -0.49 6.52 0.23 1.62 2.15 -1.12 -4.71 116.67 120.87 2jgl s ASP 390 Ca 0.07 2.49 -0.08 0.00 0.43 0.00 0.00 52.55 55.46 2jgl s ASP 390 Cb 0.05 -2.53 0.22 0.00 -0.30 0.00 0.00 42.92 40.35 2jgl s ASP 390 CO 0.07 -1.02 1.91 1.55 -0.17 0.00 0.00 175.17 177.51 2jgl h PRO 391 N 10.25 1.20 -0.99 4.34 0.13 -1.92 -2.31 132.00 142.71 2jgl h PRO 391 Ca -0.46 -0.08 0.01 0.00 -0.87 0.00 0.00 66.00 64.61 2jgl h PRO 391 Cb 1.21 -0.27 -0.05 0.00 0.13 0.00 0.00 31.00 32.03 2jgl h PRO 391 CO 0.95 0.81 0.66 1.15 -0.23 0.00 0.00 178.00 181.33 2jgl h THR 392 N 1.24 1.25 -0.05 1.56 2.02 -1.92 -1.10 112.91 115.91 2jgl h THR 392 Ca 0.33 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 2jgl h THR 392 Cb -0.13 -0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 66.08 2jgl h THR 392 CO -0.07 0.24 -0.02 0.45 0.37 0.00 0.00 175.52 176.49 2jgl h HIS 393 N 1.34 0.11 -0.97 3.16 3.86 -1.89 -2.62 115.15 118.14 2jgl h HIS 393 Ca 0.36 -0.03 0.10 0.00 -1.16 0.00 0.00 60.37 59.64 2jgl h HIS 393 Cb -0.15 -0.03 -0.08 0.00 1.06 0.00 0.00 27.41 28.22 2jgl h HIS 393 CO -0.00 0.48 0.61 -0.07 0.86 0.00 0.00 177.93 179.81 2jgl h LEU 394 N -0.29 0.91 0.65 2.43 3.38 -1.23 0.15 115.31 121.31 2jgl h LEU 394 Ca 0.01 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2jgl h LEU 394 Cb 0.45 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.06 2jgl h LEU 394 CO 0.01 0.52 -0.31 -0.09 0.09 0.00 0.00 178.44 178.66 2jgl h ARG 395 N 1.01 -0.85 -0.12 1.13 1.12 -1.24 -1.84 114.38 113.59 2jgl h ARG 395 Ca 0.46 0.06 0.03 0.00 -1.11 0.00 0.00 59.98 59.42 2jgl h ARG 395 Cb 0.36 0.19 -0.00 0.00 -0.01 0.00 0.00 29.97 30.51 2jgl h ARG 395 CO -0.23 -0.53 0.10 -0.44 -3.11 0.00 0.00 179.97 175.76 2jgl h ASP 396 N -1.03 0.00 -0.17 -3.80 3.32 -1.04 -1.37 116.42 112.34 2jgl h ASP 396 Ca -0.09 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.82 2jgl h ASP 396 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 2jgl h ASP 396 CO 0.15 0.00 -0.43 0.00 -1.72 0.00 0.00 179.24 177.24 2jgl h ALA 397 N 1.92 0.27 -0.52 3.45 0.00 -0.64 -0.72 119.26 123.02 2jgl h ALA 397 Ca 0.06 -0.47 0.05 0.00 0.00 0.00 0.00 54.91 54.55 2jgl h ALA 397 Cb 0.25 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2jgl h ALA 397 CO -0.00 0.40 0.26 1.98 0.00 0.00 0.00 179.25 181.89 2jgl h MET 398 N 0.23 0.49 0.28 0.00 1.85 -0.40 0.37 114.93 117.75 2jgl h MET 398 Ca -0.01 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 59.06 2jgl h MET 398 Cb 1.04 -0.11 -0.03 0.00 0.43 0.00 0.00 31.60 32.93 2jgl h MET 398 CO 0.09 0.33 -0.32 1.03 -0.40 0.00 0.00 176.91 177.64 2jgl h SER 399 N 0.51 -0.88 -0.42 1.39 0.87 -1.31 -2.63 113.55 111.08 2jgl h SER 399 Ca 0.23 0.08 0.07 0.00 -1.23 0.00 0.00 61.79 60.94 2jgl h SER 399 Cb 0.14 0.31 -0.06 0.00 -0.44 0.00 0.00 62.40 62.35 2jgl h SER 399 CO -0.16 -0.44 0.07 0.00 -0.53 0.00 0.00 176.83 175.76 2jgl h ALA 400 N -0.09 0.44 -0.53 6.23 0.00 -0.65 -0.94 119.26 123.73 2jgl h ALA 400 Ca -0.01 0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.10 2jgl h ALA 400 Cb 0.60 0.13 -0.11 0.00 0.00 0.00 0.00 17.79 18.42 2jgl h ALA 400 CO -0.09 -0.34 -0.21 0.28 0.00 0.00 0.00 179.25 178.90 2jgl h VAL 401 N 0.19 0.34 0.18 0.00 2.07 -0.17 0.20 116.25 119.07 2jgl h VAL 401 Ca 0.21 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.72 2jgl h VAL 401 Cb 0.26 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 2jgl h VAL 401 CO -0.29 0.00 -0.09 0.58 0.02 0.00 0.00 177.57 177.80 2jgl h VAL 402 N -0.09 0.92 -0.53 2.57 2.07 -1.08 -0.39 116.25 119.71 2jgl h VAL 402 Ca 0.25 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 2jgl h VAL 402 Cb 0.47 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 2jgl h VAL 402 CO -0.59 0.13 0.29 1.23 0.02 0.00 0.00 177.57 178.65 2jgl h GLY 403 N -0.52 0.79 0.74 2.17 0.00 -0.95 -1.59 103.07 103.70 2jgl h GLY 403 Ca -0.03 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 2jgl h GLY 403 CO 0.04 0.34 -0.08 -0.55 0.00 0.00 0.00 176.54 176.29 2jgl h ASP 404 N 0.71 -0.19 -0.85 0.19 3.32 -0.62 0.34 116.42 119.32 2jgl h ASP 404 Ca 0.19 -0.20 0.05 0.00 0.02 0.00 0.00 57.03 57.09 2jgl h ASP 404 Cb 0.04 0.05 -0.06 0.00 0.22 0.00 0.00 39.33 39.58 2jgl h ASP 404 CO -0.03 0.10 0.53 -0.74 -1.72 0.00 0.00 179.24 177.38 2jgl h HIS 405 N -0.49 0.98 0.02 4.55 2.76 -1.00 -1.66 115.15 120.31 2jgl h HIS 405 Ca -0.02 0.03 -0.35 0.00 -2.20 0.00 0.00 60.37 57.82 2jgl h HIS 405 Cb 0.38 -0.32 -0.06 0.00 1.55 0.00 0.00 27.41 28.96 2jgl h HIS 405 CO 0.01 0.52 -2.16 0.09 -1.30 0.00 0.00 177.93 175.09 2jgl n ASN 406 N -4.61 0.85 0.05 3.26 3.02 -0.61 -4.55 115.26 112.67 2jgl n ASN 406 Ca 0.12 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.79 2jgl n ASN 406 Cb 0.15 0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.54 2jgl n ASN 406 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2jgl n VAL 407 N -3.01 1.02 0.03 2.41 0.31 0.11 -4.71 118.33 114.47 2jgl n VAL 407 Ca -0.30 0.34 -0.12 0.00 -0.01 0.00 0.00 64.34 64.24 2jgl n VAL 407 Cb 1.09 -1.53 -0.08 0.00 -0.91 0.00 0.00 33.84 32.41 2jgl n VAL 407 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2jgl h VAL 408 N 0.00 1.12 -0.30 2.52 2.07 -1.26 0.27 116.25 120.67 2jgl h VAL 408 Ca 0.00 -0.36 -0.11 0.00 0.82 0.00 0.00 66.70 67.05 2jgl h VAL 408 Cb 0.14 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 2jgl h VAL 408 CO 0.00 0.09 -0.25 