#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jgm s ASP 5 N 0.00 6.39 0.16 4.31 3.68 -1.26 -4.89 116.67 125.06 2jgm s ASP 5 Ca 0.00 0.98 0.21 0.00 2.13 0.00 0.00 52.55 55.87 2jgm s ASP 5 Cb 0.00 -2.54 0.86 0.00 -1.45 0.00 0.00 42.92 39.80 2jgm s ASP 5 CO 0.00 -1.36 1.64 -0.81 0.13 0.00 0.00 175.17 174.77 2jgm n PRO 6 N 7.91 0.13 0.21 4.34 -0.04 -1.26 -1.13 135.00 145.16 2jgm n PRO 6 Ca 0.17 0.34 0.09 0.00 -0.04 0.00 0.00 63.50 64.06 2jgm n PRO 6 Cb 0.47 -1.74 0.40 0.00 -0.04 0.00 0.00 33.50 32.60 2jgm n PRO 6 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2jgm h GLN 7 N 0.00 0.00 -0.95 0.54 1.08 -2.03 -3.10 115.11 110.65 2jgm h GLN 7 Ca 0.00 0.00 -0.49 0.00 -1.45 0.00 0.00 58.65 56.71 2jgm h GLN 7 Cb 0.35 0.00 -0.29 0.00 -0.05 0.00 0.00 27.48 27.49 2jgm h GLN 7 CO 0.00 0.26 0.60 1.28 -0.95 0.00 0.00 178.83 180.02 2jgm n LEU 8 N -3.38 6.59 -3.79 1.46 4.77 -0.28 -4.87 117.00 117.49 2jgm n LEU 8 Ca 0.00 -3.60 -0.21 0.00 -0.03 0.00 0.00 56.01 52.17 2jgm n LEU 8 Cb 0.47 -0.83 -0.17 0.00 -2.33 0.00 0.00 43.42 40.56 2jgm n LEU 8 CO 0.34 1.05 -0.38 -0.22 -1.33 0.00 0.00 177.39 176.85 2jgm s LEU 9 N -3.28 0.78 -0.00 2.23 2.96 -1.17 -0.55 118.68 119.64 2jgm s LEU 9 Ca 0.56 -0.07 0.01 0.00 -0.22 0.00 0.00 54.13 54.41 2jgm s LEU 9 Cb 0.47 -0.39 -0.00 0.00 0.50 0.00 0.00 46.19 46.77 2jgm s LEU 9 CO 0.11 -0.16 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.26 2jgm s VAL 10 N 1.65 0.22 -0.48 1.68 1.01 -0.60 -4.98 120.40 118.91 2jgm s VAL 10 Ca -0.00 -0.15 -0.16 0.00 0.00 0.00 0.00 61.98 61.68 2jgm s VAL 10 Cb -0.13 -0.20 0.08 0.00 0.00 0.00 0.00 36.38 36.14 2jgm s VAL 10 CO -0.04 0.04 0.42 -0.60 0.00 0.00 0.00 175.10 174.93 2jgm s ARG 11 N -0.11 2.99 0.55 2.72 3.52 -1.26 -0.36 118.95 126.99 2jgm s ARG 11 Ca 0.01 -1.37 0.01 0.00 -0.13 0.00 0.00 55.73 54.24 2jgm s ARG 11 Cb -0.01 -4.15 0.03 0.00 -1.56 0.00 0.00 34.95 29.26 2jgm s ARG 11 CO -0.00 -1.07 0.78 0.14 -0.81 0.00 0.00 175.30 174.33 2jgm s VAL 12 N 1.69 2.80 0.48 7.11 -7.23 0.14 -4.94 120.40 120.46 2jgm s VAL 12 Ca 0.04 -0.62 0.21 0.00 -1.81 0.00 0.00 61.98 59.81 2jgm s VAL 12 Cb -0.25 -3.06 0.38 0.00 0.56 0.00 0.00 36.38 34.02 2jgm s VAL 12 CO 0.06 -0.04 1.95 0.03 -0.31 0.00 0.00 175.10 176.80 2jgm h ARG 13 N 0.07 0.18 0.00 4.82 3.08 -1.95 0.22 114.38 120.80 2jgm h ARG 13 Ca -0.43 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.61 2jgm h ARG 13 Cb 1.29 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2jgm h ARG 13 CO 0.53 0.12 -0.11 0.78 -1.07 0.00 0.00 179.97 180.23 2jgm h GLY 14 N 0.19 0.00 0.00 0.04 0.00 -1.94 -3.48 103.07 97.89 2jgm h GLY 14 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 2jgm h GLY 14 CO -0.06 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.09 2jgm n GLY 15 N 1.29 0.76 3.86 4.60 0.00 0.77 -0.52 105.19 115.93 2jgm n GLY 15 Ca 0.05 -1.76 -0.36 0.00 0.00 0.00 0.00 46.02 43.95 2jgm n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jgm s GLN 16 N -2.00 3.81 0.03 1.61 -0.21 -1.25 0.27 119.66 121.92 2jgm s GLN 16 Ca 0.00 0.25 0.05 0.00 0.02 0.00 0.00 55.36 55.68 2jgm s GLN 16 Cb 0.00 -3.04 -0.02 0.00 1.00 0.00 0.00 33.01 30.95 2jgm s GLN 16 CO 0.00 0.59 -0.15 -0.51 -2.12 0.00 0.00 175.29 173.10 2jgm s LEU 17 N -1.71 2.14 -0.19 2.90 1.43 0.51 -1.60 118.68 122.17 2jgm s LEU 17 Ca 0.31 -0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 52.99 2jgm s LEU 17 Cb -0.15 -0.67 0.01 0.00 0.03 0.00 0.00 46.19 45.41 2jgm s LEU 17 CO 0.17 0.08 -0.14 -0.60 0.23 0.00 0.00 176.35 176.09 2jgm s ARG 18 N -0.95 3.16 0.53 1.70 3.52 -0.84 -1.55 118.95 124.52 2jgm s ARG 18 Ca 0.03 -0.75 -0.05 0.00 -0.13 0.00 0.00 55.73 54.83 2jgm s ARG 18 Cb -0.07 -2.72 0.11 0.00 -1.56 0.00 0.00 34.95 30.71 2jgm s ARG 18 CO 0.01 -0.15 0.72 0.41 -0.81 0.00 0.00 175.30 175.48 2jgm n GLY 19 N 4.55 -0.32 3.35 8.12 0.00 0.29 -1.05 105.19 120.12 2jgm n GLY 19 Ca -0.20 -1.85 -0.27 0.00 0.00 0.00 0.00 46.02 43.70 2jgm n GLY 19 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jgm s ILE 20 N -2.32 2.04 -0.19 -0.61 2.07 -0.87 -4.81 121.20 116.51 2jgm s ILE 20 Ca 0.44 -1.66 -0.18 0.00 -1.41 0.00 0.00 60.65 57.84 2jgm s ILE 20 Cb -0.02 -1.82 -0.03 0.00 0.13 0.00 0.00 42.46 40.72 2jgm s ILE 20 CO 0.30 0.04 0.49 -0.60 -1.91 0.00 0.00 174.94 173.26 2jgm s ARG 21 N -1.97 4.20 0.11 3.50 3.52 -1.26 -2.02 118.95 125.02 2jgm s ARG 21 Ca 0.11 0.37 0.06 0.00 -0.13 0.00 0.00 55.73 56.14 2jgm s ARG 21 Cb -0.10 -3.55 -0.04 0.00 -1.56 0.00 0.00 34.95 29.70 2jgm s ARG 21 CO 0.05 -0.10 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.91 2jgm s LEU 22 N 1.49 3.36 -0.33 -0.88 1.43 0.15 -4.95 118.68 118.95 2jgm s LEU 22 Ca 0.23 -0.26 -0.18 0.00 -1.03 0.00 0.00 54.13 52.90 2jgm s LEU 22 Cb -0.15 -2.09 -0.01 0.00 0.03 0.00 0.00 46.19 43.97 2jgm s LEU 22 CO 0.09 0.16 0.49 -0.75 0.23 0.00 0.00 176.35 176.57 2jgm s LYS 23 N -2.42 3.71 0.01 1.70 2.20 -1.26 -0.70 119.74 122.97 2jgm s LYS 23 Ca 0.25 -0.10 0.03 0.00 -0.36 0.00 0.00 55.97 55.79 2jgm s LYS 23 Cb -0.11 -3.78 -0.03 0.00 -1.51 0.00 0.00 37.83 32.40 2jgm s LYS 23 CO 0.18 -0.57 -0.05 0.00 -0.36 0.00 0.00 175.35 174.55 2jgm s ALA 24 N 2.33 3.10 0.05 3.13 0.00 -0.07 -4.96 121.76 125.34 2jgm s ALA 24 Ca 0.18 -1.02 -0.05 0.00 0.00 0.00 0.00 51.96 51.07 2jgm s ALA 24 Cb -0.16 -1.18 0.02 0.00 0.00 0.00 0.00 23.12 21.81 2jgm s ALA 24 CO 0.12 0.63 0.36 -2.30 0.00 0.00 0.00 175.76 174.57 2jgm n PRO 25 N 1.42 -0.08 -0.86 0.00 -0.02 -1.26 0.19 135.00 134.39 2jgm n PRO 25 Ca -0.15 0.35 0.03 0.00 -2.02 0.00 0.00 63.50 61.72 2jgm n PRO 25 Cb 0.53 -0.52 0.35 0.00 -0.02 0.00 0.00 33.50 33.84 2jgm n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgm n GLY 26 N -1.09 3.40 0.00 -1.23 0.00 -1.26 -5.04 105.19 99.97 2jgm n GLY 26 Ca 0.01 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.06 2jgm n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jgm n GLY 27 N 0.18 -0.05 3.85 -0.02 0.00 0.13 -5.06 105.19 104.22 2jgm n GLY 27 Ca 0.31 -1.71 -0.34 0.00 0.00 0.00 0.00 46.02 44.27 2jgm n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jgm s PRO 28 N -1.66 3.91 0.02 1.61 0.04 -1.26 -0.89 135.00 136.77 2jgm s PRO 28 Ca 0.00 0.40 0.07 0.00 0.04 0.00 0.00 61.00 61.52 2jgm s PRO 28 Cb 0.00 -2.85 -0.02 0.00 0.04 0.00 0.00 34.50 31.66 2jgm s PRO 28 CO 0.00 0.44 -0.21 0.14 0.04 0.00 0.00 177.00 177.40 2jgm s VAL 29 N -1.56 1.70 0.42 -0.36 -7.23 0.12 -2.62 120.40 110.87 2jgm s VAL 29 Ca 0.40 -1.11 -0.19 0.00 -1.81 0.00 0.00 61.98 59.27 2jgm s VAL 29 Cb -0.14 -1.45 -0.10 0.00 0.56 0.00 0.00 36.38 35.25 2jgm s VAL 29 CO 0.20 0.31 0.90 -0.44 -0.31 0.00 0.00 175.10 175.75 2jgm s SER 30 N -0.95 6.84 -0.14 4.85 0.01 0.35 0.31 113.70 124.98 2jgm s SER 30 Ca 0.08 1.56 -0.08 0.00 1.31 0.00 0.00 55.95 58.82 2jgm s SER 30 Cb -0.09 -2.49 0.05 0.00 0.21 0.00 0.00 66.02 63.71 2jgm s SER 30 CO 0.01 -0.36 0.33 0.00 0.41 0.00 0.00 173.24 173.63 2jgm s ALA 31 N -2.21 -0.82 -0.67 1.44 0.00 -0.86 -1.98 121.76 116.66 2jgm s ALA 31 Ca 0.59 1.27 0.05 0.00 0.00 0.00 0.00 51.96 53.87 2jgm s ALA 31 Cb -0.09 -0.78 0.18 0.00 0.00 0.00 0.00 23.12 22.43 2jgm s ALA 31 CO 0.17 -0.23 0.52 1.19 0.00 0.00 0.00 175.76 177.42 2jgm n PHE 32 N 4.17 2.93 -2.98 0.00 3.01 0.17 -2.05 117.46 122.71 2jgm n PHE 32 Ca -0.24 -4.20 -0.38 0.00 1.01 0.00 0.00 57.45 53.64 2jgm n PHE 32 Cb 0.54 -0.54 -0.06 0.00 -0.01 0.00 0.00 39.48 39.41 2jgm n PHE 32 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2jgm s LEU 33 N -1.51 4.52 -0.41 4.37 1.43 -0.91 -2.43 118.68 123.74 2jgm s LEU 33 Ca 0.28 1.63 -0.02 0.00 -1.03 0.00 0.00 54.13 54.99 2jgm s LEU 33 Cb -0.00 -3.44 0.00 0.00 0.03 0.00 0.00 46.19 42.78 2jgm s LEU 33 CO -0.15 0.14 0.24 0.61 0.23 0.00 0.00 176.35 177.42 2jgm n GLY 34 N 1.29 0.42 3.69 -3.19 0.00 -1.01 -3.62 105.19 102.78 2jgm n GLY 34 Ca -0.04 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 2jgm n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jgm s ILE 35 N -2.87 4.70 -0.04 -0.61 1.01 -0.21 -4.80 121.20 118.38 2jgm s ILE 35 Ca 0.12 1.96 -0.30 0.00 0.00 0.00 0.00 60.65 62.43 2jgm s ILE 35 Cb -0.05 -4.26 -0.05 0.00 0.01 0.00 0.00 42.46 38.11 2jgm s ILE 35 CO 0.15 0.04 1.41 -2.16 0.00 0.00 0.00 174.94 174.38 2jgm s PRO 36 N 1.83 4.26 0.00 2.79 0.04 -1.26 -0.28 135.00 142.38 2jgm s PRO 36 Ca 0.50 1.94 0.13 0.00 0.04 0.00 0.00 61.00 63.62 2jgm s PRO 36 Cb -0.20 -3.67 -0.14 0.00 0.04 0.00 0.00 34.50 30.53 2jgm s PRO 36 CO 0.21 -0.64 0.58 1.97 0.04 0.00 0.00 177.00 179.16 2jgm n PHE 37 N 5.87 0.00 -3.82 0.56 1.16 -0.73 -4.83 117.46 115.66 2jgm n PHE 37 Ca 0.14 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.62 2jgm n PHE 37 Cb 0.44 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.24 2jgm n PHE 37 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2jgm s ALA 38 N -2.23 -0.36 0.35 1.98 0.00 -1.24 -3.22 121.76 117.03 2jgm s ALA 38 Ca 0.05 -0.43 -0.29 0.00 0.00 0.00 0.00 51.96 51.30 2jgm s ALA 38 Cb 0.10 0.45 -0.11 0.00 0.00 0.00 0.00 23.12 23.56 2jgm s ALA 38 CO 0.54 -0.48 1.47 -1.21 0.00 0.00 0.00 175.76 176.08 2jgm s GLU 39 N -3.46 4.16 0.13 0.00 0.41 -0.58 -4.57 118.70 114.80 2jgm s GLU 39 Ca 0.02 2.50 -0.33 0.00 -0.41 0.00 0.00 54.97 56.74 2jgm s GLU 39 Cb 0.03 -3.00 -0.13 0.00 -1.78 0.00 0.00 34.13 29.25 2jgm s GLU 39 CO -0.09 -0.49 1.67 -2.30 -0.49 0.00 0.00 175.26 173.57 2jgm n PRO 40 N 0.90 2.32 -0.97 0.39 -0.02 -1.26 -4.71 135.00 131.66 2jgm n PRO 40 Ca 0.02 