#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jgl n GLY 2 N 0.00 3.64 0.01 -1.84 0.00 -1.26 -4.92 105.19 100.81 2jgl n GLY 2 Ca 0.00 -0.56 0.11 0.00 0.00 0.00 0.00 46.02 45.56 2jgl n GLY 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jgl n ARG 3 N 0.00 0.14 -1.41 1.61 5.12 -1.26 -5.01 116.66 115.84 2jgl n ARG 3 Ca 0.00 -0.03 -0.30 0.00 -1.93 0.00 0.00 57.85 55.59 2jgl n ARG 3 Cb 0.00 -1.52 0.11 0.00 -1.16 0.00 0.00 32.46 29.90 2jgl n ARG 3 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 2jgl s GLU 4 N -3.10 1.68 -0.20 5.56 2.02 -1.26 -4.98 118.70 118.42 2jgl s GLU 4 Ca 0.05 0.69 -0.29 0.00 0.02 0.00 0.00 54.97 55.44 2jgl s GLU 4 Cb 0.16 -1.87 -0.03 0.00 0.10 0.00 0.00 34.13 32.49 2jgl s GLU 4 CO 0.85 -1.91 1.67 0.34 0.02 0.00 0.00 175.26 176.23 2jgl s ASP 5 N -3.72 6.34 0.47 -0.19 -1.08 -1.26 -4.89 116.67 112.34 2jgl s ASP 5 Ca 0.62 1.72 0.30 0.00 -0.52 0.00 0.00 52.55 54.66 2jgl s ASP 5 Cb -0.16 -2.53 1.61 0.00 -1.46 0.00 0.00 42.92 40.38 2jgl s ASP 5 CO 0.55 -1.28 1.90 1.55 0.52 0.00 0.00 175.17 178.42 2jgl h PRO 6 N 10.93 0.00 -0.00 4.34 0.13 -1.98 -1.83 132.00 143.58 2jgl h PRO 6 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2jgl h PRO 6 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2jgl h PRO 6 CO 0.99 0.00 -0.17 1.04 -0.23 0.00 0.00 178.00 179.64 2jgl n GLN 7 N -2.57 0.63 -0.11 0.86 1.13 -1.26 -3.96 117.38 112.10 2jgl n GLN 7 Ca -0.02 -0.26 0.08 0.00 -1.94 0.00 0.00 57.00 54.86 2jgl n GLN 7 Cb 0.09 -1.49 0.14 0.00 0.11 0.00 0.00 30.24 29.09 2jgl n GLN 7 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2jgl n LEU 8 N -0.95 2.80 -4.36 1.08 4.77 -0.69 -4.88 117.00 114.76 2jgl n LEU 8 Ca 0.13 -1.45 -0.37 0.00 -0.03 0.00 0.00 56.01 54.29 2jgl n LEU 8 Cb 0.30 -0.15 -0.12 0.00 -2.33 0.00 0.00 43.42 41.12 2jgl n LEU 8 CO 0.25 0.61 -0.26 -0.76 -1.33 0.00 0.00 177.39 175.89 2jgl s LEU 9 N -1.19 3.88 0.03 2.23 1.43 -1.25 -1.08 118.68 122.71 2jgl s LEU 9 Ca 0.26 -0.67 0.04 0.00 -1.03 0.00 0.00 54.13 52.73 2jgl s LEU 9 Cb 0.15 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.45 2jgl s LEU 9 CO 0.21 -0.19 -0.13 -0.69 0.23 0.00 0.00 176.35 175.78 2jgl s VAL 10 N 1.52 1.06 -0.13 -1.59 1.01 -0.79 -4.99 120.40 116.48 2jgl s VAL 10 Ca 0.03 -0.88 -0.05 0.00 0.00 0.00 0.00 61.98 61.07 2jgl s VAL 10 Cb -0.17 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2jgl s VAL 10 CO 0.03 0.06 0.06 -0.60 0.00 0.00 0.00 175.10 174.64 2jgl s ARG 11 N -0.94 3.46 0.45 2.72 3.52 -1.26 -0.00 118.95 126.89 2jgl s ARG 11 Ca 0.02 -0.32 0.03 0.00 -0.13 0.00 0.00 55.73 55.33 2jgl s ARG 11 Cb -0.07 -3.04 -0.03 0.00 -1.56 0.00 0.00 34.95 30.25 2jgl s ARG 11 CO 0.01 0.56 0.04 0.14 -0.81 0.00 0.00 175.30 175.24 2jgl s VAL 12 N -0.45 1.19 0.47 7.11 -7.23 0.43 -4.85 120.40 117.06 2jgl s VAL 12 Ca 0.10 -2.00 0.23 0.00 -1.81 0.00 0.00 61.98 58.50 2jgl s VAL 12 Cb -0.12 -2.43 0.42 0.00 0.56 0.00 0.00 36.38 34.80 2jgl s VAL 12 CO 0.02 0.00 1.88 -0.09 -0.31 0.00 0.00 175.10 176.60 2jgl h ARG 13 N 1.62 0.23 -0.01 4.82 9.65 -1.94 0.86 114.38 129.60 2jgl h ARG 13 Ca -0.42 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.45 2jgl h ARG 13 Cb 1.28 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.81 2jgl h ARG 13 CO 0.71 0.15 -0.19 0.41 2.80 0.00 0.00 179.97 183.85 2jgl n GLY 14 N -1.59 -0.25 0.00 2.80 0.00 -1.26 -4.89 105.19 99.99 2jgl n GLY 14 Ca 0.18 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 1.30 0.96 3.82 -0.02 0.00 0.29 -0.67 105.19 110.87 2jgl n GLY 15 Ca 0.14 -1.87 -0.38 0.00 0.00 0.00 0.00 46.02 43.91 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 -2.00 3.92 -0.02 1.61 -0.21 -1.25 -0.43 119.66 121.28 2jgl s GLN 16 Ca 0.00 0.27 0.07 0.00 0.02 0.00 0.00 55.36 55.72 2jgl s GLN 16 Cb 0.00 -3.26 -0.02 0.00 1.00 0.00 0.00 33.01 30.73 2jgl s GLN 16 CO 0.00 0.60 -0.24 -0.51 -2.12 0.00 0.00 175.29 173.02 2jgl s LEU 17 N -0.70 2.05 -0.24 2.90 1.43 1.00 0.24 118.68 125.35 2jgl s LEU 17 Ca 0.21 -0.44 -0.05 0.00 -1.03 0.00 0.00 54.13 52.83 2jgl s LEU 17 Cb -0.15 -1.23 -0.00 0.00 0.03 0.00 0.00 46.19 44.83 2jgl s LEU 17 CO 0.10 0.29 0.00 -0.60 0.23 0.00 0.00 176.35 176.38 2jgl s ARG 18 N -0.59 3.31 0.00 1.70 3.52 0.12 -1.89 118.95 125.12 2jgl s ARG 18 Ca 0.09 -0.68 0.00 0.00 -0.13 0.00 0.00 55.73 55.01 2jgl s ARG 18 Cb -0.09 -3.14 0.00 0.00 -1.56 0.00 0.00 34.95 30.15 2jgl s ARG 18 CO -0.01 -0.27 0.00 0.41 -0.81 0.00 0.00 175.30 174.62 2jgl n GLY 19 N 4.82 1.76 3.09 8.12 0.00 -0.24 -0.01 105.19 122.73 2jgl n GLY 19 Ca -0.17 -2.10 -0.21 0.00 0.00 0.00 0.00 46.02 43.55 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 0.95 0.97 -0.29 -0.61 2.07 0.49 -4.83 121.20 119.95 2jgl s ILE 20 Ca 0.00 -0.62 -0.27 0.00 -1.41 0.00 0.00 60.65 58.35 2jgl s ILE 20 Cb 0.00 -0.83 0.01 0.00 0.13 0.00 0.00 42.46 41.77 2jgl s ILE 20 CO 0.00 0.21 0.97 -0.60 -1.91 0.00 0.00 174.94 173.61 2jgl s ARG 21 N -0.47 4.10 0.04 3.50 3.52 -1.26 -0.99 118.95 127.39 2jgl s ARG 21 Ca 0.04 1.01 0.03 0.00 -0.13 0.00 0.00 55.73 56.68 2jgl s ARG 21 Cb -0.05 -3.70 -0.04 0.00 -1.56 0.00 0.00 34.95 29.60 2jgl s ARG 21 CO -0.00 -0.74 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.22 2jgl s LEU 22 N 3.29 3.42 -0.32 -0.88 1.43 0.04 -4.95 118.68 120.71 2jgl s LEU 22 Ca 0.41 -0.11 -0.20 0.00 -1.03 0.00 0.00 54.13 53.20 2jgl s LEU 22 Cb -0.14 -2.04 -0.01 0.00 0.03 0.00 0.00 46.19 44.04 2jgl s LEU 22 CO 0.12 0.24 0.61 -0.75 0.23 0.00 0.00 176.35 176.79 2jgl s LYS 23 N -1.82 3.82 0.43 1.70 2.36 -1.26 -0.41 119.74 124.56 2jgl s LYS 23 Ca 0.21 0.18 0.08 0.00 -2.55 0.00 0.00 55.97 53.89 2jgl s LYS 23 Cb -0.11 -3.75 -0.01 0.00 -1.05 0.00 0.00 37.83 32.90 2jgl s LYS 23 CO 0.13 -0.61 0.40 0.00 1.55 0.00 0.00 175.35 176.82 2jgl s ALA 24 N 2.59 4.12 0.19 3.13 0.00 -0.33 -4.96 121.76 126.50 2jgl s ALA 24 Ca 0.24 -1.86 -0.12 0.00 0.00 0.00 0.00 51.96 50.22 2jgl s ALA 24 Cb -0.15 -1.05 0.16 0.00 0.00 0.00 0.00 23.12 22.09 2jgl s ALA 24 CO 0.13 -0.25 1.79 -1.35 0.00 0.00 0.00 175.76 176.08 2jgl h PRO 25 N 0.98 0.55 -0.24 0.00 0.11 -1.96 -2.83 132.00 128.61 2jgl h PRO 25 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2jgl h PRO 25 Cb 1.27 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2jgl h PRO 25 CO 0.56 0.36 0.00 0.41 -0.21 0.00 0.00 178.00 179.12 2jgl n GLY 26 N -1.26 0.70 0.00 -0.55 0.00 -1.26 -5.03 105.19 97.79 2jgl n GLY 26 Ca 0.05 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 1.23 0.10 3.85 -0.02 0.00 -1.07 -5.11 105.19 104.17 2jgl n GLY 27 Ca 0.17 -1.77 -0.31 0.00 0.00 0.00 0.00 46.02 44.10 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 -1.49 3.84 0.12 1.61 0.04 -1.26 -1.19 135.00 136.68 2jgl s PRO 28 Ca 0.00 0.82 0.05 0.00 0.04 0.00 0.00 61.00 61.91 2jgl s PRO 28 Cb 0.00 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 2jgl s PRO 28 CO 0.00 -0.30 -0.11 0.14 0.04 0.00 0.00 177.00 176.77 2jgl s VAL 29 N -2.71 1.14 -0.13 -0.36 -7.23 0.46 -3.87 120.40 107.70 2jgl s VAL 29 Ca 0.57 -1.83 -0.19 0.00 -1.81 0.00 0.00 61.98 58.72 2jgl s VAL 29 Cb -0.10 -1.60 -0.04 0.00 0.56 0.00 0.00 36.38 35.20 2jgl s VAL 29 CO 0.36 -0.60 0.51 -0.44 -0.31 0.00 0.00 175.10 174.63 2jgl s SER 30 N -2.74 6.70 -0.04 4.85 0.01 0.19 -0.78 113.70 121.90 2jgl s SER 30 Ca 0.11 0.84 0.06 0.00 1.31 0.00 0.00 55.95 58.27 2jgl s SER 30 Cb -0.01 -2.30 -0.01 0.00 0.21 0.00 0.00 66.02 63.90 2jgl s SER 30 CO 0.01 -0.04 -0.22 0.00 0.41 0.00 0.00 173.24 173.39 2jgl s ALA 31 N 0.81 1.89 -0.27 1.44 0.00 -0.16 -1.36 121.76 124.11 2jgl s ALA 31 Ca 0.27 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.31 2jgl s ALA 31 Cb -0.15 -0.55 0.07 0.00 0.00 0.00 0.00 23.12 22.49 2jgl s ALA 31 CO 0.11 0.41 -0.03 -0.06 0.00 0.00 0.00 175.76 176.19 2jgl s PHE 32 N -0.29 2.85 -0.04 0.00 0.40 0.13 -0.38 117.98 120.64 2jgl s PHE 32 Ca 0.02 -2.18 0.04 0.00 -0.60 0.00 0.00 56.93 54.22 2jgl s PHE 32 Cb -0.11 -1.98 -0.03 0.00 0.51 0.00 0.00 43.02 41.41 2jgl s PHE 32 CO 0.01 -0.85 -0.15 -0.51 0.70 0.00 0.00 175.22 174.43 2jgl s LEU 33 N 1.24 2.72 -0.59 -0.37 1.43 0.49 -0.41 118.68 123.18 2jgl s LEU 33 Ca -0.01 -0.22 -0.03 0.00 -1.03 0.00 0.00 54.13 52.84 2jgl s LEU 33 Cb -0.19 -1.56 0.00 0.00 0.03 0.00 0.00 46.19 44.48 2jgl s LEU 33 CO -0.08 0.34 0.42 0.61 0.23 0.00 0.00 176.35 177.86 2jgl n GLY 34 N 2.22 0.28 3.66 -3.19 0.00 -1.03 -3.90 105.19 103.24 2jgl n GLY 34 Ca -0.17 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.10 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 -3.03 4.64 0.18 -0.61 1.01 0.15 -4.76 121.20 118.78 2jgl s ILE 35 Ca 0.21 1.97 -0.30 0.00 0.00 0.00 0.00 60.65 62.53 2jgl s ILE 35 Cb -0.09 -4.30 -0.08 0.00 0.01 0.00 0.00 42.46 37.99 2jgl s ILE 35 CO 0.26 -0.21 1.25 -2.16 0.00 0.00 0.00 174.94 174.08 2jgl s PRO 36 N 3.26 4.44 0.00 2.79 0.04 -1.26 0.44 135.00 144.71 2jgl s PRO 36 Ca 0.45 1.95 0.03 0.00 0.04 0.00 0.00 61.00 63.46 2jgl s PRO 36 Cb -0.15 -3.23 0.01 0.00 0.04 0.00 0.00 34.50 31.17 2jgl s PRO 36 CO 0.07 -0.18 0.51 1.97 0.04 0.00 0.00 177.00 179.41 2jgl n PHE 37 N 2.71 0.00 -3.70 0.56 1.16 -1.13 -4.86 117.46 112.20 2jgl n PHE 37 Ca 0.06 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.52 2jgl n PHE 37 Cb 0.44 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.25 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 -0.39 -0.81 0.28 1.98 0.00 -1.25 -2.87 121.76 118.70 2jgl s ALA 38 Ca 0.03 0.02 -0.29 0.00 0.00 0.00 0.00 51.96 51.71 2jgl s ALA 38 Cb 0.02 0.46 -0.10 0.00 0.00 0.00 0.00 23.12 23.50 2jgl s ALA 38 CO 0.04 -0.51 1.31 -1.21 0.00 0.00 0.00 175.76 175.40 2jgl s GLU 39 N -3.04 4.37 -0.20 0.00 0.41 -0.28 -4.43 118.70 115.54 2jgl s GLU 39 Ca -0.02 2.15 -0.38 0.00 -0.41 0.00 0.00 54.97 56.31 2jgl s GLU 39 Cb 0.01 -3.12 -0.15 0.00 -1.78 0.00 0.00 34.13 29.09 2jgl s GLU 39 CO -0.06 -0.21 1.75 -2.30 -0.49 0.00 0.00 175.26 173.95 2jgl n PRO 40 N 1.57 1.41 -1.03 0.39 -0.02 -1.26 -4.71 135.00 131.35 2jgl n PRO 40 Ca 0.03 0.52 -0.22 0.00 -2.02 0.00 0.00 63.50 61.80 2jgl n PRO 40 Cb 0.42 -2.24 -0.09 0.00 -0.02 0.00 0.00 33.50 31.57 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 5.46 2.53 -3.35 0.52 -0.04 -1.26 -4.89 135.00 133.97 2jgl n PRO 41 Ca 0.25 -1.43 -0.20 0.00 -0.04 0.00 0.00 63.50 62.07 2jgl n PRO 41 Cb 0.17 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.32 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 1.80 2.51 0.00 0.52 -7.23 -1.26 -3.48 120.40 113.25 2jgl s VAL 42 Ca 0.62 -1.20 0.00 0.00 -1.81 0.00 0.00 61.98 59.59 2jgl s VAL 42 Cb 0.23 -2.70 0.00 0.00 0.56 0.00 0.00 36.38 34.46 2jgl s VAL 42 CO -0.03 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.37 2jgl n GLY 43 N -1.80 3.12 0.00 2.32 0.00 -1.26 -0.36 105.19 107.20 2jgl n GLY 43 Ca 0.07 0.28 0.10 0.00 0.00 0.00 0.00 46.02 46.46 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 7.18 0.00 -0.40 1.61 3.41 -1.26 -2.82 113.62 121.34 2jgl n SER 44 Ca 0.00 -0.09 0.11 0.00 -0.26 0.00 0.00 58.87 58.64 2jgl n SER 44 Cb 0.00 -0.25 0.09 0.00 -0.26 0.00 0.00 64.21 63.79 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 -1.25 1.03 -1.71 4.33 5.12 0.51 -4.86 116.66 119.83 2jgl n ARG 45 Ca 0.10 -0.80 -0.43 0.00 -1.93 0.00 0.00 57.85 54.79 2jgl n ARG 45 Cb 0.15 -1.48 -0.02 0.00 -1.16 0.00 0.00 32.46 29.94 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 -0.29 2.33 -0.03 5.56 0.63 -1.13 -1.20 116.66 122.54 2jgl n ARG 46 Ca 0.10 0.83 0.00 0.00 -0.92 0.00 0.00 57.85 57.85 2jgl n ARG 46 Cb 0.43 -2.52 0.00 0.00 0.45 0.00 0.00 32.46 30.82 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 1.66 0.00 -3.25 -0.14 3.72 -1.26 -4.95 117.46 113.23 2jgl n PHE 47 Ca 0.09 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.17 2jgl n PHE 47 Cb 0.35 -0.23 -0.06 0.00 -0.94 0.00 0.00 39.48 38.60 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 -0.01 3.90 0.64 -1.08 -1.94 -0.34 -4.33 119.30 116.14 2jgl s MET 48 Ca 0.00 0.48 -0.17 0.00 -1.71 0.00 0.00 55.69 54.29 2jgl s MET 48 Cb 0.00 -2.53 -0.04 0.00 2.01 0.00 0.00 34.83 34.27 2jgl s MET 48 CO 0.00 0.22 0.82 -2.30 -0.01 0.00 0.00 175.02 173.75 2jgl n PRO 49 N -0.30 0.65 -2.61 2.03 -0.02 -1.26 -4.94 135.00 128.55 2jgl n PRO 49 Ca 0.02 0.26 -0.37 0.00 -2.02 0.00 0.00 63.50 61.39 2jgl n PRO 49 Cb 0.53 -2.04 -0.05 0.00 -0.02 0.00 0.00 33.50 31.92 2jgl n PRO 49 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2jgl s PRO 50 N -2.76 4.36 -0.11 0.52 0.04 -1.26 -5.04 135.00 130.75 2jgl s PRO 50 Ca 0.73 1.49 -0.05 0.00 0.04 0.00 0.00 61.00 63.21 2jgl s PRO 50 Cb -0.40 -2.71 -0.04 0.00 0.04 0.00 0.00 34.50 31.40 2jgl s PRO 50 CO 0.50 0.04 0.08 -1.21 0.04 0.00 0.00 177.00 176.44 2jgl s GLU 51 N -2.22 3.28 0.49 4.56 2.02 -1.26 -5.02 118.70 120.55 2jgl s GLU 51 Ca 0.54 -0.26 -0.23 0.00 0.02 0.00 0.00 54.97 55.04 2jgl s GLU 51 Cb -0.22 -3.03 -0.07 0.00 0.10 0.00 0.00 34.13 30.91 2jgl s GLU 51 CO 0.28 0.71 1.22 -2.30 0.02 0.00 0.00 175.26 175.19 2jgl n PRO 52 N 2.15 1.61 -1.71 0.39 -0.02 -1.26 -1.12 135.00 135.03 2jgl n PRO 52 Ca -0.19 0.58 -0.43 0.00 -2.02 0.00 0.00 63.50 61.44 2jgl n PRO 52 Cb 0.54 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 2jgl n PRO 52 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2jgl n LYS 53 N -0.48 2.53 -2.83 -0.52 3.00 -1.14 -4.09 118.16 114.64 2jgl n LYS 53 Ca 0.09 0.91 -0.41 0.00 -0.00 0.00 0.00 58.31 58.90 2jgl n LYS 53 Cb 0.43 -2.69 -0.05 0.00 0.00 0.00 0.00 35.03 32.72 2jgl n LYS 53 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2jgl s ARG 54 N 0.26 4.64 0.54 1.64 0.52 -1.26 -4.91 118.95 120.38 2jgl s ARG 54 Ca 0.71 1.31 -0.20 0.00 -0.52 0.00 0.00 55.73 57.03 2jgl s ARG 54 Cb -0.55 -3.36 -0.07 0.00 0.52 0.00 0.00 34.95 31.48 2jgl s ARG 54 CO 0.42 0.28 0.89 -2.30 0.02 0.00 0.00 175.30 174.60 2jgl n PRO 55 N 2.64 0.96 -3.69 3.54 -0.02 -1.26 -5.01 135.00 132.15 2jgl n PRO 55 Ca 0.00 0.36 -0.21 0.00 -2.02 0.00 0.00 63.50 61.63 2jgl n PRO 55 Cb 0.49 -2.03 -0.04 0.00 -0.02 0.00 0.00 33.50 31.90 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 -1.48 2.73 0.10 6.00 -2.14 0.15 -5.03 118.94 119.27 2jgl s TRP 56 Ca 0.70 -0.47 0.07 0.00 2.66 0.00 0.00 56.10 59.07 2jgl s TRP 56 Cb -0.46 -2.07 -0.04 0.00 -3.10 0.00 0.00 33.47 27.80 2jgl s TRP 56 CO 0.52 -0.02 -0.12 -1.54 -2.66 0.00 0.00 176.95 173.12 2jgl s SER 57 N -4.07 4.26 0.00 -2.66 1.04 -1.26 -4.67 113.70 106.34 2jgl s SER 57 Ca 0.46 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.47 2jgl s SER 57 Cb -0.03 -0.77 0.00 0.00 0.10 0.00 0.00 66.02 65.32 2jgl s SER 57 CO 0.27 0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.28 2jgl n GLY 58 N 0.78 -2.60 3.57 7.32 0.00 -1.26 -4.81 105.19 108.18 2jgl n GLY 58 Ca -0.14 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 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 -0.51 4.97 0.07 1.61 1.01 -1.26 -3.87 120.40 122.41 2jgl s VAL 59 Ca 0.00 0.51 -0.31 0.00 0.00 0.00 0.00 61.98 62.18 2jgl s VAL 59 Cb 0.00 -3.99 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 2jgl s VAL 59 CO 0.00 -0.22 1.29 -0.22 0.00 0.00 0.00 175.10 175.96 2jgl s LEU 60 N 2.51 4.36 -0.17 3.92 0.20 0.14 -4.84 118.68 124.80 2jgl s LEU 60 Ca 0.21 2.13 -0.29 0.00 0.69 0.00 0.00 54.13 56.87 2jgl s LEU 60 Cb -0.15 -3.58 -0.01 0.00 -0.43 0.00 0.00 46.19 42.02 2jgl s LEU 60 CO 0.13 -0.58 1.17 -0.62 -0.29 0.00 0.00 176.35 176.17 2jgl s ASP 61 N 1.21 7.02 -0.41 3.68 -1.08 -1.26 -0.70 116.67 125.12 2jgl s ASP 61 Ca 0.61 1.60 0.07 0.00 -0.52 0.00 0.00 52.55 54.32 2jgl s ASP 61 Cb -0.32 -2.54 0.43 0.00 -1.46 0.00 0.00 42.92 39.03 2jgl s ASP 61 CO 0.29 -0.70 1.09 0.00 0.52 0.00 0.00 175.17 176.37 2jgl n ALA 62 N 6.28 4.81 0.56 3.66 0.00 0.99 -4.78 120.51 132.03 2jgl n ALA 62 Ca 0.13 -4.11 0.06 0.00 0.00 0.00 0.00 53.44 49.52 2jgl n ALA 62 Cb 0.46 -0.58 -0.06 0.00 0.00 0.00 0.00 19.45 19.27 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 -0.44 0.00 -4.11 0.00 -2.24 -1.25 -0.38 114.28 105.85 2jgl n THR 63 Ca 0.35 -0.24 -0.15 0.00 -2.27 0.00 0.00 64.05 61.74 2jgl n THR 63 Cb 0.71 1.02 -0.12 0.00 -2.10 0.00 0.00 70.33 69.84 2jgl n THR 63 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2jgl s THR 64 N -2.04 0.76 0.47 4.28 -4.23 -1.26 -4.87 115.64 108.75 2jgl s THR 64 Ca 0.05 -1.14 -0.24 0.00 -1.18 0.00 0.00 61.69 59.19 2jgl s THR 64 Cb 0.09 -0.78 -0.08 0.00 1.34 0.00 0.00 72.50 73.07 2jgl s THR 64 CO 0.46 -0.30 1.27 0.49 -0.54 0.00 0.00 174.62 176.01 2jgl n PHE 65 N 1.45 2.09 -2.34 3.99 3.72 -1.26 -3.77 117.46 121.33 2jgl n PHE 65 Ca -0.22 0.47 -0.12 0.00 -0.05 0.00 0.00 57.45 57.53 2jgl n PHE 65 Cb 0.55 -2.36 0.06 0.00 -0.94 0.00 0.00 39.48 36.79 2jgl n PHE 65 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2jgl n GLN 66 N -0.33 0.17 -1.48 -1.08 1.13 -1.26 -4.90 117.38 109.62 2jgl n GLN 66 Ca 0.08 -1.35 -0.37 0.00 -1.94 0.00 0.00 57.00 53.42 2jgl n GLN 66 Cb 0.42 -0.37 0.07 0.00 0.11 0.00 0.00 30.24 30.47 2jgl n GLN 66 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2jgl n ASN 67 N -3.00 0.43 -4.83 1.08 3.02 -1.26 -4.82 115.26 105.88 2jgl n ASN 67 Ca 0.08 0.72 -0.36 0.00 -0.03 0.00 0.00 54.58 54.99 2jgl n ASN 67 Cb 0.30 -1.38 -0.06 0.00 -0.61 0.00 0.00 39.78 38.03 2jgl n ASN 67 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2jgl s VAL 68 N -1.67 4.77 0.30 2.41 1.01 -0.39 -4.73 120.40 122.09 2jgl s VAL 68 Ca 0.74 1.03 -0.29 0.00 0.00 0.00 0.00 61.98 63.46 2jgl s VAL 68 Cb -0.38 -3.81 -0.11 0.00 0.00 0.00 0.00 36.38 32.09 2jgl s VAL 68 CO 0.49 0.33 1.48 0.00 0.00 0.00 0.00 175.10 177.40 2jgl n TYR 70 N 1.72 1.84 -3.54 0.00 9.36 -0.98 -4.72 117.16 120.84 2jgl n TYR 70 Ca 0.05 0.48 -0.13 0.00 3.32 0.00 0.00 57.90 61.62 2jgl n TYR 70 Cb 0.39 -2.43 -0.04 0.00 -0.63 0.00 0.00 39.34 36.63 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 1.30 1.11 0.26 2.98 -2.07 -1.26 -4.69 119.66 117.29 2jgl s GLN 71 Ca 0.86 -0.34 -0.31 0.00 -1.82 0.00 0.00 55.36 53.75 2jgl s GLN 71 Cb -0.88 0.51 -0.12 0.00 -1.09 0.00 0.00 33.01 31.42 2jgl s GLN 71 CO 0.48 -0.43 1.66 0.98 -1.32 0.00 0.00 175.29 176.66 2jgl n TYR 72 N 0.13 2.82 -4.03 9.60 4.19 -1.26 -5.00 117.16 123.60 2jgl n TYR 72 Ca -0.18 0.16 -0.35 0.00 3.31 0.00 0.00 57.90 60.84 2jgl n TYR 72 Cb 0.62 -2.63 -0.13 0.00 0.49 0.00 0.00 39.34 37.68 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 0.52 3.68 0.21 2.97 1.01 -1.26 -4.86 120.40 122.66 2jgl s VAL 73 Ca 0.69 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.97 2jgl s VAL 73 Cb -0.50 -2.67 -0.09 0.00 0.00 0.00 0.00 36.38 33.12 2jgl s VAL 73 CO 0.41 0.43 1.38 -0.62 0.00 0.00 0.00 175.10 176.69 2jgl s ASP 74 N 1.19 6.79 -0.04 3.32 2.15 -1.26 -4.93 116.67 123.89 2jgl s ASP 74 Ca 0.03 2.50 0.06 0.00 0.43 0.00 0.00 52.55 55.57 2jgl s ASP 74 Cb -0.14 -2.61 0.09 0.00 -0.30 0.00 0.00 42.92 39.96 2jgl s ASP 74 CO 0.00 -0.61 1.02 0.35 -0.17 0.00 0.00 175.17 175.75 2jgl n THR 75 N 2.70 0.65 -0.14 1.71 -2.24 -1.26 -4.87 114.28 110.83 2jgl n THR 75 Ca 0.07 -0.77 -0.08 0.00 -2.27 0.00 0.00 64.05 61.00 2jgl n THR 75 Cb 0.42 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 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 0.51 -6.87 3.22 5.85 -2.01 -3.32 115.31 112.69 2jgl h LEU 76 Ca 0.00 -0.08 -0.61 0.00 0.84 0.00 0.00 57.88 58.03 2jgl h LEU 76 Cb 1.21 -0.13 -0.41 0.00 0.37 0.00 0.00 40.66 41.70 2jgl h LEU 76 CO 0.00 0.44 -0.68 -1.22 -0.34 0.00 0.00 178.44 176.64 2jgl n TYR 77 N -4.73 2.16 -1.51 1.25 4.01 -1.26 -5.09 117.16 111.99 2jgl n TYR 77 Ca 0.01 -4.05 -0.44 0.00 -0.16 0.00 0.00 57.90 53.26 2jgl n TYR 77 Cb 0.07 -0.39 -0.06 0.00 -0.31 0.00 0.00 39.34 38.65 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 2.15 1.11 0.00 -0.72 -0.02 -1.25 -2.10 135.00 134.17 2jgl n PRO 78 Ca 0.23 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2jgl n PRO 78 Cb 0.39 -2.