0.00 0.02 0.00 0.00 177.57 177.44 2jgl h PRO 410 N 0.44 0.97 -0.14 0.00 0.11 -1.71 -1.38 132.00 130.29 2jgl h PRO 410 Ca 0.05 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 2jgl h PRO 410 Cb 0.80 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.69 2jgl h PRO 410 CO 0.06 0.64 0.08 0.28 -0.21 0.00 0.00 178.00 178.85 2jgl h VAL 411 N 1.00 1.08 -0.66 3.15 2.07 -0.69 -1.08 116.25 121.12 2jgl h VAL 411 Ca 0.45 -0.22 0.06 0.00 0.82 0.00 0.00 66.70 67.81 2jgl h VAL 411 Cb 0.38 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 2jgl h VAL 411 CO -0.21 0.08 0.36 0.00 0.02 0.00 0.00 177.57 177.82 2jgl h ALA 412 N 0.99 0.88 -0.02 1.67 0.00 -0.87 0.29 119.26 122.20 2jgl h ALA 412 Ca 0.05 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2jgl h ALA 412 Cb 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2jgl h ALA 412 CO -0.01 0.04 -0.05 0.37 0.00 0.00 0.00 179.25 179.60 2jgl h GLN 413 N 0.67 -0.07 -0.44 0.00 5.75 -1.17 -0.29 115.11 119.56 2jgl h GLN 413 Ca 0.29 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.79 2jgl h GLN 413 Cb 0.18 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.73 2jgl h GLN 413 CO -0.18 -0.05 0.26 1.25 -2.65 0.00 0.00 178.83 177.46 2jgl h LEU 414 N -0.07 0.54 -0.52 -2.39 5.85 -0.51 -1.78 115.31 116.43 2jgl h LEU 414 Ca 0.03 -0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.72 2jgl h LEU 414 Cb 0.11 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 2jgl h LEU 414 CO -0.07 0.46 0.26 0.00 -0.34 0.00 0.00 178.44 178.75 2jgl h ALA 415 N 1.11 0.67 -0.22 1.25 0.00 -0.24 -1.37 119.26 120.45 2jgl h ALA 415 Ca 0.16 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2jgl h ALA 415 Cb 0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2jgl h ALA 415 CO -0.03 -0.09 0.02 0.78 0.00 0.00 0.00 179.25 179.94 2jgl h GLY 416 N 0.50 0.40 0.91 0.00 0.00 -0.84 -1.96 103.07 102.08 2jgl h GLY 416 Ca 0.23 -0.28 -0.07 0.00 0.00 0.00 0.00 47.33 47.22 2jgl h GLY 416 CO -0.17 0.26 -0.06 3.21 0.00 0.00 0.00 176.54 179.78 2jgl h ARG 417 N 0.16 0.60 -0.50 4.80 2.47 -1.21 -1.69 114.38 119.02 2jgl h ARG 417 Ca 0.07 -0.22 0.02 0.00 -1.26 0.00 0.00 59.98 58.59 2jgl h ARG 417 Cb 0.35 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.60 2jgl h ARG 417 CO 0.01 0.77 0.30 -0.07 0.56 0.00 0.00 179.97 181.54 2jgl h LEU 418 N 0.39 0.48 -0.16 3.04 3.38 -1.23 -1.35 115.31 119.85 2jgl h LEU 418 Ca 0.08 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2jgl h LEU 418 Cb 0.54 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2jgl h LEU 418 CO 0.03 0.34 0.03 0.00 0.09 0.00 0.00 178.44 178.93 2jgl h ALA 419 N 1.22 0.22 -0.26 1.53 0.00 -1.29 -0.17 119.26 120.51 2jgl h ALA 419 Ca 0.20 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2jgl h ALA 419 Cb 0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2jgl h ALA 419 CO -0.09 -0.12 0.18 0.00 0.00 0.00 0.00 179.25 179.22 2jgl h ALA 420 N 0.81 1.99 -0.60 0.00 0.00 -1.12 -2.99 119.26 117.35 2jgl h ALA 420 Ca 0.05 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.59 2jgl h ALA 420 Cb 0.31 -0.05 -0.21 0.00 0.00 0.00 0.00 17.79 17.84 2jgl h ALA 420 CO 0.00 -0.04 0.06 1.04 0.00 0.00 0.00 179.25 180.32 2jgl n GLN 421 N -4.49 2.26 0.00 0.00 6.02 -0.52 -4.94 117.38 115.70 2jgl n GLN 421 Ca 0.02 -3.32 0.00 0.00 -0.01 0.00 0.00 57.00 53.69 2jgl n GLN 421 Cb 0.19 -2.00 0.00 0.00 1.02 0.00 0.00 30.24 29.44 2jgl n GLN 421 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jgl n GLY 422 N -1.05 2.83 3.79 1.08 0.00 -1.13 -1.30 105.19 109.42 2jgl n GLY 422 Ca 0.43 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.12 2jgl n GLY 422 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jgl s ALA 423 N -2.52 2.65 -0.22 4.61 0.00 -0.10 -4.28 121.76 121.89 2jgl s ALA 423 Ca 0.00 0.43 -0.13 0.00 0.00 0.00 0.00 51.96 52.26 2jgl s ALA 423 Cb 0.00 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.82 2jgl s ALA 423 CO 0.00 -0.99 0.27 0.50 0.00 0.00 0.00 175.76 175.54 2jgl s ARG 424 N -4.13 4.13 -0.05 0.00 3.52 0.15 -4.43 118.95 118.15 2jgl s ARG 424 Ca 0.64 -0.05 0.02 0.00 -0.13 0.00 0.00 55.73 56.22 2jgl s ARG 424 Cb -0.17 -3.52 0.01 0.00 -1.56 0.00 0.00 34.95 29.70 2jgl s ARG 424 CO 0.39 0.04 -0.10 0.08 -0.81 0.00 0.00 175.30 174.90 2jgl s VAL 425 N 1.09 0.93 -0.10 7.11 1.01 -1.26 -0.36 120.40 128.82 2jgl s VAL 425 Ca 0.13 -0.40 0.03 0.00 0.00 0.00 0.00 61.98 61.74 2jgl s VAL 425 Cb -0.14 -0.85 0.01 0.00 0.00 0.00 0.00 36.38 35.40 2jgl s VAL 425 CO 0.06 0.30 -0.21 -0.31 0.00 0.00 0.00 175.10 174.94 2jgl s TYR 426 N 0.48 2.34 0.17 5.22 1.51 -0.26 0.58 117.35 127.38 2jgl s TYR 426 Ca -0.09 -1.02 0.10 0.00 -1.01 0.00 0.00 57.07 55.04 2jgl s TYR 426 Cb -0.13 -1.60 -0.04 0.00 -0.11 0.00 0.00 41.96 40.08 2jgl s TYR 426 CO 0.02 -0.45 -0.16 0.00 -1.11 0.00 0.00 175.55 173.85 2jgl s ALA 427 N 0.59 2.77 0.09 3.71 0.00 -1.25 -0.32 121.76 127.34 2jgl s ALA 427 Ca -0.14 -1.50 -0.07 0.00 0.00 0.00 0.00 51.96 50.25 2jgl s ALA 427 Cb -0.17 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2jgl s ALA 427 CO 0.04 0.48 0.16 1.52 0.00 0.00 0.00 175.76 177.96 2jgl s TYR 428 N -1.57 0.27 -0.08 0.00 -0.85 -0.37 -2.29 117.35 112.45 2jgl s TYR 428 Ca 0.22 -0.71 0.03 0.00 -0.52 0.00 0.00 57.07 56.09 2jgl s TYR 428 Cb -0.09 -0.13 0.01 0.00 0.38 0.00 0.00 41.96 42.13 2jgl s TYR 428 CO 0.12 -0.53 -0.17 -1.50 -1.52 0.00 0.00 