0.84 -0.18 0.00 -2.02 0.00 0.00 63.50 62.17 2jgm n PRO 40 Cb 0.39 -2.65 -0.12 0.00 -0.02 0.00 0.00 33.50 31.11 2jgm n PRO 40 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2jgm n PRO 41 N 4.18 2.22 -4.19 0.52 -0.04 -1.26 -4.89 135.00 131.54 2jgm n PRO 41 Ca 0.18 -1.21 -0.22 0.00 -0.04 0.00 0.00 63.50 62.20 2jgm n PRO 41 Cb 0.31 -2.17 -0.06 0.00 -0.04 0.00 0.00 33.50 31.54 2jgm n PRO 41 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2jgm s VAL 42 N 1.58 3.76 0.00 0.52 -7.23 -1.26 -3.26 120.40 114.51 2jgm s VAL 42 Ca 0.60 -1.68 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 2jgm s VAL 42 Cb 0.25 -3.07 0.00 0.00 0.56 0.00 0.00 36.38 34.11 2jgm s VAL 42 CO -0.02 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.05 2jgm n GLY 43 N -1.05 2.07 0.00 2.32 0.00 -1.26 -1.89 105.19 105.39 2jgm n GLY 43 Ca -0.06 0.08 0.15 0.00 0.00 0.00 0.00 46.02 46.19 2jgm n GLY 43 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jgm n SER 44 N 10.58 0.00 -0.54 1.61 3.41 -1.26 -3.15 113.62 124.28 2jgm n SER 44 Ca 0.00 -1.03 0.09 0.00 -0.26 0.00 0.00 58.87 57.67 2jgm n SER 44 Cb 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 2jgm n SER 44 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2jgm n ARG 45 N -0.97 1.58 -1.81 4.33 5.12 -0.79 -4.87 116.66 119.24 2jgm n ARG 45 Ca 0.22 -1.17 -0.41 0.00 -1.93 0.00 0.00 57.85 54.56 2jgm n ARG 45 Cb 0.10 -1.33 -0.02 0.00 -1.16 0.00 0.00 32.46 30.06 2jgm n ARG 45 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 2jgm s ARG 46 N -1.81 4.14 0.00 5.56 3.52 -1.19 -2.06 118.95 127.11 2jgm s ARG 46 Ca 0.17 2.54 0.00 0.00 -0.13 0.00 0.00 55.73 58.31 2jgm s ARG 46 Cb 0.15 -3.03 0.00 0.00 -1.56 0.00 0.00 34.95 30.51 2jgm s ARG 46 CO 0.35 -0.59 0.00 1.19 -0.81 0.00 0.00 175.30 175.44 2jgm n PHE 47 N 2.02 0.00 -3.95 5.12 3.72 -1.26 -4.97 117.46 118.15 2jgm n PHE 47 Ca 0.07 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.19 2jgm n PHE 47 Cb 0.38 -0.26 -0.04 0.00 -0.94 0.00 0.00 39.48 38.62 2jgm n PHE 47 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 2jgm s MET 48 N -0.15 3.39 0.32 -1.08 -1.94 -0.87 -4.26 119.30 114.70 2jgm s MET 48 Ca 0.00 -0.56 -0.26 0.00 -1.71 0.00 0.00 55.69 53.16 2jgm s MET 48 Cb 0.00 -2.96 -0.14 0.00 2.01 0.00 0.00 34.83 33.73 2jgm s MET 48 CO 0.00 0.55 0.71 -2.30 -0.01 0.00 0.00 175.02 173.97 2jgm n PRO 49 N -0.20 0.72 -2.32 2.03 -0.02 -1.26 -4.93 135.00 129.03 2jgm n PRO 49 Ca -0.06 0.26 -0.39 0.00 -2.02 0.00 0.00 63.50 61.28 2jgm n PRO 49 Cb 0.53 -1.51 -0.03 0.00 -0.02 0.00 0.00 33.50 32.47 2jgm n PRO 49 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2jgm s PRO 50 N -1.43 4.27 0.05 0.52 0.04 -1.26 -5.07 135.00 132.13 2jgm s PRO 50 Ca 0.62 1.89 0.02 0.00 0.04 0.00 0.00 61.00 63.57 2jgm s PRO 50 Cb -0.72 -2.88 -0.04 0.00 0.04 0.00 0.00 34.50 30.90 2jgm s PRO 50 CO 0.58 -0.14 0.07 -1.21 0.04 0.00 0.00 177.00 176.34 2jgm s GLU 51 N -1.98 2.93 0.34 4.56 2.02 -1.26 -5.01 118.70 120.29 2jgm s GLU 51 Ca 0.52 -0.63 -0.28 0.00 0.02 0.00 0.00 54.97 54.60 2jgm s GLU 51 Cb -0.32 -2.76 -0.12 0.00 0.10 0.00 0.00 34.13 31.02 2jgm s GLU 51 CO 0.42 0.59 1.29 -2.30 0.02 0.00 0.00 175.26 175.28 2jgm n PRO 52 N 0.74 2.11 -2.12 0.39 -0.02 -1.26 -1.52 135.00 133.31 2jgm n PRO 52 Ca -0.10 0.74 -0.41 0.00 -2.02 0.00 0.00 63.50 61.71 2jgm n PRO 52 Cb 0.52 -2.32 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2jgm n PRO 52 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2jgm s LYS 53 N -1.80 4.36 0.46 -0.52 2.47 -1.20 -4.19 119.74 119.33 2jgm s LYS 53 Ca 0.56 2.20 -0.22 0.00 -1.56 0.00 0.00 55.97 56.96 2jgm s LYS 53 Cb -0.57 -3.09 -0.08 0.00 -1.46 0.00 0.00 37.83 32.63 2jgm s LYS 53 CO 0.62 -0.20 1.07 1.03 0.16 0.00 0.00 175.35 178.02 2jgm s ARG 54 N -1.51 3.85 0.78 4.03 0.52 -1.26 -4.91 118.95 120.45 2jgm s ARG 54 Ca 0.50 1.50 -0.15 0.00 -0.52 0.00 0.00 55.73 57.06 2jgm s ARG 54 Cb -0.39 -2.26 0.00 0.00 0.52 0.00 0.00 34.95 32.82 2jgm s ARG 54 CO 0.51 -0.42 0.68 -2.30 0.02 0.00 0.00 175.30 173.79 2jgm n PRO 55 N -0.67 0.20 -4.57 3.54 -0.02 -1.26 -4.99 135.00 127.22 2jgm n PRO 55 Ca 0.08 0.12 -0.22 0.00 -2.02 0.00 0.00 63.50 61.46 2jgm n PRO 55 Cb 0.51 -2.00 -0.15 0.00 -0.02 0.00 0.00 33.50 31.84 2jgm n PRO 55 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 2jgm s TRP 56 N -2.03 1.20 0.56 6.00 -2.14 0.32 -5.04 118.94 117.82 2jgm s TRP 56 Ca 0.66 -0.28 -0.20 0.00 2.66 0.00 0.00 56.10 58.94 2jgm s TRP 56 Cb -0.31 -0.81 -0.04 0.00 -3.10 0.00 0.00 33.47 29.21 2jgm s TRP 56 CO 0.58 -0.08 1.25 -1.54 -2.66 0.00 0.00 176.95 174.50 2jgm s SER 57 N -0.06 5.33 0.03 -2.66 1.04 -1.26 -4.62 113.70 111.50 2jgm s SER 57 Ca 0.00 2.49 0.00 0.00 0.48 0.00 0.00 55.95 58.93 2jgm s SER 57 Cb -0.08 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.43 2jgm s SER 57 CO 0.00 -1.51 0.00 0.61 0.98 0.00 0.00 173.24 173.33 2jgm n GLY 58 N 0.59 -1.04 3.19 7.32 0.00 -1.26 -4.66 105.19 109.33 2jgm n GLY 58 Ca 0.12 -1.22 -0.36 0.00 0.00 0.00 0.00 46.02 44.55 2jgm n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jgm s VAL 59 N 0.00 3.29 0.18 1.61 1.01 -1.26 -3.77 120.40 121.45 2jgm s VAL 59 Ca 0.00 -1.50 -0.30 0.00 0.00 0.00 0.00 61.98 60.18 2jgm s VAL 59 Cb 0.00 -2.98 -0.08 0.00 0.00 0.00 0.00 36.38 33.31 2jgm s VAL 59 CO 0.00 -0.29 1.33 -0.22 0.00 0.00 0.00 175.10 175.92 2jgm s LEU 60 N 1.27 4.40 -0.55 3.92 2.96 -0.62 -4.85 118.68 125.20 2jgm s LEU 60 Ca -0.01 2.38 -0.27 0.00 -0.22 0.00 0.00 54.13 56.01 2jgm s LEU 60 Cb -0.21 -3.60 0.03 0.00 0.50 0.00 0.00 46.19 42.91 2jgm s LEU 60 CO -0.01 -0.56 1.12 -0.62 -1.32 0.00 0.00 176.35 174.96 2jgm s ASP 61 N 0.55 6.45 -0.71 3.68 -1.08 -1.26 -1.98 116.67 122.31 2jgm s ASP 61 Ca 0.59 0.06 0.03 0.00 -0.52 0.00 0.00 52.55 52.71 2jgm s ASP 61 Cb -0.36 -2.52 0.33 0.00 -1.46 0.00 0.00 42.92 38.90 2jgm s ASP 61 CO 0.36 -1.37 1.16 0.00 0.52 0.00 0.00 175.17 175.83 2jgm n ALA 62 N 8.09 4.98 -0.20 3.66 0.00 -0.21 -4.66 120.51 132.16 2jgm n ALA 62 Ca 0.07 -4.70 0.00 0.00 0.00 0.00 0.00 53.44 48.82 2jgm n ALA 62 Cb 0.49 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2jgm n ALA 62 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2jgm n THR 63 N -0.05 0.23 -3.78 0.00 -2.24 -1.24 -2.13 114.28 105.08 2jgm n THR 63 Ca 0.35 -0.51 -0.12 0.00 -2.27 0.00 0.00 64.05 61.49 2jgm n THR 63 Cb 0.36 1.03 -0.08 0.00 -2.10 0.00 0.00 70.33 69.54 2jgm n THR 63 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2jgm s THR 64 N -0.23 0.08 0.17 4.28 -1.32 -1.25 -4.81 115.64 112.55 2jgm s THR 64 Ca 0.00 -0.65 -0.30 0.00 -1.21 0.00 0.00 61.69 59.53 2jgm s THR 64 Cb 0.00 -0.80 -0.08 0.00 -1.51 0.00 0.00 72.50 70.11 2jgm s THR 64 CO 0.00 -0.36 1.30 -0.36 -2.21 0.00 0.00 174.62 172.99 2jgm s PHE 65 N -2.09 3.29 0.56 9.09 0.08 -1.26 -3.26 117.98 124.39 2jgm s PHE 65 Ca -0.08 1.20 -0.09 0.00 0.12 0.00 0.00 56.93 58.07 2jgm s PHE 65 Cb -0.03 -3.58 0.13 0.00 -0.57 0.00 0.00 43.02 38.97 2jgm s PHE 65 CO -0.01 -1.84 0.64 1.04 -0.10 0.00 0.00 175.22 174.95 2jgm n GLN 66 N 2.96 -1.26 -1.58 0.44 1.13 -1.26 -4.92 117.38 112.88 2jgm n GLN 66 Ca 0.07 -1.00 -0.35 0.00 -1.94 0.00 0.00 57.00 53.79 2jgm n GLN 66 Cb 0.43 -0.76 0.08 0.00 0.11 0.00 0.00 30.24 30.10 2jgm n GLN 66 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2jgm s ASN 67 N -3.32 4.45 0.03 1.08 0.01 -1.26 -4.81 114.94 111.12 2jgm s ASN 67 Ca 0.38 2.39 -0.22 0.00 -0.71 0.00 0.00 52.86 54.70 2jgm s ASN 67 Cb -0.02 -2.59 -0.06 0.00 0.41 0.00 0.00 41.25 38.99 2jgm s ASN 67 CO 0.28 -2.09 0.64 -0.69 -1.51 0.00 0.00 177.10 173.73 2jgm s VAL 68 N -1.85 4.80 0.58 1.60 1.01 -0.18 -4.68 120.40 121.69 2jgm s VAL 68 Ca 0.76 1.36 -0.20 0.00 0.00 0.00 0.00 61.98 63.90 2jgm s VAL 68 Cb -0.30 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 2jgm s VAL 68 CO 0.42 0.43 1.12 0.00 0.00 0.00 0.00 175.10 177.07 2jgm s TYR 70 N -1.42 2.01 0.01 0.00 5.04 -1.22 -4.68 117.35 117.08 2jgm s TYR 70 Ca 0.75 0.08 -0.15 0.00 -2.44 0.00 0.00 57.07 55.31 2jgm s TYR 70 Cb -0.42 -4.03 0.02 0.00 0.35 0.00 0.00 41.96 37.88 2jgm s TYR 70 CO 0.47 -4.33 0.31 1.14 -1.34 0.00 0.00 175.55 171.81 2jgm s GLN 71 N 3.47 0.73 0.28 4.97 -2.07 -1.26 -4.68 119.66 121.10 2jgm s GLN 71 Ca 0.78 -0.30 -0.29 0.00 -1.82 0.00 0.00 55.36 53.73 2jgm s GLN 71 Cb -0.39 0.32 -0.14 0.00 -1.09 0.00 0.00 33.01 31.71 2jgm s GLN 71 CO 0.34 -0.21 1.18 0.98 -1.32 0.00 0.00 175.29 176.25 2jgm n TYR 72 N 1.01 1.73 -4.35 9.60 4.19 -1.26 -5.00 117.16 123.09 2jgm n TYR 72 Ca -0.20 0.61 -0.34 0.00 3.31 0.00 0.00 57.90 61.27 2jgm n TYR 72 Cb 0.57 -2.34 -0.11 0.00 0.49 0.00 0.00 39.34 37.96 2jgm n TYR 72 CO 0.00 0.00 0.00 0.08 0.91 0.00 0.00 176.86 177.85 2jgm s VAL 73 N -0.80 4.16 0.08 2.97 1.01 -1.26 -4.90 120.40 121.67 2jgm s VAL 73 Ca 0.61 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 62.01 2jgm s VAL 73 Cb -0.67 -2.80 -0.06 0.00 0.00 0.00 0.00 36.38 32.85 2jgm s VAL 73 CO 0.58 0.53 1.18 -0.62 0.00 0.00 0.00 175.10 176.77 2jgm s ASP 74 N -0.15 7.11 -0.02 3.32 -1.08 -1.26 -4.93 116.67 119.67 2jgm s ASP 74 Ca 0.04 2.02 0.02 0.00 -0.52 0.00 0.00 52.55 54.11 2jgm s ASP 74 Cb -0.13 -2.58 0.04 0.00 -1.46 0.00 0.00 42.92 38.79 2jgm s ASP 74 CO 0.02 -0.43 0.82 0.35 0.52 0.00 0.00 175.17 176.45 2jgm n THR 75 N 3.67 0.49 -0.23 1.71 -2.24 -1.26 -4.82 114.28 111.60 2jgm n THR 75 Ca 0.08 -0.54 -0.08 0.00 -2.27 0.00 0.00 64.05 61.25 2jgm n THR 75 Cb 0.46 0.61 0.03 0.00 -2.10 0.00 