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.08 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 6.24 1.38 3.71 -1.23 0.00 -1.26 -5.10 105.19 108.93 2jgl n GLY 79 Ca 0.41 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.08 3.66 0.23 1.61 5.36 -0.89 -4.97 117.98 120.91 2jgl s PHE 80 Ca 0.00 1.68 -0.07 0.00 -0.96 0.00 0.00 56.93 57.58 2jgl s PHE 80 Cb 0.00 -3.09 0.22 0.00 -0.34 0.00 0.00 43.02 39.80 2jgl s PHE 80 CO 0.00 0.01 1.84 1.49 -1.46 0.00 0.00 175.22 177.11 2jgl h GLU 81 N 6.72 1.23 -0.69 10.12 4.57 -1.97 -1.15 114.58 133.41 2jgl h GLU 81 Ca -0.41 -0.16 0.17 0.00 -1.18 0.00 0.00 59.36 57.78 2jgl h GLU 81 Cb 1.22 -0.23 -0.04 0.00 -0.16 0.00 0.00 28.75 29.54 2jgl h GLU 81 CO 0.75 0.92 0.48 0.78 -1.18 0.00 0.00 179.01 180.76 2jgl h GLY 82 N 1.24 0.28 0.09 1.92 0.00 -1.93 -2.02 103.07 102.65 2jgl h GLY 82 Ca 0.30 -0.07 -0.37 0.00 0.00 0.00 0.00 47.33 47.20 2jgl h GLY 82 CO -0.04 0.02 -2.36 -1.30 0.00 0.00 0.00 176.54 172.86 2jgl n THR 83 N -4.40 1.45 0.02 4.70 -2.24 -1.09 -4.58 114.28 108.15 2jgl n THR 83 Ca 0.13 -0.76 -0.03 0.00 -2.27 0.00 0.00 64.05 61.12 2jgl n THR 83 Cb 0.65 -0.85 0.21 0.00 -2.10 0.00 0.00 70.33 68.24 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 0.46 -0.05 -0.78 4.39 -0.80 -2.72 114.58 115.09 2jgl h GLU 84 Ca -0.54 -0.17 0.01 0.00 0.34 0.00 0.00 59.36 59.00 2jgl h GLU 84 Cb 2.12 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 30.74 2jgl h GLU 84 CO -0.00 0.68 0.21 0.00 -1.16 0.00 0.00 179.01 178.74 2jgl h MET 85 N 0.41 0.00 -0.00 2.33 -0.00 -1.62 -0.20 114.93 115.84 2jgl h MET 85 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.76 2jgl h MET 85 Cb 0.66 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.26 2jgl h MET 85 CO 0.05 0.00 -0.78 0.91 -0.00 0.00 0.00 176.91 177.09 2jgl n TRP 86 N -3.13 0.00 -2.31 -0.10 7.02 -1.03 -4.77 117.44 113.12 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 0.28 -0.07 -0.02 0.00 -2.42 0.00 0.00 31.31 29.08 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 -2.92 6.27 0.33 -0.99 0.01 -0.09 -4.66 114.94 112.89 2jgl s ASN 87 Ca 0.11 1.74 -0.28 0.00 -0.71 0.00 0.00 52.86 53.71 2jgl s ASN 87 Cb 0.17 -2.53 -0.13 0.00 0.41 0.00 0.00 41.25 39.17 2jgl s ASN 87 CO 0.78 -0.83 1.22 -2.65 -1.51 0.00 0.00 177.10 174.11 2jgl n PRO 88 N -1.59 1.94 -0.05 -0.60 -0.02 -1.26 -4.92 135.00 128.50 2jgl n PRO 88 Ca 0.08 0.68 0.04 0.00 -2.02 0.00 0.00 63.50 62.27 2jgl n PRO 88 Cb 0.53 -2.22 0.05 0.00 -0.02 0.00 0.00 33.50 31.85 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 0.86 1.84 -4.14 2.55 6.94 -1.26 -5.00 115.26 117.04 2jgl n ASN 89 Ca 0.06 -2.30 -0.11 0.00 -0.02 0.00 0.00 54.58 52.21 2jgl n ASN 89 Cb 0.35 -0.16 -0.09 0.00 -2.36 0.00 0.00 39.78 37.52 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 -1.52 1.11 0.30 -3.83 1.81 -1.26 -5.08 118.95 110.48 2jgl s ARG 90 Ca 0.11 -1.49 -0.29 0.00 -1.72 0.00 0.00 55.73 52.34 2jgl s ARG 90 Cb 0.10 0.28 -0.13 0.00 -0.45 0.00 0.00 34.95 34.75 2jgl s ARG 90 CO 0.01 -0.36 1.28 -1.91 -0.68 0.00 0.00 175.30 173.64 2jgl n GLU 91 N -0.20 1.95 -2.58 3.54 2.13 -1.26 -4.39 120.64 119.82 2jgl n GLU 91 Ca -0.02 0.69 -0.42 0.00 0.66 0.00 0.00 57.16 58.07 2jgl n GLU 91 Cb 0.65 -2.25 -0.03 0.00 0.27 0.00 0.00 31.44 30.07 2jgl n GLU 91 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2jgl s LEU 92 N -0.38 4.39 -0.01 4.31 1.43 -1.26 -1.26 118.68 125.90 2jgl s LEU 92 Ca 0.60 1.85 -0.25 0.00 -1.03 0.00 0.00 54.13 55.31 2jgl s LEU 92 Cb -0.62 -3.58 0.05 0.00 0.03 0.00 0.00 46.19 42.07 2jgl s LEU 92 CO 0.58 -0.32 0.54 -0.55 0.23 0.00 0.00 176.35 176.83 2jgl s SER 93 N 0.82 -0.48 0.31 2.29 0.15 -0.28 -4.91 113.70 111.61 2jgl s SER 93 Ca 0.54 0.40 0.26 0.00 0.70 0.00 0.00 55.95 57.85 2jgl s SER 93 Cb -0.25 0.47 0.81 0.00 -1.71 0.00 0.00 66.02 65.34 2jgl s SER 93 CO 0.29 -0.61 1.75 -0.33 1.20 0.00 0.00 173.24 175.55 2jgl h GLU 94 N 3.13 0.00 -5.22 5.44 5.08 -1.95 -2.60 114.58 118.47 2jgl h GLU 94 Ca -0.29 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.41 2jgl h GLU 94 Cb 1.17 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.26 2jgl h GLU 94 CO 0.40 0.00 0.79 0.34 -1.00 0.00 0.00 179.01 179.54 2jgl s ASP 95 N -4.96 6.48 0.00 1.42 -1.08 -1.26 -4.26 116.67 113.01 2jgl s ASP 95 Ca 0.07 -1.69 0.00 0.00 -0.52 0.00 0.00 52.55 50.41 2jgl s ASP 95 Cb 0.10 -2.42 0.00 0.00 -1.46 0.00 0.00 42.92 39.14 2jgl s ASP 95 CO 0.56 -1.20 0.08 0.00 0.52 0.00 0.00 175.17 175.13 2jgl n LEU 97 N 0.00 5.03 -4.18 0.00 4.77 -1.26 -4.61 117.00 116.74 2jgl n LEU 97 Ca 0.00 -3.94 -0.15 0.00 -0.03 0.00 0.00 56.01 51.89 2jgl n LEU 97 Cb 0.31 -1.74 -0.11 0.00 -2.33 0.00 0.00 43.42 39.55 2jgl n LEU 97 CO 0.00 0.20 -0.42 -0.31 -1.33 0.00 0.00 177.39 175.53 2jgl s TYR 98 N 4.14 1.10 0.24 -1.77 2.02 -1.26 -2.82 117.35 118.99 2jgl s TYR 98 Ca 0.54 -0.65 0.04 0.00 -0.37 0.00 0.00 57.07 56.63 2jgl s TYR 98 Cb 0.04 -0.60 -0.05 0.00 -0.40 0.00 0.00 41.96 40.95 2jgl s TYR 98 CO 0.07 0.02 -0.01 -0.48 -1.57 0.00 0.00 175.55 173.58 2jgl s LEU 99 N -2.45 2.23 0.04 -1.29 0.05 0.17 -1.72 118.68 115.71 2jgl s LEU 99 Ca 0.06 -1.22 0.07 0.00 0.05 0.00 0.00 54.13 53.09 2jgl s LEU 99 Cb -0.03 -0.33 -0.02 0.00 -2.05 0.00 0.00 46.19 43.76 2jgl s LEU 99 CO 0.00 -0.49 -0.21 0.20 -0.55 0.00 0.00 176.35 175.30 2jgl s ASN 100 N -3.33 2.54 -0.06 1.48 0.01 0.86 -0.67 114.94 115.76 2jgl s ASN 100 Ca 0.29 -0.52 0.01 0.00 -0.71 0.00 0.00 52.86 51.94 2jgl s ASN 100 Cb 0.06 -0.22 0.02 0.00 0.41 0.00 0.00 41.25 41.52 2jgl s ASN 100 CO 0.09 0.18 -0.08 -0.69 -1.51 0.00 0.00 177.10 175.09 2jgl s VAL 101 N -0.77 0.83 -0.09 1.60 1.01 0.45 -1.44 120.40 121.99 2jgl s VAL 101 Ca 0.08 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 61.81 2jgl s VAL 101 Cb -0.09 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.47 2jgl s VAL 101 CO 0.02 0.30 -0.18 0.26 0.00 0.00 0.00 175.10 175.49 2jgl s TRP 102 N 0.95 2.66 0.06 5.22 0.51 0.89 0.21 118.94 129.43 2jgl s TRP 102 Ca -0.10 -0.60 0.00 0.00 -2.12 0.00 0.00 56.10 53.29 2jgl s TRP 102 Cb -0.15 -1.71 -0.04 0.00 -0.81 0.00 0.00 33.47 30.76 2jgl s TRP 102 CO 0.00 -0.14 -0.05 0.95 -0.51 0.00 0.00 176.95 177.21 2jgl s THR 103 N -0.04 0.41 1.00 2.01 -4.23 -0.47 -0.53 115.64 113.78 2jgl s THR 103 Ca -0.05 -1.73 -0.15 0.00 -1.18 0.00 0.00 61.69 58.58 2jgl s THR 103 Cb -0.14 -1.41 0.02 0.00 1.34 0.00 0.00 72.50 72.31 2jgl s THR 103 CO 0.04 -0.87 0.09 -2.65 -0.54 0.00 0.00 174.62 170.69 2jgl n PRO 104 N 0.27 -0.54 -3.80 3.99 -0.02 -1.26 -0.63 135.00 133.00 2jgl n PRO 104 Ca -0.15 -0.13 -0.25 0.00 -2.02 0.00 0.00 63.50 60.96 2jgl n PRO 104 Cb 0.60 -1.68 -0.17 0.00 -0.02 0.00 0.00 33.50 32.23 2jgl n PRO 104 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2jgl s TYR 105 N -2.30 0.95 0.87 6.00 5.04 -1.25 -3.03 117.35 123.63 2jgl s TYR 105 Ca 0.54 -0.43 -0.11 0.00 -2.44 0.00 0.00 57.07 54.62 2jgl s TYR 105 Cb -0.17 -0.95 0.12 0.00 0.35 0.00 0.00 41.96 41.30 2jgl s TYR 105 CO 0.69 -0.42 1.09 -1.25 -1.34 0.00 0.00 175.55 174.32 2jgl s PRO 106 N 1.88 1.44 0.52 4.97 0.04 -1.26 -4.80 135.00 137.79 2jgl s PRO 106 Ca 0.04 0.88 -0.22 0.00 0.04 0.00 0.00 61.00 61.74 2jgl s PRO 106 Cb -0.13 -1.82 -0.06 0.00 0.04 0.00 0.00 34.50 32.52 2jgl s PRO 106 CO -0.06 -2.13 1.28 0.54 0.04 0.00 0.00 177.00 176.66 2jgl n ARG 107 N -3.82 1.64 -1.53 4.56 1.74 -1.17 -4.89 116.66 113.19 2jgl n ARG 107 Ca 0.07 0.60 -0.35 0.00 -0.77 0.00 0.00 57.85 57.41 2jgl n ARG 107 Cb 0.55 -2.46 0.08 0.00 -1.02 0.00 0.00 32.46 29.61 2jgl n ARG 107 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2jgl s PRO 108 N -2.69 2.28 -0.08 5.56 0.04 -1.26 -4.98 135.00 133.87 2jgl s PRO 108 Ca 0.69 1.78 -0.21 0.00 0.04 0.00 0.00 61.00 63.30 2jgl s PRO 108 Cb -0.44 -1.85 -0.17 0.00 0.04 0.00 0.00 34.50 32.08 2jgl s PRO 108 CO 0.51 -1.73 0.77 0.00 0.04 0.00 0.00 177.00 176.59 2jgl h ALA 109 N -0.09 -0.10 -2.68 8.56 0.00 -1.94 -3.45 119.26 119.56 2jgl h ALA 109 Ca -0.48 -0.28 -0.62 0.00 0.00 0.00 0.00 54.91 53.53 2jgl h ALA 109 Cb 1.30 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 19.07 2jgl h ALA 109 CO 0.51 -0.17 -0.29 -1.54 0.00 0.00 0.00 179.25 177.75 2jgl s SER 110 N -5.73 6.63 -0.32 0.00 1.04 -1.26 -5.04 113.70 109.03 2jgl s SER 110 Ca -0.13 0.76 -0.43 0.00 0.48 0.00 0.00 55.95 56.63 2jgl s SER 110 Cb -0.01 -2.17 -0.18 0.00 0.10 0.00 0.00 66.02 63.76 2jgl s SER 110 CO 0.50 0.28 1.56 -0.81 0.98 0.00 0.00 173.24 175.75 2jgl n PRO 111 N 1.45 0.46 -4.26 4.02 -0.04 -1.26 -4.97 135.00 130.41 2jgl n PRO 111 Ca -0.13 0.17 -0.35 0.00 -0.04 0.00 0.00 63.50 63.15 2jgl n PRO 111 Cb 0.53 -1.74 -0.10 0.00 -0.04 0.00 0.00 33.50 32.15 2jgl n PRO 111 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2jgl s THR 112 N 2.60 4.45 0.25 0.52 2.01 -0.13 -4.72 115.64 120.62 2jgl s THR 112 Ca 1.00 -0.18 -0.29 0.00 0.31 0.00 0.00 61.69 62.52 2jgl s THR 112 Cb -1.29 -2.92 -0.15 0.00 0.01 0.00 0.00 72.50 68.16 2jgl s THR 112 CO 0.71 0.56 1.00 -2.65 -0.69 0.00 0.00 174.62 173.55 2jgl n PRO 113 N 2.63 1.18 -4.49 4.92 -0.02 -1.26 0.12 135.00 138.08 2jgl n PRO 113 Ca -0.18 0.42 -0.34 0.00 -2.02 0.00 0.00 63.50 61.38 2jgl n PRO 113 Cb 0.53 -1.78 -0.12 0.00 -0.02 0.00 0.00 33.50 32.11 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 -0.83 3.81 -0.21 -1.45 1.01 0.15 -3.17 120.40 119.72 2jgl s VAL 114 Ca 0.63 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 62.16 2jgl s VAL 114 Cb -0.76 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 2jgl s VAL 114 CO 0.58 0.53 -0.02 -0.76 0.00 0.00 0.00 175.10 175.43 2jgl s LEU 115 N -0.06 3.07 -0.27 3.92 1.43 0.39 -1.03 118.68 126.13 2jgl s LEU 115 Ca 0.01 -0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 52.74 2jgl s LEU 115 Cb -0.13 -1.78 -0.02 0.00 0.03 0.00 0.00 46.19 44.29 2jgl s LEU 115 CO 0.03 0.03 0.08 -0.63 0.23 0.00 0.00 176.35 176.08 2jgl s ILE 116 N 1.21 4.21 -0.02 -0.59 1.01 0.09 -0.99 121.20 126.11 2jgl s ILE 116 Ca 0.03 -0.35 -0.20 0.00 0.00 0.00 0.00 60.65 60.13 2jgl s ILE 116 Cb -0.14 -3.04 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 2jgl s ILE 116 CO -0.00 0.25 0.59 0.86 0.00 0.00 0.00 174.94 176.63 2jgl s TRP 117 N 1.58 3.65 -0.24 3.97 -0.11 0.57 -0.90 118.94 127.46 2jgl s TRP 117 Ca 0.05 1.16 0.02 0.00 1.22 0.00 0.00 56.10 58.55 2jgl s TRP 117 Cb -0.16 -2.61 0.05 0.00 -1.50 0.00 0.00 33.47 29.26 2jgl s TRP 117 CO 0.03 0.31 -0.09 0.42 -4.62 0.00 0.00 176.95 173.00 2jgl s ILE 118 N -0.02 1.86 0.69 5.86 1.01 -0.45 -3.88 121.20 126.27 2jgl s ILE 118 Ca 0.31 -1.36 -0.15 0.00 0.00 0.00 0.00 60.65 59.45 2jgl s ILE 118 Cb -0.18 -2.00 0.02 0.00 0.01 0.00 0.00 42.46 40.31 2jgl s ILE 118 CO 0.16 0.01 1.16 -0.72 0.00 0.00 0.00 174.94 175.55 2jgl s TYR 119 N 1.26 2.34 0.18 3.97 -0.85 -1.26 -3.51 117.35 119.48 2jgl s TYR 119 Ca -0.06 1.58 0.02 0.00 -0.52 0.00 0.00 57.07 58.09 2jgl s TYR 119 Cb -0.19 -3.31 0.03 0.00 0.38 0.00 0.00 41.96 38.87 2jgl s TYR 119 CO -0.06 -2.13 0.25 0.41 -1.52 0.00 0.00 175.55 172.50 2jgl n GLY 120 N -0.07 1.49 0.00 5.49 0.00 -1.10 -3.15 105.19 107.85 2jgl n GLY 120 Ca 0.12 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 44.05 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 2.88 0.53 2.68 -0.02 0.00 -1.26 -4.30 105.19 105.70 2jgl n GLY 121 Ca 0.05 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.04 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 0.40 2.56 -0.02 0.00 -1.26 -1.04 105.19 105.83 2jgl n GLY 122 Ca 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.32 0.00 -0.05 1.61 3.72 -1.26 -4.81 117.46 114.35 2jgl n PHE 123 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 2jgl n PHE 123 Cb 0.39 -1.12 0.00 0.00 -0.94 0.00 0.00 39.48 37.81 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 -2.44 0.00 -4.02 1.38 0.18 -0.67 0.85 117.16 112.44 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 0.28 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.21 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 -0.51 0.70 0.00 9.48 1.04 -0.20 -3.99 113.70 120.22 2jgl s SER 125 Ca 0.00 -1.40 0.00 0.00 0.48 0.00 0.00 55.95 55.03 2jgl s SER 125 Cb 0.00 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.83 2jgl s SER 125 CO 0.00 -1.38 0.00 0.61 0.98 0.00 0.00 173.24 173.45 2jgl n GLY 126 N -0.56 2.67 3.59 7.32 0.00 -1.26 -4.20 105.19 112.75 2jgl n GLY 126 Ca -0.01 -2.10 -0.10 0.00 0.00 0.00 0.00 46.02 43.81 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 -2.26 -1.94 -2.03 4.61 0.00 -1.26 -4.67 121.76 114.21 2jgl s ALA 127 Ca 0.00 1.67 0.30 0.00 0.00 0.00 0.00 51.96 53.93 2jgl s ALA 127 Cb 0.00 -0.91 1.57 0.00 0.00 0.00 0.00 23.12 23.78 2jgl s ALA 127 CO 0.00 -0.29 2.04 0.00 0.00 0.00 0.00 175.76 177.51 2jgl n ALA 128 N 1.21 2.66 1.02 0.00 0.00 -1.26 -3.79 120.51 120.35 2jgl n ALA 128 Ca -0.11 -0.27 0.11 0.00 0.00 0.00 0.00 53.44 53.17 2jgl n ALA 128 Cb 0.57 -1.40 0.05 0.00 0.00 0.00 0.00 19.45 18.67 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 -0.72 2.30 -4.69 0.00 3.41 -1.26 -4.86 113.62 107.80 2jgl n SER 129 Ca 0.21 -1.65 -0.37 0.00 -0.26 0.00 0.00 58.87 56.79 2jgl n SER 129 Cb 0.20 0.30 0.06 0.00 -0.26 0.00 0.00 64.21 64.52 2jgl n SER 129 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jgl n LEU 130 N 0.40 5.12 -0.30 1.04 4.77 -1.25 -4.92 117.00 121.86 2jgl n LEU 130 Ca 0.11 0.83 0.05 0.00 -0.03 0.00 0.00 56.01 56.97 2jgl n LEU 130 Cb 0.51 -1.49 0.26 0.00 -2.33 0.00 0.00 43.42 40.36 2jgl n LEU 130 CO 0.24 -1.30 1.24 0.44 -1.33 0.00 0.00 177.39 176.68 2jgl h ASP 131 N 0.57 0.88 0.33 -1.43 3.32 -1.94 -1.69 116.42 116.46 2jgl h ASP 131 Ca -0.50 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2jgl h ASP 131 Cb 1.35 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2jgl h ASP 131 CO 0.52 0.54 0.00 1.33 -1.72 0.00 0.00 179.24 179.92 2jgl n VAL 132 N -4.51 1.04 -0.55 -1.35 0.24 -1.26 -2.28 118.33 109.65 2jgl n VAL 132 Ca 0.15 0.26 0.07 0.00 -2.04 0.00 0.00 64.34 62.78 2jgl n VAL 132 Cb 0.24 -1.06 0.23 0.00 -1.47 0.00 0.00 33.84 31.79 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 -1.43 0.84 -1.66 6.34 4.01 -0.64 -4.57 117.16 120.06 2jgl n TYR 133 Ca 0.04 -0.65 -0.43 0.00 -0.16 0.00 0.00 57.90 56.70 2jgl n TYR 133 Cb 0.12 -0.17 -0.03 0.00 -0.31 0.00 0.00 39.34 38.95 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 -1.30 5.93 0.00 7.72 -1.08 -0.97 -4.87 116.67 122.11 2jgl s ASP 134 Ca 0.36 2.21 0.29 0.00 -0.52 0.00 0.00 52.55 54.89 2jgl s ASP 134 Cb 0.24 -2.52 1.52 0.00 -1.46 0.00 0.00 42.92 40.70 2jgl s ASP 134 CO 0.15 -1.54 2.03 0.61 0.52 0.00 0.00 175.17 176.95 2jgl n GLY 135 N 5.18 -1.20 0.37 2.66 0.00 -1.26 -4.22 105.19 106.72 2jgl n GLY 135 Ca 0.25 -0.15 0.04 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 1.03 -0.18 1.61 0.11 -1.90 -2.19 114.38 112.85 2jgl h ARG 136 Ca 0.00 -0.06 -0.10 0.00 0.10 0.00 0.00 59.98 59.92 2jgl h ARG 136 Cb 0.23 -0.23 -0.00 0.00 1.11 0.00 0.00 29.97 31.08 2jgl h ARG 136 CO 0.00 0.68 -0.27 0.74 0.10 0.00 0.00 179.97 181.22 2jgl h PHE 137 N 1.07 0.63 -0.37 4.08 0.04 -1.78 -0.30 116.94 120.30 2jgl h PHE 137 Ca 0.42 -0.21 -0.09 0.00 2.80 0.00 0.00 57.97 60.88 2jgl h PHE 137 Cb 0.24 -0.12 -0.02 0.00 2.20 0.00 0.00 35.95 38.25 2jgl h PHE 137 CO -0.00 0.91 -0.16 -0.07 -0.60 0.00 0.00 178.31 178.40 2jgl h LEU 138 N 0.16 0.68 0.34 1.54 3.38 -1.71 0.12 115.31 119.83 2jgl h LEU 138 Ca 0.02 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 2jgl h LEU 138 Cb 0.85 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2jgl h LEU 138 CO 0.06 0.85 -0.16 0.00 0.09 0.00 0.00 178.44 179.28 2jgl h ALA 139 N 1.21 -0.46 -0.08 1.53 0.00 -1.34 -1.78 119.26 118.35 2jgl h ALA 139 Ca 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2jgl h ALA 139 Cb 0.61 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2jgl h ALA 139 CO 0.04 -0.72 -0.04 0.37 0.00 0.00 0.00 179.25 178.90 2jgl h GLN 140 N -0.53 0.17 0.17 0.00 -0.00 -0.95 -1.88 115.11 112.09 2jgl h GLN 140 Ca -0.05 -0.07 -0.31 0.00 -0.00 0.00 0.00 58.65 58.22 2jgl h GLN 140 Cb 0.40 -0.00 0.01 0.00 0.00 0.00 