175.55 171.95 2jgl s ILE 429 N -3.89 1.54 -0.18 -3.49 2.07 -0.10 -2.44 121.20 114.71 2jgl s ILE 429 Ca 0.07 -0.72 -0.15 0.00 -1.41 0.00 0.00 60.65 58.44 2jgl s ILE 429 Cb 0.05 -1.36 -0.04 0.00 0.13 0.00 0.00 42.46 41.25 2jgl s ILE 429 CO -0.09 0.44 0.37 0.12 -1.91 0.00 0.00 174.94 173.87 2jgl s PHE 430 N 0.46 3.42 0.00 3.50 2.19 0.11 -0.05 117.98 127.61 2jgl s PHE 430 Ca -0.15 0.64 0.00 0.00 0.33 0.00 0.00 56.93 57.75 2jgl s PHE 430 Cb -0.16 -2.46 0.00 0.00 -1.31 0.00 0.00 43.02 39.09 2jgl s PHE 430 CO 0.06 0.10 0.19 0.39 1.83 0.00 0.00 175.22 177.79 2jgl n GLU 431 N 4.04 0.72 -2.83 10.12 1.02 0.47 -1.21 120.64 132.97 2jgl n GLU 431 Ca -0.10 -0.19 -0.42 0.00 -0.02 0.00 0.00 57.16 56.44 2jgl n GLU 431 Cb 0.51 -0.62 -0.04 0.00 -0.02 0.00 0.00 31.44 31.28 2jgl n GLU 431 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2jgl s HIS 432 N -0.16 3.38 -0.23 -0.32 2.46 -1.23 -4.92 115.29 114.27 2jgl s HIS 432 Ca 0.00 1.29 -0.19 0.00 0.47 0.00 0.00 55.06 56.62 2jgl s HIS 432 Cb 0.00 -3.08 -0.03 0.00 -0.13 0.00 0.00 32.58 29.34 2jgl s HIS 432 CO 0.00 -0.32 0.58 0.50 -2.47 0.00 0.00 174.74 173.03 2jgl s ARG 433 N 2.51 4.14 0.32 2.88 3.52 -1.26 -4.94 118.95 126.12 2jgl s ARG 433 Ca 0.39 0.48 -0.29 0.00 -0.13 0.00 0.00 55.73 56.19 2jgl s ARG 433 Cb -0.16 -3.61 -0.12 0.00 -1.56 0.00 0.00 34.95 29.49 2jgl s ARG 433 CO 0.10 -0.30 1.42 0.00 -0.81 0.00 0.00 175.30 175.72 2jgl n ALA 434 N 5.31 1.75 0.06 6.12 0.00 -1.26 -4.89 120.51 127.60 2jgl n ALA 434 Ca -0.02 0.37 0.03 0.00 0.00 0.00 0.00 53.44 53.82 2jgl n ALA 434 Cb 0.50 -2.34 0.41 0.00 0.00 0.00 0.00 19.45 18.02 2jgl n ALA 434 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2jgl h SER 435 N 3.50 0.36 -0.04 0.00 4.64 -1.96 -2.72 113.55 117.33 2jgl h SER 435 Ca -0.47 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2jgl h SER 435 Cb 1.26 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2jgl h SER 435 CO 0.69 0.36 0.00 0.35 -0.87 0.00 0.00 176.83 177.36 2jgl n THR 436 N -4.39 0.05 -2.06 2.95 -2.24 -1.26 -4.94 114.28 102.40 2jgl n THR 436 Ca 0.01 -0.07 -0.41 0.00 -2.27 0.00 0.00 64.05 61.30 2jgl n THR 436 Cb 0.16 -0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.23 2jgl n THR 436 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2jgl s LEU 437 N -1.50 4.39 0.03 3.22 2.96 -1.03 -4.91 118.68 121.84 2jgl s LEU 437 Ca 0.26 2.59 0.22 0.00 -0.22 0.00 0.00 54.13 56.98 2jgl s LEU 437 Cb 0.12 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.15 2jgl s LEU 437 CO 0.20 -0.67 0.94 0.35 -1.32 0.00 0.00 176.35 175.84 2jgl n THR 438 N 2.64 0.12 -2.04 3.68 -2.24 -1.26 -4.91 114.28 110.26 2jgl n THR 438 Ca 0.08 -0.23 -0.32 0.00 -2.27 0.00 0.00 64.05 61.30 2jgl n THR 438 Cb 0.41 0.31 0.01 0.00 -2.10 0.00 0.00 70.33 68.96 2jgl n THR 438 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 2jgl s TRP 439 N -3.20 3.05 1.12 4.78 0.52 -1.26 -4.94 118.94 119.01 2jgl s TRP 439 Ca 0.03 1.50 -0.14 0.00 0.02 0.00 0.00 56.10 57.51 2jgl s TRP 439 Cb 0.15 -2.97 0.25 0.00 -1.15 0.00 0.00 33.47 29.75 2jgl s TRP 439 CO 0.83 -1.05 1.05 -1.25 0.02 0.00 0.00 176.95 176.55 2jgl s PRO 440 N -4.16 -0.58 0.36 4.98 0.04 -1.26 -4.93 135.00 129.45 2jgl s PRO 440 Ca 0.63 0.55 0.09 0.00 0.04 0.00 0.00 61.00 62.31 2jgl s PRO 440 Cb -0.15 -1.62 0.69 0.00 0.04 0.00 0.00 34.50 33.46 2jgl s PRO 440 CO 0.38 -3.42 1.84 -0.07 0.04 0.00 0.00 177.00 175.78 2jgl h LEU 441 N -2.39 0.19 -0.49 -3.56 3.38 -1.94 -3.14 115.31 107.36 2jgl h LEU 441 Ca -0.57 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.35 2jgl h LEU 441 Cb 1.33 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2jgl h LEU 441 CO 0.52 0.45 0.00 -2.67 0.09 0.00 0.00 178.44 176.82 2jgl n TRP 442 N -4.18 0.47 1.05 1.13 4.27 -1.26 -1.61 117.44 117.32 2jgl n TRP 442 Ca -0.01 0.19 0.13 0.00 -3.89 0.00 0.00 57.50 53.92 2jgl n TRP 442 Cb 0.35 -0.81 0.38 0.00 -1.36 0.00 0.00 31.31 29.86 2jgl n TRP 442 CO 0.00 0.00 0.00 -1.33 -2.29 0.00 0.00 177.69 174.07 2jgl n MET 443 N -1.94 0.13 0.00 -2.67 2.81 -1.19 -5.00 117.12 109.26 2jgl n MET 443 Ca 0.02 -0.06 0.00 0.00 -1.81 0.00 0.00 57.70 55.85 2jgl n MET 443 Cb 0.17 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 2jgl n MET 443 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jgl n GLY 444 N 1.47 4.03 3.28 3.03 0.00 -0.63 -3.64 105.19 112.72 2jgl n GLY 444 Ca 0.07 0.04 -0.45 0.00 0.00 0.00 0.00 46.02 45.69 2jgl n GLY 444 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jgl s VAL 445 N 0.00 5.05 0.57 1.61 1.01 -1.26 -4.85 120.40 122.53 2jgl s VAL 445 Ca 0.00 -2.03 -0.14 0.00 0.00 0.00 0.00 61.98 59.81 2jgl s VAL 445 Cb 0.00 -4.21 -0.06 0.00 0.00 0.00 0.00 36.38 32.11 2jgl s VAL 445 CO 0.00 -0.91 1.01 -2.84 0.00 0.00 0.00 175.10 172.36 2jgl s PRO 446 N 0.90 3.76 -0.17 2.72 0.02 -1.24 -1.37 135.00 139.61 2jgl s PRO 446 Ca 0.10 0.88 -0.41 0.00 0.02 0.00 0.00 61.00 61.58 2jgl s PRO 446 Cb -0.21 -2.11 -0.19 0.00 0.02 0.00 0.00 34.50 32.01 2jgl s PRO 446 CO -0.03 -0.43 1.38 1.58 -0.33 0.00 0.00 177.00 179.17 2jgl n HIS 447 N -2.13 1.34 0.00 6.54 -0.00 -1.23 -2.15 115.22 117.59 2jgl n HIS 447 Ca 0.06 0.93 0.00 0.00 -0.00 0.00 0.00 57.72 58.71 2jgl n HIS 447 Cb 0.54 -2.23 0.00 0.00 -0.00 0.00 0.00 29.99 28.30 2jgl n HIS 447 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2jgl n GLY 448 N 2.83 0.93 1.22 1.57 0.00 -1.26 -4.96 105.19 