0.00 70.33 69.34 2jgm n THR 75 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2jgm h LEU 76 N 0.00 0.92 -6.12 3.22 5.85 -2.02 -3.34 115.31 113.82 2jgm h LEU 76 Ca 0.00 -0.21 -0.58 0.00 0.84 0.00 0.00 57.88 57.93 2jgm h LEU 76 Cb 0.97 -0.24 -0.41 0.00 0.37 0.00 0.00 40.66 41.35 2jgm h LEU 76 CO 0.00 0.88 -0.82 -1.22 -0.34 0.00 0.00 178.44 176.94 2jgm n TYR 77 N -4.37 1.86 -1.68 1.25 4.01 -1.26 -5.11 117.16 111.86 2jgm n TYR 77 Ca 0.04 -3.89 -0.45 0.00 -0.16 0.00 0.00 57.90 53.44 2jgm n TYR 77 Cb 0.21 -0.46 -0.04 0.00 -0.31 0.00 0.00 39.34 38.74 2jgm n TYR 77 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2jgm n PRO 78 N 1.12 2.29 -0.73 -0.72 -0.02 -1.26 -1.54 135.00 134.15 2jgm n PRO 78 Ca 0.26 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.57 2jgm n PRO 78 Cb 0.46 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 2jgm n PRO 78 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgm n GLY 79 N 3.44 1.33 3.68 -1.23 0.00 -1.26 -5.00 105.19 106.14 2jgm n GLY 79 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2jgm n GLY 79 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jgm s PHE 80 N -3.49 3.28 0.19 1.61 5.36 -0.59 -4.95 117.98 119.40 2jgm s PHE 80 Ca 0.00 1.36 -0.12 0.00 -0.96 0.00 0.00 56.93 57.21 2jgm s PHE 80 Cb 0.00 -3.33 0.18 0.00 -0.34 0.00 0.00 43.02 39.54 2jgm s PHE 80 CO 0.00 -0.84 1.77 1.49 -1.46 0.00 0.00 175.22 176.18 2jgm h GLU 81 N 7.43 0.46 -0.95 10.12 4.57 -1.94 0.01 114.58 134.28 2jgm h GLU 81 Ca -0.29 -0.03 0.29 0.00 -1.18 0.00 0.00 59.36 58.15 2jgm h GLU 81 Cb 1.13 -0.10 -0.16 0.00 -0.16 0.00 0.00 28.75 29.46 2jgm h GLU 81 CO 0.90 0.31 0.33 0.78 -1.18 0.00 0.00 179.01 180.15 2jgm h GLY 82 N 0.48 1.67 0.51 1.92 0.00 -1.92 -2.62 103.07 103.11 2jgm h GLY 82 Ca 0.25 -0.07 -0.35 0.00 0.00 0.00 0.00 47.33 47.16 2jgm h GLY 82 CO -0.20 -0.50 -2.07 -1.30 0.00 0.00 0.00 176.54 172.47 2jgm n THR 83 N -5.24 1.62 0.04 4.70 -2.24 -0.72 -4.46 114.28 107.98 2jgm n THR 83 Ca 0.27 -0.71 -0.01 0.00 -2.27 0.00 0.00 64.05 61.33 2jgm n THR 83 Cb 0.88 -1.28 0.28 0.00 -2.10 0.00 0.00 70.33 68.11 2jgm n THR 83 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2jgm h GLU 84 N 0.03 0.41 0.00 -0.78 4.39 -0.68 -2.66 114.58 115.28 2jgm h GLU 84 Ca -0.43 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.14 2jgm h GLU 84 Cb 2.04 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 30.65 2jgm h GLU 84 CO 0.04 0.57 -0.00 0.00 -1.16 0.00 0.00 179.01 178.46 2jgm h MET 85 N 0.38 0.00 0.00 2.33 -0.00 -1.70 0.22 114.93 116.16 2jgm h MET 85 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.77 2jgm h MET 85 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.12 2jgm h MET 85 CO 0.03 0.00 -0.96 0.91 -0.00 0.00 0.00 176.91 176.89 2jgm n TRP 86 N -3.14 0.58 -2.12 -0.10 7.02 -1.01 -4.65 117.44 114.03 2jgm n TRP 86 Ca -0.03 0.17 -0.32 0.00 -1.02 0.00 0.00 57.50 56.30 2jgm n TRP 86 Cb 0.07 -0.69 -0.00 0.00 -2.42 0.00 0.00 31.31 28.28 2jgm n TRP 86 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 2jgm s ASN 87 N -4.54 6.02 0.17 -0.99 0.01 0.78 -4.67 114.94 111.71 2jgm s ASN 87 Ca 0.02 1.73 -0.32 0.00 -0.71 0.00 0.00 52.86 53.58 2jgm s ASN 87 Cb 0.12 -2.52 -0.11 0.00 0.41 0.00 0.00 41.25 39.15 2jgm s ASN 87 CO 0.78 -1.00 1.78 -2.65 -1.51 0.00 0.00 177.10 174.50 2jgm n PRO 88 N -1.97 2.78 -0.55 -0.60 -0.02 -1.26 -4.86 135.00 128.52 2jgm n PRO 88 Ca 0.08 1.01 0.09 0.00 -2.02 0.00 0.00 63.50 62.65 2jgm n PRO 88 Cb 0.53 -2.88 0.32 0.00 -0.02 0.00 0.00 33.50 31.46 2jgm n PRO 88 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2jgm n ASN 89 N 4.78 4.47 -3.50 2.55 6.94 -1.26 -4.93 115.26 124.31 2jgm n ASN 89 Ca 0.17 -2.51 -0.18 0.00 -0.02 0.00 0.00 54.58 52.05 2jgm n ASN 89 Cb 0.36 -0.54 -0.08 0.00 -2.36 0.00 0.00 39.78 37.16 2jgm n ASN 89 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2jgm s ARG 90 N -1.94 1.67 0.28 -3.83 1.81 -1.26 -5.08 118.95 110.59 2jgm s ARG 90 Ca 0.46 -1.92 -0.30 0.00 -1.72 0.00 0.00 55.73 52.25 2jgm s ARG 90 Cb 0.31 0.33 -0.11 0.00 -0.45 0.00 0.00 34.95 35.02 2jgm s ARG 90 CO 0.21 -0.61 1.62 -1.21 -0.68 0.00 0.00 175.30 174.62 2jgm s GLU 91 N -3.55 4.12 0.12 3.54 0.41 -1.26 -4.64 118.70 117.45 2jgm s GLU 91 Ca 0.40 2.58 -0.30 0.00 -0.41 0.00 0.00 54.97 57.23 2jgm s GLU 91 Cb 0.03 -3.03 -0.07 0.00 -1.78 0.00 0.00 34.13 29.28 2jgm s GLU 91 CO 0.24 -0.65 1.21 -0.51 -0.49 0.00 0.00 175.26 175.06 2jgm s LEU 92 N -0.19 4.41 -0.19 1.80 1.43 -1.26 -1.01 118.68 123.67 2jgm s LEU 92 Ca 0.65 2.12 -0.27 0.00 -1.03 0.00 0.00 54.13 55.60 2jgm s LEU 92 Cb -0.48 -3.59 0.09 0.00 0.03 0.00 0.00 46.19 42.23 2jgm s LEU 92 CO 0.45 -0.43 0.80 -0.55 0.23 0.00 0.00 176.35 176.84 2jgm s SER 93 N 0.66 -0.62 0.60 2.29 0.15 -0.40 -4.91 113.70 111.46 2jgm s SER 93 Ca 0.57 0.99 0.38 0.00 0.70 0.00 0.00 55.95 58.59 2jgm s SER 93 Cb -0.31 0.93 1.83 0.00 -1.71 0.00 0.00 66.02 66.76 2jgm s SER 93 CO 0.32 -0.35 2.16 -0.33 1.20 0.00 0.00 173.24 176.24 2jgm h GLU 94 N 3.94 0.00 -5.90 5.44 5.08 -1.93 -3.24 114.58 117.96 2jgm h GLU 94 Ca -0.27 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.50 2jgm h GLU 94 Cb 1.16 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.29 2jgm h GLU 94 CO 0.20 0.01 0.89 0.34 -1.00 0.00 0.00 179.01 179.45 2jgm s ASP 95 N -5.50 6.23 0.00 1.42 -1.08 -1.26 -4.37 116.67 112.11 2jgm s ASP 95 Ca -0.02 -0.85 0.00 0.00 -0.52 0.00 0.00 52.55 51.16 2jgm s ASP 95 Cb 0.11 -2.50 0.00 0.00 -1.46 0.00 0.00 42.92 39.07 2jgm s ASP 95 CO 0.49 -1.61 0.16 0.00 0.52 0.00 0.00 175.17 174.73 2jgm n LEU 97 N 0.00 5.95 -4.20 0.00 4.77 -1.26 -4.59 117.00 117.66 2jgm n LEU 97 Ca 0.00 -4.18 -0.22 0.00 -0.03 0.00 0.00 56.01 51.58 2jgm n LEU 97 Cb 0.39 -1.66 -0.13 0.00 -2.33 0.00 0.00 43.42 39.69 2jgm n LEU 97 CO 0.00 0.77 -0.49 -0.31 -1.33 0.00 0.00 177.39 176.03 2jgm s TYR 98 N 2.93 1.48 0.40 -1.77 2.02 -1.26 -1.78 117.35 119.37 2jgm s TYR 98 Ca 0.48 -0.39 0.07 0.00 -0.37 0.00 0.00 57.07 56.85 2jgm s TYR 98 Cb 0.08 -0.85 -0.08 0.00 -0.40 0.00 0.00 41.96 40.71 2jgm s TYR 98 CO -0.00 0.09 0.00 -0.48 -1.57 0.00 0.00 175.55 173.59 2jgm s LEU 99 N -1.45 2.85 -0.02 -1.29 0.05 0.62 -1.67 118.68 117.77 2jgm s LEU 99 Ca 0.03 -1.36 0.02 0.00 0.05 0.00 0.00 54.13 52.87 2jgm s LEU 99 Cb -0.09 -0.89 0.00 0.00 -2.05 0.00 0.00 46.19 43.16 2jgm s LEU 99 CO 0.02 -0.44 -0.07 0.20 -0.55 0.00 0.00 176.35 175.51 2jgm s ASN 100 N -3.70 0.94 -0.11 1.48 0.01 0.15 -1.04 114.94 112.67 2jgm s ASN 100 Ca 0.35 -0.14 0.03 0.00 -0.71 0.00 0.00 52.86 52.38 2jgm s ASN 100 Cb 0.09 -0.22 -0.01 0.00 0.41 0.00 0.00 41.25 41.53 2jgm s ASN 100 CO 0.18 0.05 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.93 2jgm s VAL 101 N 0.14 2.42 -0.10 1.60 1.01 -1.02 -1.07 120.40 123.39 2jgm s VAL 101 Ca -0.02 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 61.07 2jgm s VAL 101 Cb -0.07 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 2jgm s VAL 101 CO -0.00 0.55 -0.08 0.26 0.00 0.00 0.00 175.10 175.82 2jgm s TRP 102 N 0.31 2.90 0.05 5.22 0.51 0.52 0.43 118.94 128.87 2jgm s TRP 102 Ca -0.15 -0.22 0.01 0.00 -2.12 0.00 0.00 56.10 53.63 2jgm s TRP 102 Cb -0.17 -1.78 -0.03 0.00 -0.81 0.00 0.00 33.47 30.68 2jgm s TRP 102 CO 0.08 0.11 -0.06 0.95 -0.51 0.00 0.00 176.95 177.52 2jgm s THR 103 N -0.28 0.46 0.37 2.01 -4.23 -0.84 -1.40 115.64 111.73 2jgm s THR 103 Ca 0.03 -1.28 -0.24 0.00 -1.18 0.00 0.00 61.69 59.03 2jgm s THR 103 Cb -0.13 -0.83 -0.13 0.00 1.34 0.00 0.00 72.50 72.75 2jgm s THR 103 CO 0.03 -0.55 0.64 -2.65 -0.54 0.00 0.00 174.62 171.55 2jgm n PRO 104 N 1.08 0.68 -4.00 3.99 -0.01 -1.26 -0.49 135.00 134.99 2jgm n PRO 104 Ca -0.20 0.24 -0.34 0.00 -0.01 0.00 0.00 63.50 63.19 2jgm n PRO 104 Cb 0.56 -1.53 -0.15 0.00 -0.01 0.00 0.00 33.50 32.38 2jgm n PRO 104 CO 0.00 0.00 0.00 -0.47 -0.01 0.00 0.00 175.50 175.02 2jgm s TYR 105 N -1.34 2.94 0.72 6.00 5.04 -1.08 -2.45 117.35 127.19 2jgm s TYR 105 Ca 0.62 -1.39 -0.14 0.00 -2.44 0.00 0.00 57.07 53.72 2jgm s TYR 105 Cb -0.66 -2.03 0.04 0.00 0.35 0.00 0.00 41.96 39.66 2jgm s TYR 105 CO 0.58 -0.70 1.15 -1.25 -1.34 0.00 0.00 175.55 173.99 2jgm s PRO 106 N 1.36 2.31 -0.05 4.97 0.04 -1.26 -4.58 135.00 137.79 2jgm s PRO 106 Ca 0.03 1.51 -0.30 0.00 0.04 0.00 0.00 61.00 62.29 2jgm s PRO 106 Cb -0.15 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 2jgm s PRO 106 CO -0.07 -1.65 1.30 -0.98 0.04 0.00 0.00 177.00 175.64 2jgm s ARG 107 N -4.19 4.30 -0.01 4.56 1.70 -1.03 -4.82 118.95 119.47 2jgm s ARG 107 Ca 0.69 1.80 -0.10 0.00 -0.47 0.00 0.00 55.73 57.65 2jgm s ARG 107 Cb -0.23 -3.61 -0.05 0.00 -0.57 0.00 0.00 34.95 30.49 2jgm s ARG 107 CO 0.46 -0.55 0.27 -2.30 -1.08 0.00 0.00 175.30 172.10 2jgm n PRO 108 N 5.56 0.00 0.15 3.89 -0.01 -1.26 -4.89 135.00 138.44 2jgm n PRO 108 Ca 0.12 0.00 0.01 0.00 -0.01 0.00 0.00 63.50 63.62 2jgm n PRO 108 Cb 0.45 -0.36 0.18 0.00 -0.01 0.00 0.00 33.50 33.76 2jgm n PRO 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 2jgm h ALA 109 N 0.75 0.87 -2.26 3.55 0.00 -1.93 -3.44 119.26 116.79 2jgm h ALA 109 Ca -0.12 -0.52 -0.28 0.00 0.00 0.00 0.00 54.91 53.99 2jgm h ALA 109 Cb 0.34 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 17.90 2jgm h ALA 109 CO 0.16 0.71 -0.68 -1.54 0.00 0.00 0.00 179.25 177.90 2jgm s SER 110 N -6.63 1.30 0.02 0.00 1.04 -1.26 -5.12 113.70 103.05 2jgm s SER 110 Ca 0.00 -1.12 -0.35 0.00 0.48 0.00 0.00 55.95 54.96 2jgm s SER 110 Cb 0.11 0.09 -0.13 