0.00 27.48 27.89 2jgl h GLN 140 CO 0.08 0.54 -1.50 0.28 0.00 0.00 0.00 178.83 178.23 2jgl h VAL 141 N -0.21 1.08 -0.01 2.39 2.07 -0.86 -3.37 116.25 117.35 2jgl h VAL 141 Ca 0.02 -2.51 0.00 0.00 0.82 0.00 0.00 66.70 65.03 2jgl h VAL 141 Cb 0.49 2.84 0.00 0.00 -1.52 0.00 0.00 31.29 33.10 2jgl h VAL 141 CO 0.01 0.79 -0.77 -0.62 0.02 0.00 0.00 177.57 177.00 2jgl n GLU 142 N -3.78 0.54 -1.23 1.57 -0.58 -0.70 -4.97 120.64 111.49 2jgl n GLU 142 Ca -0.22 -0.43 -0.05 0.00 -0.42 0.00 0.00 57.16 56.04 2jgl n GLU 142 Cb 1.00 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 30.36 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 1.46 0.71 3.84 0.62 0.00 -0.71 -4.99 105.19 106.12 2jgl n GLY 143 Ca 0.06 -0.82 -0.32 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.19 3.15 -0.26 4.61 0.00 -1.03 -4.74 121.76 121.30 2jgl s ALA 144 Ca 0.00 0.21 -0.19 0.00 0.00 0.00 0.00 51.96 51.98 2jgl s ALA 144 Cb 0.00 -3.00 -0.02 0.00 0.00 0.00 0.00 23.12 20.10 2jgl s ALA 144 CO 0.00 0.11 0.55 0.08 0.00 0.00 0.00 175.76 176.49 2jgl s VAL 145 N -2.22 5.05 -0.07 0.00 1.01 -1.19 -4.12 120.40 118.85 2jgl s VAL 145 Ca 0.58 0.95 0.04 0.00 0.00 0.00 0.00 61.98 63.55 2jgl s VAL 145 Cb -0.10 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.41 2jgl s VAL 145 CO 0.19 0.07 -0.19 -0.22 0.00 0.00 0.00 175.10 174.95 2jgl s LEU 146 N 2.35 2.42 -0.02 3.92 0.20 0.31 -0.46 118.68 127.39 2jgl s LEU 146 Ca 0.23 -0.38 0.04 0.00 0.69 0.00 0.00 54.13 54.71 2jgl s LEU 146 Cb -0.16 -1.48 -0.01 0.00 -0.43 0.00 0.00 46.19 44.11 2jgl s LEU 146 CO 0.09 0.25 -0.14 -0.69 -0.29 0.00 0.00 176.35 175.57 2jgl s VAL 147 N -0.18 1.12 0.01 1.68 1.01 -0.16 -0.08 120.40 123.79 2jgl s VAL 147 Ca -0.02 -0.59 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 2jgl s VAL 147 Cb -0.14 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.29 2jgl s VAL 147 CO 0.03 0.32 -0.00 -0.94 0.00 0.00 0.00 175.10 174.51 2jgl s SER 148 N -0.23 0.11 0.09 3.32 1.04 -0.52 -0.32 113.70 117.19 2jgl s SER 148 Ca 0.03 -0.24 0.09 0.00 0.48 0.00 0.00 55.95 56.31 2jgl s SER 148 Cb -0.07 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.09 2jgl s SER 148 CO -0.00 -0.16 -0.22 0.00 0.98 0.00 0.00 173.24 173.84 2jgl s MET 149 N -0.74 1.27 0.23 4.02 0.23 -1.25 -0.09 119.30 122.96 2jgl s MET 149 Ca -0.08 -1.15 -0.27 0.00 -1.03 0.00 0.00 55.69 53.16 2jgl s MET 149 Cb -0.05 -1.54 -0.09 0.00 -1.53 0.00 0.00 34.83 31.62 2jgl s MET 149 CO -0.00 0.37 0.87 -0.80 -2.03 0.00 0.00 175.02 173.43 2jgl s ASN 150 N -1.75 7.45 0.10 -1.18 0.01 -0.70 -4.53 114.94 114.34 2jgl s ASN 150 Ca 0.08 1.78 0.04 0.00 -0.71 0.00 0.00 52.86 54.05 2jgl s ASN 150 Cb -0.10 -2.55 -0.04 0.00 0.41 0.00 0.00 41.25 38.98 2jgl s ASN 150 CO 0.04 0.11 -0.10 -0.72 -1.51 0.00 0.00 177.10 174.93 2jgl s TYR 151 N -1.30 1.05 0.21 2.20 1.13 -1.26 -4.54 117.35 114.84 2jgl s TYR 151 Ca 0.42 -0.67 -0.30 0.00 -1.41 0.00 0.00 57.07 55.11 2jgl s TYR 151 Cb -0.23 -0.57 -0.09 0.00 -1.10 0.00 0.00 41.96 39.97 2jgl s TYR 151 CO 0.27 -0.01 1.23 1.03 -2.51 0.00 0.00 175.55 175.56 2jgl s ARG 152 N -2.86 4.47 0.48 -3.49 0.52 -1.26 -4.84 118.95 111.97 2jgl s ARG 152 Ca 0.06 1.94 0.05 0.00 -0.52 0.00 0.00 55.73 57.26 2jgl s ARG 152 Cb -0.02 -3.21 -0.02 0.00 0.52 0.00 0.00 34.95 32.22 2jgl s ARG 152 CO -0.00 -0.11 0.16 0.14 0.02 0.00 0.00 175.30 175.50 2jgl s VAL 153 N -0.20 1.73 0.00 3.52 -7.23 -1.26 -4.19 120.40 112.78 2jgl s VAL 153 Ca 0.53 -1.78 0.00 0.00 -1.81 0.00 0.00 61.98 58.92 2jgl s VAL 153 Cb -0.34 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.09 2jgl s VAL 153 CO 0.39 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.79 2jgl n GLY 154 N -1.35 1.00 0.27 2.32 0.00 0.25 -1.97 105.19 105.72 2jgl n GLY 154 Ca -0.08 -0.60 -0.07 0.00 0.00 0.00 0.00 46.02 45.28 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 0.38 -0.04 2.61 1.35 -1.88 0.12 112.91 115.44 2jgl h THR 155 Ca 0.00 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.87 2jgl h THR 155 Cb 0.00 0.38 -0.00 0.00 -1.73 0.00 0.00 68.15 66.80 2jgl h THR 155 CO 0.00 0.00 0.18 -0.26 -0.25 0.00 0.00 175.52 175.19 2jgl h PHE 156 N -0.19 0.00 0.00 4.73 0.04 -1.90 -0.36 116.94 119.26 2jgl h PHE 156 Ca 0.17 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.83 2jgl h PHE 156 Cb 0.46 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.59 2jgl h PHE 156 CO -0.43 0.00 -1.84 0.41 -0.60 0.00 0.00 178.31 175.85 2jgl n GLY 157 N -1.21 -0.72 0.00 -1.45 0.00 -0.36 -4.33 105.19 97.12 2jgl n GLY 157 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2jgl n GLY 157 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jgl n PHE 158 N -2.25 0.00 -1.79 1.61 3.72 0.26 -0.67 117.46 118.34 2jgl n PHE 158 Ca -0.11 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.87 2jgl n PHE 158 Cb 0.64 0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 39.16 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 0.00 4.37 -0.01 4.37 0.20 -0.21 -4.52 118.68 122.87 2jgl s LEU 159 Ca 0.00 2.80 0.01 0.00 0.69 0.00 0.00 54.13 57.63 2jgl s LEU 159 Cb 0.00 -3.60 0.01 0.00 -0.43 0.00 0.00 46.19 42.17 2jgl s LEU 159 CO 0.00 -0.92 -0.01 0.00 -0.29 0.00 0.00 176.35 175.12 2jgl s ALA 160 N 1.04 0.24 -0.72 5.97 0.00 -1.26 -4.24 121.76 122.79 2jgl s ALA 160 Ca 0.72 0.00 -0.05 0.00 0.00 0.00 0.00 51.96 52.63 2jgl s ALA 160 Cb -0.48 -0.15 0.19 0.00 0.00 0.00 0.00 23.12 22.68 2jgl s ALA 160 CO 0.33 0.00 0.58 -0.51 0.00 0.00 0.00 175.76 176.17 2jgl s LEU 161 N 0.35 5.65 0.17 0.00 1.43 -0.16 -3.94 118.68 122.18 2jgl s LEU 161 Ca -0.03 -2.98 -0.34 0.00 -1.03 0.00 0.00 54.13 49.75 2jgl s LEU 161 Cb -0.06 -1.95 -0.15 0.00 0.03 0.00 0.00 46.19 44.07 2jgl s LEU 161 CO -0.01 -0.38 1.44 -2.65 0.23 0.00 0.00 176.35 174.98 2jgl n PRO 162 N 3.39 1.81 0.00 1.29 -0.02 -1.26 -1.51 135.00 138.70 2jgl n PRO 162 Ca 0.12 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2jgl n PRO 162 Cb 0.40 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 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 2.75 3.00 3.43 -1.23 0.00 -1.26 -5.06 105.19 106.82 2jgl n GLY 163 Ca 0.16 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 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 0.36 0.20 -0.12 1.61 1.04 -0.57 -4.98 113.70 111.24 2jgl s SER 164 Ca 0.00 1.17 0.16 0.00 0.48 0.00 0.00 55.95 57.76 2jgl s SER 164 Cb 0.00 -1.77 -0.23 0.00 0.10 0.00 0.00 66.02 64.12 2jgl s SER 164 CO 0.00 -4.63 0.16 -1.14 0.98 0.00 0.00 173.24 168.61 2jgl n ARG 165 N -5.17 1.07 0.00 4.02 0.63 -1.26 -4.30 116.66 111.64 2jgl n ARG 165 Ca 0.07 -0.05 0.12 0.00 -0.92 0.00 0.00 57.85 57.06 2jgl n ARG 165 Cb 0.57 -1.43 0.15 0.00 0.45 0.00 0.00 32.46 32.21 2jgl n ARG 165 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2jgl n GLU 166 N -2.47 0.56 -2.74 -0.14 4.71 -1.26 -4.53 120.64 114.77 2jgl n GLU 166 Ca -0.20 -0.40 -0.08 0.00 -0.01 0.00 0.00 57.16 56.48 2jgl n GLU 166 Cb 0.87 -1.49 0.05 0.00 -1.01 0.00 0.00 31.44 29.86 2jgl n GLU 166 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2jgl n ALA 167 N -0.87 -1.67 1.11 0.62 0.00 -1.26 -4.38 120.51 114.06 2jgl n ALA 167 Ca 0.08 -1.27 0.14 0.00 0.00 0.00 0.00 53.44 52.39 2jgl n ALA 167 Cb 0.37 -1.55 0.64 0.00 0.00 0.00 0.00 19.45 18.91 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 1.66 0.15 0.00 0.00 -0.04 -1.26 -0.98 135.00 134.53 2jgl n PRO 168 Ca 0.08 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2jgl n PRO 168 Cb 0.64 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 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 1.30 -0.93 2.40 0.55 0.00 -1.26 -4.71 105.19 102.54 2jgl n GLY 169 Ca 0.09 -1.64 -0.15 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.60 -4.63 0.26 1.61 3.02 -1.26 -4.86 115.26 107.80 2jgl n ASN 170 Ca 0.00 0.37 0.14 0.00 -0.03 0.00 0.00 54.58 55.06 2jgl n ASN 170 Cb 0.00 -3.98 0.64 0.00 -0.61 0.00 0.00 39.78 35.84 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 0.33 -0.45 2.41 -1.51 -1.85 -1.58 116.25 113.60 2jgl h VAL 171 Ca -0.31 -0.72 -0.05 0.00 -1.23 0.00 0.00 66.70 64.39 2jgl h VAL 171 Cb 1.09 1.54 -0.02 0.00 -2.13 0.00 0.00 31.29 31.77 2jgl h VAL 171 CO 0.45 0.11 0.06 1.23 -1.23 0.00 0.00 177.57 178.19 2jgl h GLY 172 N 1.66 0.75 1.46 5.19 0.00 -1.11 0.23 103.07 111.26 2jgl h GLY 172 Ca -0.00 -0.45 -0.13 0.00 0.00 0.00 0.00 47.33 46.76 2jgl h GLY 172 CO 0.01 0.42 -0.35 1.41 0.00 0.00 0.00 176.54 178.03 2jgl h LEU 173 N 0.67 0.63 -0.77 3.11 3.38 -1.56 -2.63 115.31 118.14 2jgl h LEU 173 Ca 0.14 -0.26 -0.13 0.00 0.09 0.00 0.00 57.88 57.73 2jgl h LEU 173 Cb 0.33 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2jgl h LEU 173 CO 0.01 0.93 -0.46 -0.07 0.09 0.00 0.00 178.44 178.94 2jgl h LEU 174 N 0.51 0.39 -0.42 1.67 3.38 -1.04 -0.42 115.31 119.37 2jgl h LEU 174 Ca 0.05 -0.18 0.05 0.00 0.09 0.00 0.00 57.88 57.89 2jgl h LEU 174 Cb 0.85 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.44 2jgl h LEU 174 CO 0.07 0.79 0.16 0.44 0.09 0.00 0.00 178.44 180.00 2jgl h ASP 175 N 0.29 0.19 -0.54 -0.43 3.32 -0.82 -0.23 116.42 118.21 2jgl h ASP 175 Ca 0.02 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 2jgl h ASP 175 Cb 0.92 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.46 2jgl h ASP 175 CO 0.08 0.14 0.31 1.56 -1.72 0.00 0.00 179.24 179.61 2jgl h GLN 176 N 0.34 0.74 -0.75 3.56 4.20 -1.03 -1.97 115.11 120.19 2jgl h GLN 176 Ca 0.19 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.78 2jgl h GLN 176 Cb 0.17 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 2jgl h GLN 176 CO -0.18 0.55 0.26 -0.09 -0.67 0.00 0.00 178.83 178.70 2jgl h ARG 177 N 0.72 1.14 -0.68 1.46 2.43 -0.81 -0.53 114.38 118.11 2jgl h ARG 177 Ca 0.19 -0.23 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 2jgl h ARG 177 Cb 0.01 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.36 2jgl h ARG 177 CO -0.03 0.96 0.40 1.25 -1.51 0.00 0.00 179.97 181.03 2jgl h LEU 178 N 1.10 0.83 -1.10 3.80 5.85 -0.79 0.24 115.31 125.24 2jgl h LEU 178 Ca 0.24 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 2jgl h LEU 178 Cb 0.27 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2jgl h LEU 178 CO -0.01 0.67 -0.07 0.00 -0.34 0.00 0.00 178.44 178.68 2jgl h ALA 179 N 1.20 1.25 -0.77 1.25 0.00 -1.10 0.27 119.26 121.36 2jgl h ALA 179 Ca 0.24 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2jgl h ALA 179 Cb -0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2jgl h ALA 179 CO -0.04 0.49 0.30 -0.07 0.00 0.00 0.00 179.25 179.93 2jgl h LEU 180 N 0.52 1.07 -0.70 0.00 3.38 -0.24 -1.34 115.31 118.01 2jgl h LEU 180 Ca 0.10 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2jgl h LEU 180 Cb 0.44 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2jgl h LEU 180 CO 0.02 0.96 0.27 1.56 0.09 0.00 0.00 178.44 181.34 2jgl h GLN 181 N 1.12 1.05 -0.92 1.13 4.20 0.24 -2.02 115.11 119.91 2jgl h GLN 181 Ca 0.26 -0.20 0.10 0.00 0.06 0.00 0.00 58.65 58.87 2jgl h GLN 181 Cb 0.23 -0.17 -0.07 0.00 0.30 0.00 0.00 27.48 27.77 2jgl h GLN 181 CO -0.02 0.87 0.59 2.35 -0.67 0.00 0.00 178.83 181.96 2jgl h TRP 182 N 1.00 1.01 -0.24 2.96 7.01 -0.23 -2.32 115.95 125.14 2jgl h TRP 182 Ca 0.23 0.03 -0.08 0.00 2.11 0.00 0.00 58.89 61.17 2jgl h TRP 182 Cb 0.22 -0.33 -0.00 0.00 -2.10 0.00 0.00 29.16 26.95 2jgl h TRP 182 CO 0.02 0.46 -0.18 0.28 -2.79 0.00 0.00 178.44 176.22 2jgl h VAL 183 N 0.93 1.31 -0.66 2.65 2.07 -0.54 -1.65 116.25 120.36 2jgl h VAL 183 Ca 0.43 -1.31 0.12 0.00 0.82 0.00 0.00 66.70 66.76 2jgl h VAL 183 Cb 0.41 1.64 -0.08 0.00 -1.52 0.00 0.00 31.29 31.74 2jgl h VAL 183 CO -0.19 0.41 0.23 1.56 0.02 0.00 0.00 177.57 179.59 2jgl h GLN 184 N 0.25 0.37 0.05 1.57 1.08 -1.11 -0.32 115.11 117.00 2jgl h GLN 184 Ca 0.05 -0.02 -0.25 0.00 -1.45 0.00 0.00 58.65 56.98 2jgl h GLN 184 Cb 0.71 -0.08 0.01 0.00 -0.05 0.00 0.00 27.48 28.06 2jgl h GLN 184 CO 0.05 0.24 -1.05 1.49 -0.95 0.00 0.00 178.83 178.61 2jgl h GLU 185 N 0.38 0.39 0.00 1.46 4.81 -1.30 -3.41 114.58 116.91 2jgl h GLU 185 Ca 0.35 -0.48 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2jgl h GLU 185 Cb 0.49 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.03 2jgl h GLU 185 CO -0.37 1.16 -1.19 0.09 -0.73 0.00 0.00 179.01 177.97 2jgl n ASN 186 N -3.69 3.49 0.28 1.04 3.02 -0.63 -4.67 115.26 114.10 2jgl n ASN 186 Ca -0.08 -0.04 0.13 0.00 -0.03 0.00 0.00 54.58 54.56 2jgl n ASN 186 Cb 0.90 1.24 0.81 0.00 -0.61 0.00 0.00 39.78 42.12 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 0.66 0.00 2.41 6.09 -1.21 -1.45 117.51 124.01 2jgl h ILE 187 Ca 0.00 -0.11 -0.01 0.00 -1.37 0.00 0.00 64.86 63.37 2jgl h ILE 187 Cb 0.25 1.07 -0.00 0.00 0.47 0.00 0.00 36.82 38.60 2jgl h ILE 187 CO 0.00 0.03 -0.04 0.00 -3.07 0.00 0.00 178.15 175.07 2jgl h ALA 188 N 1.97 1.04 0.00 0.18 0.00 -1.79 -0.68 119.26 119.98 2jgl h ALA 188 Ca -0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2jgl h ALA 188 Cb 0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2jgl h ALA 188 CO 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 179.25 179.30 2jgl h ALA 189 N 1.96 1.01 -0.09 0.00 0.00 -1.56 -2.19 119.26 118.39 2jgl h ALA 189 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jgl h ALA 189 Cb 0.38 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2jgl h ALA 189 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.45 2jgl n PHE 190 N -3.10 0.10 -0.40 0.00 3.01 -0.38 -4.90 117.46 111.79 2jgl n PHE 190 Ca -0.01 -0.07 0.00 0.00 1.01 0.00 0.00 57.45 58.37 2jgl n PHE 190 Cb 0.18 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.65 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 0.94 0.80 3.83 1.37 0.00 -0.82 -4.57 105.19 106.74 2jgl n GLY 191 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.98 2.46 -0.47 -0.02 0.00 -0.51 -0.96 107.32 105.84 2jgl s GLY 192 Ca 0.00 0.17 -0.12 0.00 0.00 0.00 0.00 44.72 44.77 2jgl s GLY 192 CO 0.00 0.45 0.36 -0.35 0.00 0.00 0.00 173.10 173.56 2jgl s ASP 193 N -2.03 5.88 0.18 1.64 2.15 0.12 -3.32 116.67 121.29 2jgl s ASP 193 Ca 0.52 -1.62 0.14 0.00 0.43 0.00 0.00 52.55 52.02 2jgl s ASP 193 Cb -0.12 -2.08 0.72 0.00 -0.30 0.00 0.00 42.92 41.13 2jgl s ASP 193 CO 0.18 -0.66 1.44 -0.81 -0.17 0.00 0.00 175.17 175.15 2jgl n PRO 194 N 5.05 0.09 0.00 4.34 -0.04 -1.26 -0.74 135.00 142.44 2jgl n PRO 194 Ca -0.11 0.53 0.14 0.00 -0.04 0.00 0.00 63.50 64.02 2jgl n PRO 194 Cb 0.42 -1.76 0.50 0.00 -0.04 0.00 0.00 33.50 32.63 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 -1.94 1.69 -3.48 0.54 2.81 -1.26 -4.43 117.12 111.05 2jgl n MET 195 Ca -0.00 -1.01 -0.28 0.00 -1.81 0.00 0.00 57.70 54.61 2jgl n MET 195 Cb 0.06 -1.48 -0.11 0.00 -0.71 0.00 0.00 33.22 30.99 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 -2.00 2.21 -0.22 7.83 0.15 0.08 -4.94 113.70 116.81 2jgl s SER 196 Ca 0.37 -2.94 0.01 0.00 0.70 0.00 0.00 55.95 54.09 2jgl s SER 196 Cb 0.21 -0.59 0.03 0.00 -1.71 0.00 0.00 66.02 63.97 2jgl s SER 196 CO 0.33 -0.20 -0.14 -0.69 1.20 0.00 0.00 173.24 173.75 2jgl s VAL 197 N 0.13 2.31 -0.20 4.45 1.01 -1.26 0.33 120.40 127.17 2jgl s VAL 197 Ca 0.28 -1.16 -0.06 0.00 0.00 0.00 0.00 61.98 61.05 2jgl s VAL 197 Cb -0.04 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 2jgl s VAL 197 CO -0.14 0.29 0.02 -0.89 0.00 0.00 0.00 175.10 174.38 2jgl s THR 198 N 1.25 4.17 0.09 3.92 2.01 -0.20 -0.22 115.64 126.66 2jgl s THR 198 Ca -0.00 -0.24 -0.25 0.00 0.31 0.00 0.00 61.69 61.51 2jgl s THR 198 Cb -0.16 -2.89 -0.06 0.00 0.01 0.00 0.00 72.50 69.40 2jgl s THR 198 CO -0.08 0.43 0.75 -0.76 -0.69 0.00 0.00 174.62 174.27 2jgl s LEU 199 N 0.85 4.50 0.01 4.42 1.43 -0.22 -0.73 118.68 128.94 2jgl s LEU 199 Ca 0.01 1.49 -0.01 0.00 -1.03 0.00 0.00 54.13 54.60 2jgl s LEU 199 Cb -0.14 -3.22 -0.01 0.00 0.03 0.00 0.00 46.19 42.85 2jgl s LEU 199 CO 0.02 0.10 -0.00 0.72 0.23 0.00 0.00 176.35 177.42 2jgl s PHE 200 N -0.50 0.16 0.05 0.29 -0.71 -0.08 0.05 117.98 117.25 2jgl s PHE 200 Ca 0.37 -0.33 -0.27 0.00 -1.04 0.00 0.00 56.93 55.66 2jgl s PHE 200 Cb -0.21 -0.12 0.09 0.00 -1.21 0.00 0.00 43.02 41.57 2jgl s PHE 200 CO 0.24 -0.14 0.94 0.20 -1.34 0.00 0.00 175.22 175.11 2jgl s GLY 201 N -1.02 -0.37 -0.34 1.99 0.00 -1.14 -1.34 107.32 105.10 2jgl s GLY 201 Ca -0.11 0.66 0.09 0.00 0.00 0.00 0.00 44.72 45.37 2jgl s GLY 201 CO -0.00 0.20 1.13 -2.21 0.00 0.00 0.00 173.10 172.21 2jgl n GLU 202 N -0.34 3.06 0.00 2.90 0.00 -1.23 -1.47 120.64 123.56 2jgl n GLU 202 Ca -0.07 -4.11 0.00 0.00 0.00 0.00 0.00 57.16 52.98 2jgl n GLU 202 Cb 0.61 -2.08 0.00 0.00 0.00 0.00 0.00 31.44 29.97 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 -0.55 0.00 -0.20 4.31 0.00 -1.26 -2.70 120.51 120.11 2jgl n ALA 204 Ca 0.34 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.69 2jgl n ALA 204 Cb 0.83 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.29 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 1.04 0.98 0.00 0.00 -1.72 -0.02 103.07 103.35 2jgl h GLY 205 Ca 0.00 -0.74 -0.07 0.00 0.00 0.00 0.00 47.33 46.52 2jgl h GLY 205 CO 0.00 0.68 -0.02 0.00 0.00 0.00 0.00 176.54 177.20 2jgl h ALA 206 N 0.98 0.59 -0.88 3.60 0.00 -1.55 -0.89 119.26 121.11 2jgl h ALA 206 Ca 0.16 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2jgl h ALA 206 Cb 0.49 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2jgl h ALA 206 CO 0.02 0.40 0.51 0.00 0.00 0.00 0.00 179.25 180.18 2jgl h ALA 207 N 0.90 1.24 -0.40 0.00 0.00 -1.72 -1.53 119.26 117.74 2jgl h ALA 207 Ca 0.12 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2jgl h ALA 207 Cb 0.52 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2jgl h ALA 207 CO 0.03 0.63 0.26 0.77 0.00 0.00 0.00 179.25 180.94 2jgl h SER 208 N 1.22 0.45 -0.30 0.00 0.02 -0.57 0.32 113.55 114.69 2jgl h SER 208 Ca 0.31 -0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.29 2jgl h SER 208 Cb -0.02 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 2jgl h SER 208 CO -0.06 0.33 0.07 