105.52 2jgl n GLY 448 Ca 0.24 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.33 2jgl n GLY 448 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2jgl n TYR 449 N -2.00 1.06 0.05 1.61 4.02 -0.91 -3.36 117.16 117.63 2jgl n TYR 449 Ca 0.00 -0.43 0.04 0.00 -0.01 0.00 0.00 57.90 57.49 2jgl n TYR 449 Cb 0.00 -0.16 -0.06 0.00 -0.02 0.00 0.00 39.34 39.10 2jgl n TYR 449 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 2jgl n GLU 450 N 0.85 0.62 -0.01 -0.72 0.00 -1.26 -4.54 120.64 115.57 2jgl n GLU 450 Ca 0.19 0.18 -0.09 0.00 0.00 0.00 0.00 57.16 57.44 2jgl n GLU 450 Cb 0.66 -1.80 -0.03 0.00 0.00 0.00 0.00 31.44 30.27 2jgl n GLU 450 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 2jgl h ILE 451 N 0.00 0.56 -0.44 3.84 2.04 -1.94 -0.71 117.51 120.87 2jgl h ILE 451 Ca -0.12 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.87 2jgl h ILE 451 Cb 1.40 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 2jgl h ILE 451 CO 0.03 0.00 0.37 1.05 0.00 0.00 0.00 178.15 179.60 2jgl h GLU 452 N -0.19 0.00 0.00 2.37 4.11 -1.80 -1.08 114.58 118.00 2jgl h GLU 452 Ca 0.11 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.53 2jgl h GLU 452 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2jgl h GLU 452 CO -0.27 0.00 -0.00 0.74 0.07 0.00 0.00 179.01 179.54 2jgl h PHE 453 N 0.00 0.00 -0.99 2.06 0.04 -1.42 -1.36 116.94 115.27 2jgl h PHE 453 Ca 0.21 -0.00 0.15 0.00 2.80 0.00 0.00 57.97 61.13 2jgl h PHE 453 Cb 0.94 -0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.99 2jgl h PHE 453 CO 0.00 0.94 0.62 0.82 -0.60 0.00 0.00 178.31 180.09 2jgl h ILE 454 N -0.93 0.82 0.00 -0.55 1.08 -1.02 -2.32 117.51 114.58 2jgl h ILE 454 Ca -0.00 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.17 2jgl h ILE 454 Cb 0.94 -0.12 0.00 0.00 -3.07 0.00 0.00 36.82 34.57 2jgl h ILE 454 CO 0.00 0.16 0.00 0.49 -0.69 0.00 0.00 178.15 178.11 2jgl n PHE 455 N -4.67 0.97 -0.26 1.37 3.01 -0.44 -4.48 117.46 112.94 2jgl n PHE 455 Ca 0.21 0.28 0.00 0.00 1.01 0.00 0.00 57.45 58.95 2jgl n PHE 455 Cb 0.47 -0.96 0.00 0.00 -0.01 0.00 0.00 39.48 38.98 2jgl n PHE 455 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jgl n GLY 456 N 1.27 0.84 0.27 1.37 0.00 -0.87 -4.13 105.19 103.95 2jgl n GLY 456 Ca 0.05 -0.23 0.04 0.00 0.00 0.00 0.00 46.02 45.89 2jgl n GLY 456 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jgl h LEU 457 N 0.00 0.30 0.00 0.99 4.07 -1.49 -0.94 115.31 118.24 2jgl h LEU 457 Ca 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2jgl h LEU 457 Cb 0.00 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 41.66 2jgl h LEU 457 CO 0.00 0.31 0.00 -2.65 -1.08 0.00 0.00 178.44 175.02 2jgl n PRO 458 N -4.41 0.00 0.00 1.13 -0.02 -1.26 -1.79 135.00 128.66 2jgl n PRO 458 Ca 0.00 0.42 0.14 0.00 -2.02 0.00 0.00 63.50 62.04 2jgl n PRO 458 Cb 0.15 -1.50 0.62 0.00 -0.02 0.00 0.00 33.50 32.75 2jgl n PRO 458 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2jgl n LEU 459 N -1.43 0.00 -4.55 2.45 4.32 -0.36 -4.58 117.00 112.85 2jgl n LEU 459 Ca 0.00 0.47 -0.43 0.00 -0.02 0.00 0.00 56.01 56.03 2jgl n LEU 459 Cb 0.01 -0.47 -0.04 0.00 -1.62 0.00 0.00 43.42 41.29 2jgl n LEU 459 CO 0.01 -0.01 0.72 -0.62 -1.22 0.00 0.00 177.39 176.26 2jgl s ASP 460 N -2.94 6.45 0.41 -1.43 -1.08 -0.74 -4.79 116.67 112.56 2jgl s ASP 460 Ca 0.16 -0.01 0.09 0.00 -0.52 0.00 0.00 52.55 52.27 2jgl s ASP 460 Cb 0.19 -2.44 0.86 0.00 -1.46 0.00 0.00 42.92 40.07 2jgl s ASP 460 CO 0.50 -1.06 2.00 -0.65 0.52 0.00 0.00 175.17 176.48 2jgl h PRO 461 N 9.11 0.36 0.00 4.34 0.11 -1.88 -1.50 132.00 142.55 2jgl h PRO 461 Ca -0.25 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2jgl h PRO 461 Cb 1.08 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2jgl h PRO 461 CO 1.03 0.34 0.00 -1.13 -0.21 0.00 0.00 178.00 178.02 2jgl n SER 462 N -4.40 0.00 0.00 -2.05 3.41 -1.26 -2.84 113.62 106.48 2jgl n SER 462 Ca 0.01 0.04 0.12 0.00 -0.26 0.00 0.00 58.87 58.77 2jgl n SER 462 Cb 0.15 -0.24 0.16 0.00 -0.26 0.00 0.00 64.21 64.03 2jgl n SER 462 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jgl n LEU 463 N -1.24 0.60 -0.47 1.04 4.77 -0.56 -4.98 117.00 116.16 2jgl n LEU 463 Ca 0.06 -0.08 -0.05 0.00 -0.03 0.00 0.00 56.01 55.92 2jgl n LEU 463 Cb 0.09 -0.19 -0.01 0.00 -2.33 0.00 0.00 43.42 40.98 2jgl n LEU 463 CO 0.09 0.13 -0.05 0.59 -1.33 0.00 0.00 177.39 176.82 2jgl n ASN 464 N -1.56 -2.68 -4.80 -1.43 3.02 -1.13 -5.03 115.26 101.65 2jgl n ASN 464 Ca 0.05 0.04 -0.34 0.00 -0.03 0.00 0.00 54.58 54.30 2jgl n ASN 464 Cb 0.35 -1.49 -0.06 0.00 -0.61 0.00 0.00 39.78 37.97 2jgl n ASN 464 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2jgl s TYR 465 N -2.21 3.36 0.75 3.10 2.02 -1.26 -4.87 117.35 118.24 2jgl s TYR 465 Ca 0.00 1.65 -0.13 0.00 -0.37 0.00 0.00 57.07 58.22 2jgl s TYR 465 Cb 0.00 -2.92 0.05 0.00 -0.40 0.00 0.00 41.96 38.69 2jgl s TYR 465 CO 0.00 -0.17 1.14 0.95 -1.57 0.00 0.00 175.55 175.89 2jgl s THR 466 N -1.97 2.81 0.34 -0.71 -4.23 -1.26 -4.85 115.64 105.77 2jgl s THR 466 Ca 0.59 0.33 0.18 0.00 -1.18 0.00 0.00 61.69 61.62 2jgl s THR 466 Cb -0.13 -2.77 0.16 0.00 1.34 0.00 0.00 72.50 71.10 2jgl s THR 466 CO 0.18 -0.28 1.88 0.00 -0.54 0.00 0.00 174.62 175.86 2jgl h THR 467 N -0.69 0.99 -0.52 3.99 1.03 -1.97 -1.55 112.91 114.19 2jgl h THR 467 Ca -0.45 -1.10 -0.09 0.00 -0.01 0.00 0.00 66.41 64.75 2jgl h THR 467 Cb 