0.00 0.10 0.00 0.00 66.02 66.19 2jgm s SER 110 CO 0.74 -0.51 1.69 -2.65 0.98 0.00 0.00 173.24 173.48 2jgm n PRO 111 N -0.20 1.99 -4.23 4.02 -0.02 -1.26 -4.91 135.00 130.40 2jgm n PRO 111 Ca -0.08 0.72 -0.35 0.00 -2.02 0.00 0.00 63.50 61.77 2jgm n PRO 111 Cb 0.62 -2.50 -0.09 0.00 -0.02 0.00 0.00 33.50 31.51 2jgm n PRO 111 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2jgm s THR 112 N 2.31 4.54 0.33 3.45 2.01 0.99 -4.70 115.64 124.57 2jgm s THR 112 Ca 0.86 -0.15 -0.26 0.00 0.31 0.00 0.00 61.69 62.45 2jgm s THR 112 Cb -0.74 -2.96 -0.13 0.00 0.01 0.00 0.00 72.50 68.68 2jgm s THR 112 CO 0.46 0.56 0.94 -2.65 -0.69 0.00 0.00 174.62 173.24 2jgm n PRO 113 N 2.58 1.21 -4.60 4.92 -0.02 -1.26 0.52 135.00 138.33 2jgm n PRO 113 Ca -0.18 0.43 -0.33 0.00 -2.02 0.00 0.00 63.50 61.39 2jgm n PRO 113 Cb 0.53 -1.82 -0.13 0.00 -0.02 0.00 0.00 33.50 32.07 2jgm n PRO 113 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2jgm s VAL 114 N -1.16 3.49 -0.18 -1.45 1.01 -0.04 -3.18 120.40 118.88 2jgm s VAL 114 Ca 0.60 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 62.00 2jgm s VAL 114 Cb -0.66 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 2jgm s VAL 114 CO 0.59 0.52 0.04 -0.76 0.00 0.00 0.00 175.10 175.49 2jgm s LEU 115 N 0.18 3.66 -0.21 3.92 1.02 -0.42 -0.46 118.68 126.37 2jgm s LEU 115 Ca -0.05 0.01 -0.03 0.00 0.02 0.00 0.00 54.13 54.08 2jgm s LEU 115 Cb -0.14 -1.92 -0.01 0.00 0.02 0.00 0.00 46.19 44.14 2jgm s LEU 115 CO 0.04 0.16 -0.06 -0.63 0.02 0.00 0.00 176.35 175.87 2jgm s ILE 116 N 0.47 3.27 0.03 -0.59 1.01 0.44 -0.42 121.20 125.41 2jgm s ILE 116 Ca 0.02 -0.53 -0.13 0.00 0.00 0.00 0.00 60.65 60.00 2jgm s ILE 116 Cb -0.13 -2.47 -0.06 0.00 0.01 0.00 0.00 42.46 39.81 2jgm s ILE 116 CO 0.01 0.44 0.41 0.86 0.00 0.00 0.00 174.94 176.67 2jgm s TRP 117 N 1.34 3.68 -0.22 3.97 -0.11 0.61 -0.28 118.94 127.94 2jgm s TRP 117 Ca 0.04 0.94 0.00 0.00 1.22 0.00 0.00 56.10 58.30 2jgm s TRP 117 Cb -0.14 -2.25 0.06 0.00 -1.50 0.00 0.00 33.47 29.63 2jgm s TRP 117 CO -0.03 0.60 -0.05 0.42 -4.62 0.00 0.00 176.95 173.26 2jgm s ILE 118 N -1.20 1.39 0.61 5.86 1.01 -0.37 -3.77 121.20 124.73 2jgm s ILE 118 Ca 0.27 -1.05 -0.18 0.00 0.00 0.00 0.00 60.65 59.70 2jgm s ILE 118 Cb -0.16 -1.64 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 2jgm s ILE 118 CO 0.15 -0.04 1.16 -0.72 0.00 0.00 0.00 174.94 175.49 2jgm s TYR 119 N 1.47 2.48 0.00 3.97 -0.85 -1.26 -3.58 117.35 119.58 2jgm s TYR 119 Ca -0.04 1.54 0.00 0.00 -0.52 0.00 0.00 57.07 58.05 2jgm s TYR 119 Cb -0.18 -3.36 0.00 0.00 0.38 0.00 0.00 41.96 38.80 2jgm s TYR 119 CO -0.07 -1.97 0.00 0.41 -1.52 0.00 0.00 175.55 172.41 2jgm n GLY 120 N 0.17 -0.04 0.00 5.49 0.00 -1.16 -3.03 105.19 106.63 2jgm n GLY 120 Ca 0.12 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.41 2jgm n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jgm n GLY 121 N 5.00 1.86 2.32 -0.02 0.00 -1.26 -4.30 105.19 108.79 2jgm n GLY 121 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2jgm n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jgm n GLY 122 N 0.00 -0.17 2.73 -0.02 0.00 -1.26 -1.67 105.19 104.80 2jgm n GLY 122 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2jgm n GLY 122 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jgm n PHE 123 N -2.96 0.00 -0.04 1.61 3.72 -1.26 -4.77 117.46 113.75 2jgm n PHE 123 Ca -0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 2jgm n PHE 123 Cb 0.55 -1.69 0.00 0.00 -0.94 0.00 0.00 39.48 37.40 2jgm n PHE 123 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 2jgm n TYR 124 N -2.27 0.00 -3.77 1.38 0.18 -0.67 -0.30 117.16 111.71 2jgm n TYR 124 Ca -0.02 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.67 2jgm n TYR 124 Cb 0.40 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.37 2jgm n TYR 124 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 2jgm n SER 125 N -0.31 -1.60 0.00 9.48 3.41 -0.70 -4.07 113.62 119.83 2jgm n SER 125 Ca 0.00 -2.41 0.00 0.00 -0.26 0.00 0.00 58.87 56.20 2jgm n SER 125 Cb 0.01 2.75 0.00 0.00 -0.26 0.00 0.00 64.21 66.72 2jgm n SER 125 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jgm n GLY 126 N -0.45 2.80 3.31 5.00 0.00 -1.26 -4.39 105.19 110.20 2jgm n GLY 126 Ca -0.04 -1.86 -0.14 0.00 0.00 0.00 0.00 46.02 43.97 2jgm n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jgm s ALA 127 N -2.60 -1.01 -0.90 4.61 0.00 -1.26 -4.70 121.76 115.91 2jgm s ALA 127 Ca 0.00 0.51 0.24 0.00 0.00 0.00 0.00 51.96 52.71 2jgm s ALA 127 Cb 0.00 0.10 0.98 0.00 0.00 0.00 0.00 23.12 24.20 2jgm s ALA 127 CO 0.00 -0.31 1.76 0.00 0.00 0.00 0.00 175.76 177.21 2jgm n ALA 128 N 1.08 2.08 0.77 0.00 0.00 -1.26 -3.73 120.51 119.45 2jgm n ALA 128 Ca -0.21 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.30 2jgm n ALA 128 Cb 0.57 -1.40 0.25 0.00 0.00 0.00 0.00 19.45 18.87 2jgm n ALA 128 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2jgm n SER 129 N -1.72 2.80 -4.77 0.00 3.41 -1.26 -4.80 113.62 107.28 2jgm n SER 129 Ca 0.05 -1.89 -0.32 0.00 -0.26 0.00 0.00 58.87 56.45 2jgm n SER 129 Cb 0.30 -0.14 0.06 0.00 -0.26 0.00 0.00 64.21 64.17 2jgm n SER 129 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2jgm s LEU 130 N -1.67 3.28 0.35 1.04 1.43 -1.24 -4.93 118.68 116.94 2jgm s LEU 130 Ca 0.35 1.93 0.08 0.00 -1.03 0.00 0.00 54.13 55.46 2jgm s LEU 130 Cb 0.21 -4.54 0.64 0.00 0.03 0.00 0.00 46.19 42.53 2jgm s LEU 130 CO 0.30 -1.74 1.83 0.44 0.23 0.00 0.00 176.35 177.41 2jgm h ASP 131 N -0.33 0.25 0.42 2.29 3.32 -1.93 -2.31 116.42 118.13 2jgm h ASP 131 Ca -0.46 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.52 2jgm h ASP 131 Cb 1.24 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2jgm h ASP 131 CO 0.53 0.49 0.00 1.33 -1.72 0.00 0.00 179.24 179.88 2jgm n VAL 132 N -4.17 0.27 -1.26 -1.35 0.24 -1.26 -2.62 118.33 108.17 2jgm n VAL 132 Ca -0.01 0.07 0.04 0.00 -2.04 0.00 0.00 64.34 62.39 2jgm n VAL 132 Cb 0.35 -0.69 0.21 0.00 -1.47 0.00 0.00 33.84 32.24 2jgm n VAL 132 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2jgm n TYR 133 N -1.28 0.67 -2.03 6.34 4.01 -0.87 -4.50 117.16 119.51 2jgm n TYR 133 Ca 0.11 -1.26 -0.43 0.00 -0.16 0.00 0.00 57.90 56.17 2jgm n TYR 133 Cb 0.18 -0.34 -0.03 0.00 -0.31 0.00 0.00 39.34 38.85 2jgm n TYR 133 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2jgm s ASP 134 N -2.53 6.40 0.00 7.72 -1.08 -1.08 -4.87 116.67 121.23 2jgm s ASP 134 Ca 0.40 1.86 0.15 0.00 -0.52 0.00 0.00 52.55 54.45 2jgm s ASP 134 Cb 0.36 -2.53 0.68 0.00 -1.46 0.00 0.00 42.92 39.96 2jgm s ASP 134 CO 0.02 -1.20 1.47 0.61 0.52 0.00 0.00 175.17 176.59 2jgm n GLY 135 N 4.57 -0.24 0.27 2.66 0.00 -1.26 -4.33 105.19 106.88 2jgm n GLY 135 Ca 0.19 -0.26 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 2jgm n GLY 135 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2jgm h ARG 136 N 1.18 0.95 0.02 1.61 0.11 -1.89 -2.34 114.38 114.02 2jgm h ARG 136 Ca 0.00 -0.33 -0.00 0.00 0.10 0.00 0.00 59.98 59.75 2jgm h ARG 136 Cb 0.26 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.27 2jgm h ARG 136 CO 0.00 0.99 -0.01 0.74 0.10 0.00 0.00 179.97 181.78 2jgm h PHE 137 N 0.81 -0.03 -0.99 4.08 0.04 -1.77 -0.36 116.94 118.73 2jgm h PHE 137 Ca 0.14 -0.00 0.13 0.00 2.80 0.00 0.00 57.97 61.04 2jgm h PHE 137 Cb 0.59 0.01 -0.09 0.00 2.20 0.00 0.00 35.95 38.66 2jgm h PHE 137 CO 0.04 0.47 0.62 -0.07 -0.60 0.00 0.00 178.31 178.78 2jgm h LEU 138 N -0.54 0.87 0.00 1.54 3.38 -1.68 0.18 115.31 119.06 2jgm h LEU 138 Ca -0.00 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2jgm h LEU 138 Cb 0.51 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2jgm h LEU 138 CO 0.00 0.44 -0.00 0.00 0.09 0.00 0.00 178.44 178.98 2jgm h ALA 139 N 1.56 -0.00 0.38 1.53 0.00 -1.22 -2.52 119.26 118.99 2jgm h ALA 139 Ca 0.50 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.32 2jgm h ALA 139 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2jgm h ALA 139 CO -0.27 -0.43 -0.18 0.37 0.00 0.00 0.00 179.25 178.73 2jgm h GLN 140 N -0.14 -0.50 -0.51 0.00 -0.00 -0.24 -0.47 115.11 113.26 2jgm h GLN 140 Ca -0.00 0.03 -0.11 0.00 -0.00 0.00 0.00 58.65 58.57 2jgm h GLN 140 Cb 0.14 0.11 -0.02 0.00 0.00 0.00 0.00 27.48 27.71 2jgm h GLN 140 CO 0.00 -0.33 -0.12 0.28 0.00 0.00 0.00 178.83 178.66 2jgm h VAL 141 N -1.12 1.27 -0.00 2.39 2.07 -0.83 -3.27 116.25 116.74 2jgm h VAL 141 Ca -0.05 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.22 2jgm h VAL 141 Cb 0.40 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2jgm h VAL 141 CO 0.09 0.44 -0.48 -0.62 0.02 0.00 0.00 177.57 177.02 2jgm n GLU 142 N -4.15 2.30 -2.54 1.57 -0.58 -0.98 -4.99 120.64 111.26 2jgm n GLU 142 Ca 0.01 -0.32 -0.11 0.00 -0.42 0.00 0.00 57.16 56.33 2jgm n GLU 142 Cb 0.40 -1.16 0.01 0.00 -0.57 0.00 0.00 31.44 30.12 2jgm n GLU 142 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jgm n GLY 143 N 1.20 0.07 3.83 0.62 0.00 -0.21 -5.00 105.19 105.71 2jgm n GLY 143 Ca 0.04 -0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 2jgm n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jgm s ALA 144 N -2.78 3.65 -0.39 4.61 0.00 -1.02 -4.80 121.76 121.02 2jgm s ALA 144 Ca 0.12 -0.11 -0.27 0.00 0.00 0.00 0.00 51.96 51.70 2jgm s ALA 144 Cb -0.05 -2.50 0.02 0.00 0.00 0.00 0.00 23.12 20.59 2jgm s ALA 144 CO 0.15 0.45 1.00 0.08 0.00 0.00 0.00 175.76 177.44 2jgm s VAL 145 N -1.12 4.47 -0.16 0.00 1.01 -1.19 -3.99 120.40 119.42 