0.58 -1.14 0.00 0.00 176.83 176.61 2jgl h VAL 209 N 0.54 0.87 -0.62 2.27 2.07 -0.68 -1.71 116.25 118.98 2jgl h VAL 209 Ca 0.15 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.60 2jgl h VAL 209 Cb -0.05 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2jgl h VAL 209 CO -0.04 0.03 0.36 1.23 0.02 0.00 0.00 177.57 179.18 2jgl h GLY 210 N 0.18 0.90 1.65 2.17 0.00 -0.68 -1.06 103.07 106.22 2jgl h GLY 210 Ca 0.14 -0.37 -0.13 0.00 0.00 0.00 0.00 47.33 46.97 2jgl h GLY 210 CO -0.18 0.36 -0.46 -0.33 0.00 0.00 0.00 176.54 175.93 2jgl h MET 211 N 0.86 0.38 -0.68 4.80 2.86 -0.22 -0.60 114.93 122.33 2jgl h MET 211 Ca 0.22 -0.21 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 2jgl h MET 211 Cb -0.02 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.62 2jgl h MET 211 CO -0.04 0.77 0.19 0.45 1.06 0.00 0.00 176.91 179.34 2jgl h HIS 212 N 0.31 1.11 -0.89 -0.22 3.86 -0.51 0.64 115.15 119.45 2jgl h HIS 212 Ca 0.02 -0.12 0.06 0.00 -1.16 0.00 0.00 60.37 59.17 2jgl h HIS 212 Cb 0.94 -0.32 -0.06 0.00 1.06 0.00 0.00 27.41 29.03 2jgl h HIS 212 CO 0.03 0.89 0.56 0.82 0.86 0.00 0.00 177.93 181.09 2jgl h ILE 213 N 1.02 1.07 -0.01 2.45 2.04 -0.58 -2.68 117.51 120.82 2jgl h ILE 213 Ca 0.22 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2jgl h ILE 213 Cb 0.33 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 2jgl h ILE 213 CO -0.00 0.19 -0.12 0.18 0.00 0.00 0.00 178.15 178.40 2jgl n LEU 214 N -4.58 1.12 -4.20 1.44 4.77 -0.29 -4.75 117.00 110.50 2jgl n LEU 214 Ca 0.13 -0.32 -0.36 0.00 -0.03 0.00 0.00 56.01 55.43 2jgl n LEU 214 Cb 0.16 -0.07 -0.13 0.00 -2.33 0.00 0.00 43.42 41.05 2jgl n LEU 214 CO 0.32 0.20 -0.32 -0.55 -1.33 0.00 0.00 177.39 175.70 2jgl s SER 215 N -2.26 5.03 0.22 -1.43 0.15 0.15 -4.84 113.70 110.72 2jgl s SER 215 Ca 0.32 -1.26 -0.09 0.00 0.70 0.00 0.00 55.95 55.61 2jgl s SER 215 Cb 0.20 -1.76 0.33 0.00 -1.71 0.00 0.00 66.02 63.08 2jgl s SER 215 CO 0.43 -0.29 1.68 0.25 1.20 0.00 0.00 173.24 176.51 2jgl h LEU 216 N 8.06 -0.11 -2.76 3.45 5.85 -1.85 0.84 115.31 128.80 2jgl h LEU 216 Ca -0.21 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2jgl h LEU 216 Cb 1.07 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 2jgl h LEU 216 CO 0.56 -0.05 0.07 -0.65 -0.34 0.00 0.00 178.44 178.03 2jgl h PRO 217 N 0.20 0.00 0.00 5.25 0.11 -1.95 -0.67 132.00 134.95 2jgl h PRO 217 Ca 0.34 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.42 2jgl h PRO 217 Cb 0.55 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 2jgl h PRO 217 CO -0.48 0.00 -0.63 0.77 -0.21 0.00 0.00 178.00 177.46 2jgl h SER 218 N 0.00 0.00 -0.75 -2.05 0.02 -1.07 -3.39 113.55 106.30 2jgl h SER 218 Ca 0.00 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 2jgl h SER 218 Cb 0.15 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.65 2jgl h SER 218 CO -0.00 0.14 0.50 0.03 -1.14 0.00 0.00 176.83 176.35 2jgl h ARG 219 N 0.00 0.92 -0.01 3.45 2.47 -1.00 -1.14 114.38 119.07 2jgl h ARG 219 Ca -0.02 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.64 2jgl h ARG 219 Cb 1.12 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 29.23 2jgl h ARG 219 CO 0.01 0.61 0.00 -1.13 0.56 0.00 0.00 179.97 180.02 2jgl n SER 220 N -4.44 0.10 -0.27 7.04 3.41 -1.26 -3.55 113.62 114.64 2jgl n SER 220 Ca 0.09 -1.55 0.08 0.00 -0.26 0.00 0.00 58.87 57.24 2jgl n SER 220 Cb 0.10 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.01 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 -0.67 1.42 -3.86 1.04 4.77 -0.43 -5.01 117.00 114.26 2jgl n LEU 221 Ca 0.11 -0.69 -0.09 0.00 -0.03 0.00 0.00 56.01 55.31 2jgl n LEU 221 Cb 0.07 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.11 2jgl n LEU 221 CO 0.09 0.28 0.18 0.72 -1.33 0.00 0.00 177.39 177.33 2jgl s PHE 222 N -2.12 0.13 0.00 -1.77 -0.71 -1.23 -4.90 117.98 107.38 2jgl s PHE 222 Ca 0.12 -0.49 0.00 0.00 -1.04 0.00 0.00 56.93 55.52 2jgl s PHE 222 Cb 0.13 0.24 0.00 0.00 -1.21 0.00 0.00 43.02 42.18 2jgl s PHE 222 CO 0.49 -0.89 0.00 0.72 -1.34 0.00 0.00 175.22 174.20 2jgl n HIS 223 N -0.32 0.00 -4.01 3.49 8.25 0.69 -4.93 115.22 118.38 2jgl n HIS 223 Ca -0.07 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.31 2jgl n HIS 223 Cb 0.62 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.64 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 -1.87 0.65 -0.05 -0.41 0.52 -1.12 -4.49 118.95 112.19 2jgl s ARG 224 Ca 0.00 -1.08 -0.02 0.00 -0.52 0.00 0.00 55.73 54.11 2jgl s ARG 224 Cb 0.00 0.24 0.04 0.00 0.52 0.00 0.00 34.95 35.75 2jgl s ARG 224 CO 0.00 -0.15 0.09 0.00 0.02 0.00 0.00 175.30 175.26 2jgl s ALA 225 N -3.67 -0.10 -0.15 2.13 0.00 -0.93 -1.06 121.76 117.98 2jgl s ALA 225 Ca 0.04 0.51 -0.02 0.00 0.00 0.00 0.00 51.96 52.49 2jgl s ALA 225 Cb 0.06 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.77 2jgl s ALA 225 CO -0.09 -0.16 -0.09 0.08 0.00 0.00 0.00 175.76 175.49 2jgl s VAL 226 N 1.21 3.32 -0.25 0.00 1.01 0.11 -0.73 120.40 125.06 2jgl s VAL 226 Ca -0.08 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.37 2jgl s VAL 226 Cb -0.12 -2.43 0.06 0.00 0.00 0.00 0.00 36.38 33.88 2jgl s VAL 226 CO -0.05 0.50 -0.12 -0.76 0.00 0.00 0.00 175.10 174.68 2jgl s LEU 227 N 0.50 3.21 -0.37 3.92 1.02 0.95 -2.89 118.68 125.03 2jgl s LEU 227 Ca -0.07 -1.29 -0.11 0.00 0.02 0.00 0.00 54.13 52.68 2jgl s LEU 227 Cb -0.15 -1.51 0.02 0.00 0.02 0.00 0.00 46.19 44.57 2jgl s LEU 227 CO 0.04 -0.17 0.20 -1.10 0.02 0.00 0.00 176.35 175.34 2jgl s GLN 228 N 1.15 2.94 -1.33 1.70 -0.21 -0.54 -2.47 119.66 120.90 2jgl s GLN 228 Ca -0.07 -1.00 -0.04 0.00 0.02 0.00 0.00 55.36 54.26 2jgl s GLN 228 Cb -0.19 -3.72 0.02 0.00 1.00 0.00 0.00 33.01 30.12 2jgl s GLN 228 CO -0.06 -0.65 0.94 0.43 -2.12 0.00 0.00 175.29 173.83 2jgl n SER 229 N 5.01 -3.14 0.00 5.90 7.64 -0.07 -4.21 113.62 124.75 2jgl n SER 229 Ca -0.12 -0.69 0.00 0.00 1.01 0.00 0.00 58.87 59.06 2jgl n SER 229 Cb 0.47 -4.55 0.00 0.00 -1.01 0.00 0.00 64.21 59.11 2jgl n SER 229 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jgl n GLY 230 N -1.55 0.70 3.40 0.23 0.00 -1.26 -4.81 105.19 101.90 2jgl n GLY 230 Ca -0.17 -0.59 -0.15 0.00 0.00 0.00 0.00 46.02 45.10 2jgl n GLY 230 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jgl s THR 231 N -2.00 0.03 -0.01 2.61 -4.23 -1.26 -4.30 115.64 106.47 2jgl s THR 231 Ca 0.00 -0.22 0.22 0.00 -1.18 0.00 0.00 61.69 60.51 2jgl s THR 231 Cb 0.00 -0.87 0.21 0.00 1.34 0.00 0.00 72.50 73.18 2jgl s THR 231 CO 0.00 -0.12 1.71 1.55 -0.54 0.00 0.00 174.62 177.22 2jgl h PRO 232 N 3.24 0.00 -7.30 3.99 0.13 -1.82 -3.41 132.00 126.83 2jgl h PRO 232 Ca -0.29 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.37 2jgl h PRO 232 Cb 1.17 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.37 2jgl h PRO 232 CO 0.40 0.26 0.26 0.54 -0.23 0.00 0.00 178.00 179.23 2jgl s ASN 233 N -6.23 5.20 0.00 1.44 4.22 -1.26 -4.55 114.94 113.76 2jgl s ASN 233 Ca 0.02 0.72 0.00 0.00 -2.14 0.00 0.00 52.86 51.46 2jgl s ASN 233 Cb 0.09 -1.51 0.00 0.00 1.28 0.00 0.00 41.25 41.11 2jgl s ASN 233 CO 0.66 -1.38 0.00 0.61 -2.04 0.00 0.00 177.10 174.95 2jgl n GLY 234 N -2.85 0.87 0.01 0.45 0.00 -1.26 -4.76 105.19 97.65 2jgl n GLY 234 Ca 0.06 -2.21 0.13 0.00 0.00 0.00 0.00 46.02 44.01 2jgl n GLY 234 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jgl n PRO 235 N -0.40 0.06 -0.02 1.61 -0.04 -1.26 -4.14 135.00 130.81 2jgl n PRO 235 Ca 0.00 -0.02 -0.01 0.00 -0.04 0.00 0.00 63.50 63.43 2jgl n PRO 235 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2jgl n PRO 235 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2jgl n TRP 236 N -1.45 0.00 0.25 0.54 4.27 -1.26 -4.78 117.44 115.00 2jgl n TRP 236 Ca 0.07 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.80 2jgl n TRP 236 Cb 0.33 -0.18 0.58 0.00 -1.36 0.00 0.00 31.31 30.69 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 0.23 1.07 -2.26 -1.67 0.00 -1.85 -3.44 119.26 111.34 2jgl h ALA 237 Ca -0.09 -0.13 -0.25 0.00 0.00 0.00 0.00 54.91 54.44 2jgl h ALA 237 Cb 1.07 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 18.68 2jgl h ALA 237 CO 0.00 0.18 -0.68 0.95 0.00 0.00 0.00 179.25 179.71 2jgl s THR 238 N -3.78 0.67 0.11 0.00 -4.23 -1.26 -3.72 115.64 103.43 2jgl s THR 238 Ca -0.00 -1.95 0.06 0.00 -1.18 0.00 0.00 61.69 58.61 2jgl s THR 238 Cb 0.11 -1.88 -0.04 0.00 1.34 0.00 0.00 72.50 72.03 2jgl s THR 238 CO 0.60 -0.69 -0.14 0.68 -0.54 0.00 0.00 174.62 174.52 2jgl s VAL 239 N -3.65 1.30 0.89 2.29 -7.23 -0.34 -4.98 120.40 108.68 2jgl s VAL 239 Ca 0.17 -1.66 -0.10 0.00 -1.81 0.00 0.00 61.98 58.58 2jgl s VAL 239 Cb 0.06 -1.47 0.13 0.00 0.56 0.00 0.00 36.38 35.65 2jgl s VAL 239 CO -0.01 -0.39 1.12 -0.94 -0.31 0.00 0.00 175.10 174.58 2jgl s SER 240 N -2.35 3.23 0.22 4.85 1.04 -1.26 -1.61 113.70 117.82 2jgl s SER 240 Ca 0.07 2.04 -0.08 0.00 0.48 0.00 0.00 55.95 58.46 2jgl s SER 240 Cb -0.06 -2.53 0.21 0.00 0.10 0.00 0.00 66.02 63.75 2jgl s SER 240 CO 0.03 -2.88 1.88 0.00 0.98 0.00 0.00 173.24 173.25 2jgl h ALA 241 N -1.72 1.06 -0.05 5.32 0.00 -1.95 -1.65 119.26 120.27 2jgl h ALA 241 Ca -0.44 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.44 2jgl h ALA 241 Cb 1.26 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2jgl h ALA 241 CO 0.45 0.39 -0.05 0.78 0.00 0.00 0.00 179.25 180.82 2jgl h GLY 242 N 1.06 0.00 1.73 0.00 0.00 -1.92 -0.69 103.07 103.25 2jgl h GLY 242 Ca 0.31 0.06 -0.07 0.00 0.00 0.00 0.00 47.33 47.63 2jgl h GLY 242 CO -0.09 -0.06 -0.19 -2.09 0.00 0.00 0.00 176.54 174.11 2jgl h GLU 243 N -0.06 0.32 -0.29 4.80 4.57 -1.88 -1.19 114.58 120.85 2jgl h GLU 243 Ca 0.04 -0.10 -0.13 0.00 -1.18 0.00 0.00 59.36 57.99 2jgl h GLU 243 Cb 0.12 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 2jgl h GLU 243 CO -0.09 0.51 -0.36 0.00 -1.18 0.00 0.00 179.01 177.89 2jgl h ALA 244 N 1.51 0.82 -0.20 2.92 0.00 -0.78 -1.31 119.26 122.22 2jgl h ALA 244 Ca 0.05 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 2jgl h ALA 244 Cb 0.52 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2jgl h ALA 244 CO 0.03 0.64 0.06 -0.09 0.00 0.00 0.00 179.25 179.90 2jgl h ARG 245 N 0.55 0.30 -0.15 0.00 2.43 -0.67 -1.00 114.38 115.84 2jgl h ARG 245 Ca 0.05 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.20 2jgl h ARG 245 Cb 0.88 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.34 2jgl h ARG 245 CO 0.08 0.40 -0.11 -0.09 -1.51 0.00 0.00 179.97 178.73 2jgl h ARG 246 N 0.15 -0.11 -0.27 0.20 2.43 -1.06 -0.36 114.38 115.35 2jgl h ARG 246 Ca 0.06 0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.13 2jgl h ARG 246 Cb 0.22 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 2jgl h ARG 246 CO -0.00 -0.07 -0.28 0.00 -1.51 0.00 0.00 179.97 178.11 2jgl h ARG 247 N -0.12 0.55 -0.42 0.20 3.08 -1.21 -1.79 114.38 114.68 2jgl h ARG 247 Ca 0.09 -0.22 -0.15 0.00 0.07 0.00 0.00 59.98 59.77 2jgl h ARG 247 Cb 0.25 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2jgl h ARG 247 CO -0.22 0.77 -0.31 0.00 -1.07 0.00 0.00 179.97 179.14 2jgl h ALA 248 N 1.22 0.65 -0.06 0.04 0.00 -0.81 -1.50 119.26 118.79 2jgl h ALA 248 Ca 0.06 -0.43 -0.20 0.00 0.00 0.00 0.00 54.91 54.34 2jgl h ALA 248 Cb 0.73 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2jgl h ALA 248 CO 0.06 0.68 -0.80 0.00 0.00 0.00 0.00 179.25 179.18 2jgl h THR 249 N 0.79 1.37 -0.65 0.00 1.03 -1.00 -2.06 112.91 112.39 2jgl h THR 249 Ca 0.08 -2.21 -0.03 0.00 -0.01 0.00 0.00 66.41 64.24 2jgl h THR 249 Cb 0.90 2.19 -0.03 0.00 -1.07 0.00 0.00 68.15 70.13 2jgl h THR 249 CO 0.08 0.67 0.29 0.25 -0.01 0.00 0.00 175.52 176.80 2jgl h LEU 250 N 0.30 0.87 -0.46 0.00 5.85 -1.30 0.12 115.31 120.70 2jgl h LEU 250 Ca -0.05 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.50 2jgl h LEU 250 Cb 1.41 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 2jgl h LEU 250 CO 0.14 0.78 0.19 0.25 -0.34 0.00 0.00 178.44 179.46 2jgl h LEU 251 N 0.91 0.63 -0.17 2.25 5.85 -1.23 -1.07 115.31 122.48 2jgl h LEU 251 Ca 0.22 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.82 2jgl h LEU 251 Cb 0.16 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 40.95 2jgl h LEU 251 CO -0.02 0.62 -0.46 0.00 -0.34 0.00 0.00 178.44 178.24 2jgl h ALA 252 N 1.03 -0.65 -0.63 1.25 0.00 -1.11 -2.23 119.26 116.92 2jgl h ALA 252 Ca 0.15 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.15 2jgl h ALA 252 Cb 0.19 0.86 -0.11 0.00 0.00 0.00 0.00 17.79 18.73 2jgl h ALA 252 CO -0.01 -0.96 -0.43 0.00 0.00 0.00 0.00 179.25 177.85 2jgl h ARG 253 N -0.49 -0.19 -0.20 0.00 3.08 -0.53 -1.31 114.38 114.75 2jgl h ARG 253 Ca 0.07 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.19 2jgl h ARG 253 Cb 0.64 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 2jgl h ARG 253 CO -0.44 -0.12 0.29 -0.07 -1.07 0.00 0.00 179.97 178.56 2jgl h LEU 254 N -0.19 0.00 -2.23 3.04 3.38 -0.62 0.13 115.31 118.82 2jgl h LEU 254 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2jgl h LEU 254 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2jgl h LEU 254 CO -0.72 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.14 2jgl n VAL 255 N -3.52 0.52 -0.74 1.22 0.24 -0.62 -5.00 118.33 110.42 2jgl n VAL 255 Ca 0.02 -0.76 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 2jgl n VAL 255 Cb 0.41 0.88 0.00 0.00 -1.47 0.00 0.00 33.84 33.65 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 0.79 0.55 2.79 7.63 0.00 0.47 -5.07 105.19 112.35 2jgl n GLY 256 Ca 0.12 -0.26 -0.17 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.84 0.00 0.01 0.00 2.85 -1.26 -4.82 115.26 110.21 2jgl n ASN 265 Ca 0.06 0.94 -0.12 0.00 -0.11 0.00 0.00 54.58 55.35 2jgl n ASN 265 Cb 0.53 -1.41 -0.07 0.00 1.24 0.00 0.00 39.78 40.06 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 3.79 0.04 -0.87 1.20 3.32 -2.01 -3.10 116.42 118.79 2jgl h ASP 266 Ca 0.00 -0.13 0.18 0.00 0.02 0.00 0.00 57.03 57.10 2jgl h ASP 266 Cb 0.00 -0.01 -0.16 0.00 0.22 0.00 0.00 39.33 39.38 2jgl h ASP 266 CO 0.00 0.16 -0.17 0.74 -1.72 0.00 0.00 179.24 178.24 2jgl h THR 267 N -0.08 0.14 -0.26 0.35 2.02 -2.01 -1.15 112.91 111.92 2jgl h THR 267 Ca 0.01 -0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.02 2jgl h THR 267 Cb 0.13 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 66.66 2jgl h THR 267 CO -0.00 0.00 -0.52 -0.08 0.37 0.00 0.00 175.52 175.29 2jgl h GLU 268 N 0.01 0.76 -0.02 6.66 4.81 -1.98 -1.09 114.58 123.73 2jgl h GLU 268 Ca 0.43 -0.46 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2jgl h GLU 268 Cb 0.70 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.13 2jgl h GLU 268 CO -0.87 1.09 0.01 1.25 -0.73 0.00 0.00 179.01 179.75 2jgl h LEU 269 N 0.59 0.03 -0.44 1.64 6.46 -1.33 -1.99 115.31 120.27 2jgl h LEU 269 Ca 0.02 -0.09 -0.04 0.00 -0.12 0.00 0.00 57.88 57.65 2jgl h LEU 269 Cb 1.10 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 41.00 2jgl h LEU 269 CO 0.11 0.11 0.13 0.40 -0.62 0.00 0.00 178.44 178.57 2jgl h ILE 270 N -0.06 1.22 -0.57 4.05 2.04 -1.18 -1.01 117.51 122.01 2jgl h ILE 270 Ca 0.01 -0.75 0.05 0.00 1.00 0.00 0.00 64.86 65.16 2jgl h ILE 270 Cb 0.09 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 2jgl h ILE 270 CO -0.00 0.27 0.38 0.00 0.00 0.00 0.00 178.15 178.80 2jgl h ALA 271 N 0.98 1.78 0.09 1.87 0.00 -1.17 0.10 119.26 122.91 2jgl h ALA 271 Ca 0.14 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2jgl h ALA 271 Cb 0.28 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2jgl h ALA 271 CO -0.00 0.14 -0.04 0.00 0.00 0.00 0.00 179.25 179.35 2jgl h LEU 273 N -0.57 0.25 -0.30 0.00 3.38 -0.30 0.13 115.31 117.91 2jgl h LEU 273 Ca -0.01 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2jgl h LEU 273 Cb 0.47 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2jgl h LEU 273 CO 0.02 0.08 0.00 0.54 0.09 0.00 0.00 178.44 179.17 2jgl n ARG 274 N -4.43 0.17 0.06 1.13 1.74 0.27 -2.50 116.66 113.10 2jgl n ARG 274 Ca 0.21 0.29 0.12 0.00 -0.77 0.00 0.00 57.85 57.70 2jgl n ARG 274 Cb 0.89 -1.77 0.17 0.00 -1.02 0.00 0.00 32.46 30.73 2jgl n ARG 274 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2jgl n THR 275 N -2.08 0.36 -2.58 0.55 -2.24 0.45 -4.91 114.28 103.83 2jgl n THR 275 Ca 0.04 -0.28 -0.38 0.00 -2.27 0.00 0.00 64.05 61.16 2jgl n THR 275 Cb 0.30 -0.13 -0.05 0.00 -2.10 0.00 0.00 70.33 68.35 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 -3.17 4.41 0.45 -0.78 1.81 -1.04 -5.01 118.95 115.62 2jgl s ARG 276 Ca 0.06 1.56 -0.24 0.00 -1.72 0.00 0.00 55.73 55.39 2jgl s ARG 276 Cb 0.13 -2.80 -0.07 0.00 -0.45 0.00 0.00 34.95 31.75 2jgl s ARG 276 CO 0.72 0.07 1.20 -2.14 -0.68 0.00 0.00 175.30 174.46 2jgl s PRO 277 N -2.06 3.78 0.27 3.54 0.02 -1.26 -4.91 135.00 134.38 2jgl s PRO 277 Ca 0.52 1.87 -0.03 0.00 0.02 0.00 0.00 61.00 63.37 2jgl s PRO 277 Cb -0.24 -2.48 0.55 0.00 0.02 0.00 0.00 34.50 32.35 2jgl s PRO 277 CO 0.31 -0.56 1.63 0.00 -0.33 0.00 0.00 177.00 178.05 2jgl h ALA 278 N 2.17 0.96 -0.41 -1.55 0.00 -1.96 -0.99 119.26 117.49 2jgl h ALA 278 Ca -0.49 0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2jgl h ALA 278 Cb 1.25 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 19.44 2jgl h ALA 278 CO 0.61 -0.45 0.15 0.37 0.00 0.00 0.00 179.25 179.93 2jgl h GLN 279 N 0.12 0.59 -0.78 0.00 5.75 -1.99 -1.13 115.11 117.66 2jgl h GLN 279 Ca 0.48 -0.08 -0.02 0.00 -0.15 0.00 0.00 58.65 58.88 2jgl h GLN 279 Cb 0.89 -0.11 -0.04 0.00 1.07 0.00 0.00 27.48 29.30 2jgl h GLN 279 CO -0.70 0.50 0.42 -0.44 -2.65 0.00 0.00 178.83 175.95 2jgl h ASP 280 N 0.58 0.98 -0.42 -0.69 5.19 -1.55 0.96 116.42 121.47 2jgl h ASP 280 Ca 0.14 -0.11 -0.03 0.00 -0.62 0.00 0.00 57.03 56.42 2jgl h ASP 280 Cb 0.14 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.38 2jgl h ASP 280 CO -0.01 0.81 0.16 -0.07 -3.12 0.00 0.00 179.24 177.00 2jgl h LEU 281 N 1.08 0.59 -0.38 1.55 3.38 -1.17 -2.71 115.31 117.67 2jgl h LEU 281 Ca 0.27 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.08 2jgl h LEU 281 