1.26 1.64 -0.02 0.00 -1.07 0.00 0.00 68.15 69.95 2jgl h THR 467 CO 0.50 0.29 -0.05 -0.33 -0.01 0.00 0.00 175.52 175.93 2jgl h GLU 468 N 0.00 0.92 -0.32 0.00 3.07 -2.00 -2.72 114.58 113.53 2jgl h GLU 468 Ca -0.00 -0.29 -0.07 0.00 -0.50 0.00 0.00 59.36 58.50 2jgl h GLU 468 Cb 0.61 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.42 2jgl h GLU 468 CO 0.04 0.94 -0.09 0.93 -1.40 0.00 0.00 179.01 179.43 2jgl h GLU 469 N 0.84 0.52 -0.34 2.33 5.08 -1.66 -1.14 114.58 120.21 2jgl h GLU 469 Ca 0.15 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2jgl h GLU 469 Cb 0.56 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2jgl h GLU 469 CO 0.03 0.62 0.09 -0.09 -1.00 0.00 0.00 179.01 178.66 2jgl h ARG 470 N 0.49 0.54 -0.64 2.33 1.12 -1.23 0.24 114.38 117.22 2jgl h ARG 470 Ca 0.09 -0.12 -0.07 0.00 -1.11 0.00 0.00 59.98 58.77 2jgl h ARG 470 Cb 0.45 -0.07 -0.03 0.00 -0.01 0.00 0.00 29.97 30.32 2jgl h ARG 470 CO 0.02 0.58 0.13 0.82 -3.11 0.00 0.00 179.97 178.42 2jgl h ILE 471 N 0.39 1.26 0.07 1.20 2.04 -1.29 -2.47 117.51 118.71 2jgl h ILE 471 Ca 0.11 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 65.01 2jgl h ILE 471 Cb 0.28 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 2jgl h ILE 471 CO -0.00 0.37 -0.12 0.15 0.00 0.00 0.00 178.15 178.54 2jgl h PHE 472 N 0.96 -0.31 -0.78 1.37 3.57 -1.03 -1.74 116.94 118.98 2jgl h PHE 472 Ca 0.20 0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.84 2jgl h PHE 472 Cb 0.39 0.13 -0.09 0.00 2.79 0.00 0.00 35.95 39.17 2jgl h PHE 472 CO 0.03 -0.18 0.37 0.00 -2.23 0.00 0.00 178.31 176.29 2jgl h ALA 473 N 0.66 1.13 -0.56 2.41 0.00 -0.82 -0.63 119.26 121.45 2jgl h ALA 473 Ca 0.02 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2jgl h ALA 473 Cb 0.26 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2jgl h ALA 473 CO -0.07 -0.12 0.10 1.96 0.00 0.00 0.00 179.25 181.12 2jgl h GLN 474 N 0.56 0.89 -0.46 0.00 4.20 -1.15 -0.78 115.11 118.36 2jgl h GLN 474 Ca 0.42 -0.21 0.01 0.00 0.06 0.00 0.00 58.65 58.93 2jgl h GLN 474 Cb 0.57 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.21 2jgl h GLN 474 CO -0.35 0.82 0.30 0.00 -0.67 0.00 0.00 178.83 178.92 2jgl h ARG 475 N 0.85 0.58 -0.17 1.46 3.08 -0.25 -2.16 114.38 117.77 2jgl h ARG 475 Ca 0.18 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 60.04 2jgl h ARG 475 Cb 0.36 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2jgl h ARG 475 CO 0.01 0.39 -0.53 -0.07 -1.07 0.00 0.00 179.97 178.69 2jgl h LEU 476 N 0.60 0.54 -1.19 3.04 3.38 -0.60 -2.15 115.31 118.93 2jgl h LEU 476 Ca 0.18 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 2jgl h LEU 476 Cb -0.04 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2jgl h LEU 476 CO -0.05 0.97 -0.13 0.24 0.09 0.00 0.00 178.44 179.56 2jgl h MET 477 N 0.38 0.40 -0.30 1.13 2.86 -1.03 -1.69 114.93 116.69 2jgl h MET 477 Ca 0.01 -0.11 -0.05 0.00 -2.06 0.00 0.00 59.70 57.49 2jgl h MET 477 Cb 1.06 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.66 2jgl h MET 477 CO 0.10 0.53 -0.01 0.87 1.06 0.00 0.00 176.91 179.46 2jgl h LYS 478 N 0.38 0.54 0.38 1.72 1.79 -1.04 -1.45 116.57 118.88 2jgl h LYS 478 Ca 0.07 -0.18 -0.02 0.00 -2.18 0.00 0.00 60.65 58.35 2jgl h LYS 478 Cb 0.46 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 2jgl h LYS 478 CO 0.03 0.69 -0.18 1.88 -1.08 0.00 0.00 179.45 180.79 2jgl h TYR 479 N 0.33 -0.47 -0.34 -1.35 0.05 -0.89 0.17 116.97 114.47 2jgl h TYR 479 Ca 0.08 -0.01 0.05 0.00 0.05 0.00 0.00 58.73 58.90 2jgl h TYR 479 Cb 0.45 0.16 -0.04 0.00 1.01 0.00 0.00 36.73 38.31 2jgl h TYR 479 CO 0.04 -0.26 0.08 -1.49 -1.05 0.00 0.00 178.16 175.48 2jgl h TRP 480 N -0.56 0.13 -0.05 4.88 6.55 -1.38 0.30 115.95 125.82 2jgl h TRP 480 Ca -0.05 0.02 -0.16 0.00 0.95 0.00 0.00 58.89 59.65 2jgl h TRP 480 Cb 0.42 -0.01 -0.01 0.00 -0.86 0.00 0.00 29.16 28.71 2jgl h TRP 480 CO -0.04 0.03 -0.67 1.79 -1.05 0.00 0.00 178.44 178.50 2jgl h THR 481 N 0.20 1.41 -0.45 1.49 1.35 -1.25 0.52 112.91 116.17 2jgl h THR 481 Ca 0.16 -2.14 -0.05 0.00 -0.55 0.00 0.00 66.41 63.83 2jgl h THR 481 Cb 0.17 2.12 -0.02 0.00 -1.73 0.00 0.00 68.15 68.69 2jgl h THR 481 CO -0.20 0.63 0.09 0.78 -0.25 0.00 0.00 175.52 176.57 2jgl h ASN 482 N 0.16 0.70 -0.56 5.36 2.35 -0.32 0.64 115.58 123.92 2jgl h ASN 482 Ca -0.02 -0.25 0.06 0.00 -0.55 0.00 0.00 56.30 55.55 2jgl h ASN 482 Cb 1.21 -0.19 -0.06 0.00 0.05 0.00 0.00 38.32 39.34 2jgl h ASN 482 CO 0.10 0.77 0.26 0.15 -1.65 0.00 0.00 177.43 177.06 2jgl h PHE 483 N 0.61 0.46 -0.78 1.19 3.57 -0.24 -1.06 116.94 120.70 2jgl h PHE 483 Ca 0.14 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.69 2jgl h PHE 483 Cb 0.35 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 38.92 2jgl h PHE 483 CO 0.02 0.19 0.50 0.00 -2.23 0.00 0.00 178.31 176.79 2jgl h ALA 484 N 1.33 1.01 -0.20 2.41 0.00 -0.29 0.39 119.26 123.92 2jgl h ALA 484 Ca 0.26 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 2jgl h ALA 484 Cb 0.23 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2jgl h ALA 484 CO -0.21 0.32 -0.45 0.00 0.00 0.00 0.00 179.25 178.91 2jgl h ARG 485 N 0.98 0.49 0.00 0.00 3.08 -0.38 -3.40 114.38 115.15 2jgl h ARG 485 Ca 0.31 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2jgl h ARG 485 Cb -0.01 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2jgl h ARG 485 CO -0.10 0.84 -0.01 0.25 -1.07 0.00 0.00 179.97 179.88 