2jgm s VAL 145 Ca 0.27 1.24 -0.01 0.00 0.00 0.00 0.00 61.98 63.48 2jgm s VAL 145 Cb -0.18 -4.42 -0.01 0.00 0.00 0.00 0.00 36.38 31.77 2jgm s VAL 145 CO 0.16 -0.67 -0.11 -0.22 0.00 0.00 0.00 175.10 174.27 2jgm s LEU 146 N 3.76 2.74 -0.03 3.92 0.20 -0.49 -1.31 118.68 127.46 2jgm s LEU 146 Ca 0.41 -0.37 0.06 0.00 0.69 0.00 0.00 54.13 54.93 2jgm s LEU 146 Cb -0.11 -1.65 -0.02 0.00 -0.43 0.00 0.00 46.19 43.98 2jgm s LEU 146 CO 0.22 0.09 -0.21 -0.69 -0.29 0.00 0.00 176.35 175.48 2jgm s VAL 147 N 0.79 2.52 0.00 1.68 1.01 0.44 -0.36 120.40 126.49 2jgm s VAL 147 Ca -0.04 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.02 2jgm s VAL 147 Cb -0.15 -1.93 -0.00 0.00 0.00 0.00 0.00 36.38 34.29 2jgm s VAL 147 CO 0.01 0.58 -0.03 -0.94 0.00 0.00 0.00 175.10 174.73 2jgm s SER 148 N -0.65 0.29 0.16 3.32 1.04 -0.23 -0.28 113.70 117.34 2jgm s SER 148 Ca 0.10 -0.10 0.11 0.00 0.48 0.00 0.00 55.95 56.54 2jgm s SER 148 Cb -0.10 -0.02 -0.04 0.00 0.10 0.00 0.00 66.02 65.96 2jgm s SER 148 CO -0.00 -0.01 -0.23 0.00 0.98 0.00 0.00 173.24 173.98 2jgm s MET 149 N -0.23 1.57 0.23 4.02 0.23 -1.25 0.34 119.30 124.21 2jgm s MET 149 Ca -0.01 -1.39 -0.22 0.00 -1.03 0.00 0.00 55.69 53.04 2jgm s MET 149 Cb -0.02 -1.94 -0.08 0.00 -1.53 0.00 0.00 34.83 31.26 2jgm s MET 149 CO -0.00 0.43 0.78 -0.80 -2.03 0.00 0.00 175.02 173.40 2jgm s ASN 150 N -2.40 7.19 0.07 -1.18 0.01 -0.67 -4.45 114.94 113.51 2jgm s ASN 150 Ca 0.18 1.55 0.02 0.00 -0.71 0.00 0.00 52.86 53.91 2jgm s ASN 150 Cb -0.09 -2.47 -0.03 0.00 0.41 0.00 0.00 41.25 39.07 2jgm s ASN 150 CO 0.09 0.06 -0.08 -0.72 -1.51 0.00 0.00 177.10 174.94 2jgm s TYR 151 N -1.45 0.80 0.37 2.20 1.13 -1.26 -4.51 117.35 114.64 2jgm s TYR 151 Ca 0.42 -0.64 -0.28 0.00 -1.41 0.00 0.00 57.07 55.17 2jgm s TYR 151 Cb -0.19 -0.47 -0.10 0.00 -1.10 0.00 0.00 41.96 40.10 2jgm s TYR 151 CO 0.23 -0.09 1.38 1.03 -2.51 0.00 0.00 175.55 175.59 2jgm s ARG 152 N -2.40 4.15 0.38 -3.49 0.52 -1.26 -4.86 118.95 112.00 2jgm s ARG 152 Ca -0.01 2.35 0.04 0.00 -0.52 0.00 0.00 55.73 57.59 2jgm s ARG 152 Cb -0.05 -2.95 -0.06 0.00 0.52 0.00 0.00 34.95 32.42 2jgm s ARG 152 CO -0.01 -0.41 0.05 0.14 0.02 0.00 0.00 175.30 175.09 2jgm s VAL 153 N -1.16 1.32 0.00 3.52 -7.23 -1.26 -4.35 120.40 111.24 2jgm s VAL 153 Ca 0.52 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.69 2jgm s VAL 153 Cb -0.42 -2.72 0.00 0.00 0.56 0.00 0.00 36.38 33.80 2jgm s VAL 153 CO 0.56 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.96 2jgm n GLY 154 N -0.86 2.68 0.27 2.32 0.00 0.58 -2.61 105.19 107.58 2jgm n GLY 154 Ca -0.05 -0.41 0.01 0.00 0.00 0.00 0.00 46.02 45.57 2jgm n GLY 154 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2jgm h THR 155 N 0.00 1.18 0.00 2.61 1.35 -1.89 0.06 112.91 116.22 2jgm h THR 155 Ca 0.00 -0.72 -0.05 0.00 -0.55 0.00 0.00 66.41 65.09 2jgm h THR 155 Cb 0.00 0.97 -0.01 0.00 -1.73 0.00 0.00 68.15 67.39 2jgm h THR 155 CO 0.00 0.24 -0.24 -0.26 -0.25 0.00 0.00 175.52 175.01 2jgm h PHE 156 N 0.43 0.00 0.00 4.73 0.04 -1.86 -2.04 116.94 118.24 2jgm h PHE 156 Ca 0.09 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.80 2jgm h PHE 156 Cb 0.30 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.44 2jgm h PHE 156 CO 0.01 0.24 -1.56 0.41 -0.60 0.00 0.00 178.31 176.81 2jgm n GLY 157 N -0.11 -0.50 0.00 -1.45 0.00 -1.03 -4.10 105.19 98.00 2jgm n GLY 157 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2jgm n GLY 157 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jgm n PHE 158 N -2.04 0.00 -1.77 1.61 3.72 -0.02 -0.42 117.46 118.54 2jgm n PHE 158 Ca -0.07 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.91 2jgm n PHE 158 Cb 0.46 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.97 2jgm n PHE 158 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2jgm s LEU 159 N -1.02 4.15 0.06 4.37 0.20 -0.77 -4.47 118.68 121.20 2jgm s LEU 159 Ca 0.00 2.32 0.09 0.00 0.69 0.00 0.00 54.13 57.23 2jgm s LEU 159 Cb 0.00 -3.53 -0.03 0.00 -0.43 0.00 0.00 46.19 42.20 2jgm s LEU 159 CO 0.00 -1.24 -0.26 0.00 -0.29 0.00 0.00 176.35 174.56 2jgm s ALA 160 N 5.27 2.31 -0.68 5.97 0.00 -1.26 -4.38 121.76 128.98 2jgm s ALA 160 Ca 0.86 -1.31 0.05 0.00 0.00 0.00 0.00 51.96 51.57 2jgm s ALA 160 Cb -0.37 -0.48 0.20 0.00 0.00 0.00 0.00 23.12 22.47 2jgm s ALA 160 CO 0.37 0.54 0.58 1.28 0.00 0.00 0.00 175.76 178.53 2jgm n LEU 161 N 1.57 3.22 -4.47 0.00 4.77 -0.16 -3.95 117.00 117.98 2jgm n LEU 161 Ca -0.17 -5.28 -0.48 0.00 -0.03 0.00 0.00 56.01 50.05 2jgm n LEU 161 Cb 0.52 -0.70 -0.03 0.00 -2.33 0.00 0.00 43.42 40.88 2jgm n LEU 161 CO 0.23 1.86 0.26 -2.65 -1.33 0.00 0.00 177.39 175.76 2jgm n PRO 162 N 1.59 0.45 0.00 3.23 -0.02 -1.26 -1.59 135.00 137.40 2jgm n PRO 162 Ca 0.23 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2jgm n PRO 162 Cb 0.37 -1.35 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 2jgm n PRO 162 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgm n GLY 163 N 1.76 3.03 3.84 -1.23 0.00 -1.26 -5.04 105.19 106.29 2jgm n GLY 163 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 2jgm n GLY 163 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jgm s SER 164 N -1.27 5.90 0.10 1.61 1.04 -0.62 -4.98 113.70 115.49 2jgm s SER 164 Ca 0.00 1.58 0.13 0.00 0.48 0.00 0.00 55.95 58.14 2jgm s SER 164 Cb 0.00 -2.50 -0.13 0.00 0.10 0.00 0.00 66.02 63.49 2jgm s SER 164 CO 0.00 -1.09 1.05 -0.09 0.98 0.00 0.00 173.24 174.09 2jgm h ARG 165 N -0.15 0.00 -0.01 4.02 2.43 -1.96 -3.36 114.38 115.35 2jgm h ARG 165 Ca -0.45 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2jgm h ARG 165 Cb 1.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 2jgm h ARG 165 CO 0.59 0.57 -0.52 -0.85 -1.51 0.00 0.00 179.97 178.25 2jgm n GLU 166 N -3.12 1.01 -2.89 0.20 0.00 -1.26 -4.53 120.64 110.05 2jgm n GLU 166 Ca -0.06 -0.82 -0.11 0.00 0.00 0.00 0.00 57.16 56.18 2jgm n GLU 166 Cb 0.89 -1.48 -0.00 0.00 0.00 0.00 0.00 31.44 30.85 2jgm n GLU 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2jgm n ALA 167 N -0.28 -0.64 1.04 -1.84 0.00 -1.26 -4.54 120.51 112.99 2jgm n ALA 167 Ca 0.09 -1.67 0.14 0.00 0.00 0.00 0.00 53.44 52.00 2jgm n ALA 167 Cb 0.44 -1.27 0.62 0.00 0.00 0.00 0.00 19.45 19.24 2jgm n ALA 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jgm n PRO 168 N 2.36 0.04 0.00 0.00 -0.04 -1.26 -0.99 135.00 135.11 2jgm n PRO 168 Ca 0.17 -0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 2jgm n PRO 168 Cb 0.57 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 2jgm n PRO 168 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2jgm n GLY 169 N 1.48 -1.64 2.34 0.55 0.00 -1.26 -4.69 105.19 101.98 2jgm n GLY 169 Ca 0.08 -1.51 -0.11 0.00 0.00 0.00 0.00 46.02 44.48 2jgm n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jgm n ASN 170 N -1.51 -4.38 -0.02 1.61 3.02 -1.26 -4.92 115.26 107.80 2jgm n ASN 170 Ca 0.00 0.26 -0.02 0.00 -0.03 0.00 0.00 54.58 54.79 2jgm n ASN 170 Cb 0.00 -2.82 0.24 0.00 -0.61 0.00 0.00 39.78 36.59 2jgm n ASN 170 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2jgm h VAL 171 N 0.00 1.23 -0.81 2.41 -1.51 -1.77 -0.34 116.25 115.45 2jgm h VAL 171 Ca -0.22 -0.97 0.14 0.00 -1.23 0.00 0.00 66.70 64.42 2jgm h VAL 171 Cb 0.73 1.04 -0.06 0.00 -2.13 0.00 0.00 31.29 30.87 2jgm h VAL 171 CO 0.32 0.33 0.53 1.23 -1.23 0.00 0.00 177.57 178.75 2jgm h GLY 172 N 0.92 0.96 1.66 5.19 0.00 -0.94 0.29 103.07 111.14 2jgm h GLY 172 Ca 0.10 -0.25 -0.20 0.00 0.00 0.00 0.00 47.33 46.99 2jgm h GLY 172 CO 0.02 0.09 -0.83 1.41 0.00 0.00 0.00 176.54 177.23 2jgm h LEU 173 N 0.57 0.40 -0.72 3.11 3.38 -1.36 -2.74 115.31 117.96 2jgm h LEU 173 Ca 0.40 -0.29 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 2jgm h LEU 173 Cb 0.73 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2jgm h LEU 173 CO -0.16 1.06 -0.51 -0.07 0.09 0.00 0.00 178.44 178.86 2jgm h LEU 174 N 0.19 0.37 -0.01 1.67 3.38 -0.16 -0.46 115.31 120.30 2jgm h LEU 174 Ca -0.05 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 57.77 2jgm h LEU 174 Cb 1.43 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 42.02 2jgm h LEU 174 CO 0.14 0.81 -0.43 0.44 0.09 0.00 0.00 178.44 179.49 2jgm h ASP 175 N 0.26 -1.31 -0.58 -0.43 3.32 -0.48 -0.64 116.42 116.57 2jgm h ASP 175 Ca 0.01 0.16 0.11 0.00 0.02 0.00 0.00 57.03 57.33 2jgm h ASP 175 Cb 0.99 0.51 -0.08 0.00 0.22 0.00 0.00 39.33 40.97 2jgm h ASP 175 CO 0.08 -0.46 0.10 1.56 -1.72 0.00 0.00 179.24 178.80 2jgm h GLN 176 N -0.58 0.22 -0.74 3.56 4.20 -1.16 -1.67 115.11 118.94 2jgm h GLN 176 Ca 0.05 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.76 2jgm h GLN 176 Cb 0.66 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 2jgm h GLN 176 CO -0.32 0.15 0.48 -0.09 -0.67 0.00 0.00 178.83 178.38 2jgm h ARG 177 N 0.23 0.94 -0.75 1.46 2.43 -0.71 -1.78 114.38 116.20 2jgm h ARG 177 Ca 0.30 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.38 2jgm h ARG 177 Cb 0.45 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 2jgm h ARG 177 CO -0.40 0.62 0.34 1.25 -1.51 0.00 0.00 179.97 180.27 2jgm h LEU 178 N 0.97 0.99 -0.85 3.80 5.85 -0.23 0.17 115.31 126.01 2jgm h LEU 178 Ca 0.28 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 2jgm h LEU 178 Cb -0.07 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.67 2jgm h LEU 178 CO -0.08 0.85 0.42 0.00 -0.34 0.00 0.00 178.44 179.29 2jgm h ALA 179 N 1.30 1.09 -0.61 1.25 0.00 -0.86 0.40 119.26 121.83 2jgm h ALA 179 