Cb 0.05 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2jgl h LEU 281 CO -0.04 0.61 0.21 0.58 0.09 0.00 0.00 178.44 179.89 2jgl h VAL 282 N 0.54 1.02 0.00 1.22 2.07 -0.97 -1.96 116.25 118.17 2jgl h VAL 282 Ca 0.14 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2jgl h VAL 282 Cb 0.21 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2jgl h VAL 282 CO -0.01 0.08 0.17 0.44 0.02 0.00 0.00 177.57 178.27 2jgl h ASP 283 N 0.43 0.00 -0.00 0.57 3.32 -0.50 -2.43 116.42 117.81 2jgl h ASP 283 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2jgl h ASP 283 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 2jgl h ASP 283 CO -0.08 0.00 -0.03 1.41 -1.72 0.00 0.00 179.24 178.82 2jgl n HIS 284 N -2.91 0.00 -0.29 4.55 8.25 -0.95 -4.76 115.22 119.11 2jgl n HIS 284 Ca -0.02 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.53 2jgl n HIS 284 Cb 0.23 0.00 0.22 0.00 1.12 0.00 0.00 29.99 31.56 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 0.39 0.11 0.00 -0.41 4.81 -0.85 -1.33 114.58 117.30 2jgl h GLU 285 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2jgl h GLU 285 Cb 0.10 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2jgl h GLU 285 CO 0.00 0.07 -0.10 0.91 -0.73 0.00 0.00 179.01 179.17 2jgl n TRP 286 N -5.35 0.02 1.95 0.92 7.02 -1.26 -3.74 117.44 117.00 2jgl n TRP 286 Ca 0.18 0.01 0.16 0.00 -1.02 0.00 0.00 57.50 56.82 2jgl n TRP 286 Cb 0.59 -0.47 0.93 0.00 -2.42 0.00 0.00 31.31 29.94 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 -1.52 0.00 0.66 -5.99 8.25 -0.50 -3.95 115.22 112.17 2jgl n HIS 287 Ca 0.07 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.62 2jgl n HIS 287 Cb 0.34 -0.02 0.09 0.00 1.12 0.00 0.00 29.99 31.52 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 -1.02 0.08 -2.48 1.59 0.24 -1.25 -5.00 118.33 110.50 2jgl n VAL 288 Ca 0.23 -0.54 -0.41 0.00 -2.04 0.00 0.00 64.34 61.58 2jgl n VAL 288 Cb 0.12 1.30 -0.04 0.00 -1.47 0.00 0.00 33.84 33.75 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 -1.45 4.51 0.42 1.34 1.43 -1.25 -4.83 118.68 118.85 2jgl s LEU 289 Ca 0.22 2.18 0.10 0.00 -1.03 0.00 0.00 54.13 55.60 2jgl s LEU 289 Cb 0.15 -3.61 0.92 0.00 0.03 0.00 0.00 46.19 43.67 2jgl s LEU 289 CO 0.23 -0.21 2.03 1.55 0.23 0.00 0.00 176.35 180.18 2jgl h PRO 290 N 4.59 0.34 -4.78 1.29 0.13 -1.97 -3.44 132.00 128.16 2jgl h PRO 290 Ca -0.45 -0.04 -0.27 0.00 -0.87 0.00 0.00 66.00 64.37 2jgl h PRO 290 Cb 1.21 -0.07 -0.15 0.00 0.13 0.00 0.00 31.00 32.13 2jgl h PRO 290 CO 0.70 0.30 -0.68 -0.65 -0.23 0.00 0.00 178.00 177.44 2jgl s GLN 291 N -5.16 1.03 0.12 0.86 1.11 -1.26 -5.11 119.66 111.25 2jgl s GLN 291 Ca -0.07 -1.47 -0.33 0.00 0.01 0.00 0.00 55.36 53.51 2jgl s GLN 291 Cb 0.17 -0.28 -0.12 0.00 -1.01 0.00 0.00 33.01 31.77 2jgl s GLN 291 CO 0.72 -0.08 1.74 -1.91 0.01 0.00 0.00 175.29 175.77 2jgl n GLU 292 N -0.18 2.51 -3.44 2.91 2.13 -1.26 -4.96 120.64 118.35 2jgl n GLU 292 Ca -0.08 0.91 -0.12 0.00 0.66 0.00 0.00 57.16 58.53 2jgl n GLU 292 Cb 0.62 -2.75 -0.02 0.00 0.27 0.00 0.00 31.44 29.56 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 2.03 -0.54 0.24 4.31 1.04 -1.26 -4.59 113.70 114.93 2jgl s SER 293 Ca 0.81 -0.02 0.11 0.00 0.48 0.00 0.00 55.95 57.33 2jgl s SER 293 Cb -0.58 0.59 -0.05 0.00 0.10 0.00 0.00 66.02 66.08 2jgl s SER 293 CO 0.38 -0.95 -0.19 0.27 0.98 0.00 0.00 173.24 173.73 2jgl s ILE 294 N -3.72 2.23 -1.46 -1.02 -4.36 -1.09 -4.76 121.20 107.02 2jgl s ILE 294 Ca 0.01 -2.26 -0.10 0.00 -0.26 0.00 0.00 60.65 58.04 2jgl s ILE 294 Cb -0.01 -2.17 0.04 0.00 1.25 0.00 0.00 42.46 41.57 2jgl s ILE 294 CO -0.13 -0.39 0.91 0.33 0.24 0.00 0.00 174.94 175.90 2jgl n PHE 295 N -0.34 -2.36 -4.26 1.37 -0.00 -1.26 -4.82 117.46 105.79 2jgl n PHE 295 Ca -0.08 0.80 -0.17 0.00 -0.00 0.00 0.00 57.45 58.01 2jgl n PHE 295 Cb 0.59 -4.31 -0.14 0.00 -0.00 0.00 0.00 39.48 35.63 2jgl n PHE 295 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2jgl s ARG 296 N -6.25 0.63 -0.00 -4.13 1.81 -1.26 -4.72 118.95 105.02 2jgl s ARG 296 Ca 0.53 -0.39 0.02 0.00 -1.72 0.00 0.00 55.73 54.18 2jgl s ARG 296 Cb -0.25 -0.58 -0.01 0.00 -0.45 0.00 0.00 34.95 33.66 2jgl s ARG 296 CO 0.66 0.15 -0.08 -0.06 -0.68 0.00 0.00 175.30 175.29 2jgl s PHE 297 N -0.41 0.72 0.09 -0.53 0.08 -1.26 -5.06 117.98 111.60 2jgl s PHE 297 Ca 0.01 -0.17 -0.17 0.00 0.12 0.00 0.00 56.93 56.72 2jgl s PHE 297 Cb -0.04 -0.46 -0.08 0.00 -0.57 0.00 0.00 43.02 41.87 2jgl s PHE 297 CO -0.00 -0.01 1.48 0.77 -0.10 0.00 0.00 175.22 177.36 2jgl h SER 298 N 5.80 0.53 -3.58 1.36 0.02 -1.89 -3.40 113.55 112.39 2jgl h SER 298 Ca -0.31 -0.37 -0.63 0.00 -0.84 0.00 0.00 61.79 59.65 2jgl h SER 298 Cb 1.18 -0.15 -0.39 0.00 0.14 0.00 0.00 62.40 63.19 2jgl h SER 298 CO 0.49 0.78 -0.76 -0.36 -1.14 0.00 0.00 176.83 175.84 2jgl s PHE 299 N -4.75 2.87 0.38 3.45 0.08 -1.26 -5.02 117.98 113.72 2jgl s PHE 299 Ca -0.13 -2.29 0.03 0.00 0.12 0.00 0.00 56.93 54.66 2jgl s PHE 299 Cb 0.08 -2.16 -0.04 0.00 -0.57 0.00 0.00 43.02 40.33 2jgl s PHE 299 CO 0.77 -0.87 0.10 0.14 -0.10 0.00 0.00 175.22 175.25 2jgl s VAL 300 N 1.22 0.83 0.28 -0.44 -7.23 -1.26 -4.48 120.40 109.32 2jgl s VAL 300 Ca 0.04 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.92 2jgl s VAL 300 Cb -0.19 -2.51 -0.14 0.00 0.56 0.00 0.00 36.38 34.10 2jgl s VAL 300 CO -0.11 0.00 0.98 -2.65 -0.31 0.00 0.00 175.10 173.01 2jgl n PRO 301 N -0.83 1.24 -4.47 4.82 -0.02 -1.24 -4.70 135.00 129.79 2jgl n PRO 301 Ca -0.05 0.44 -0.34 0.00 -2.02 0.00 0.00 63.50 61.52 2jgl n PRO 301 Cb 0.66 -1.78 -0.10 0.00 -0.02 0.00 0.00 33.50 32.25 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 -1.02 4.05 -0.87 -1.45 0.11 -1.26 -1.20 120.40 118.76 2jgl s VAL 302 Ca 0.59 -0.37 -0.25 0.00 -2.93 0.00 0.00 61.98 59.03 2jgl s VAL 302 Cb -0.72 -2.69 -0.01 0.00 -1.53 0.00 0.00 36.38 31.43 2jgl s VAL 302 CO 0.59 0.59 1.72 -0.69 -3.33 0.00 0.00 175.10 173.98 2jgl s VAL 303 N -0.87 3.60 -0.57 2.04 1.01 -0.63 -4.58 120.40 120.39 2jgl s VAL 303 Ca 0.13 -0.31 0.22 0.00 0.00 0.00 0.00 61.98 62.03 2jgl s VAL 303 Cb -0.11 -4.40 -0.16 0.00 0.00 0.00 0.00 36.38 31.71 2jgl s VAL 303 CO 0.02 -1.32 0.92 -0.90 0.00 0.00 0.00 175.10 173.82 2jgl n ASP 304 N 11.83 0.58 -0.40 3.32 5.75 -1.21 -3.85 116.55 132.56 2jgl n ASP 304 Ca 0.31 -0.29 -0.04 0.00 -0.01 0.00 0.00 54.79 54.75 2jgl n ASP 304 Cb 0.49 1.01 -0.01 0.00 -1.03 0.00 0.00 41.12 41.58 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 1.37 0.56 0.00 6.12 0.00 0.32 -4.93 105.19 108.63 2jgl n GLY 305 Ca 0.01 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 1.23 0.00 -0.02 1.61 2.03 -1.26 -4.68 116.55 115.46 2jgl n ASP 306 Ca -0.05 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.17 2jgl n ASP 306 Cb 0.27 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.65 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 -0.44 -3.56 -0.67 3.04 -1.92 -3.34 116.94 110.06 2jgl h PHE 307 Ca 0.00 0.03 -0.71 0.00 3.98 0.00 0.00 57.97 61.27 2jgl h PHE 307 Cb 0.00 0.22 -0.27 0.00 2.56 0.00 0.00 35.95 38.46 2jgl h PHE 307 CO 0.00 -0.24 -0.52 -0.51 -2.02 0.00 0.00 178.31 175.02 2jgl s LEU 308 N -10.44 4.79 0.51 0.59 1.43 -1.26 -4.62 118.68 109.68 2jgl s LEU 308 Ca -0.14 -1.23 0.30 0.00 -1.03 0.00 0.00 54.13 52.03 2jgl s LEU 308 Cb 0.11 -1.97 1.11 0.00 0.03 0.00 0.00 46.19 45.47 2jgl s LEU 308 CO 0.68 -0.43 1.89 0.77 0.23 0.00 0.00 176.35 179.49 2jgl h SER 309 N 8.37 0.00 -2.77 2.29 4.64 -1.84 0.95 113.55 125.20 2jgl h SER 309 Ca -0.24 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.02 2jgl h SER 309 Cb 1.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2jgl h SER 309 CO 0.69 0.05 0.16 -0.67 -0.87 0.00 0.00 176.83 176.19 2jgl n ASP 310 N -3.15 -1.73 -4.76 4.97 -0.08 -1.26 -4.49 116.55 106.04 2jgl n ASP 310 Ca 0.01 -2.34 -0.38 0.00 -1.51 0.00 0.00 54.79 50.57 2jgl n ASP 310 Cb 0.37 2.93 0.01 0.00 2.34 0.00 0.00 41.12 46.77 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 -2.36 2.46 0.29 5.18 -4.23 -1.26 -4.79 115.64 110.93 2jgl s THR 311 Ca 0.15 0.37 0.03 0.00 -1.18 0.00 0.00 61.69 61.06 2jgl s THR 311 Cb -0.03 -3.20 0.28 0.00 1.34 0.00 0.00 72.50 70.88 2jgl s THR 311 CO 0.11 0.02 1.73 -0.65 -0.54 0.00 0.00 174.62 175.28 2jgl h PRO 312 N 2.01 0.50 -0.58 3.99 0.11 -1.98 0.06 132.00 136.12 2jgl h PRO 312 Ca -0.50 -0.03 0.12 0.00 0.11 0.00 0.00 66.00 65.70 2jgl h PRO 312 Cb 1.27 -0.11 -0.10 0.00 0.11 0.00 0.00 31.00 32.17 2jgl h PRO 312 CO 0.60 0.33 -0.00 1.49 -0.21 0.00 0.00 178.00 180.21 2jgl h GLU 313 N 0.52 0.11 -0.46 1.05 4.81 -1.90 -0.42 114.58 118.28 2jgl h GLU 313 Ca 0.54 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.63 2jgl h GLU 313 Cb 0.95 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 2jgl h GLU 313 CO -0.46 0.08 -0.26 0.00 -0.73 0.00 0.00 179.01 177.63 2jgl h ALA 314 N 1.53 0.66 -0.06 2.92 0.00 -1.41 -2.40 119.26 120.49 2jgl h ALA 314 Ca 0.30 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 2jgl h ALA 314 Cb 0.47 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2jgl h ALA 314 CO -0.49 0.68 -0.68 -0.07 0.00 0.00 0.00 179.25 178.68 2jgl h LEU 315 N 0.84 0.30 -0.10 0.00 3.38 -0.58 -2.67 115.31 116.47 2jgl h LEU 315 Ca 0.10 -0.19 -0.20 0.00 0.09 0.00 0.00 57.88 57.68 2jgl h LEU 315 Cb 0.85 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 2jgl h LEU 315 CO 0.08 0.89 -0.94 0.16 0.09 0.00 0.00 178.44 178.72 2jgl h ILE 316 N 0.18 1.66 -0.63 1.22 3.07 -1.11 -2.19 117.51 119.71 2jgl h ILE 316 Ca -0.02 -3.22 -0.07 0.00 1.55 0.00 0.00 64.86 63.10 2jgl h ILE 316 Cb 1.22 2.74 -0.02 0.00 -0.27 0.00 0.00 36.82 40.49 2jgl h ILE 316 CO 0.11 0.92 0.11 0.78 -1.05 0.00 0.00 178.15 179.01 2jgl h ASN 317 N 0.00 0.99 -0.01 2.16 2.35 -1.32 -3.35 115.58 116.41 2jgl h ASN 317 Ca -0.01 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 2jgl h ASN 317 Cb 1.67 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.78 2jgl h ASN 317 CO 0.12 1.00 -0.26 0.35 -1.65 0.00 0.00 177.43 176.98 2jgl n THR 318 N -4.28 0.00 -1.91 2.81 -2.24 -1.02 -5.04 114.28 102.61 2jgl n THR 318 Ca 0.04 -0.37 -0.32 0.00 -2.27 0.00 0.00 64.05 61.13 2jgl n THR 318 Cb 0.28 1.12 0.02 0.00 -2.10 0.00 0.00 70.33 69.64 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 -1.52 1.91 -0.37 3.38 0.00 -0.82 -5.03 107.32 104.86 2jgl s GLY 319 Ca 0.09 0.21 -0.15 0.00 0.00 0.00 0.00 44.72 44.86 2jgl s GLY 319 CO 0.30 0.51 0.36 -0.35 0.00 0.00 0.00 173.10 173.92 2jgl s ASP 320 N -3.32 6.16 -0.47 1.64 2.15 -1.26 -4.89 116.67 116.68 2jgl s ASP 320 Ca 0.60 -0.49 0.03 0.00 0.43 0.00 0.00 52.55 53.13 2jgl s ASP 320 Cb -0.14 -2.19 0.44 0.00 -0.30 0.00 0.00 42.92 40.73 2jgl s ASP 320 CO 0.44 -0.41 1.50 0.49 -0.17 0.00 0.00 175.17 177.02 2jgl n PHE 321 N 5.37 3.02 -0.03 -5.34 3.72 -0.27 -4.87 117.46 119.06 2jgl n PHE 321 Ca -0.09 -2.60 -0.01 0.00 -0.05 0.00 0.00 57.45 54.69 2jgl n PHE 321 Cb 0.48 -0.70 -0.01 0.00 -0.94 0.00 0.00 39.48 38.32 2jgl n PHE 321 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2jgl h GLN 322 N 2.27 -0.02 -1.05 -1.08 5.75 -1.78 -1.67 115.11 117.53 2jgl h GLN 322 Ca 0.45 0.00 -0.63 0.00 -0.15 0.00 0.00 58.65 58.31 2jgl h GLN 322 Cb 1.09 0.00 -0.35 0.00 1.07 0.00 0.00 27.48 29.29 2jgl h GLN 322 CO 1.08 -0.01 0.13 -0.25 -2.65 0.00 0.00 178.83 177.13 2jgl n ASP 323 N -3.10 6.41 -4.58 -0.69 8.00 -1.26 -4.38 116.55 116.95 2jgl n ASP 323 Ca -0.00 -3.77 -0.34 0.00 0.71 0.00 0.00 54.79 51.38 2jgl n ASP 323 Cb 0.03 -0.71 -0.11 0.00 -0.02 0.00 0.00 41.12 40.31 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 -3.75 3.62 -0.14 0.64 2.96 -1.18 -5.03 118.68 115.80 2jgl s LEU 324 Ca 0.57 -0.00 -0.02 0.00 -0.22 0.00 0.00 54.13 54.46 2jgl s LEU 324 Cb 0.46 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 45.22 2jgl s LEU 324 CO -0.05 0.16 -0.08 -1.10 -1.32 0.00 0.00 176.35 173.96 2jgl s GLN 325 N 0.46 3.51 -0.01 1.98 1.11 -1.26 -0.17 119.66 125.28 2jgl s GLN 325 Ca 0.01 -0.59 0.00 0.00 0.01 0.00 0.00 55.36 54.80 2jgl s GLN 325 Cb -0.13 -2.79 0.01 0.00 -1.01 0.00 0.00 33.01 29.09 2jgl s GLN 325 CO 0.01 0.26 -0.00 0.54 0.01 0.00 0.00 175.29 176.11 2jgl s VAL 326 N 0.28 0.09 -0.16 1.09 0.11 0.45 -2.20 120.40 120.07 2jgl s VAL 326 Ca -0.06 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.02 2jgl s VAL 326 Cb -0.15 -0.13 -0.00 0.00 -1.53 0.00 0.00 36.38 34.57 2jgl s VAL 326 CO 0.04 0.06 -0.16 -0.22 -3.33 0.00 0.00 175.10 171.50 2jgl s LEU 327 N 0.38 2.45 0.04 2.54 2.96 0.09 -1.11 118.68 126.02 2jgl s LEU 327 Ca -0.03 -0.48 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 2jgl s LEU 327 Cb -0.05 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 45.06 2jgl s LEU 327 CO -0.01 0.08 -0.10 0.68 -1.32 0.00 0.00 176.35 175.68 2jgl s VAL 328 N 0.85 0.79 0.18 1.68 -7.23 0.14 -0.03 120.40 116.78 2jgl s VAL 328 Ca -0.05 -0.92 -0.22 0.00 -1.81 0.00 0.00 61.98 58.98 2jgl s VAL 328 Cb -0.15 -0.76 0.08 0.00 0.56 0.00 0.00 36.38 36.11 2jgl s VAL 328 CO -0.01 -0.13 1.05 -0.83 -0.31 0.00 0.00 175.10 174.87 2jgl s GLY 329 N -1.17 0.14 0.07 2.32 0.00 -1.03 -1.51 107.32 106.14 2jgl s GLY 329 Ca -0.03 -0.38 -0.02 0.00 0.00 0.00 0.00 44.72 44.29 2jgl s GLY 329 CO 0.01 2.92 0.01 -1.34 0.00 0.00 0.00 173.10 174.70 2jgl s VAL 330 N -2.06 0.18 0.56 1.40 -7.23 -0.93 -0.89 120.40 111.43 2jgl s VAL 330 Ca 0.23 -1.78 -0.00 0.00 -1.81 0.00 0.00 61.98 58.62 2jgl s VAL 330 Cb -0.03 -1.64 0.03 0.00 0.56 0.00 0.00 36.38 35.31 2jgl s VAL 330 CO 0.05 -0.84 0.79 0.68 -0.31 0.00 0.00 175.10 175.48 2jgl s VAL 331 N -3.95 2.86 0.22 1.32 -7.23 -1.26 0.02 120.40 112.38 2jgl s VAL 331 Ca 0.11 -0.57 -0.06 0.00 -1.81 0.00 0.00 61.98 59.66 2jgl s VAL 331 Cb 0.08 -3.09 0.09 0.00 0.56 0.00 0.00 36.38 34.01 2jgl s VAL 331 CO -0.07 -0.07 1.69 0.50 -0.31 0.00 0.00 175.10 176.84 2jgl h LYS 332 N 0.03 0.95 -2.20 4.82 3.64 -1.19 -3.35 116.57 119.27 2jgl h LYS 332 Ca -0.43 -0.28 -0.59 0.00 -1.27 0.00 0.00 60.65 58.07 2jgl h LYS 332 Cb 1.29 -0.10 -0.41 0.00 -0.41 0.00 0.00 32.23 32.60 2jgl h LYS 332 CO 0.54 0.94 -0.70 -0.25 -2.27 0.00 0.00 179.45 177.71 2jgl n ASP 333 N -4.19 2.92 -0.34 4.20 9.92 -0.76 -4.95 116.55 123.36 2jgl n ASP 333 Ca 0.03 -3.26 0.01 0.00 -0.53 0.00 0.00 54.79 51.04 2jgl n ASP 333 Cb 0.33 -0.67 0.18 0.00 -0.64 0.00 0.00 41.12 40.32 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 4.22 1.15 0.00 -1.24 4.39 -1.78 -3.27 114.58 118.06 2jgl h GLU 334 Ca 0.17 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.74 2jgl h GLU 334 Cb 0.71 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 2jgl h GLU 334 CO 0.75 0.76 -0.79 0.78 -1.16 0.00 0.00 179.01 179.35 2jgl h GLY 335 N 1.19 0.00 0.32 -3.84 0.00 -1.86 -3.38 103.07 95.50 2jgl h GLY 335 Ca 0.38 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.80 2jgl h GLY 335 CO -0.12 0.00 0.13 1.48 0.00 0.00 0.00 176.54 178.03 2jgl h SER 336 N 0.00 0.04 -0.71 0.19 4.64 -1.77 -2.17 113.55 113.77 2jgl h SER 336 Ca -0.04 0.09 0.16 0.00 -0.47 0.00 0.00 61.79 61.53 2jgl h SER 336 Cb 1.21 0.12 -0.11 0.00 -0.31 0.00 0.00 62.40 63.30 2jgl h SER 336 CO 0.02 0.04 0.09 0.22 -0.87 0.00 0.00 176.83 176.34 2jgl h TYR 337 N 0.27 0.11 0.00 4.77 3.20 -1.83 -2.67 116.97 120.83 2jgl h TYR 337 Ca 0.28 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.18 2jgl h TYR 337 Cb 0.37 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.70 2jgl h TYR 337 CO -0.22 -0.15 -0.04 0.74 -1.64 0.00 0.00 178.16 176.85 2jgl h PHE 338 N 0.18 0.00 -0.05 -3.82 -1.00 -1.68 -3.15 116.94 107.43 2jgl h PHE 338 Ca 0.40 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 61.11 2jgl h PHE 338 Cb 0.68 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.23 2jgl h PHE 338 CO -0.33 0.04 -0.29 -0.07 -1.61 0.00 0.00 178.31 176.05 2jgl h LEU 339 N 0.00 0.08 -0.10 1.54 3.38 -1.50 -2.46 115.31 116.24 2jgl h LEU 339 Ca -0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2jgl h LEU 339 Cb 0.65 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2jgl h LEU 339 CO 0.00 0.37 -0.05 1.33 0.09 0.00 0.00 178.44 180.18 2jgl n VAL 340 N -4.17 0.00 -1.16 1.22 0.24 -1.19 -2.11 118.33 111.16 2jgl n VAL 340 Ca -0.02 -0.03 -0.20 0.00 -2.04 0.00 0.00 64.34 62.06 2jgl n VAL 340 Cb 0.35 -0.32 0.20 0.00 -1.47 0.00 0.00 33.84 32.61 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 -1.12 2.92 0.00 6.34 4.02 -0.93 -4.76 117.16 123.63 2jgl n TYR 341 Ca 0.15 -1.70 0.00 0.00 -0.01 0.00 0.00 57.90 56.34 2jgl n TYR 341 Cb 0.25 -0.89 0.00 0.00 -0.02 0.00 0.00 39.34 38.68 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 -0.92 -0.57 3.48 2.72 0.00 -1.22 -4.92 105.19 103.76 2jgl n GLY 342 Ca 0.55 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.19 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 4.84 0.39 1.61 1.01 -0.90 -4.95 120.40 122.39 2jgl s VAL 343 Ca 0.00 -0.26 -0.27 0.00 0.00 0.00 0.00 61.98 61.45 2jgl s VAL 343 Cb 0.00 -3.43 -0.10 0.00 0.00 0.00 0.00 36.38 32.86 2jgl s VAL 343 CO 0.00 0.10 1.37 -2.84 0.00 0.00 0.00 175.10 173.73 2jgl s PRO 344 N 1.66 4.04 0.00 2.72 0.02 -1.26 -2.32 135.00 139.85 2jgl s PRO 344 Ca 0.05 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.39 2jgl s PRO 344 Cb -0.17 -2.86 0.00 0.00 0.02 0.00 0.00 34.50 31.49 2jgl s PRO 344 CO 0.08 -0.49 0.00 0.41 -0.33 0.00 0.00 177.00 176.66 2jgl n GLY 345 N 0.63 1.52 3.87 0.52 0.00 -1.26 -4.93 105.19 105.54 2jgl n GLY 345 Ca 0.02 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.67 3.60 0.08 1.61 0.40 -0.98 -4.63 117.98 116.40 2jgl s PHE 346 Ca 0.00 0.57 -0.21 0.00 -0.60 0.00 0.00 56.93 56.68 2jgl s PHE 346 Cb 0.00 -1.98 0.05 0.00 0.51 0.00 0.00 43.02 41.60 2jgl s PHE 346 CO 0.00 0.71 0.51 0.45 0.70 0.00 0.00 175.22 177.59 2jgl s SER 347 N -0.97 -0.42 0.38 1.36 0.15 -1.26 -4.70 113.70 108.23 2jgl s SER 347 Ca 0.16 0.04 0.24 0.00 0.70 0.00 0.00 55.95 57.09 2jgl s SER 347 Cb -0.12 0.51 0.51 0.00 -1.71 0.00 0.00 66.02 65.20 2jgl s SER 347 CO 0.05 -0.80 1.67 0.07 1.20 0.00 0.00 173.24 175.43 2jgl h LYS 348 N 2.54 0.00 0.00 5.44 2.10 -1.99 -3.35 116.57 121.31 2jgl h LYS 348 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 2jgl h LYS 348 Cb 1.