2jgl n THR 486 N -4.00 0.00 -0.98 2.04 -2.24 -0.45 -5.01 114.28 103.64 2jgl n THR 486 Ca -0.02 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2jgl n THR 486 Cb 0.53 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 2jgl n THR 486 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jgl n GLY 487 N 0.29 0.42 2.76 3.38 0.00 0.14 -5.00 105.19 107.18 2jgl n GLY 487 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2jgl n GLY 487 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jgl s ASP 488 N -2.10 1.62 0.00 1.61 -1.08 -1.26 -4.86 116.67 110.62 2jgl s ASP 488 Ca 0.00 -0.11 0.24 0.00 -0.52 0.00 0.00 52.55 52.16 2jgl s ASP 488 Cb 0.00 -0.43 1.27 0.00 -1.46 0.00 0.00 42.92 42.29 2jgl s ASP 488 CO 0.00 -0.20 1.79 -0.81 0.52 0.00 0.00 175.17 176.47 2jgl n PRO 489 N 5.15 0.46 -2.72 4.34 -0.04 -1.26 -3.36 135.00 137.57 2jgl n PRO 489 Ca -0.07 0.05 -0.40 0.00 -0.04 0.00 0.00 63.50 63.04 2jgl n PRO 489 Cb 0.50 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.40 2jgl n PRO 489 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2jgl s ASN 490 N -2.40 7.60 -0.13 3.54 0.01 -1.26 -4.41 114.94 117.89 2jgl s ASN 490 Ca 0.26 1.99 -0.29 0.00 -0.71 0.00 0.00 52.86 54.11 2jgl s ASN 490 Cb 0.16 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 39.16 2jgl s ASN 490 CO 0.34 0.12 1.87 -0.62 -1.51 0.00 0.00 177.10 177.30 2jgl s ASP 491 N -1.15 6.18 0.00 -1.22 -1.08 -1.26 -4.86 116.67 113.28 2jgl s ASP 491 Ca 0.41 2.04 0.26 0.00 -0.52 0.00 0.00 52.55 54.74 2jgl s ASP 491 Cb -0.27 -2.53 1.45 0.00 -1.46 0.00 0.00 42.92 40.12 2jgl s ASP 491 CO 0.33 -1.36 1.95 -0.81 0.52 0.00 0.00 175.17 175.80 2jgl n PRO 492 N 7.87 1.11 0.00 4.34 -0.04 -1.26 -2.71 135.00 144.30 2jgl n PRO 492 Ca 0.22 -0.16 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 2jgl n PRO 492 Cb 0.44 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2jgl n PRO 492 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2jgl n ARG 493 N -0.73 4.04 -1.96 0.54 3.00 -1.26 -5.01 116.66 115.28 2jgl n ARG 493 Ca 0.19 0.00 -0.43 0.00 -0.01 0.00 0.00 57.85 57.61 2jgl n ARG 493 Cb 0.13 -0.63 -0.03 0.00 0.00 0.00 0.00 32.46 31.93 2jgl n ARG 493 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2jgl s ASP 494 N -0.60 6.29 0.56 0.55 2.15 -1.10 -5.03 116.67 119.50 2jgl s ASP 494 Ca 0.00 1.89 -0.08 0.00 0.43 0.00 0.00 52.55 54.79 2jgl s ASP 494 Cb 0.00 -2.53 -0.03 0.00 -0.30 0.00 0.00 42.92 40.06 2jgl s ASP 494 CO 0.00 -1.29 0.92 -0.55 -0.17 0.00 0.00 175.17 174.09 2jgl s SER 495 N 4.73 6.17 0.15 -0.34 0.15 -1.26 -4.78 113.70 118.51 2jgl s SER 495 Ca 0.78 1.16 0.00 0.00 0.70 0.00 0.00 55.95 58.59 2jgl s SER 495 Cb -0.30 -2.30 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2jgl s SER 495 CO 0.32 -0.78 0.00 1.17 1.20 0.00 0.00 173.24 175.15 2jgl n LYS 496 N -2.55 -5.57 0.05 5.44 3.00 -1.26 -5.09 118.16 112.18 2jgl n LYS 496 Ca 0.04 3.97 0.00 0.00 -0.00 0.00 0.00 58.31 62.31 2jgl n LYS 496 Cb 0.55 -4.49 0.00 0.00 0.00 0.00 0.00 35.03 31.09 2jgl n LYS 496 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2jgl n SER 497 N 1.91 0.02 -4.28 3.14 3.41 -1.26 -4.98 113.62 111.59 2jgl n SER 497 Ca 0.00 0.15 -0.29 0.00 -0.26 0.00 0.00 58.87 58.47 2jgl n SER 497 Cb 0.00 0.10 0.20 0.00 -0.26 0.00 0.00 64.21 64.25 2jgl n SER 497 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2jgl s PRO 498 N -2.00 -0.20 0.45 4.33 0.04 -1.26 -4.37 135.00 131.99 2jgl s PRO 498 Ca 0.00 0.15 -0.22 0.00 0.04 0.00 0.00 61.00 60.96 2jgl s PRO 498 Cb 0.00 -1.70 -0.08 0.00 0.04 0.00 0.00 34.50 32.76 2jgl s PRO 498 CO 0.00 -3.08 1.08 -0.65 0.04 0.00 0.00 177.00 174.40 2jgl s GLN 499 N -5.27 3.89 -0.53 4.56 -1.52 -1.26 -4.85 119.66 114.67 2jgl s GLN 499 Ca 0.68 1.55 -0.28 0.00 -1.95 0.00 0.00 55.36 55.36 2jgl s GLN 499 Cb -0.13 -2.35 0.03 0.00 -0.22 0.00 0.00 33.01 30.34 2jgl s GLN 499 CO 0.56 -0.39 1.24 -0.46 -0.25 0.00 0.00 175.29 175.99 2jgl s TRP 500 N -1.72 2.59 0.41 0.91 -0.11 -1.26 -4.96 118.94 114.80 2jgl s TRP 500 Ca 0.63 0.54 -0.16 0.00 1.22 0.00 0.00 56.10 58.33 2jgl s TRP 500 Cb -0.22 -4.46 -0.09 0.00 -1.50 0.00 0.00 33.47 27.20 2jgl s TRP 500 CO 0.27 -1.61 0.85 -1.25 -4.62 0.00 0.00 176.95 170.60 2jgl s PRO 501 N 4.91 3.99 0.31 5.86 0.04 -1.26 -4.90 135.00 143.94 2jgl s PRO 501 Ca 0.48 0.79 -0.29 0.00 0.04 0.00 0.00 61.00 62.01 2jgl s PRO 501 Cb -0.08 -2.30 -0.12 0.00 0.04 0.00 0.00 34.50 32.04 2jgl s PRO 501 CO 0.28 -0.03 1.46 -2.30 0.04 0.00 0.00 177.00 176.45 2jgl n PRO 502 N -0.93 2.42 -2.18 0.56 -0.02 -1.26 -4.71 135.00 128.88 2jgl n PRO 502 Ca 0.05 0.86 -0.41 0.00 -2.02 0.00 0.00 63.50 61.97 2jgl n PRO 502 Cb 0.54 -2.55 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 2jgl n PRO 502 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2jgl s TYR 503 N -0.53 3.21 0.06 6.00 6.14 0.20 -4.54 117.35 127.89 2jgl s TYR 503 Ca 0.60 1.15 -0.00 0.00 0.64 0.00 0.00 57.07 59.46 2jgl s TYR 503 Cb -0.54 -3.65 -0.04 0.00 0.42 0.00 0.00 41.96 38.15 2jgl s TYR 503 CO 0.56 -2.08 -0.04 0.95 0.64 0.00 0.00 175.55 175.58 2jgl s THR 504 N 0.21 0.31 0.19 4.34 -4.23 -1.26 -4.42 115.64 110.78 2jgl s THR 504 Ca 0.58 -1.79 -0.04 0.00 -1.18 0.00 0.00 61.69 59.26 2jgl s THR 504 Cb -0.37 -1.49 -0.06 0.00 1.34 0.00 0.00 72.50 71.91 2jgl s THR 504 CO 0.38 -0.95 1.50 0.71 -0.54 0.00 0.00 174.62 175.72 2jgl h THR 505 N 3.19 1.32 0.00 3.99 