Ca 0.26 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2jgm h ALA 179 Cb 0.14 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2jgm h ALA 179 CO -0.03 0.65 0.14 -0.07 0.00 0.00 0.00 179.25 179.94 2jgm h LEU 180 N 1.20 0.90 -0.67 0.00 3.38 -0.41 -0.70 115.31 119.02 2jgm h LEU 180 Ca 0.29 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 2jgm h LEU 180 Cb 0.10 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2jgm h LEU 180 CO -0.04 0.88 0.26 1.56 0.09 0.00 0.00 178.44 181.20 2jgm h GLN 181 N 0.91 1.00 -0.89 1.13 4.20 0.09 -2.26 115.11 119.28 2jgm h GLN 181 Ca 0.19 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 2jgm h GLN 181 Cb 0.34 -0.16 -0.04 0.00 0.30 0.00 0.00 27.48 27.92 2jgm h GLN 181 CO 0.00 0.83 0.51 2.35 -0.67 0.00 0.00 178.83 181.86 2jgm h TRP 182 N 0.94 1.19 -0.32 2.96 7.01 0.29 -2.07 115.95 125.95 2jgm h TRP 182 Ca 0.22 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.17 2jgm h TRP 182 Cb 0.21 -0.39 -0.01 0.00 -2.10 0.00 0.00 29.16 26.87 2jgm h TRP 182 CO 0.01 0.81 0.04 0.28 -2.79 0.00 0.00 178.44 176.79 2jgm h VAL 183 N 1.24 1.24 -0.89 2.65 2.07 -0.95 -0.13 116.25 121.47 2jgm h VAL 183 Ca 0.32 -0.85 0.22 0.00 0.82 0.00 0.00 66.70 67.21 2jgm h VAL 183 Cb -0.01 1.17 -0.06 0.00 -1.52 0.00 0.00 31.29 30.87 2jgm h VAL 183 CO -0.06 0.28 0.61 1.56 0.02 0.00 0.00 177.57 179.98 2jgm h GLN 184 N 0.36 0.24 0.00 1.57 1.08 -0.79 -2.22 115.11 115.34 2jgm h GLN 184 Ca 0.10 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2jgm h GLN 184 Cb 0.37 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.74 2jgm h GLN 184 CO 0.01 0.16 -1.76 0.39 -0.95 0.00 0.00 178.83 176.68 2jgm n GLU 185 N -4.43 0.65 0.00 1.46 1.02 -0.83 -4.64 120.64 113.87 2jgm n GLU 185 Ca 0.19 -0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 2jgm n GLU 185 Cb 0.80 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.62 2jgm n GLU 185 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2jgm n ASN 186 N -2.37 0.00 0.15 1.62 3.02 -0.12 -4.83 115.26 112.73 2jgm n ASN 186 Ca -0.03 -0.22 0.03 0.00 -0.03 0.00 0.00 54.58 54.33 2jgm n ASN 186 Cb 0.57 0.44 0.10 0.00 -0.61 0.00 0.00 39.78 40.27 2jgm n ASN 186 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2jgm h ILE 187 N 0.00 0.87 -0.72 2.41 6.09 -1.60 -2.75 117.51 121.81 2jgm h ILE 187 Ca 0.00 -2.08 0.09 0.00 -1.37 0.00 0.00 64.86 61.50 2jgm h ILE 187 Cb 0.00 2.32 -0.07 0.00 0.47 0.00 0.00 36.82 39.54 2jgm h ILE 187 CO 0.00 0.47 0.38 0.00 -3.07 0.00 0.00 178.15 175.93 2jgm h ALA 188 N 1.52 1.00 0.00 0.18 0.00 -1.80 0.89 119.26 121.05 2jgm h ALA 188 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2jgm h ALA 188 Cb 1.28 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2jgm h ALA 188 CO 0.06 -0.01 0.27 0.00 0.00 0.00 0.00 179.25 179.57 2jgm h ALA 189 N 1.42 1.23 -0.14 0.00 0.00 -1.79 0.37 119.26 120.35 2jgm h ALA 189 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2jgm h ALA 189 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2jgm h ALA 189 CO -0.25 -0.23 0.00 1.19 0.00 0.00 0.00 179.25 179.96 2jgm n PHE 190 N -2.48 0.16 -0.48 0.00 3.01 -0.03 -4.88 117.46 112.76 2jgm n PHE 190 Ca -0.02 -0.12 0.00 0.00 1.01 0.00 0.00 57.45 58.33 2jgm n PHE 190 Cb 0.31 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.77 2jgm n PHE 190 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jgm n GLY 191 N 0.94 0.76 3.78 1.37 0.00 0.13 -4.58 105.19 107.59 2jgm n GLY 191 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 2jgm n GLY 191 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jgm s GLY 192 N -1.50 2.35 -0.38 -0.02 0.00 0.10 -0.01 107.32 107.86 2jgm s GLY 192 Ca 0.00 0.64 -0.11 0.00 0.00 0.00 0.00 44.72 45.24 2jgm s GLY 192 CO 0.00 0.98 0.22 -0.35 0.00 0.00 0.00 173.10 173.96 2jgm s ASP 193 N -2.28 5.78 0.00 1.64 2.15 0.18 -3.43 116.67 120.72 2jgm s ASP 193 Ca 0.69 -1.02 0.17 0.00 0.43 0.00 0.00 52.55 52.81 2jgm s ASP 193 Cb -0.21 -2.04 0.73 0.00 -0.30 0.00 0.00 42.92 41.10 2jgm s ASP 193 CO 0.35 -0.41 1.54 -0.81 -0.17 0.00 0.00 175.17 175.67 2jgm n PRO 194 N 5.01 0.02 0.00 4.34 -0.04 -1.26 -1.78 135.00 141.29 2jgm n PRO 194 Ca -0.12 0.20 0.15 0.00 -0.04 0.00 0.00 63.50 63.69 2jgm n PRO 194 Cb 0.46 -1.50 0.70 0.00 -0.04 0.00 0.00 33.50 33.12 2jgm n PRO 194 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2jgm n MET 195 N -1.49 0.69 -3.13 0.54 2.81 -1.26 -4.22 117.12 111.06 2jgm n MET 195 Ca 0.04 -0.16 -0.22 0.00 -1.81 0.00 0.00 57.70 55.56 2jgm n MET 195 Cb 0.19 -1.50 -0.05 0.00 -0.71 0.00 0.00 33.22 31.15 2jgm n MET 195 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2jgm n SER 196 N -1.02 -0.17 -4.58 7.83 2.88 -0.73 -4.95 113.62 112.89 2jgm n SER 196 Ca 0.16 -2.79 -0.38 0.00 -1.33 0.00 0.00 58.87 54.53 2jgm n SER 196 Cb 0.24 -0.33 -0.11 0.00 -0.75 0.00 0.00 64.21 63.27 2jgm n SER 196 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2jgm s VAL 197 N -1.02 5.27 -0.17 2.46 1.01 -1.26 -0.86 120.40 125.82 2jgm s VAL 197 Ca 0.35 0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.38 2jgm s VAL 197 Cb 0.19 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 2jgm s VAL 197 CO -0.12 0.22 -0.00 -0.89 0.00 0.00 0.00 175.10 174.30 2jgm s THR 198 N 1.75 4.17 0.02 3.92 2.01 0.39 -0.33 115.64 127.57 2jgm s THR 198 Ca 0.07 -0.26 -0.18 0.00 0.31 0.00 0.00 61.69 61.63 2jgm s THR 198 Cb -0.16 -2.85 -0.06 0.00 0.01 0.00 0.00 72.50 69.44 2jgm s THR 198 CO 0.11 0.47 0.51 -0.76 -0.69 0.00 0.00 174.62 174.26 2jgm s LEU 199 N 0.46 4.46 0.03 4.42 1.43 -0.88 -0.42 118.68 128.18 2jgm s LEU 199 Ca -0.01 1.10 0.00 0.00 -1.03 0.00 0.00 54.13 54.19 2jgm s LEU 199 Cb -0.14 -2.78 -0.02 0.00 0.03 0.00 0.00 46.19 43.28 2jgm s LEU 199 CO 0.02 0.23 -0.04 0.72 0.23 0.00 0.00 176.35 177.52 2jgm s PHE 200 N -0.75 0.38 0.13 0.29 -0.71 0.62 -1.21 117.98 116.73 2jgm s PHE 200 Ca 0.27 -0.64 -0.25 0.00 -1.04 0.00 0.00 56.93 55.28 2jgm s PHE 200 Cb -0.18 -0.27 0.07 0.00 -1.21 0.00 0.00 43.02 41.44 2jgm s PHE 200 CO 0.16 -0.21 0.75 0.20 -1.34 0.00 0.00 175.22 174.78 2jgm s GLY 201 N -1.79 -0.43 -0.16 1.99 0.00 -1.15 -1.24 107.32 104.53 2jgm s GLY 201 Ca -0.10 0.45 0.14 0.00 0.00 0.00 0.00 44.72 45.21 2jgm s GLY 201 CO -0.03 0.14 1.19 -2.21 0.00 0.00 0.00 173.10 172.20 2jgm n GLU 202 N -0.37 1.34 0.00 2.90 0.00 -1.23 -1.62 120.64 121.65 2jgm n GLU 202 Ca -0.11 -2.92 0.00 0.00 0.00 0.00 0.00 57.16 54.14 2jgm n GLU 202 Cb 0.62 -1.44 0.00 0.00 0.00 0.00 0.00 31.44 30.62 2jgm n GLU 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2jgm n ALA 204 N -1.08 0.00 -0.26 4.31 0.00 -1.26 -2.50 120.51 119.72 2jgm n ALA 204 Ca 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.56 2jgm n ALA 204 Cb 0.70 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.26 2jgm n ALA 204 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2jgm h GLY 205 N 0.00 1.21 0.90 0.00 0.00 -1.70 0.27 103.07 103.75 2jgm h GLY 205 Ca 0.00 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.69 2jgm h GLY 205 CO 0.00 0.60 0.06 0.00 0.00 0.00 0.00 176.54 177.19 2jgm h ALA 206 N 1.25 0.15 -0.63 3.60 0.00 -1.55 -0.92 119.26 121.15 2jgm h ALA 206 Ca 0.26 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2jgm h ALA 206 Cb 0.18 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2jgm h ALA 206 CO -0.03 -0.28 0.42 0.00 0.00 0.00 0.00 179.25 179.36 2jgm h ALA 207 N 0.93 1.55 0.15 0.00 0.00 -1.63 0.02 119.26 120.28 2jgm h ALA 207 Ca 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2jgm h ALA 207 Cb 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2jgm h ALA 207 CO -0.01 0.41 -0.07 0.77 0.00 0.00 0.00 179.25 180.35 2jgm h SER 208 N 0.85 -0.17 -0.75 0.00 0.02 -0.35 0.30 113.55 113.46 2jgm h SER 208 Ca 0.23 -0.23 0.17 0.00 -0.84 0.00 0.00 61.79 61.13 2jgm h SER 208 Cb -0.09 0.04 -0.13 0.00 0.14 0.00 0.00 62.40 62.37 2jgm h SER 208 CO -0.05 0.14 0.01 0.58 -1.14 0.00 0.00 176.83 176.37 2jgm h VAL 209 N -0.49 0.36 -0.83 2.27 2.07 -0.68 0.78 116.25 119.72 2jgm h VAL 209 Ca -0.02 -0.04 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 2jgm h VAL 209 Cb 0.39 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 2jgm h VAL 209 CO 0.03 0.02 0.36 1.23 0.02 0.00 0.00 177.57 179.24 2jgm h GLY 210 N 0.11 1.31 2.00 2.17 0.00 -0.34 -1.77 103.07 106.55 2jgm h GLY 210 Ca 0.41 -0.68 -0.06 0.00 0.00 0.00 0.00 47.33 46.99 2jgm h GLY 210 CO -0.65 0.65 -0.29 -0.33 0.00 0.00 0.00 176.54 175.91 2jgm h MET 211 N 1.20 0.00 -0.28 4.80 2.86 0.18 -1.66 114.93 122.02 2jgm h MET 211 Ca 0.28 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.80 2jgm h MET 211 Cb 0.17 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 2jgm h MET 211 CO -0.03 0.29 -0.34 0.45 1.06 0.00 0.00 176.91 178.35 2jgm h HIS 212 N 0.00 0.72 -0.89 -0.22 3.86 -0.27 -1.34 115.15 117.01 2jgm h HIS 212 Ca -0.00 -0.19 0.01 0.00 -1.16 0.00 0.00 60.37 59.03 2jgm h HIS 212 Cb 0.53 -0.16 -0.04 0.00 1.06 0.00 0.00 27.41 28.80 2jgm h HIS 212 CO 0.00 0.87 0.59 0.82 0.86 0.00 0.00 177.93 181.07 2jgm h ILE 213 N 0.52 1.23 -0.01 2.45 2.04 -0.55 -2.72 117.51 120.46 2jgm h ILE 213 Ca 0.06 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2jgm h ILE 213 Cb 0.83 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2jgm h ILE 213 CO 0.07 0.22 -0.08 0.18 0.00 0.00 0.00 178.15 178.55 2jgm n LEU 214 N -4.40 1.12 -4.21 1.44 4.77 -0.74 -4.81 117.00 110.18 2jgm n LEU 214 Ca 0.10 -0.33 -0.33 0.00 -0.03 0.00 0.00 56.01 55.42 2jgm n LEU 214 Cb 0.02 -0.05 -0.16 0.00 -2.33 0.00 0.00 43.42 40.90 2jgm n LEU 214 CO 0.37 0.19 -0.50 -0.55 -1.33 0.00 0.00 177.39 175.57 2jgm s SER 215 N -2.18 3.42 0.15 -1.43 0.15 -0.54 -4.75 113.70 108.53 2jgm s SER 215 Ca 0.34 -0.54 -0.14 0.00 0.70 0.00 0.00 55.95 56.31 2jgm s SER 215 Cb 0.21 -1.52 0.02 0.00 -1.71 0.00 0.00 66.02 63.02 2jgm s SER 215 CO 0.40 0.06 1.69 0.25 1.20 0.00 0.00 173.24 176.84 2jgm h LEU 216 N 7.51 0.65 -0.85 3.45 5.85 -1.84 -2.63 115.31 127.46 2jgm h LEU 216 Ca -0.36 -0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.26 2jgm h LEU 216 Cb 1.18 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.97 2jgm h LEU 216 CO 0.58 0.65 0.51 -0.65 -0.34 0.00 0.00 178.44 179.19 2jgm h PRO 217 N 0.62 0.87 -0.85 5.25 0.11 -1.96 -2.33 132.00 133.71 2jgm h PRO 217 Ca 0.16 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 66.26 2jgm h PRO 217 Cb 0.21 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 31.07 2jgm h PRO 217 CO -0.01 0.58 0.56 0.77 -0.21 0.00 0.00 178.00 179.68 2jgm h SER 218 N 0.90 0.88 -0.96 -2.05 0.02 -1.74 -3.20 113.55 107.40 2jgm h SER 218 Ca 0.39 -0.01 0.20 0.00 -0.84 0.00 0.00 61.79 61.54 2jgm h SER 218 Cb 0.27 -0.20 -0.08 0.00 0.14 0.00 0.00 62.40 62.52 2jgm h SER 218 CO -0.21 0.60 0.61 0.03 -1.14 0.00 0.00 176.83 176.72 2jgm h ARG 219 N 1.02 0.52 0.00 3.45 2.47 -1.24 0.94 114.38 121.54 2jgm h ARG 219 Ca 0.35 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 59.03 2jgm h ARG 219 Cb 0.09 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 2jgm h ARG 219 CO -0.11 0.34 0.00 -1.13 0.56 0.00 0.00 179.97 179.63 2jgm n SER 220 N -4.60 0.00 -0.17 7.04 3.41 -1.21 -3.53 113.62 114.56 2jgm n SER 220 Ca 0.21 -1.75 0.02 0.00 -0.26 0.00 0.00 58.87 57.10 2jgm n SER 220 Cb 0.67 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.64 2jgm n SER 220 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jgm n LEU 221 N -0.52 1.31 -3.77 1.04 4.77 0.32 -5.04 117.00 115.12 2jgm n LEU 221 Ca 0.01 -0.97 -0.09 0.00 -0.03 0.00 0.00 56.01 54.93 2jgm n LEU 221 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2jgm n LEU 221 CO 0.00 0.28 0.34 0.72 -1.33 0.00 0.00 177.39 177.41 2jgm s PHE 222 N -0.44 -0.14 0.00 -1.77 -0.71 -1.23 -4.86 117.98 108.83 2jgm s PHE 222 Ca 0.05 -0.23 0.00 0.00 -1.04 0.00 0.00 56.93 55.71 2jgm s PHE 222 Cb 0.04 0.49 0.00 0.00 -1.21 0.00 0.00 43.02 42.33 2jgm s PHE 222 CO 0.06 -1.02 0.00 0.72 -1.34 0.00 0.00 175.22 173.65 2jgm n HIS 223 N -0.39 0.00 -4.14 3.49 8.25 0.55 -4.94 115.22 118.05 2jgm n HIS 223 Ca -0.08 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.28 2jgm n HIS 223 Cb 0.62 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.63 2jgm n HIS 223 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2jgm s ARG 224 N -1.83 1.07 -0.01 -0.41 0.52 -1.19 -4.40 118.95 112.70 2jgm s ARG 224 Ca 0.00 -1.46 -0.12 0.00 -0.52 0.00 0.00 55.73 53.63 2jgm s ARG 224 Cb 0.00 0.28 0.02 0.00 0.52 0.00 0.00 34.95 35.76 2jgm s ARG 224 CO 0.00 -0.34 0.25 0.00 0.02 0.00 0.00 175.30 175.24 2jgm s ALA 225 N -4.07 -0.64 -0.09 2.13 0.00 -1.04 -2.08 121.76 115.97 2jgm s ALA 225 Ca 0.28 0.21 0.02 0.00 0.00 0.00 0.00 51.96 52.47 2jgm s ALA 225 Cb 0.06 0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.25 2jgm s ALA 225 CO 0.05 -0.24 -0.15 0.08 0.00 0.00 0.00 175.76 175.50 2jgm s VAL 226 N -1.26 1.46 -0.26 0.00 1.01 -0.35 -1.12 120.40 119.88 2jgm s VAL 226 Ca -0.13 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.22 2jgm s VAL 226 Cb -0.06 -1.32 0.05 0.00 0.00 0.00 0.00 36.38 35.05 2jgm s VAL 226 CO 0.03 0.43 -0.08 -0.76 0.00 0.00 0.00 175.10 174.72 2jgm s LEU 227 N 0.80 3.41 -0.23 3.92 1.02 -0.31 -2.93 118.68 124.37 2jgm s LEU 227 Ca -0.11 -1.21 -0.07 0.00 0.02 0.00 0.00 54.13 52.76 2jgm s LEU 227 Cb -0.16 -1.61 -0.03 0.00 0.02 0.00 0.00 46.19 44.41 2jgm s LEU 227 CO 0.02 -0.18 0.07 -1.10 0.02 0.00 0.00 176.35 175.17 2jgm s GLN 228 N 1.20 3.77 -1.64 1.70 -0.21 -0.64 -2.52 119.66 121.32 2jgm s GLN 228 Ca -0.05 -0.43 -0.12 0.00 0.02 0.00 0.00 55.36 54.78 2jgm s GLN 228 Cb -0.19 -3.29 0.11 0.00 1.00 0.00 0.00 33.01 30.64 2jgm s GLN 228 CO -0.05 -0.03 0.55 0.43 -2.12 0.00 0.00 175.29 174.08 2jgm n SER 229 N 4.46 -1.73 -3.59 5.90 7.64 -0.51 -4.23 113.62 121.55 2jgm n SER 229 Ca -0.16 -1.08 -0.04 0.00 1.01 0.00 0.00 58.87 58.59 2jgm n SER 229 Cb 0.52 -2.49 -0.02 0.00 -1.01 0.00 0.00 64.21 61.21 2jgm n SER 229 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2jgm s GLY 230 N -3.71 -0.32 0.08 0.23 0.00 -1.26 -4.79 107.32 97.55 2jgm s GLY 230 Ca 0.47 1.48 -0.15 0.00 0.00 0.00 0.00 44.72 46.52 2jgm s GLY 230 CO 0.94 0.49 0.36 -0.51 0.00 0.00 0.00 173.10 174.38 2jgm s THR 231 N -2.49 0.08 0.16 0.90 -4.23 -1.26 -4.27 115.64 104.52 2jgm s THR 231 Ca 0.09 -0.64 -0.06 0.00 -1.18 0.00 0.00 61.69 59.91 2jgm s THR 231 Cb -0.01 -1.08 -0.10 0.00 1.34 0.00 0.00 72.50 72.65 2jgm s THR 231 CO -0.05 -0.35 1.42 -0.65 -0.54 0.00 0.00 174.62 174.45 2jgm h PRO 232 N 2.77 0.59 -7.28 3.99 0.11 -1.85 -3.40 132.00 126.92 2jgm h PRO 232 Ca -0.33 -0.44 -0.43 0.00 0.11 0.00 0.00 66.00 64.92 2jgm h PRO 232 Cb 1.22 0.08 0.19 0.00 0.11 0.00 0.00 31.00 32.60 2jgm h PRO 232 CO 0.47 1.06 0.09 0.54 -0.21 0.00 0.00 178.00 179.95 2jgm s ASN 233 N -6.99 1.23 0.00 -2.05 4.22 -1.26 -4.52 114.94 105.56 2jgm s ASN 233 Ca -0.08 1.04 0.00 0.00 -2.14 0.00 0.00 52.86 51.68 2jgm s ASN 233 Cb 0.10 -1.58 0.00 0.00 1.28 0.00 0.00 41.25 41.05 2jgm s ASN 233 CO 0.86 -3.98 0.00 0.61 -2.04 0.00 0.00 177.10 172.55 2jgm n GLY 234 N -0.30 1.74 0.32 0.45 0.00 -1.26 -4.68 105.19 101.45 2jgm n GLY 234 Ca 0.08 -1.98 0.06 0.00 0.00 0.00 0.00 46.02 44.17 2jgm n GLY 234 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jgm h PRO 235 N 0.00 0.49 0.00 1.61 0.13 -1.89 -3.36 132.00 128.97 2jgm h PRO 235 Ca 0.00 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2jgm h PRO 235 Cb 0.00 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.02 2jgm h PRO 235 CO 0.00 0.32 -1.66 -2.67 -0.23 0.00 0.00 178.00 173.76 2jgm n TRP 236 N -4.48 0.00 0.17 1.56 4.27 -1.26 -4.67 117.44 113.03 2jgm n TRP 236 Ca 0.04 0.00 0.10 0.00 -3.89 0.00 0.00 57.50 53.75 2jgm n TRP 236 Cb 0.13 -0.33 0.09 0.00 -1.36 0.00 0.00 31.31 29.84 2jgm n TRP 236 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2jgm h ALA 237 N 1.33 0.80 -2.35 -1.67 0.00 -1.84 -3.48 119.26 112.06 2jgm h ALA 237 Ca -0.00 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.64 2jgm h ALA 237 Cb 0.67 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.30 2jgm h ALA 237 CO 0.00 0.16 -0.68 0.95 0.00 0.00 0.00 179.25 179.68 2jgm s THR 238 N -3.19 0.24 0.09 0.00 -4.23 -1.26 -3.71 115.64 103.59 2jgm s THR 238 Ca 0.04 -1.69 0.03 0.00 -1.18 0.00 0.00 61.69 58.89 2jgm s THR 238 Cb 0.07 -1.36 -0.04 0.00 1.34 0.00 0.00 72.50 72.52 2jgm s THR 238 CO 0.72 -0.92 -0.09 0.68 -0.54 0.00 0.00 174.62 174.47 2jgm s VAL 239 N -3.54 0.85 0.45 2.29 -7.23 -0.84 -4.98 120.40 107.40 2jgm s VAL 239 Ca 0.04 -1.67 -0.21 0.00 -1.81 0.00 0.00 61.98 58.33 2jgm s VAL 239 Cb 0.05 -1.38 -0.10 0.00 0.56 0.00 0.00 36.38 35.51 2jgm s VAL 239 CO -0.08 -0.62 0.99 -0.94 -0.31 0.00 0.00 175.10 174.13 2jgm s SER 240 N -2.54 6.68 0.20 4.85 1.04 -1.26 -0.24 113.70 122.44 2jgm s SER 240 Ca 0.06 1.79 -0.17 0.00 0.48 0.00 0.00 55.95 58.12 2jgm s SER 240 Cb -0.01 -2.55 0.19 0.00 0.10 0.00 0.00 66.02 63.75 2jgm s SER 240 CO -0.01 -0.54 1.61 0.00 0.98 0.00 0.00 173.24 175.28 2jgm h ALA 241 N 1.76 0.22 -0.39 5.32 0.00 -1.93 -1.24 119.26 123.00 2jgm h ALA 241 Ca -0.49 0.21 0.08 0.00 0.00 0.00 0.00 54.91 54.71 2jgm h ALA 241 Cb 1.20 0.60 -0.08 0.00 0.00 0.00 0.00 17.79 19.50 2jgm h ALA 241 CO 0.60 -0.53 -0.18 0.78 0.00 0.00 0.00 179.25 179.93 2jgm h GLY 242 N -0.08 0.13 1.93 0.00 0.00 -1.93 -2.32 103.07 100.80 2jgm h GLY 242 Ca 0.27 0.22 -0.09 0.00 0.00 0.00 0.00 47.33 47.74 2jgm h GLY 242 CO -0.65 -0.19 -0.40 -2.09 0.00 0.00 0.00 176.54 173.21 2jgm h GLU 243 N -0.10 0.08 -0.24 4.80 4.57 -1.67 -2.58 114.58 119.43 2jgm h GLU 243 Ca 0.19 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.29 2jgm h GLU 243 Cb 0.40 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 2jgm h GLU 243 CO -0.46 0.47 -0.04 0.00 -1.18 0.00 0.00 179.01 177.81 2jgm h ALA 244 N 1.52 0.33 -0.50 2.92 0.00 -0.78 -1.64 119.26 121.11 2jgm h ALA 244 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2jgm h ALA 244 Cb 0.74 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2jgm h ALA 244 CO 0.06 0.11 0.31 -0.09 0.00 0.00 0.00 179.25 179.64 2jgm h ARG 245 N 0.21 0.66 -0.05 0.00 2.43 -1.29 0.16 114.38 116.51 2jgm h ARG 245 Ca 0.06 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 2jgm h ARG 245 Cb 0.48 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2jgm h ARG 245 CO 0.02 0.45 -0.00 -0.09 -1.51 0.00 0.00 179.97 178.84 2jgm h ARG 246 N 0.68 0.09 0.00 0.20 2.43 -1.29 -1.90 114.38 114.59 2jgm h ARG 246 Ca 0.18 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.24 2jgm h ARG 246 Cb -0.05 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 2jgm h ARG 246 CO -0.04 0.40 -0.39 0.00 -1.51 0.00 0.00 179.97 178.43 2jgm h ARG 247 N -0.23 0.00 0.26 0.20 3.08 -0.61 -0.36 114.38 116.73 2jgm h ARG 247 Ca 0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2jgm h ARG 247 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.41 2jgm h ARG 247 CO 0.00 