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 2jgl h LYS 348 CO 0.42 0.00 -0.61 -0.25 -2.00 0.00 0.00 179.45 177.00 2jgl n ASP 349 N -2.86 0.60 -3.47 7.07 8.00 -1.26 -4.46 116.55 120.17 2jgl n ASP 349 Ca 0.04 -0.39 -0.20 0.00 0.71 0.00 0.00 54.79 54.96 2jgl n ASP 349 Cb 0.49 0.41 -0.08 0.00 -0.02 0.00 0.00 41.12 41.92 2jgl n ASP 349 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2jgl s ASN 350 N -3.04 1.73 0.21 -2.24 2.20 -1.26 -5.04 114.94 107.49 2jgl s ASN 350 Ca 0.10 -1.74 0.18 0.00 -0.94 0.00 0.00 52.86 50.47 2jgl s ASN 350 Cb 0.17 0.55 0.86 0.00 -2.00 0.00 0.00 41.25 40.83 2jgl s ASN 350 CO 0.74 -1.04 1.56 -0.62 -2.94 0.00 0.00 177.10 174.79 2jgl n GLU 351 N -0.64 0.12 -3.89 3.55 -0.58 -1.26 -4.71 120.64 113.23 2jgl n GLU 351 Ca 0.06 0.49 -0.31 0.00 -0.42 0.00 0.00 57.16 56.98 2jgl n GLU 351 Cb 0.63 -1.80 -0.00 0.00 -0.57 0.00 0.00 31.44 29.70 2jgl n GLU 351 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2jgl n SER 352 N -2.04 -4.04 -4.70 1.62 7.64 -1.26 -4.93 113.62 105.91 2jgl n SER 352 Ca 0.01 -0.77 -0.42 0.00 1.01 0.00 0.00 58.87 58.70 2jgl n SER 352 Cb 0.12 -3.27 -0.03 0.00 -1.01 0.00 0.00 64.21 60.02 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 -7.09 4.35 0.33 -3.43 1.43 -1.26 -4.71 118.68 108.30 2jgl s LEU 353 Ca 0.63 2.23 0.10 0.00 -1.03 0.00 0.00 54.13 56.07 2jgl s LEU 353 Cb -0.33 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.25 2jgl s LEU 353 CO 0.78 -0.69 -0.11 0.27 0.23 0.00 0.00 176.35 176.83 2jgl s ILE 354 N 1.79 2.28 0.62 -0.59 -4.36 -1.23 -5.03 121.20 114.68 2jgl s ILE 354 Ca 0.65 -2.24 -0.04 0.00 -0.26 0.00 0.00 60.65 58.76 2jgl s ILE 354 Cb -0.34 -2.59 0.04 0.00 1.25 0.00 0.00 42.46 40.81 2jgl s ILE 354 CO 0.29 -0.23 0.89 -0.94 0.24 0.00 0.00 174.94 175.19 2jgl s SER 355 N -3.59 5.20 0.24 4.36 1.04 -1.26 -4.07 113.70 115.61 2jgl s SER 355 Ca 0.32 0.37 -0.07 0.00 0.48 0.00 0.00 55.95 57.04 2jgl s SER 355 Cb 0.01 -1.21 0.22 0.00 0.10 0.00 0.00 66.02 65.15 2jgl s SER 355 CO 0.16 -1.28 1.90 -0.09 0.98 0.00 0.00 173.24 174.91 2jgl h ARG 356 N -0.24 1.23 0.13 4.02 2.43 -1.88 -0.91 114.38 119.16 2jgl h ARG 356 Ca -0.44 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 58.64 2jgl h ARG 356 Cb 1.29 -0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 2jgl h ARG 356 CO 0.58 0.83 -0.10 0.00 -1.51 0.00 0.00 179.97 179.77 2jgl h ALA 357 N 1.32 -0.22 -0.53 2.80 0.00 -1.98 -0.77 119.26 119.89 2jgl h ALA 357 Ca 0.34 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.24 2jgl h ALA 357 Cb -0.11 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2jgl h ALA 357 CO -0.07 -0.63 0.35 1.96 0.00 0.00 0.00 179.25 180.86 2jgl h GLN 358 N -0.24 0.58 -0.08 0.00 4.20 -1.86 -0.83 115.11 116.88 2jgl h GLN 358 Ca -0.01 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.67 2jgl h GLN 358 Cb 0.21 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 2jgl h GLN 358 CO -0.01 0.38 0.04 0.35 -0.67 0.00 0.00 178.83 178.92 2jgl h PHE 359 N 0.60 0.12 -0.77 2.96 3.04 -0.49 -0.42 116.94 121.99 2jgl h PHE 359 Ca 0.22 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.15 2jgl h PHE 359 Cb 0.12 -0.04 -0.04 0.00 2.56 0.00 0.00 35.95 38.55 2jgl h PHE 359 CO -0.00 0.21 0.45 -0.07 -2.02 0.00 0.00 178.31 176.88 2jgl h LEU 360 N -0.00 0.92 -0.55 0.59 3.38 -0.57 -1.52 115.31 117.57 2jgl h LEU 360 Ca 0.03 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 2jgl h LEU 360 Cb 0.14 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2jgl h LEU 360 CO -0.00 0.72 0.06 0.00 0.09 0.00 0.00 178.44 179.30 2jgl h ALA 361 N 1.44 0.73 -0.58 1.53 0.00 -1.08 -3.15 119.26 118.14 2jgl h ALA 361 Ca 0.27 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2jgl h ALA 361 Cb -0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2jgl h ALA 361 CO -0.05 0.50 0.09 0.78 0.00 0.00 0.00 179.25 180.57 2jgl h GLY 362 N 0.81 1.00 1.36 0.00 0.00 -0.63 -2.61 103.07 103.01 2jgl h GLY 362 Ca 0.16 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 2jgl h GLY 362 CO 0.02 0.59 0.33 -2.08 0.00 0.00 0.00 176.54 175.40 2jgl h VAL 363 N 0.88 1.19 -0.57 4.60 2.07 -1.29 0.26 116.25 123.39 2jgl h VAL 363 Ca 0.18 -0.49 -0.10 0.00 0.82 0.00 0.00 66.70 67.12 2jgl h VAL 363 Cb 0.40 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 2jgl h VAL 363 CO 0.01 0.21 -0.03 0.03 0.02 0.00 0.00 177.57 177.82 2jgl h ARG 364 N 0.85 1.01 -0.14 1.57 2.47 -1.44 0.55 114.38 119.26 2jgl h ARG 364 Ca 0.22 -0.33 -0.22 0.00 -1.26 0.00 0.00 59.98 58.39 2jgl h ARG 364 Cb 0.04 -0.09 0.01 0.00 -1.65 0.00 0.00 29.97 28.27 2jgl h ARG 364 CO -0.03 1.01 -0.79 0.82 0.56 0.00 0.00 179.97 181.54 2jgl h ILE 365 N 0.92 1.29 0.00 2.04 2.04 -1.14 -3.08 117.51 119.58 2jgl h ILE 365 Ca 0.16 -2.00 -0.08 0.00 1.00 0.00 0.00 64.86 63.94 2jgl h ILE 365 Cb 0.57 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 2jgl h ILE 365 CO 0.03 0.63 -0.39 1.23 0.00 0.00 0.00 178.15 179.66 2jgl h GLY 366 N 0.63 0.00 -5.85 5.37 0.00 -0.46 -2.90 103.07 99.87 2jgl h GLY 366 Ca -0.05 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.69 2jgl h GLY 366 CO 0.16 0.00 -0.68 -0.62 0.00 0.00 0.00 176.54 175.40 2jgl n VAL 367 N -3.22 2.25 0.31 4.60 0.31 0.18 -4.86 118.33 117.89 2jgl n VAL 367 Ca 0.02 -5.23 0.19 0.00 -0.01 0.00 0.00 64.34 59.32 2jgl n VAL 367 Cb 0.67 -1.74 0.96 0.00 -0.91 0.00 0.00 33.84 32.81 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 3.68 0.00 -0.05 5.55 0.13 -1.63 -0.91 132.00 138.77 2jgl h PRO 368 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2jgl h PRO 368 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2jgl h PRO 368 CO 0.79 0.02 0.00 1.04 -0.23 0.00 0.00 178.00 179.61 2jgl n GLN 369 N -3.18 1.62 -2.73 0.86 3.00 -1.26 -4.92 117.38 110.78 2jgl n GLN 369 Ca -0.02 -0.91 -0.41 0.00 -0.01 0.00 0.00 57.00 55.65 2jgl n GLN 369 Cb 0.18 -1.46 -0.04 0.00 0.00 0.00 0.00 30.24 28.91 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 -1.96 3.25 1.31 -1.58 0.00 -0.35 -5.05 121.76 117.39 2jgl s ALA 370 Ca 0.37 0.58 -0.21 0.00 0.00 0.00 0.00 51.96 52.70 2jgl s ALA 370 Cb 0.20 -3.28 0.33 0.00 0.00 0.00 0.00 23.12 20.37 2jgl s ALA 370 CO 0.32 -0.02 1.03 -1.54 0.00 0.00 0.00 175.76 175.55 2jgl s SER 371 N -0.06 -0.07 0.11 0.00 1.04 -1.26 -4.76 113.70 108.70 2jgl s SER 371 Ca 0.47 0.68 -0.16 0.00 0.48 0.00 0.00 55.95 57.42 2jgl s SER 371 Cb -0.24 -0.94 -0.03 0.00 0.10 0.00 0.00 66.02 64.91 2jgl s SER 371 CO 0.30 -4.74 1.57 0.44 0.98 0.00 0.00 173.24 171.79 2jgl h ASP 372 N -3.00 0.60 -0.22 7.02 5.19 -1.99 -1.85 116.42 122.17 2jgl h ASP 372 Ca -0.43 -0.29 -0.00 0.00 -0.62 0.00 0.00 57.03 55.69 2jgl h ASP 372 Cb 1.31 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 40.65 2jgl h ASP 372 CO 0.30 0.74 0.12 0.25 -3.12 0.00 0.00 179.24 177.53 2jgl h LEU 373 N 0.44 0.27 -1.00 1.55 5.85 -1.99 -1.90 115.31 118.53 2jgl h LEU 373 Ca 0.11 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2jgl h LEU 373 Cb 0.42 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 2jgl h LEU 373 CO 0.01 0.27 0.62 0.00 -0.34 0.00 0.00 178.44 179.00 2jgl h ALA 374 N 1.02 1.27 -0.30 1.25 0.00 -1.86 -0.64 119.26 119.99 2jgl h ALA 374 Ca 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2jgl h ALA 374 Cb 0.05 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 2jgl h ALA 374 CO -0.01 0.66 0.06 0.00 0.00 0.00 0.00 179.25 179.95 2jgl h ALA 375 N 1.36 0.40 -0.60 0.00 0.00 -1.16 -1.40 119.26 117.86 2jgl h ALA 375 Ca 0.35 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 2jgl h ALA 375 Cb -0.11 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2jgl h ALA 375 CO -0.07 0.08 0.22 1.49 0.00 0.00 0.00 179.25 180.98 2jgl h GLU 376 N 0.32 0.88 -0.24 0.00 4.57 -0.92 0.43 114.58 119.62 2jgl h GLU 376 Ca 0.09 -0.15 0.03 0.00 -1.18 0.00 0.00 59.36 58.15 2jgl h GLU 376 Cb 0.33 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 2jgl h GLU 376 CO 0.00 0.73 0.08 0.00 -1.18 0.00 0.00 179.01 178.65 2jgl h ALA 377 N 1.38 0.27 -0.51 2.92 0.00 -0.80 0.26 119.26 122.78 2jgl h ALA 377 Ca 0.20 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.21 2jgl h ALA 377 Cb 0.19 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 2jgl h ALA 377 CO -0.02 -0.34 0.19 0.28 0.00 0.00 0.00 179.25 179.36 2jgl h VAL 378 N 0.19 0.83 -0.62 0.00 2.07 -0.50 0.66 116.25 118.87 2jgl h VAL 378 Ca 0.11 -0.13 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 2jgl h VAL 378 Cb 0.08 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 2jgl h VAL 378 CO -0.11 0.07 0.15 0.58 0.02 0.00 0.00 177.57 178.27 2jgl h VAL 379 N 0.37 1.25 -0.34 2.57 2.07 -0.44 -1.55 116.25 120.18 2jgl h VAL 379 Ca 0.25 -0.92 -0.04 0.00 0.82 0.00 0.00 66.70 66.81 2jgl h VAL 379 Cb 0.27 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 2jgl h VAL 379 CO -0.25 0.35 0.07 -0.07 0.02 0.00 0.00 177.57 177.69 2jgl h LEU 380 N 0.91 0.52 -1.15 2.57 3.38 -0.04 -1.18 115.31 120.32 2jgl h LEU 380 Ca 0.19 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2jgl h LEU 380 Cb 0.36 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 2jgl h LEU 380 CO 0.00 0.63 0.36 -0.74 0.09 0.00 0.00 178.44 178.78 2jgl h HIS 381 N 0.39 0.93 0.00 1.13 2.76 -0.71 -3.24 115.15 116.40 2jgl h HIS 381 Ca 0.10 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 2jgl h HIS 381 Cb 0.32 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 28.98 2jgl h HIS 381 CO 0.02 0.66 -1.40 0.66 -1.30 0.00 0.00 177.93 176.57 2jgl n TYR 382 N -4.36 0.54 -1.84 5.26 4.02 -0.60 -4.89 117.16 115.29 2jgl n TYR 382 Ca 0.07 0.16 -0.41 0.00 -0.01 0.00 0.00 57.90 57.70 2jgl n TYR 382 Cb 0.11 -0.74 -0.02 0.00 -0.02 0.00 0.00 39.34 38.67 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 -3.41 2.22 -0.48 -0.72 2.01 -0.46 -4.94 115.64 109.86 2jgl s THR 383 Ca -0.03 0.19 -0.22 0.00 0.31 0.00 0.00 61.69 61.94 2jgl s THR 383 Cb 0.12 -3.12 0.04 0.00 0.01 0.00 0.00 72.50 69.54 2jgl s THR 383 CO 0.84 0.03 0.75 -0.62 -0.69 0.00 0.00 174.62 174.93 2jgl s ASP 384 N 0.40 6.33 0.06 3.53 2.15 -1.26 -4.96 116.67 122.93 2jgl s ASP 384 Ca 0.61 -0.39 0.21 0.00 0.43 0.00 0.00 52.55 53.41 2jgl s ASP 384 Cb -0.46 -2.36 0.85 0.00 -0.30 0.00 0.00 42.92 40.65 2jgl s ASP 384 CO 0.48 -0.95 1.65 0.79 -0.17 0.00 0.00 175.17 176.97 2jgl n TRP 385 N 6.67 0.22 0.05 -5.34 7.02 -1.26 -1.21 117.44 123.59 2jgl n TRP 385 Ca -0.01 0.08 -0.08 0.00 -1.02 0.00 0.00 57.50 56.48 2jgl n TRP 385 Cb 0.47 -0.63 0.08 0.00 -2.42 0.00 0.00 31.31 28.82 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 0.44 -5.91 -0.99 4.07 -2.04 -3.38 115.31 107.50 2jgl h LEU 386 Ca 0.00 -0.25 -0.52 0.00 0.08 0.00 0.00 57.88 57.19 2jgl h LEU 386 Cb 0.37 -0.13 -0.40 0.00 1.08 0.00 0.00 40.66 41.58 2jgl h LEU 386 CO 0.00 0.94 -1.07 1.41 -1.08 0.00 0.00 178.44 178.64 2jgl n HIS 387 N -3.90 0.78 0.19 1.13 8.25 -0.35 -4.96 115.22 116.36 2jgl n HIS 387 Ca -0.03 -3.80 0.04 0.00 -0.26 0.00 0.00 57.72 53.66 2jgl n HIS 387 Cb 0.63 -0.42 0.18 0.00 1.12 0.00 0.00 29.99 31.49 2jgl n HIS 387 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2jgl n PRO 388 N 0.50 0.02 -0.00 -0.41 -0.04 -0.61 -2.45 135.00 132.01 2jgl n PRO 388 Ca 0.25 0.43 0.01 0.00 -0.04 0.00 0.00 63.50 64.15 2jgl n PRO 388 Cb 0.58 -1.56 0.01 0.00 -0.04 0.00 0.00 33.50 32.49 2jgl n PRO 388 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2jgl n GLU 389 N -1.61 -0.11 -2.15 0.54 -0.58 -1.26 -4.84 120.64 110.63 2jgl n GLU 389 Ca 0.01 -0.77 -0.42 0.00 -0.42 0.00 0.00 57.16 55.56 2jgl n GLU 389 Cb 0.07 -1.03 -0.03 0.00 -0.57 0.00 0.00 31.44 29.88 2jgl n GLU 389 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2jgl s ASP 390 N -0.29 6.78 0.28 1.62 2.15 -1.02 -4.77 116.67 121.42 2jgl s ASP 390 Ca 0.02 2.15 0.02 0.00 0.43 0.00 0.00 52.55 55.17 2jgl s ASP 390 Cb 0.01 -2.55 0.42 0.00 -0.30 0.00 0.00 42.92 40.51 2jgl s ASP 390 CO 0.02 -0.80 1.74 -0.65 -0.17 0.00 0.00 175.17 175.31 2jgl h PRO 391 N 8.40 0.51 -0.32 4.34 0.11 -1.93 -1.21 132.00 141.90 2jgl h PRO 391 Ca -0.38 -0.18 -0.06 0.00 0.11 0.00 0.00 66.00 65.50 2jgl h PRO 391 Cb 1.17 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2jgl h PRO 391 CO 0.93 0.69 -0.03 1.15 -0.21 0.00 0.00 178.00 180.53 2jgl h THR 392 N 0.46 1.27 -0.48 -1.15 2.02 -1.91 -1.07 112.91 112.04 2jgl h THR 392 Ca 0.07 -1.03 -0.04 0.00 0.77 0.00 0.00 66.41 66.18 2jgl h THR 392 Cb 0.62 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 68.30 2jgl h THR 392 CO 0.04 0.34 0.15 -0.74 0.37 0.00 0.00 175.52 175.68 2jgl h HIS 393 N 0.38 0.77 -0.66 3.16 -0.00 -1.90 -2.17 115.15 114.73 2jgl h HIS 393 Ca 0.09 -0.08 -0.05 0.00 -0.00 0.00 0.00 60.37 60.32 2jgl h HIS 393 Cb 0.50 -0.22 -0.03 0.00 -0.00 0.00 0.00 27.41 27.66 2jgl h HIS 393 CO 0.04 0.68 0.20 -0.07 -0.00 0.00 0.00 177.93 178.78 2jgl h LEU 394 N 0.64 0.95 -0.02 0.26 3.38 -1.15 0.38 115.31 119.76 2jgl h LEU 394 Ca 0.15 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.96 2jgl h LEU 394 Cb 0.27 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2jgl h LEU 394 CO -0.00 0.89 -0.01 -0.09 0.09 0.00 0.00 178.44 179.31 2jgl h ARG 395 N 0.98 -0.02 0.00 1.13 1.12 -1.08 -1.70 114.38 114.82 2jgl h ARG 395 Ca 0.22 0.00 -0.06 0.00 -1.11 0.00 0.00 59.98 59.02 2jgl h ARG 395 Cb 0.29 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.24 2jgl h ARG 395 CO -0.01 -0.01 -0.30 -0.44 -3.11 0.00 0.00 179.97 176.10 2jgl h ASP 396 N -0.02 0.00 0.45 -3.80 3.32 -0.96 -2.69 116.42 112.73 2jgl h ASP 396 Ca 0.01 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.90 2jgl h ASP 396 Cb 0.04 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 2jgl h ASP 396 CO -0.03 0.30 -0.71 0.00 -1.72 0.00 0.00 179.24 177.09 2jgl h ALA 397 N 1.70 0.73 -0.48 3.45 0.00 0.02 -2.13 119.26 122.55 2jgl h ALA 397 Ca -0.00 -0.61 -0.09 0.00 0.00 0.00 0.00 54.91 54.20 2jgl h ALA 397 Cb 0.84 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2jgl h ALA 397 CO 0.04 0.80 -0.06 1.98 0.00 0.00 0.00 179.25 182.01 2jgl h MET 398 N 0.15 0.88 0.08 0.00 1.85 -0.99 -0.34 114.93 116.56 2jgl h MET 398 Ca -0.02 -0.31 -0.00 0.00 -0.61 0.00 0.00 59.70 58.76 2jgl h MET 398 Cb 1.26 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 33.22 2jgl h MET 398 CO 0.11 0.95 -0.04 1.03 -0.40 0.00 0.00 176.91 178.56 2jgl h SER 399 N 0.73 -0.09 -0.94 1.39 0.87 -1.48 -2.82 113.55 111.21 2jgl h SER 399 Ca 0.13 -0.08 0.03 0.00 -1.23 0.00 0.00 61.79 60.64 2jgl h SER 399 Cb 0.59 0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 62.52 2jgl h SER 399 CO 0.04 0.02 0.62 0.00 -0.53 0.00 0.00 176.83 176.98 2jgl h ALA 400 N 0.71 1.38 0.22 6.23 0.00 -1.18 0.30 119.26 126.93 2jgl h ALA 400 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2jgl h ALA 400 Cb 0.17 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2jgl h ALA 400 CO 0.02 0.54 -0.20 0.28 0.00 0.00 0.00 179.25 179.88 2jgl h VAL 401 N 1.20 0.55 -0.45 0.00 2.07 -0.98 0.39 116.25 119.03 2jgl h VAL 401 Ca 0.37 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.85 2jgl h VAL 401 Cb -0.02 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2jgl h VAL 401 CO -0.10 0.00 0.16 0.58 0.02 0.00 0.00 177.57 178.22 2jgl h VAL 402 N -0.45 1.21 -0.48 2.57 2.07 -1.21 -1.11 116.25 118.85 2jgl h VAL 402 Ca -0.00 -0.69 -0.07 0.00 0.82 0.00 0.00 66.70 66.75 2jgl h VAL 402 Cb 0.42 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 2jgl h VAL 402 CO -0.04 0.25 0.03 1.23 0.02 0.00 0.00 177.57 179.06 2jgl h GLY 403 N 0.59 0.90 0.90 2.17 0.00 -0.81 -2.29 103.07 104.52 2jgl h GLY 403 Ca 0.15 -0.64 -0.09 0.00 0.00 0.00 0.00 47.33 46.75 2jgl h GLY 403 CO -0.01 0.59 -0.16 -0.55 0.00 0.00 0.00 176.54 176.40 2jgl h ASP 404 N 0.69 0.63 -0.43 0.19 3.32 -0.09 -0.44 116.42 120.29 2jgl h ASP 404 Ca 0.14 -0.42 -0.10 0.00 0.02 0.00 0.00 57.03 56.66 2jgl h ASP 404 Cb 0.47 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 2jgl h ASP 404 CO 0.02 0.92 -0.14 -0.74 -1.72 0.00 0.00 179.24 177.58 2jgl h HIS 405 N 0.35 0.97 0.00 4.55 2.76 -1.22 -0.67 115.15 121.89 2jgl h HIS 405 Ca 0.06 -0.22 -0.20 0.00 -2.20 0.00 0.00 60.37 57.80 2jgl h HIS 405 Cb 0.69 -0.23 -0.04 0.00 1.55 0.00 0.00 27.41 29.38 2jgl h HIS 405 CO 0.06 0.98 -1.82 0.09 -1.30 0.00 0.00 177.93 175.95 2jgl n ASN 406 N -4.26 0.46 0.07 3.26 3.02 -0.86 -4.51 115.26 112.44 2jgl n ASN 406 Ca -0.01 0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.75 2jgl n ASN 406 Cb 0.40 0.71 0.00 0.00 -0.61 0.00 0.00 39.78 40.28 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 -2.75 0.35 -0.08 2.41 0.31 -0.65 -4.75 118.33 113.17 2jgl n VAL 407 Ca -0.16 0.11 -0.09 0.00 -0.01 0.00 0.00 64.34 64.19 2jgl n VAL 407 Cb 0.90 -0.78 -0.02 0.00 -0.91 0.00 0.00 33.84 33.03 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 1.08 0.01 2.52 2.07 -1.19 -0.29 116.25 120.45 2jgl h VAL 408 Ca 0.00 -0.14 -0.25 0.00 0.82 0.00 0.00 66.70 67.13 2jgl h VAL 408 Cb 0.00 0.66 0.01 0.00 -1.52 0.00 0.00 31.29 30.44 2jgl h VAL 408 CO 0.00 0.07 -1.02 0.00 0.02 0.00 0.00 177.57 176.65 2jgl h PRO 410 N 0.29 0.17 -0.12 0.00 0.11 -1.72 0.42 132.00 131.16 2jgl h PRO 410 Ca -0.11 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.00 2jgl h PRO 410 Cb 1.67 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.72 2jgl h PRO 410 CO 0.19 0.11 0.03 0.28 -0.21 0.00 0.00 178.00 178.40 2jgl h VAL 411 N 0.18 0.96 -0.36 3.15 2.07 -0.99 -0.93 116.25 120.34 2jgl h VAL 411 Ca 0.33 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.88 2jgl h VAL 411 Cb 0.54 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 31.13 2jgl h VAL 411 CO -0.49 0.02 0.06 0.00 0.02 0.00 0.00 177.57 177.18 2jgl h ALA 412 N 1.08 0.37 -0.30 1.67 0.00 -1.00 0.28 119.26 121.36 2jgl h ALA 412 Ca 0.05 