1.35 -1.91 0.14 112.91 120.98 2jgl h THR 505 Ca -0.34 -1.80 0.00 0.00 -0.55 0.00 0.00 66.41 63.71 2jgl h THR 505 Cb 1.15 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 69.34 2jgl h THR 505 CO 0.64 0.56 0.00 0.00 -0.25 0.00 0.00 175.52 176.48 2jgl n ALA 506 N -2.52 -0.39 0.06 6.62 0.00 -1.26 -4.22 120.51 118.80 2jgl n ALA 506 Ca -0.03 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.34 2jgl n ALA 506 Cb 0.61 0.06 -0.11 0.00 0.00 0.00 0.00 19.45 20.01 2jgl n ALA 506 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jgl h ALA 507 N -1.88 0.43 -4.00 0.00 0.00 -1.97 -3.48 119.26 108.35 2jgl h ALA 507 Ca 0.00 -0.94 -0.40 0.00 0.00 0.00 0.00 54.91 53.57 2jgl h ALA 507 Cb 0.00 -0.07 0.04 0.00 0.00 0.00 0.00 17.79 17.76 2jgl h ALA 507 CO 0.00 1.23 -0.58 1.04 0.00 0.00 0.00 179.25 180.94 2jgl n GLN 508 N -3.30 -3.99 -2.94 0.00 6.02 0.48 -4.50 117.38 109.16 2jgl n GLN 508 Ca -0.02 0.93 -0.35 0.00 -0.01 0.00 0.00 57.00 57.55 2jgl n GLN 508 Cb 0.93 -5.72 -0.06 0.00 1.02 0.00 0.00 30.24 26.41 2jgl n GLN 508 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2jgl s GLN 509 N -5.51 4.31 0.14 -1.09 -0.21 -1.26 -1.29 119.66 114.76 2jgl s GLN 509 Ca 0.22 1.04 -0.19 0.00 0.02 0.00 0.00 55.36 56.45 2jgl s GLN 509 Cb -0.10 -2.61 0.05 0.00 1.00 0.00 0.00 33.01 31.35 2jgl s GLN 509 CO 0.27 0.22 0.49 1.52 -2.12 0.00 0.00 175.29 175.66 2jgl s TYR 510 N -1.79 -0.33 0.16 0.91 1.13 -0.44 -3.76 117.35 113.23 2jgl s TYR 510 Ca 0.52 0.06 0.07 0.00 -1.41 0.00 0.00 57.07 56.31 2jgl s TYR 510 Cb -0.14 0.39 -0.04 0.00 -1.10 0.00 0.00 41.96 41.06 2jgl s TYR 510 CO 0.19 -0.77 -0.04 0.14 -2.51 0.00 0.00 175.55 172.57 2jgl s VAL 511 N -3.79 3.56 -0.06 -3.49 -7.23 -0.97 -0.27 120.40 108.16 2jgl s VAL 511 Ca 0.02 -1.44 -0.15 0.00 -1.81 0.00 0.00 61.98 58.61 2jgl s VAL 511 Cb 0.01 -2.76 -0.05 0.00 0.56 0.00 0.00 36.38 34.13 2jgl s VAL 511 CO -0.12 -0.07 0.39 -0.94 -0.31 0.00 0.00 175.10 174.06 2jgl s SER 512 N -2.78 6.70 -0.37 4.85 1.04 -1.01 -0.93 113.70 121.21 2jgl s SER 512 Ca 0.26 0.83 -0.12 0.00 0.48 0.00 0.00 55.95 57.40 2jgl s SER 512 Cb -0.10 -2.24 0.01 0.00 0.10 0.00 0.00 66.02 63.80 2jgl s SER 512 CO 0.17 0.21 0.23 -0.76 0.98 0.00 0.00 173.24 174.07 2jgl s LEU 513 N -0.41 4.68 0.00 2.42 1.43 0.93 -4.19 118.68 123.53 2jgl s LEU 513 Ca 0.23 -0.80 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 2jgl s LEU 513 Cb -0.15 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 43.99 2jgl s LEU 513 CO 0.11 -0.34 0.00 -0.46 0.23 0.00 0.00 176.35 175.88 2jgl n ASN 514 N 5.05 0.00 0.13 2.29 0.23 -1.26 -0.39 115.26 121.31 2jgl n ASN 514 Ca -0.12 -0.73 -0.02 0.00 -0.53 0.00 0.00 54.58 53.18 2jgl n ASN 514 Cb 0.47 0.00 0.16 0.00 -2.08 0.00 0.00 39.78 38.33 2jgl n ASN 514 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 2jgl h LEU 515 N 0.00 0.02-10.31 -4.53 3.38 -1.96 -3.44 115.31 98.48 2jgl h LEU 515 Ca 0.00 -0.01 -0.52 0.00 0.09 0.00 0.00 57.88 57.44 2jgl h LEU 515 Cb 0.00 -0.00 0.14 0.00 0.09 0.00 0.00 40.66 40.89 2jgl h LEU 515 CO 0.00 0.64 0.30 -0.54 0.09 0.00 0.00 178.44 178.93 2jgl s LYS 516 N -3.59 2.02 0.92 1.13 1.02 -1.26 -5.02 119.74 114.97 2jgl s LYS 516 Ca -0.01 1.22 -0.11 0.00 0.02 0.00 0.00 55.97 57.09 2jgl s LYS 516 Cb 0.13 -1.87 0.11 0.00 -0.52 0.00 0.00 37.83 35.68 2jgl s LYS 516 CO 0.77 -1.82 0.91 -2.30 -0.92 0.00 0.00 175.35 171.98 2jgl n PRO 517 N -3.65 -0.38 -1.64 -1.68 -0.02 -1.26 -4.90 135.00 121.46 2jgl n PRO 517 Ca 0.09 -0.05 -0.47 0.00 -2.02 0.00 0.00 63.50 61.06 2jgl n PRO 517 Cb 0.53 -2.21 -0.04 0.00 -0.02 0.00 0.00 33.50 31.76 2jgl n PRO 517 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2jgl n LEU 518 N -3.24 2.65 -4.24 2.45 4.77 -1.26 -4.93 117.00 113.19 2jgl n LEU 518 Ca 0.10 1.12 -0.31 0.00 -0.03 0.00 0.00 56.01 56.90 2jgl n LEU 518 Cb 0.52 -1.36 -0.17 0.00 -2.33 0.00 0.00 43.42 40.09 2jgl n LEU 518 CO 0.49 -0.64 -0.56 -0.70 -1.33 0.00 0.00 177.39 174.65 2jgl s GLU 519 N 0.07 2.58 -0.13 3.23 2.12 -1.26 -4.46 118.70 120.85 2jgl s GLU 519 Ca 0.74 -0.87 -0.18 0.00 0.36 0.00 0.00 54.97 55.01 2jgl s GLU 519 Cb -0.73 -2.13 -0.04 0.00 0.26 0.00 0.00 34.13 31.49 2jgl s GLU 519 CO 0.46 0.33 0.49 0.08 -0.54 0.00 0.00 175.26 176.08 2jgl s VAL 520 N -0.04 5.17 0.34 3.70 1.01 -1.26 -2.39 120.40 126.93 2jgl s VAL 520 Ca -0.07 0.97 0.08 0.00 0.00 0.00 0.00 61.98 62.96 2jgl s VAL 520 Cb -0.14 -3.83 -0.07 0.00 0.00 0.00 0.00 36.38 32.34 2jgl s VAL 520 CO 0.05 0.30 -0.07 -0.13 0.00 0.00 0.00 175.10 175.25 2jgl s ARG 521 N 0.80 1.77 -0.07 2.72 0.52 0.63 -4.96 118.95 120.36 2jgl s ARG 521 Ca 0.26 -1.92 0.02 0.00 -0.52 0.00 0.00 55.73 53.57 2jgl s ARG 521 Cb -0.15 -1.54 0.01 0.00 0.52 0.00 0.00 34.95 33.79 2jgl s ARG 521 CO 0.10 0.08 -0.13 1.03 0.02 0.00 0.00 175.30 176.41 2jgl s ARG 522 N -3.66 1.82 0.00 3.54 0.52 -1.26 -1.33 118.95 118.58 2jgl s ARG 522 Ca 0.32 -0.45 0.00 0.00 -0.52 0.00 0.00 55.73 55.08 2jgl s ARG 522 Cb 0.04 -1.50 0.00 0.00 0.52 0.00 0.00 34.95 34.01 2jgl s ARG 522 CO 0.16 0.03 0.00 0.41 0.02 0.00 0.00 175.30 175.91 2jgl n GLY 523 N 3.84 -1.98 3.53 -3.53 0.00 -0.41 -4.93 105.19 101.72 2jgl n GLY 523 Ca -0.22 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 2jgl n GLY 523 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jgl s LEU 524 N 0.00 3.61 -1.43 0.99 2.96 -1.26 -4.07 118.68 119.48 2jgl s LEU 524 Ca 0.00 -1.09 -0.04 