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.09 2jgl h ALA 412 Cb 0.03 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2jgl h ALA 412 CO -0.06 -0.34 -0.08 0.37 0.00 0.00 0.00 179.25 179.14 2jgl h GLN 413 N 0.18 -0.01 0.20 0.00 5.75 -0.82 -1.42 115.11 119.00 2jgl h GLN 413 Ca 0.17 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.66 2jgl h GLN 413 Cb 0.20 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.75 2jgl h GLN 413 CO -0.23 -0.00 -0.10 1.25 -2.65 0.00 0.00 178.83 177.10 2jgl h LEU 414 N -0.01 -0.23 -0.66 -2.39 5.85 0.14 -0.92 115.31 117.10 2jgl h LEU 414 Ca 0.15 -0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.89 2jgl h LEU 414 Cb 0.23 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.26 2jgl h LEU 414 CO -0.32 -0.10 0.35 0.00 -0.34 0.00 0.00 178.44 178.03 2jgl h ALA 415 N 0.46 0.89 -0.36 1.25 0.00 -0.38 -0.64 119.26 120.49 2jgl h ALA 415 Ca -0.03 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2jgl h ALA 415 Cb 0.26 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2jgl h ALA 415 CO 0.04 -0.01 0.11 0.78 0.00 0.00 0.00 179.25 180.18 2jgl h GLY 416 N 0.62 0.60 1.09 0.00 0.00 -1.06 -0.37 103.07 103.95 2jgl h GLY 416 Ca 0.31 -0.35 -0.18 0.00 0.00 0.00 0.00 47.33 47.11 2jgl h GLY 416 CO -0.22 0.33 -0.55 3.21 0.00 0.00 0.00 176.54 179.32 2jgl h ARG 417 N 0.43 0.79 -0.54 4.80 2.47 -0.80 -2.28 114.38 119.27 2jgl h ARG 417 Ca 0.12 -0.53 -0.03 0.00 -1.26 0.00 0.00 59.98 58.28 2jgl h ARG 417 Cb 0.25 0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.62 2jgl h ARG 417 CO -0.00 1.16 0.23 -0.07 0.56 0.00 0.00 179.97 181.85 2jgl h LEU 418 N 0.54 0.72 -0.37 3.04 4.07 -1.09 -2.49 115.31 119.74 2jgl h LEU 418 Ca -0.00 -0.15 -0.02 0.00 0.08 0.00 0.00 57.88 57.79 2jgl h LEU 418 Cb 1.16 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 42.70 2jgl h LEU 418 CO 0.12 0.68 0.16 0.00 -1.08 0.00 0.00 178.44 178.31 2jgl h ALA 419 N 1.08 0.48 0.00 1.53 0.00 -1.02 -1.65 119.26 119.68 2jgl h ALA 419 Ca 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2jgl h ALA 419 Cb 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2jgl h ALA 419 CO -0.02 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.30 2jgl h ALA 420 N 1.00 1.00 -0.37 0.00 0.00 -1.32 -2.92 119.26 116.66 2jgl h ALA 420 Ca 0.12 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 2jgl h ALA 420 Cb 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 2jgl h ALA 420 CO -0.01 0.00 -0.02 1.04 0.00 0.00 0.00 179.25 180.26 2jgl n GLN 421 N -2.89 2.07 -0.00 0.00 6.02 -0.95 -4.96 117.38 116.68 2jgl n GLN 421 Ca -0.00 -3.10 0.00 0.00 -0.01 0.00 0.00 57.00 53.88 2jgl n GLN 421 Cb 0.21 -1.84 0.00 0.00 1.02 0.00 0.00 30.24 29.63 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 -1.01 0.13 3.80 1.08 0.00 -1.10 -1.12 105.19 106.98 2jgl n GLY 422 Ca 0.32 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.03 2.68 -0.32 4.61 0.00 -0.64 -4.45 121.76 121.61 2jgl s ALA 423 Ca 0.00 0.38 -0.14 0.00 0.00 0.00 0.00 51.96 52.20 2jgl s ALA 423 Cb 0.00 -3.24 -0.02 0.00 0.00 0.00 0.00 23.12 19.86 2jgl s ALA 423 CO 0.00 -0.94 0.33 0.50 0.00 0.00 0.00 175.76 175.65 2jgl s ARG 424 N -4.19 3.66 -0.12 0.00 3.52 0.76 -4.49 118.95 118.09 2jgl s ARG 424 Ca 0.63 -0.36 0.03 0.00 -0.13 0.00 0.00 55.73 55.90 2jgl s ARG 424 Cb -0.17 -3.77 0.01 0.00 -1.56 0.00 0.00 34.95 29.47 2jgl s ARG 424 CO 0.40 -0.44 -0.22 0.08 -0.81 0.00 0.00 175.30 174.31 2jgl s VAL 425 N 1.97 1.97 -0.06 7.11 1.01 -1.26 -0.41 120.40 130.73 2jgl s VAL 425 Ca 0.11 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2jgl s VAL 425 Cb -0.16 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 2jgl s VAL 425 CO 0.11 0.54 -0.11 -0.31 0.00 0.00 0.00 175.10 175.33 2jgl s TYR 426 N 0.69 2.82 -0.03 5.22 1.51 -0.27 0.59 117.35 127.89 2jgl s TYR 426 Ca -0.11 -0.08 0.04 0.00 -1.01 0.00 0.00 57.07 55.91 2jgl s TYR 426 Cb -0.16 -1.68 -0.00 0.00 -0.11 0.00 0.00 41.96 40.01 2jgl s TYR 426 CO 0.01 0.25 -0.14 0.00 -1.11 0.00 0.00 175.55 174.56 2jgl s ALA 427 N -0.73 1.21 0.15 3.71 0.00 -1.25 -0.68 121.76 124.17 2jgl s ALA 427 Ca 0.11 -0.56 0.02 0.00 0.00 0.00 0.00 51.96 51.53 2jgl s ALA 427 Cb -0.11 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 2jgl s ALA 427 CO 0.01 0.25 -0.04 1.52 0.00 0.00 0.00 175.76 177.50 2jgl s TYR 428 N -0.07 1.15 -0.08 0.00 -0.85 -0.57 -1.76 117.35 115.16 2jgl s TYR 428 Ca 0.00 -0.93 0.02 0.00 -0.52 0.00 0.00 57.07 55.64 2jgl s TYR 428 Cb -0.08 -0.64 0.01 0.00 0.38 0.00 0.00 41.96 41.63 2jgl s TYR 428 CO 0.01 -0.13 -0.13 -1.50 -1.52 0.00 0.00 175.55 172.28 2jgl s ILE 429 N -3.57 1.28 -0.22 -3.49 2.07 -0.37 -2.20 121.20 114.71 2jgl s ILE 429 Ca 0.19 -0.54 -0.14 0.00 -1.41 0.00 0.00 60.65 58.76 2jgl s ILE 429 Cb 0.05 -1.18 -0.04 0.00 0.13 0.00 0.00 42.46 41.42 2jgl s ILE 429 CO 0.01 0.39 0.29 0.12 -1.91 0.00 0.00 174.94 173.85 2jgl s PHE 430 N 0.83 3.35 0.00 3.50 2.19 0.10 -0.68 117.98 127.27 2jgl s PHE 430 Ca -0.11 0.45 0.00 0.00 0.33 0.00 0.00 56.93 57.60 2jgl s PHE 430 Cb -0.15 -2.41 0.00 0.00 -1.31 0.00 0.00 43.02 39.15 2jgl s PHE 430 CO 0.02 0.04 0.64 0.39 1.83 0.00 0.00 175.22 178.13 2jgl n GLU 431 N 4.34 1.07 -3.68 10.12 1.02 0.16 -1.04 120.64 132.63 2jgl n GLU 431 Ca -0.11 -0.85 -0.36 0.00 -0.02 0.00 0.00 57.16 55.81 2jgl n GLU 431 Cb 0.51 -0.78 -0.10 0.00 -0.02 0.00 0.00 31.44 31.05 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 -0.41 3.30 -0.20 -0.32 2.46 -1.23 -4.95 115.29 113.94 2jgl s HIS 432 Ca 0.00 0.19 -0.19 0.00 0.47 0.00 0.00 55.06 55.53 2jgl s HIS 432 Cb 0.00 -2.26 -0.03 0.00 -0.13 0.00 0.00 32.58 30.16 2jgl s HIS 432 CO 0.00 0.04 0.56 0.50 -2.47 0.00 0.00 174.74 173.37 2jgl s ARG 433 N 1.08 4.19 0.22 2.88 3.52 -1.26 -4.93 118.95 124.65 2jgl s ARG 433 Ca 0.07 0.49 -0.32 0.00 -0.13 0.00 0.00 55.73 55.84 2jgl s ARG 433 Cb -0.14 -3.57 -0.13 0.00 -1.56 0.00 0.00 34.95 29.55 2jgl s ARG 433 CO 0.05 -0.19 1.50 0.00 -0.81 0.00 0.00 175.30 175.84 2jgl n ALA 434 N 4.93 1.44 0.32 6.12 0.00 -1.26 -4.84 120.51 127.21 2jgl n ALA 434 Ca -0.03 0.42 0.19 0.00 0.00 0.00 0.00 53.44 54.01 2jgl n ALA 434 Cb 0.50 -2.33 1.06 0.00 0.00 0.00 0.00 19.45 18.68 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 4.97 0.00 0.15 0.00 4.64 -1.96 -2.30 113.55 119.05 2jgl h SER 435 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2jgl h SER 435 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2jgl h SER 435 CO 0.81 0.01 -0.13 0.35 -0.87 0.00 0.00 176.83 177.01 2jgl n THR 436 N -3.43 0.00 -1.68 2.95 -2.24 -1.26 -4.96 114.28 103.66 2jgl n THR 436 Ca -0.03 -0.16 -0.45 0.00 -2.27 0.00 0.00 64.05 61.15 2jgl n THR 436 Cb 0.09 0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 68.60 2jgl n THR 436 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2jgl n LEU 437 N -0.41 3.24 -0.09 3.22 7.94 -0.87 -4.91 117.00 125.12 2jgl n LEU 437 Ca 0.16 1.13 0.10 0.00 -1.11 0.00 0.00 56.01 56.28 2jgl n LEU 437 Cb 0.33 -1.45 -0.08 0.00 0.53 0.00 0.00 43.42 42.75 2jgl n LEU 437 CO 0.22 -0.36 0.04 0.35 -1.11 0.00 0.00 177.39 176.52 2jgl n THR 438 N 2.36 0.00 -2.13 1.96 -2.24 -1.26 -4.94 114.28 108.03 2jgl n THR 438 Ca 0.13 -0.04 -0.33 0.00 -2.27 0.00 0.00 64.05 61.53 2jgl n THR 438 Cb 0.31 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 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 -2.91 3.00 0.92 4.78 0.52 -1.26 -4.92 118.94 119.07 2jgl s TRP 439 Ca 0.10 1.52 -0.10 0.00 0.02 0.00 0.00 56.10 57.64 2jgl s TRP 439 Cb 0.16 -3.01 0.15 0.00 -1.15 0.00 0.00 33.47 29.62 2jgl s TRP 439 CO 0.81 -1.05 1.13 -1.25 0.02 0.00 0.00 176.95 176.60 2jgl s PRO 440 N -3.94 1.01 0.49 4.98 0.04 -1.26 -4.91 135.00 131.42 2jgl s PRO 440 Ca 0.64 1.43 0.23 0.00 0.04 0.00 0.00 61.00 63.34 2jgl s PRO 440 Cb -0.16 -1.74 1.27 0.00 0.04 0.00 0.00 34.50 33.91 2jgl s PRO 440 CO 0.34 -2.59 2.03 -0.07 0.04 0.00 0.00 177.00 176.75 2jgl h LEU 441 N -1.84 0.00 -1.76 -3.56 3.38 -1.94 -2.72 115.31 106.86 2jgl h LEU 441 Ca -0.45 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.49 2jgl h LEU 441 Cb 1.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.01 2jgl h LEU 441 CO 0.44 0.16 -0.15 4.11 0.09 0.00 0.00 178.44 183.09 2jgl h TRP 442 N 0.00 0.00 0.00 1.13 5.08 -1.93 -2.21 115.95 118.02 2jgl h TRP 442 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2jgl h TRP 442 Cb 0.36 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.52 2jgl h TRP 442 CO 0.00 0.15 0.00 -1.33 -1.28 0.00 0.00 178.44 175.98 2jgl n MET 443 N -3.63 0.43 0.00 0.12 2.81 -1.03 -4.95 117.12 110.87 2jgl n MET 443 Ca -0.02 0.06 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 2jgl n MET 443 Cb 0.27 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.28 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 0.48 3.73 3.24 3.03 0.00 -0.83 -3.62 105.19 111.22 2jgl n GLY 444 Ca 0.12 0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 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 4.79 0.83 1.61 1.01 -1.26 -4.87 120.40 122.51 2jgl s VAL 445 Ca 0.00 -2.38 -0.12 0.00 0.00 0.00 0.00 61.98 59.48 2jgl s VAL 445 Cb 0.00 -4.04 0.09 0.00 0.00 0.00 0.00 36.38 32.43 2jgl s VAL 445 CO 0.00 -0.92 1.17 -2.84 0.00 0.00 0.00 175.10 172.51 2jgl s PRO 446 N 0.47 1.81 0.26 2.72 0.02 -1.24 -1.83 135.00 137.22 2jgl s PRO 446 Ca 0.14 0.16 -0.30 0.00 0.02 0.00 0.00 61.00 61.02 2jgl s PRO 446 Cb -0.18 -1.93 -0.11 0.00 0.02 0.00 0.00 34.50 32.31 2jgl s PRO 446 CO -0.05 -1.72 1.49 -1.58 -0.33 0.00 0.00 177.00 174.82 2jgl s HIS 447 N -3.51 2.92 0.00 6.54 5.65 -1.24 -2.37 115.29 123.28 2jgl s HIS 447 Ca 0.62 0.94 0.00 0.00 0.25 0.00 0.00 55.06 56.87 2jgl s HIS 447 Cb -0.12 -3.91 0.00 0.00 -1.18 0.00 0.00 32.58 27.37 2jgl s HIS 447 CO 0.50 -2.99 0.00 0.41 -0.65 0.00 0.00 174.74 172.01 2jgl n GLY 448 N 2.18 1.58 1.58 1.59 0.00 -1.26 -4.95 105.19 105.91 2jgl n GLY 448 Ca 0.07 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.17 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 1.56 0.02 1.61 4.02 -1.00 -3.15 117.16 118.23 2jgl n TYR 449 Ca 0.00 -0.58 0.06 0.00 -0.01 0.00 0.00 57.90 57.37 2jgl n TYR 449 Cb 0.00 -0.33 -0.11 0.00 -0.02 0.00 0.00 39.34 38.88 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 0.80 0.64 -0.09 -0.72 0.00 -1.26 -4.60 120.64 115.40 2jgl n GLU 450 Ca 0.24 0.00 -0.06 0.00 0.00 0.00 0.00 57.16 57.34 2jgl n GLU 450 Cb 0.93 -1.66 0.01 0.00 0.00 0.00 0.00 31.44 30.72 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 0.80 -0.15 3.84 2.04 -1.94 -0.56 117.51 121.54 2jgl h ILE 451 Ca -0.11 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 65.75 2jgl h ILE 451 Cb 1.29 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.00 2jgl h ILE 451 CO 0.01 0.03 0.15 1.05 0.00 0.00 0.00 178.15 179.39 2jgl h GLU 452 N 0.15 0.00 0.08 2.37 4.11 -1.80 -1.92 114.58 117.56 2jgl h GLU 452 Ca 0.16 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.47 2jgl h GLU 452 Cb 0.19 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.46 2jgl h GLU 452 CO -0.23 0.00 -0.51 0.74 0.07 0.00 0.00 179.01 179.08 2jgl h PHE 453 N 0.00 0.36 -0.60 2.06 0.04 -1.40 -1.82 116.94 115.58 2jgl h PHE 453 Ca 0.07 -0.25 0.09 0.00 2.80 0.00 0.00 57.97 60.68 2jgl h PHE 453 Cb 0.37 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 38.46 2jgl h PHE 453 CO 0.00 1.18 0.40 0.82 -0.60 0.00 0.00 178.31 180.11 2jgl h ILE 454 N -0.55 0.92 -0.00 -0.55 1.08 -1.07 -1.98 117.51 115.36 2jgl h ILE 454 Ca -0.09 -0.16 0.00 0.00 -0.39 0.00 0.00 64.86 64.23 2jgl h ILE 454 Cb 1.38 0.43 0.00 0.00 -3.07 0.00 0.00 36.82 35.55 2jgl h ILE 454 CO 0.10 0.08 -0.31 0.49 -0.69 0.00 0.00 178.15 177.82 2jgl n PHE 455 N -4.47 0.00 -1.51 1.37 3.01 -0.75 -4.55 117.46 110.55 2jgl n PHE 455 Ca 0.10 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.51 2jgl n PHE 455 Cb 0.34 -0.26 -0.01 0.00 -0.01 0.00 0.00 39.48 39.53 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 1.44 0.52 0.35 1.37 0.00 -0.74 -4.26 105.19 103.86 2jgl n GLY 456 Ca 0.08 -0.79 0.07 0.00 0.00 0.00 0.00 46.02 45.38 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 0.86 -2.09 0.99 4.07 -1.59 -1.90 115.31 115.64 2jgl h LEU 457 Ca -0.10 0.06 0.00 0.00 0.08 0.00 0.00 57.88 57.91 2jgl h LEU 457 Cb 0.61 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.24 2jgl h LEU 457 CO 0.14 0.44 0.21 -0.65 -1.08 0.00 0.00 178.44 177.50 2jgl h PRO 458 N 0.93 0.00 0.00 1.13 0.11 -1.91 0.20 132.00 132.46 2jgl h PRO 458 Ca 0.49 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.60 2jgl h PRO 458 Cb 0.53 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.64 2jgl h PRO 458 CO -0.28 0.00 -0.03 -0.07 -0.21 0.00 0.00 178.00 177.41 2jgl h LEU 459 N 0.00 0.00 -8.57 2.35 4.07 -1.67 -3.41 115.31 108.08 2jgl h LEU 459 Ca 0.00 0.00 -0.57 0.00 0.08 0.00 0.00 57.88 57.39 2jgl h LEU 459 Cb 0.43 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 42.08 2jgl h LEU 459 CO 0.00 0.03 0.86 -0.62 -1.08 0.00 0.00 178.44 177.63 2jgl s ASP 460 N -5.60 6.44 0.56 -0.43 -1.08 0.70 -4.86 116.67 112.40 2jgl s ASP 460 Ca -0.03 0.02 0.25 0.00 -0.52 0.00 0.00 52.55 52.28 2jgl s ASP 460 Cb 0.12 -2.52 1.53 0.00 -1.46 0.00 0.00 42.92 40.59 2jgl s ASP 460 CO 0.50 -1.39 2.10 1.55 0.52 0.00 0.00 175.17 178.44 2jgl h PRO 461 N 9.45 0.00 0.00 4.34 0.13 -1.87 0.11 132.00 144.17 2jgl h PRO 461 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 2jgl h PRO 461 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2jgl h PRO 461 CO 1.15 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.79 2jgl n SER 462 N -4.09 0.00 -0.56 1.44 3.41 -1.26 -3.25 113.62 109.31 2jgl n SER 462 Ca 0.02 0.09 0.12 0.00 -0.26 0.00 0.00 58.87 58.85 2jgl n SER 462 Cb 0.33 -0.30 0.21 0.00 -0.26 0.00 0.00 64.21 64.19 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 -1.30 1.97 -0.37 1.04 4.77 0.40 -4.98 117.00 118.52 2jgl n LEU 463 Ca 0.07 -0.66 -0.05 0.00 -0.03 0.00 0.00 56.01 55.34 2jgl n LEU 463 Cb 0.14 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 2jgl n LEU 463 CO 0.13 0.34 -0.05 0.59 -1.33 0.00 0.00 177.39 177.08 2jgl n ASN 464 N 0.25 -3.75 -4.80 -1.43 3.02 -1.20 -5.00 115.26 102.34 2jgl n ASN 464 Ca 0.13 0.12 -0.32 0.00 -0.03 0.00 0.00 54.58 54.48 2jgl n ASN 464 Cb 0.46 -1.67 0.03 0.00 -0.61 0.00 0.00 39.78 37.98 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 -2.12 2.99 0.82 3.10 2.02 -1.26 -4.88 117.35 118.02 2jgl s TYR 465 Ca 0.00 1.49 -0.11 0.00 -0.37 0.00 0.00 57.07 58.07 2jgl s TYR 465 Cb 0.00 -2.97 0.08 0.00 -0.40 0.00 0.00 41.96 38.67 2jgl s TYR 465 CO 0.00 -1.22 1.09 0.95 -1.57 0.00 0.00 175.55 174.80 2jgl s THR 466 N -2.68 3.01 0.24 -0.71 -4.23 -1.26 -4.90 115.64 105.12 2jgl s THR 466 Ca 0.62 0.33 -0.06 0.00 -1.18 0.00 0.00 61.69 61.40 2jgl s THR 466 Cb -0.16 -2.96 0.18 0.00 1.34 0.00 0.00 72.50 70.91 2jgl s THR 466 CO 0.44 -0.43 1.82 0.74 -0.54 0.00 0.00 174.62 176.65 2jgl h THR 467 N -1.23 1.25 -0.33 3.99 2.02 -1.97 -1.76 112.91 114.88 2jgl h THR 467 Ca -0.47 -0.76 -0.09 0.00 0.77 0.00 0.00 66.41 65.86 2jgl h THR 467 Cb 1.27 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 2jgl h THR 467 CO 0.57 0.31 -0.19 -0.33 0.37 0.00 0.00 175.52 176.25 2jgl h GLU 468 N 1.11 0.60 -0.85 6.66 3.07 -2.00 -2.13 114.58 121.04 2jgl h GLU 468 Ca 0.26 -0.21 0.02 0.00 -0.50 0.00 0.00 59.36 58.93 2jgl h GLU 468 Cb 0.17 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 27.99 2jgl h GLU 468 CO -0.03 0.76 0.56 0.93 -1.40 0.00 0.00 179.01 179.83 2jgl h GLU 469 N 0.54 1.09 -0.20 2.33 5.08 -1.82 0.69 114.58 122.28 2jgl h GLU 469 Ca 0.09 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 2jgl h GLU 469 Cb 0.63 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 2jgl h GLU 469 CO 0.04 0.72 0.06 -0.09 -1.00 0.00 0.00 179.01 178.74 2jgl h ARG 470 N 1.12 0.14 -0.70 2.33 2.43 -0.81 0.45 114.38 119.35 2jgl h ARG 470 Ca 0.32 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.45 2jgl h ARG 470 Cb -0.08 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 2jgl h ARG 470 CO -0.09 0.09 0.32 0.82 -1.51 0.00 0.00 179.97 179.61 2jgl h ILE 471 N 0.15 1.23 -0.37 1.20 2.04 -1.02 -2.38 117.51 118.36 2jgl h ILE 471 Ca 0.09 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.26 2jgl h ILE 471 Cb 0.07 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 2jgl h ILE 471 CO -0.10 0.28 0.17 0.15 0.00 0.00 0.00 178.15 178.65 2jgl h PHE 472 N 0.98 0.54 -0.20 1.37 3.57 -0.65 -1.34 116.94 121.21 2jgl h PHE 472 Ca 0.24 -0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.74 2jgl h PHE 472 Cb 0.14 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 2jgl h PHE 472 CO 0.01 0.46 -0.01 0.00 -2.23 0.00 0.00 178.31 176.55 2jgl h ALA 473 N 1.02 0.17 -0.92 2.41 0.00 -0.64 -0.94 119.26 120.37 2jgl h ALA 473 Ca 0.13 0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.21 2jgl h ALA 473 Cb 0.13 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 2jgl h ALA 473 CO -0.02 -0.44 0.55 1.96 0.00 0.00 0.00 179.25 181.31 2jgl h GLN 474 N 0.06 0.85 -0.14 0.00 4.20 -1.30 0.70 115.11 119.48 2jgl h GLN 474 Ca 0.10 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.78 2jgl h GLN 474 Cb 0.12 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 2jgl h GLN 474 CO -0.17 0.56 -0.02 0.00 -0.67 0.00 0.00 178.83 178.53 2jgl h ARG 475 N 0.88 0.01 -0.72 1.46 3.08 -0.31 -0.94 114.38 117.84 2jgl h ARG 475 Ca 0.45 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.48 2jgl h ARG 475 Cb 0.45 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 2jgl h ARG 475 CO -0.27 0.01 0.35 -0.07 -1.07 0.00 0.00 179.97 178.93 2jgl h LEU 476 N 0.01 0.93 -0.69 3.04 3.38 -0.29 -0.37 115.31 121.33 2jgl h LEU 476 Ca 0.07 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2jgl h LEU 476 Cb 0.09 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2jgl h LEU 476 CO -0.13 0.79 0.35 0.24 0.09 0.00 0.00 178.44 179.78 2jgl h MET 477 N 1.00 0.98 -0.23 1.13 2.86 -0.75 -1.04 114.93 118.88 2jgl h MET 477 Ca 0.25 -0.13 0.04 0.00 -2.06 0.00 0.00 59.70 57.80 2jgl h MET 477 Cb 0.10 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.54 2jgl h MET 477 CO -0.03 0.76 -0.01 0.87 1.06 0.00 0.00 176.91 179.55 2jgl h LYS 478 N 0.95 0.05 0.38 1.72 1.79 -0.70 -1.51 116.57 119.26 2jgl h LYS 478 Ca 0.24 -0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.70 2jgl h LYS 478 Cb 0.09 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.70 2jgl h LYS 478 CO -0.03 0.04 -0.36 1.88 -1.08 0.00 0.00 179.45 179.89 2jgl h TYR 479 N 0.06 -0.97 -0.02 -1.35 0.05 -0.35 0.23 116.97 114.62 2jgl h TYR 479 Ca 0.11 0.01 0.03 0.00 0.05 0.00 0.00 58.73 58.92 2jgl h TYR 479 Cb 0.15 0.38 -0.03 0.00 1.01 0.00 0.00 36.73 38.23 2jgl h TYR 479 CO -0.20 -0.51 -0.16 -1.49 -1.05 0.00 0.00 178.16 174.75 2jgl h TRP 480 N -0.76 -0.42 -0.04 4.88 -0.00 -1.20 -1.42 115.95 116.99 2jgl h TRP 480 Ca -0.03 0.02 -0.12 0.00 -0.00 0.00 0.00 58.89 58.75 2jgl h TRP 480 Cb 0.68 0.19 -0.01 0.00 -0.00 0.00 0.00 29.16 30.01 2jgl h TRP 480 CO -0.20 -0.24 -0.55 1.79 -0.00 0.00 0.00 178.44 179.24 2jgl h THR 481 N -0.26 1.38 -0.46 1.49 1.35 -1.18 -0.42 112.91 114.81 2jgl h THR 481 Ca 0.06 -1.88 0.00 0.00 -0.55 0.00 0.00 66.41 64.04 2jgl h THR 481 Cb 0.34 1.98 -0.02 0.00 -1.73 0.00 0.00 68.15 68.71 2jgl h THR 481 CO -0.17 0.55 0.29 0.78 -0.25 0.00 0.00 175.52 176.72 2jgl h ASN 482 N 0.08 0.54 -0.79 5.36 2.35 -0.35 -0.83 115.58 121.94 2jgl h ASN 482 Ca -0.00 -0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 2jgl h ASN 482 Cb 1.00 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 39.20 2jgl h ASN 482 CO 0.08 0.41 0.43 0.15 -1.65 0.00 0.00 177.43 176.85 2jgl h PHE 483 N 0.62 1.09 -0.49 1.19 3.57 -0.75 -0.94 116.94 121.22 2jgl h PHE 483 Ca 0.17 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.64 2jgl h PHE 483 Cb -0.04 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.33 2jgl h PHE 483 CO -0.04 0.76 0.32 0.00 -2.23 0.00 0.00 178.31 177.12 2jgl h ALA 484 N 1.23 0.62 -0.55 2.41 0.00 -0.89 0.50 119.26 122.58 2jgl h ALA 484 Ca 0.28 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 2jgl h ALA 484 Cb 0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2jgl h ALA 484 CO -0.04 0.08 0.19 0.00 0.00 0.00 0.00 179.25 179.48 2jgl h ARG 485 N 0.66 0.84 0.00 0.00 3.08 -0.70 -3.40 114.38 114.86 2jgl h ARG 485 Ca 0.18 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2jgl h ARG 485 Cb -0.06 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.86 2jgl h ARG 485 CO -0.04 0.75 -0.41 0.25 -1.07 0.00 0.00 179.97 179.45 2jgl n THR 486 N -4.48 0.00 -0.87 2.04 -2.24 -0.40 -5.00 114.28 103.32 2jgl n THR 486 Ca 0.03 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2jgl n THR 486 Cb 0.18 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 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 1.13 0.50 2.69 3.38 0.00 0.17 -5.03 105.19 108.04 2jgl n GLY 487 Ca 0.00 -0.55 -0.21 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.50 1.39 0.56 1.61 -1.08 -1.26 -4.92 116.67 110.48 2jgl s ASP 488 Ca 0.00 -0.07 0.35 0.00 -0.52 0.00 0.00 52.55 52.31 2jgl s ASP 488 Cb 0.00 -0.05 1.56 0.00 -1.46 0.00 0.00 42.92 42.97 2jgl s ASP 488 CO 0.00 -0.28 2.06 1.55 0.52 0.00 0.00 175.17 179.02 2jgl h PRO 489 N 8.41 0.00 -7.16 4.34 0.13 -1.82 -3.16 132.00 132.74 2jgl h PRO 489 Ca -0.13 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.51 2jgl h PRO 489 Cb 1.13 0.00 0.06 0.00 0.13 0.00 0.00 31.00 32.32 2jgl h PRO 489 CO 0.19 0.03 0.38 -0.80 -0.23 0.00 0.00 178.00 177.57 2jgl s ASN 490 N -5.66 5.86 -0.09 1.44 0.01 -1.26 -4.44 114.94 110.79 2jgl s ASN 490 Ca -0.00 1.89 -0.28 0.00 -0.71 0.00 0.00 52.86 53.76 2jgl s ASN 490 Cb 0.10 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 39.20 2jgl s ASN 490 CO 0.53 -1.12 0.93 -0.62 -1.51 0.00 0.00 177.10 175.31 2jgl s ASP 491 N -2.48 7.18 0.23 -1.22 3.68 -1.26 -4.95 116.67 117.85 2jgl s ASP 491 Ca 0.66 1.44 -0.08 0.00 2.13 0.00 0.00 52.55 56.70 2jgl s ASP 491 Cb -0.17 -2.52 0.26 0.00 -1.45 0.00 0.00 42.92 39.03 2jgl s ASP 491 CO 0.32 -0.36 1.86 -0.65 0.13 0.00 0.00 175.17 176.47 2jgl h PRO 492 N 7.05 0.94 0.00 4.34 0.11 -1.95 -3.27 132.00 139.22 2jgl h PRO 492 Ca -0.34 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2jgl h PRO 492 Cb 1.16 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.06 2jgl h PRO 492 CO 0.82 0.62 0.00 0.54 -0.21 0.00 0.00 178.00 179.77 2jgl n ARG 493 N -4.61 0.00 -1.01 1.05 1.74 -1.26 -4.71 116.66 107.86 2jgl n ARG 493 Ca 0.10 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.09 2jgl n ARG 493 Cb 0.11 -0.82 -0.04 0.00 -1.02 0.00 0.00 32.46 30.70 2jgl n ARG 493 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2jgl n ASP 494 N -0.44 -0.65 -0.13 0.55 -0.08 -1.23 -4.71 116.55 109.86 2jgl n ASP 494 Ca 0.00 -1.43 0.13 0.00 -1.51 0.00 0.00 54.79 51.98 2jgl n ASP 494 Cb 0.00 -0.55 0.44 0.00 2.34 0.00 0.00 41.12 43.35 2jgl n ASP 494 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2jgl n SER 495 N 7.29 0.66 0.42 1.67 3.41 -1.26 -3.81 113.62 122.00 2jgl n SER 495 Ca 0.14 -0.54 -0.19 0.00 -0.26 0.00 0.00 58.87 58.02 2jgl n SER 495 Cb 0.39 0.05 -0.09 0.00 -0.26 0.00 0.00 64.21 64.30 2jgl n SER 495 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2jgl h LYS 496 N 0.65 -1.05 -6.75 4.33 6.56 -1.98 -3.44 116.57 114.88 2jgl h LYS 496 Ca 0.00 0.07 -0.57 0.00 -1.06 0.00 0.00 60.65 59.09 2jgl h LYS 496 Cb 0.46 0.24 0.13 0.00 -0.57 0.00 0.00 32.23 32.49 2jgl h LYS 496 CO 0.00 -0.70 0.32 0.43 -2.06 0.00 0.00 179.45 177.44 2jgl n SER 497 N -5.57 1.85 -4.75 0.86 7.64 -1.25 -4.96 113.62 107.45 2jgl n SER 497 Ca -0.15 1.05 -0.34 0.00 1.01 0.00 0.00 58.87 60.45 2jgl n SER 497 Cb 0.45 -1.43 0.06 0.00 -1.01 0.00 0.00 64.21 62.28 2jgl n SER 497 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2jgl s PRO 498 N -2.17 2.57 0.22 1.43 0.02 -1.26 -5.01 135.00 130.79 2jgl s PRO 498 Ca 0.63 1.64 -0.10 0.00 0.02 0.00 0.00 61.00 63.20 2jgl s PRO 498 Cb -0.52 -1.90 -0.07 0.00 0.02 0.00 0.00 34.50 32.03 2jgl s PRO 498 CO 0.56 -1.48 0.55 -0.65 -0.33 0.00 0.00 177.00 175.65 2jgl s GLN 499 N -3.83 3.82 -0.52 5.54 -1.52 -1.26 -4.89 119.66 116.99 2jgl s GLN 499 Ca 0.72 0.29 -0.16 0.00 -1.95 0.00 0.00 55.36 54.27 2jgl s GLN 499 Cb -0.26 -2.67 0.11 0.00 -0.22 0.00 0.00 33.01 29.97 2jgl s GLN 499 CO 0.41 0.33 0.47 -0.46 -0.25 0.00 0.00 175.29 175.79 2jgl s TRP 500 N -1.79 3.25 0.50 0.91 -0.11 -1.26 -4.92 118.94 115.52 2jgl s TRP 500 Ca 0.47 -1.19 -0.20 0.00 1.22 0.00 0.00 56.10 56.39 2jgl s TRP 500 Cb -0.11 -3.63 -0.07 0.00 -1.50 0.00 0.00 33.47 28.15 2jgl s TRP 500 CO 0.21 -0.96 1.08 -1.25 -4.62 0.00 0.00 176.95 171.41 2jgl s PRO 501 N 1.62 3.65 0.63 5.86 0.04 -1.26 -4.90 135.00 140.63 2jgl s PRO 501 Ca 0.03 1.49 -0.18 0.00 0.04 0.00 0.00 61.00 62.39 2jgl s PRO 501 Cb -0.28 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 2jgl s PRO 501 CO 0.04 -0.58 0.86 -2.30 0.04 0.00 0.00 177.00 175.06 2jgl n PRO 502 N -1.02 0.71 -2.55 0.56 -0.02 -1.26 -4.71 135.00 126.71 2jgl n PRO 502 Ca 0.10 0.29 -0.42 0.00 -2.02 0.00 0.00 63.50 61.44 2jgl n PRO 502 Cb 0.51 -2.08 -0.03 0.00 -0.02 0.00 0.00 33.50 31.89 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 -1.63 3.30 0.23 6.00 6.14 0.20 -4.42 117.35 127.17 2jgl s TYR 503 Ca 0.74 1.36 0.10 0.00 0.64 0.00 0.00 57.07 59.91 2jgl s TYR 503 Cb -0.40 -3.33 -0.05 0.00 0.42 0.00 0.00 41.96 38.60 2jgl s TYR 503 CO 0.49 -0.90 -0.19 0.95 0.64 0.00 0.00 175.55 176.54 2jgl s THR 504 N 2.24 2.18 0.30 4.34 -4.23 -1.26 -4.52 115.64 114.69 2jgl s THR 504 Ca 0.53 -2.22 0.09 0.00 -1.18 0.00 0.00 61.69 58.91 2jgl s THR 504 Cb -0.22 -2.14 0.03 0.00 1.34 0.00 0.00 72.50 71.51 2jgl s THR 504 CO 0.19 -0.38 1.70 0.71 -0.54 0.00 0.00 174.62 176.30 2jgl h THR 505 N 2.66 1.34 -0.07 3.99 1.35 -1.91 1.46 112.91 121.72 2jgl h THR 505 Ca -0.41 -1.65 -0.04 0.00 -0.55 0.00 0.00 66.41 63.76 2jgl h THR 505 Cb 1.23 1.83 -0.00 0.00 -1.73 0.00 0.00 68.15 69.49 2jgl h THR 505 CO 0.57 0.48 -0.12 0.00 -0.25 0.00 0.00 175.52 176.20 2jgl h ALA 506 N 1.43 0.11 0.00 6.62 0.00 -2.01 -3.38 119.26 122.02 2jgl h ALA 506 Ca 0.00 -0.33 -0.17 0.00 0.00 0.00 0.00 54.91 54.41 2jgl h ALA 506 Cb 0.87 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 2jgl h ALA 506 CO 0.07 -0.02 -2.14 0.00 0.00 0.00 0.00 179.25 177.16 2jgl n ALA 507 N -2.42 2.18 -3.87 0.00 0.00 -1.18 -5.01 120.51 110.20 2jgl n ALA 507 Ca -0.08 -0.88 -0.26 0.00 0.00 0.00 0.00 53.44 52.23 2jgl n ALA 507 Cb 0.36 -0.46 0.01 0.00 0.00 0.00 0.00 19.45 19.36 2jgl n ALA 507 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2jgl n GLN 508 N -2.46 -4.32 -3.22 0.00 6.02 0.50 -4.46 117.38 109.44 2jgl n GLN 508 Ca -0.17 0.52 -0.37 0.00 -0.01 0.00 0.00 57.00 56.97 2jgl n GLN 508 Cb 0.83 -5.00 -0.06 0.00 1.02 0.00 0.00 30.24 27.03 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 -6.38 4.19 0.18 -1.09 -0.21 -1.26 -0.67 119.66 114.42 2jgl s GLN 509 Ca 0.19 0.75 -0.13 0.00 0.02 0.00 0.00 55.36 56.18 2jgl s GLN 509 Cb -0.10 -3.04 0.01 0.00 1.00 0.00 0.00 33.01 30.88 2jgl s GLN 509 CO 0.85 0.51 0.39 1.52 -2.12 0.00 0.00 175.29 176.44 2jgl s TYR 510 N -1.35 0.16 0.25 0.91 1.13 -0.41 -3.74 117.35 114.31 2jgl s TYR 510 Ca 0.36 -0.52 0.10 0.00 -1.41 0.00 0.00 57.07 55.61 2jgl s TYR 510 Cb -0.18 0.15 -0.04 0.00 -1.10 0.00 0.00 41.96 40.79 2jgl s TYR 510 CO 0.20 -0.81 -0.08 0.14 -2.51 0.00 0.00 175.55 172.50 2jgl s VAL 511 N -3.92 3.13 -0.07 -3.49 -7.23 -0.73 -0.71 120.40 107.38 2jgl s VAL 511 Ca 0.13 -1.99 -0.10 0.00 -1.81 0.00 0.00 61.98 58.21 2jgl s VAL 511 Cb 0.01 -2.64 -0.05 0.00 0.56 0.00 0.00 36.38 34.27 2jgl s VAL 511 CO -0.02 -0.32 0.25 -0.94 -0.31 0.00 0.00 175.10 173.77 2jgl s SER 512 N -3.44 6.57 -0.34 4.85 1.04 -0.83 -1.23 113.70 120.31 2jgl s SER 512 Ca 0.29 0.68 -0.04 0.00 0.48 0.00 0.00 55.95 57.36 2jgl s SER 512 Cb -0.07 -2.15 0.05 0.00 0.10 0.00 0.00 66.02 63.96 2jgl s SER 512 CO 0.17 0.37 0.08 -0.76 0.98 0.00 0.00 173.24 174.09 2jgl s LEU 513 N -1.07 4.31 0.00 2.42 1.43 0.14 -4.19 118.68 121.73 2jgl s LEU 513 Ca 0.19 -1.33 -0.01 0.00 -1.03 0.00 0.00 54.13 51.95 2jgl s LEU 513 Cb -0.14 -1.81 0.00 0.00 0.03 0.00 0.00 46.19 44.28 2jgl s LEU 513 CO 0.08 -0.34 0.07 -0.46 0.23 0.00 0.00 176.35 175.94 2jgl n ASN 514 N 4.71 -0.21 0.23 2.29 0.23 -1.26 -0.67 115.26 120.58 2jgl n ASN 514 Ca -0.11 -1.17 0.06 0.00 -0.53 0.00 0.00 54.58 52.83 2jgl n ASN 514 Cb 0.44 0.36 0.54 0.00 -2.08 0.00 0.00 39.78 39.04 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 0.00-10.19 -4.53 3.38 -1.95 -3.43 115.31 98.58 2jgl h LEU 515 Ca -0.03 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.46 2jgl h LEU 515 Cb 0.12 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.91 2jgl h LEU 515 CO 0.04 0.13 0.38 -0.54 0.09 0.00 0.00 178.44 178.54 2jgl s LYS 516 N -4.75 3.63 0.68 1.13 1.02 -1.26 -5.01 119.74 115.19 2jgl s LYS 516 Ca -0.04 1.08 -0.17 0.00 0.02 0.00 0.00 55.97 56.87 2jgl s LYS 516 Cb 0.16 -2.08 -0.01 0.00 -0.52 0.00 0.00 37.83 35.38 2jgl s LYS 516 CO 0.69 -0.54 0.99 -2.30 -0.92 0.00 0.00 175.35 173.26 2jgl n PRO 517 N -1.80 0.66 -1.45 -1.68 -0.02 -1.26 -4.82 135.00 124.63 2jgl n PRO 517 Ca 0.08 0.28 -0.57 0.00 -2.02 0.00 0.00 63.50 61.26 2jgl n PRO 517 Cb 0.53 -2.23 -0.08 0.00 -0.02 0.00 0.00 33.50 31.70 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 -1.44 0.08 -4.33 2.45 4.77 -1.26 -4.98 117.00 112.29 2jgl n LEU 518 Ca 0.14 1.11 -0.32 0.00 -0.03 0.00 0.00 56.01 56.90 2jgl n LEU 518 Cb 0.49 -0.88 -0.15 0.00 -2.33 0.00 0.00 43.42 40.55 2jgl n LEU 518 CO 0.49 -1.75 -0.50 -0.70 -1.33 0.00 0.00 177.39 173.59 2jgl s GLU 519 N 0.22 2.96 -0.20 3.23 2.12 -1.26 -4.86 118.70 120.91 2jgl s GLU 519 Ca 0.88 -0.79 -0.18 0.00 0.36 0.00 0.00 54.97 55.24 2jgl s GLU 519 Cb -1.23 -2.40 -0.03 0.00 0.26 0.00 0.00 34.13 30.73 2jgl s GLU 519 CO 0.56 0.31 0.52 0.08 -0.54 0.00 0.00 175.26 176.19 2jgl s VAL 520 N 0.05 5.10 0.29 3.70 1.01 -1.26 -1.97 120.40 127.32 2jgl s VAL 520 Ca -0.07 0.95 0.10 0.00 0.00 0.00 0.00 61.98 62.96 2jgl s VAL 520 Cb -0.15 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 2jgl s VAL 520 CO 0.05 0.17 -0.07 -0.13 0.00 0.00 0.00 175.10 175.12 2jgl s ARG 521 N 1.66 2.02 -0.06 2.72 0.52 0.11 -4.98 118.95 120.93 2jgl s ARG 521 Ca 0.24 -1.63 0.05 0.00 -0.52 0.00 0.00 55.73 53.87 2jgl s ARG 521 Cb -0.15 -1.96 -0.00 0.00 0.52 0.00 0.00 34.95 33.35 2jgl s ARG 521 CO 0.10 0.29 -0.22 1.03 0.02 0.00 0.00 175.30 176.52 2jgl s ARG 522 N -3.62 2.40 0.01 3.54 0.52 -1.26 -1.29 118.95 119.25 2jgl s ARG 522 Ca 0.32 -0.78 0.00 0.00 -0.52 0.00 0.00 55.73 54.75 2jgl s ARG 522 Cb -0.04 -1.97 0.00 0.00 0.52 0.00 0.00 34.95 33.45 2jgl s ARG 522 CO 0.18 0.27 0.00 0.41 0.02 0.00 0.00 175.30 176.18 2jgl n GLY 523 N 3.21 -3.22 3.53 -3.53 0.00 0.16 -4.90 105.19 100.43 2jgl n GLY 523 Ca -0.18 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 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 -0.04 3.74 -1.18 0.99 2.96 -1.26 -4.21 118.68 119.68 2jgl s LEU 524 Ca 0.00 -1.25 -0.26 0.00 -0.22 0.00 0.00 54.13 52.40 2jgl s LEU 524 Cb 0.00 -2.53 0.04 0.00 0.50 0.00 0.00 46.19 44.20 2jgl s LEU 524 CO 0.00 -1.52 0.50 0.54 -1.32 0.00 0.00 176.35 174.55 2jgl n ARG 525 N 8.54 -0.39 -0.19 1.98 5.12 -1.26 -4.75 116.66 125.71 2jgl n ARG 525 Ca 0.20 0.02 -0.08 0.00 -1.93 0.00 0.00 57.85 56.06 2jgl n ARG 525 Cb 0.50 -2.38 0.02 0.00 -1.16 0.00 0.00 32.46 29.44 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 1.63 0.69 0.20 7.54 0.00 -1.93 0.41 119.26 127.81 2jgl h ALA 526 Ca -0.65 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.10 2jgl h ALA 526 Cb 1.29 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2jgl h ALA 526 CO 0.51 0.29 -0.10 1.96 0.00 0.00 0.00 179.25 181.91 2jgl h GLN 527 N 0.72 -0.26 -0.85 0.00 1.08 -1.96 -2.46 115.11 111.38 2jgl h GLN 527 Ca 0.18 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.43 2jgl h GLN 527 Cb 0.18 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.62 2jgl h GLN 527 CO -0.02 0.08 0.56 1.15 -0.95 0.00 0.00 178.83 179.65 2jgl h THR 528 N -0.65 1.15 0.00 -0.54 2.02 -1.94 -2.69 112.91 110.26 2jgl h THR 528 Ca -0.03 -0.36 -0.11 0.00 0.77 0.00 0.00 66.41 66.67 2jgl h THR 528 Cb 0.47 -0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 2jgl h THR 528 CO 0.05 0.19 -0.54 0.00 0.37 0.00 0.00 175.52 175.59 2jgl h ALA 530 N 1.46 1.70 0.11 0.00 0.00 -1.10 0.24 119.26 121.68 2jgl h ALA 530 Ca -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2jgl h ALA 530 Cb 1.02 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2jgl h ALA 530 CO 0.07 0.23 -0.06 0.35 0.00 0.00 0.00 179.25 179.85 2jgl h PHE 531 N 0.69 -0.14 -0.21 0.00 3.57 -1.24 -0.84 116.94 118.78 2jgl h PHE 531 Ca 0.25 -0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.59 2jgl h PHE 531 Cb 0.11 0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.90 2jgl h PHE 531 CO -0.00 0.02 -0.46 -1.49 -2.23 0.00 0.00 178.31 174.15 2jgl h TRP 532 N -0.28 0.87 0.00 0.41 4.06 -1.15 0.48 115.95 120.34 2jgl h TRP 532 Ca -0.02 -0.32 -0.29 0.00 2.06 0.00 0.00 58.89 60.32 2jgl h TRP 532 Cb 0.23 -0.16 -0.05 0.00 -1.00 0.00 0.00 29.16 28.18 2jgl h TRP 532 CO -0.03 1.10 -1.68 -0.91 -3.56 0.00 0.00 178.44 173.37 2jgl h ASN 533 N 0.38 0.00 0.00 -3.49 2.35 -0.63 -3.37 115.58 110.82 2jgl h ASN 533 Ca 0.00 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.46 2jgl h ASN 533 Cb 1.07 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.40 2jgl h ASN 533 CO 0.10 0.99 -2.01 0.54 -1.65 0.00 0.00 177.43 175.41 2jgl n ARG 534 N -3.05 0.40 -0.06 0.81 1.74 -0.41 -4.72 116.66 111.37 2jgl n ARG 534 Ca -0.16 0.14 -0.09 0.00 -0.77 0.00 0.00 57.85 56.97 2jgl n ARG 534 Cb 1.04 -1.23 -0.09 0.00 -1.02 0.00 0.00 32.46 31.17 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 -0.39 0.00 -0.98 -1.55 3.57 -1.07 -3.38 116.94 113.15 2jgl h PHE 535 Ca -0.43 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.16 2jgl h PHE 535 Cb 1.48 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 40.15 2jgl h PHE 535 CO -0.03 0.67 0.62 1.25 -2.23 0.00 0.00 178.31 178.59 2jgl h LEU 536 N -1.00 0.95 -0.84 0.59 7.12 -1.06 -0.54 115.31 120.53 2jgl h LEU 536 Ca -0.00 0.03 0.08 0.00 0.13 0.00 0.00 57.88 58.11 2jgl h LEU 536 Cb 0.67 -0.17 -0.07 0.00 -0.53 0.00 0.00 40.66 40.57 2jgl h LEU 536 CO -0.00 0.56 0.50 -0.65 -0.13 0.00 0.00 178.44 178.72 2jgl h PRO 537 N 1.06 0.85 0.00 5.25 0.11 -1.75 -2.31 132.00 135.21 2jgl h PRO 537 Ca 0.45 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.46 2jgl h PRO 537 Cb 0.31 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 2jgl h PRO 537 CO -0.22 0.57 -0.22 0.87 -0.21 0.00 0.00 178.00 178.79 2jgl h LYS 538 N 0.88 0.00 -2.36 1.05 1.57 -1.27 -2.61 116.57 113.83 2jgl h LYS 538 Ca 0.38 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.80 2jgl h LYS 538 Cb 0.26 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 2jgl h LYS 538 CO -0.21 0.22 1.15 -0.11 -0.57 0.00 0.00 179.45 179.93 2jgl n LEU 539 N -3.68 6.52 0.00 2.94 7.94 -0.87 -2.89 117.00 126.97 2jgl n LEU 539 Ca -0.01 -3.61 0.00 0.00 -1.11 0.00 0.00 56.01 51.27 2jgl n LEU 539 Cb 0.34 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 42.82 2jgl n LEU 539 CO 0.33 1.84 0.00 -0.11 -1.11 0.00 0.00 177.39 178.34 2jgl n LEU 540 N 2.88 0.00 -1.78 -1.96 7.94 -1.00 -4.82 117.00 118.26 2jgl n LEU 540 Ca 0.56 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 55.45 2jgl n LEU 540 Cb 0.67 0.09 -0.01 0.00 0.53 0.00 0.00 43.42 44.70 2jgl n LEU 540 CO 0.39 -0.09 0.59 -1.20 -1.11 0.00 0.00 177.39 175.97 2jgl n SER 541 N -1.48 2.87 0.00 1.96 7.64 -1.13 -5.16 113.62 118.32 2jgl n SER 541 Ca 0.00 -1.79 0.00 0.00 1.01 0.00 0.00 58.87 58.09 2jgl n SER 541 Cb 0.00 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 62.58 2jgl n SER 541 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03