0.00 -0.22 0.00 0.00 54.13 52.77 2jgl s LEU 524 Cb 0.00 -2.53 0.00 0.00 0.50 0.00 0.00 46.19 44.16 2jgl s LEU 524 CO 0.00 -1.58 0.31 0.54 -1.32 0.00 0.00 176.35 174.30 2jgl n ARG 525 N 8.72 -2.03 -0.36 1.98 5.12 -1.26 -4.75 116.66 124.08 2jgl n ARG 525 Ca 0.17 0.26 -0.00 0.00 -1.93 0.00 0.00 57.85 56.36 2jgl n ARG 525 Cb 0.50 -3.98 0.14 0.00 -1.16 0.00 0.00 32.46 27.95 2jgl n ARG 525 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2jgl h ALA 526 N 0.89 1.28 -0.02 7.54 0.00 -1.93 0.25 119.26 127.27 2jgl h ALA 526 Ca -0.65 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.06 2jgl h ALA 526 Cb 1.39 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.85 2jgl h ALA 526 CO 0.64 0.50 -0.59 1.96 0.00 0.00 0.00 179.25 181.75 2jgl h GLN 527 N 1.20 0.43 -0.37 0.00 1.08 -1.95 -2.58 115.11 112.92 2jgl h GLN 527 Ca 0.39 -0.44 -0.15 0.00 -1.45 0.00 0.00 58.65 57.00 2jgl h GLN 527 Cb 0.02 0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.56 2jgl h GLN 527 CO -0.13 1.10 -0.36 1.15 -0.95 0.00 0.00 178.83 179.64 2jgl h THR 528 N -0.06 1.28 0.00 -0.54 2.02 -1.89 -2.91 112.91 110.80 2jgl h THR 528 Ca -0.07 -1.52 -0.09 0.00 0.77 0.00 0.00 66.41 65.49 2jgl h THR 528 Cb 1.29 1.37 -0.01 0.00 -1.74 0.00 0.00 68.15 69.06 2jgl h THR 528 CO 0.12 0.51 -0.44 0.00 0.37 0.00 0.00 175.52 176.08 2jgl h ALA 530 N 1.56 0.93 -0.11 0.00 0.00 -1.36 0.53 119.26 120.81 2jgl h ALA 530 Ca -0.00 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.94 2jgl h ALA 530 Cb 0.90 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2jgl h ALA 530 CO 0.06 0.10 -0.09 0.35 0.00 0.00 0.00 179.25 179.67 2jgl h PHE 531 N 0.74 -0.21 -0.17 0.00 3.57 -1.20 0.01 116.94 119.69 2jgl h PHE 531 Ca 0.30 0.01 -0.20 0.00 3.53 0.00 0.00 57.97 61.62 2jgl h PHE 531 Cb 0.16 0.11 0.01 0.00 2.79 0.00 0.00 35.95 39.02 2jgl h PHE 531 CO -0.07 -0.13 -0.69 -1.49 -2.23 0.00 0.00 178.31 173.70 2jgl h TRP 532 N -0.10 1.01 0.00 0.41 4.06 -1.25 0.17 115.95 120.25 2jgl h TRP 532 Ca 0.07 -0.43 -0.20 0.00 2.06 0.00 0.00 58.89 60.39 2jgl h TRP 532 Cb 0.20 -0.16 -0.03 0.00 -1.00 0.00 0.00 29.16 28.17 2jgl h TRP 532 CO -0.20 1.25 -1.35 -0.91 -3.56 0.00 0.00 178.44 173.67 2jgl h ASN 533 N 0.48 0.00 0.00 -3.49 2.35 0.05 -3.38 115.58 111.58 2jgl h ASN 533 Ca -0.04 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.51 2jgl h ASN 533 Cb 1.32 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.65 2jgl h ASN 533 CO 0.14 0.73 -1.68 0.54 -1.65 0.00 0.00 177.43 175.51 2jgl n ARG 534 N -3.02 0.27 -0.08 0.81 1.74 -0.04 -4.75 116.66 111.59 2jgl n ARG 534 Ca -0.09 0.10 -0.13 0.00 -0.77 0.00 0.00 57.85 56.96 2jgl n ARG 534 Cb 0.90 -1.01 -0.09 0.00 -1.02 0.00 0.00 32.46 31.24 2jgl n ARG 534 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2jgl h PHE 535 N -0.34 0.00 -0.67 -1.55 3.57 -1.15 -3.37 116.94 113.43 2jgl h PHE 535 Ca -0.30 0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.34 2jgl h PHE 535 Cb 1.30 0.00 -0.12 0.00 2.79 0.00 0.00 35.95 39.92 2jgl h PHE 535 CO -0.03 0.87 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.74 2jgl h LEU 536 N -1.00 -0.51 -0.47 0.59 3.38 -0.85 -1.79 115.31 114.67 2jgl h LEU 536 Ca -0.11 0.19 0.09 0.00 0.09 0.00 0.00 57.88 58.15 2jgl h LEU 536 Cb 0.87 0.37 -0.10 0.00 0.09 0.00 0.00 40.66 41.89 2jgl h LEU 536 CO -0.07 -0.19 -0.26 -0.65 0.09 0.00 0.00 178.44 177.36 2jgl h PRO 537 N 0.04 -0.15 -0.86 1.13 0.11 -1.75 -1.49 132.00 129.03 2jgl h PRO 537 Ca 0.34 0.01 0.16 0.00 0.11 0.00 0.00 66.00 66.62 2jgl h PRO 537 Cb 0.54 0.03 -0.10 0.00 0.11 0.00 0.00 31.00 31.58 2jgl h PRO 537 CO -0.65 -0.10 0.43 0.87 -0.21 0.00 0.00 178.00 178.33 2jgl h LYS 538 N -0.16 0.56 -0.79 1.05 1.57 -1.49 0.91 116.57 118.22 2jgl h LYS 538 Ca 0.21 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 2jgl h LYS 538 Cb 0.50 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 2jgl h LYS 538 CO -0.56 0.37 0.30 1.25 -0.57 0.00 0.00 179.45 180.23 2jgl h LEU 539 N 0.58 1.11 0.00 2.94 5.85 -0.85 -2.51 115.31 122.42 2jgl h LEU 539 Ca 0.48 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 2jgl h LEU 539 Cb 0.73 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2jgl h LEU 539 CO -0.40 0.99 -0.00 -0.07 -0.34 0.00 0.00 178.44 178.62 2jgl h LEU 540 N 1.16 -0.01 -1.80 2.25 3.38 -1.08 -3.00 115.31 116.20 2jgl h LEU 540 Ca 0.26 -0.81 0.10 0.00 0.09 0.00 0.00 57.88 57.52 2jgl h LEU 540 Cb 0.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2jgl h LEU 540 CO -0.02 0.89 0.34 0.77 0.09 0.00 0.00 178.44 180.51 2jgl h SER 541 N -0.98 0.20 0.00 -0.43 4.64 -0.80 -3.35 113.55 112.83 2jgl h SER 541 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jgl h SER 541 Cb 0.81 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2jgl h SER 541 CO 0.00 0.12 0.00 0.00 -0.87 0.00 0.00 176.83 176.08 2jgl n ALA 542 N -2.56 0.18 -0.96 5.18 0.00 -0.95 -5.08 120.51 116.32 2jgl n ALA 542 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2jgl n ALA 542 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2jgl n ALA 542 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2jgl n THR 543 N -0.45 -0.64 0.00 0.00 -1.04 -1.13 -5.07 114.28 105.95 2jgl n THR 543 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2jgl n THR 543 Cb 0.00 -2.23 0.00 0.00 -1.82 0.00 0.00 70.33 66.28 2jgl n THR 543 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43