0.39 -0.12 0.00 -1.07 0.00 0.00 179.97 179.16 2jgm h ALA 248 N 1.61 -0.35 -0.68 0.04 0.00 -0.66 -1.80 119.26 117.42 2jgm h ALA 248 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2jgm h ALA 248 Cb 0.75 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2jgm h ALA 248 CO 0.05 -0.42 0.43 1.79 0.00 0.00 0.00 179.25 181.11 2jgm h THR 249 N -0.91 1.18 -0.72 0.00 1.35 -1.26 -0.35 112.91 112.20 2jgm h THR 249 Ca -0.04 -0.36 -0.07 0.00 -0.55 0.00 0.00 66.41 65.40 2jgm h THR 249 Cb 0.50 0.19 -0.03 0.00 -1.73 0.00 0.00 68.15 67.09 2jgm h THR 249 CO 0.06 0.18 0.19 0.25 -0.25 0.00 0.00 175.52 175.95 2jgm h LEU 250 N 0.93 1.08 -0.63 3.87 5.85 -1.09 -0.16 115.31 125.17 2jgm h LEU 250 Ca 0.25 -0.22 -0.07 0.00 0.84 0.00 0.00 57.88 58.68 2jgm h LEU 250 Cb -0.08 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.64 2jgm h LEU 250 CO -0.05 1.02 0.11 0.25 -0.34 0.00 0.00 178.44 179.43 2jgm h LEU 251 N 1.09 0.98 0.31 2.25 5.85 -0.31 -1.84 115.31 123.66 2jgm h LEU 251 Ca 0.23 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2jgm h LEU 251 Cb 0.35 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.12 2jgm h LEU 251 CO -0.00 0.99 -0.15 0.00 -0.34 0.00 0.00 178.44 178.93 2jgm h ALA 252 N 1.03 -0.43 -0.77 1.25 0.00 -0.80 -1.99 119.26 117.55 2jgm h ALA 252 Ca 0.19 -0.09 0.16 0.00 0.00 0.00 0.00 54.91 55.17 2jgm h ALA 252 Cb 0.42 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2jgm h ALA 252 CO 0.01 -0.74 0.52 -0.09 0.00 0.00 0.00 179.25 178.95 2jgm h ARG 253 N -0.43 0.36 0.00 0.00 2.43 -0.99 0.03 114.38 115.78 2jgm h ARG 253 Ca -0.04 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2jgm h ARG 253 Cb 0.33 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 2jgm h ARG 253 CO 0.07 0.24 0.00 -0.07 -1.51 0.00 0.00 179.97 178.69 2jgm h LEU 254 N 0.37 0.00 -3.34 3.80 3.38 -0.57 -2.92 115.31 116.03 2jgm h LEU 254 Ca 0.38 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.12 2jgm h LEU 254 Cb 0.96 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.53 2jgm h LEU 254 CO -0.12 0.00 -0.50 1.33 0.09 0.00 0.00 178.44 179.24 2jgm n VAL 255 N -2.58 2.42 -3.41 1.22 0.24 -0.15 -4.99 118.33 111.08 2jgm n VAL 255 Ca 0.03 -3.50 -0.17 0.00 -2.04 0.00 0.00 64.34 58.65 2jgm n VAL 255 Cb 0.33 -0.59 0.09 0.00 -1.47 0.00 0.00 33.84 32.20 2jgm n VAL 255 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jgm n GLY 256 N -0.98 -0.36 1.64 7.63 0.00 -1.01 -5.03 105.19 107.09 2jgm n GLY 256 Ca 0.31 0.10 -0.13 0.00 0.00 0.00 0.00 46.02 46.30 2jgm n GLY 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jgm n ASN 265 N -1.68 0.00 -0.02 0.00 4.05 -1.26 -4.81 115.26 111.54 2jgm n ASN 265 Ca -0.04 0.86 -0.09 0.00 0.45 0.00 0.00 54.58 55.75 2jgm n ASN 265 Cb 0.30 -1.29 -0.04 0.00 1.23 0.00 0.00 39.78 39.98 2jgm n ASN 265 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 177.26 174.65 2jgm h ASP 266 N 2.30 -0.09 -0.22 1.20 3.32 -2.00 -2.26 116.42 118.68 2jgm h ASP 266 Ca 0.00 0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.12 2jgm h ASP 266 Cb 0.00 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 2jgm h ASP 266 CO 0.00 -0.02 0.02 0.74 -1.72 0.00 0.00 179.24 178.26 2jgm h THR 267 N 0.03 0.88 -0.10 0.35 2.02 -2.01 -1.62 112.91 112.46 2jgm h THR 267 Ca 0.07 -0.03 -0.12 0.00 0.77 0.00 0.00 66.41 67.09 2jgm h THR 267 Cb 0.10 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 2jgm h THR 267 CO -0.13 0.02 -0.49 -0.33 0.37 0.00 0.00 175.52 174.96 2jgm h GLU 268 N 0.10 0.25 -0.32 6.66 5.08 -1.98 -1.74 114.58 122.62 2jgm h GLU 268 Ca 0.10 -0.14 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 2jgm h GLU 268 Cb 0.11 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 2jgm h GLU 268 CO -0.15 0.68 -0.08 1.25 -1.00 0.00 0.00 179.01 179.71 2jgm h LEU 269 N 0.20 0.63 -0.06 1.33 6.46 -0.90 -2.36 115.31 120.61 2jgm h LEU 269 Ca 0.01 -0.37 -0.03 0.00 -0.12 0.00 0.00 57.88 57.37 2jgm h LEU 269 Cb 0.93 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.69 2jgm h LEU 269 CO 0.08 0.85 -0.09 0.40 -0.62 0.00 0.00 178.44 179.06 2jgm h ILE 270 N 0.40 1.39 -0.95 4.05 2.04 -1.26 -2.47 117.51 120.71 2jgm h ILE 270 Ca 0.08 -1.32 0.25 0.00 1.00 0.00 0.00 64.86 64.87 2jgm h ILE 270 Cb 0.58 2.13 -0.13 0.00 -0.74 0.00 0.00 36.82 38.66 2jgm h ILE 270 CO 0.03 0.36 0.47 0.00 0.00 0.00 0.00 178.15 179.02 2jgm h ALA 271 N 0.52 1.62 -0.34 1.87 0.00 -1.34 0.26 119.26 121.86 2jgm h ALA 271 Ca 0.01 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2jgm h ALA 271 Cb 0.63 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2jgm h ALA 271 CO 0.02 -0.38 -0.06 0.00 0.00 0.00 0.00 179.25 178.83 2jgm h LEU 273 N 0.43 0.70 -2.01 0.00 3.38 -0.48 -2.60 115.31 114.72 2jgm h LEU 273 Ca 0.09 -0.06 0.16 0.00 0.09 0.00 0.00 57.88 58.15 2jgm h LEU 273 Cb 0.55 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2jgm h LEU 273 CO 0.03 0.55 0.43 0.03 0.09 0.00 0.00 178.44 179.57 2jgm h ARG 274 N 0.78 0.00 0.00 1.13 3.08 -0.48 -0.71 114.38 118.18 2jgm h ARG 274 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2jgm h ARG 274 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2jgm h ARG 274 CO -0.04 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.11 2jgm n THR 275 N -4.18 0.14 -3.35 2.04 -2.24 -0.98 -4.87 114.28 100.85 2jgm n THR 275 Ca 0.10 0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.51 2jgm n THR 275 Cb 0.65 -0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 68.26 2jgm n THR 275 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2jgm s ARG 276 N -3.01 4.22 0.41 -0.78 1.81 -0.27 -5.05 118.95 116.28 2jgm s ARG 276 Ca 0.13 0.49 -0.23 0.00 -1.72 0.00 0.00 55.73 54.40 2jgm s ARG 276 Cb 0.18 -3.36 -0.13 0.00 -0.45 0.00 0.00 34.95 31.19 2jgm s ARG 276 CO 0.51 0.35 0.55 -0.35 -0.68 0.00 0.00 175.30 175.68 2jgm n PRO 277 N 2.95 0.57 -0.21 3.54 -0.04 -1.26 -4.86 135.00 135.68 2jgm n PRO 277 Ca -0.09 0.21 0.02 0.00 -0.04 0.00 0.00 63.50 63.60 2jgm n PRO 277 Cb 0.52 -1.49 0.13 0.00 -0.04 0.00 0.00 33.50 32.62 2jgm n PRO 277 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jgm h ALA 278 N 0.84 0.79 0.00 0.55 0.00 -1.96 -1.89 119.26 117.58 2jgm h ALA 278 Ca -0.40 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2jgm h ALA 278 Cb 1.40 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2jgm h ALA 278 CO 0.52 -0.30 0.00 0.37 0.00 0.00 0.00 179.25 179.84 2jgm h GLN 279 N 0.28 0.00 0.06 0.00 5.75 -2.00 -2.44 115.11 116.76 2jgm h GLN 279 Ca 0.34 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.84 2jgm h GLN 279 Cb 0.53 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.08 2jgm h GLN 279 CO -0.43 0.00 -0.03 -0.44 -2.65 0.00 0.00 178.83 175.28 2jgm h ASP 280 N 0.00 -0.07 -0.86 -0.69 5.19 -1.68 -2.07 116.42 116.24 2jgm h ASP 280 Ca 0.00 -0.23 0.07 0.00 -0.62 0.00 0.00 57.03 56.25 2jgm h ASP 280 Cb 0.42 0.02 -0.07 0.00 0.18 0.00 0.00 39.33 39.89 2jgm h ASP 280 CO 0.00 0.20 0.52 -0.07 -3.12 0.00 0.00 179.24 176.77 2jgm h LEU 281 N -0.34 0.80 -1.27 1.55 3.38 -1.50 -2.42 115.31 115.52 2jgm h LEU 281 Ca -0.01 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 2jgm h LEU 281 Cb 0.30 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2jgm h LEU 281 CO 0.01 0.50 -0.24 0.58 0.09 0.00 0.00 178.44 179.38 2jgm h VAL 282 N 0.93 1.22 -0.50 1.22 2.07 -1.49 -2.06 116.25 117.64 2jgm h VAL 282 Ca 0.39 -1.04 0.07 0.00 0.82 0.00 0.00 66.70 66.94 2jgm h VAL 282 Cb 0.23 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2jgm h VAL 282 CO -0.20 0.31 0.34 0.44 0.02 0.00 0.00 177.57 178.49 2jgm h ASP 283 N 0.18 0.34 -0.18 0.57 3.32 -0.84 -2.91 116.42 116.90 2jgm h ASP 283 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2jgm h ASP 283 Cb 0.53 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.01 2jgm h ASP 283 CO 0.04 0.22 0.00 1.41 -1.72 0.00 0.00 179.24 179.18 2jgm n HIS 284 N -4.47 0.23 -0.13 4.55 8.25 -1.07 -4.64 115.22 117.94 2jgm n HIS 284 Ca 0.07 -0.31 0.03 0.00 -0.26 0.00 0.00 57.72 57.25 2jgm n HIS 284 Cb 0.29 -0.02 0.33 0.00 1.12 0.00 0.00 29.99 31.71 2jgm n HIS 284 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2jgm h GLU 285 N 1.68 0.77 -0.62 -0.41 4.81 -1.16 -2.14 114.58 117.51 2jgm h GLU 285 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2jgm h GLU 285 Cb 0.57 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.77 2jgm h GLU 285 CO 0.00 0.51 0.00 0.91 -0.73 0.00 0.00 179.01 179.70 2jgm n TRP 286 N -4.45 0.83 -0.41 0.92 7.02 -1.26 -3.99 117.44 116.09 2jgm n TRP 286 Ca 0.07 -0.41 0.06 0.00 -1.02 0.00 0.00 57.50 56.19 2jgm n TRP 286 Cb 0.07 0.00 0.16 0.00 -2.42 0.00 0.00 31.31 29.13 2jgm n TRP 286 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 2jgm n HIS 287 N 1.34 0.52 0.01 -5.99 8.25 -0.80 -4.52 115.22 114.02 2jgm n HIS 287 Ca 0.21 -0.62 -0.10 0.00 -0.26 0.00 0.00 57.72 56.95 2jgm n HIS 287 Cb 0.53 -0.11 -0.14 0.00 1.12 0.00 0.00 29.99 31.39 2jgm n HIS 287 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2jgm h VAL 288 N 1.65 1.08 -3.56 1.59 2.07 -1.69 -3.38 116.25 114.00 2jgm h VAL 288 Ca 0.00 -2.86 -0.67 0.00 0.82 0.00 0.00 66.70 63.99 2jgm h VAL 288 Cb 0.91 2.57 -0.38 0.00 -1.52 0.00 0.00 31.29 32.87 2jgm h VAL 288 CO 0.06 0.67 -0.62 -0.76 0.02 0.00 0.00 177.57 176.95 2jgm s LEU 289 N -6.42 4.91 0.28 2.57 1.43 -1.26 -4.95 118.68 115.24 2jgm s LEU 289 Ca -0.05 -2.31 0.02 0.00 -1.03 0.00 0.00 54.13 50.75 2jgm s LEU 289 Cb 0.08 -1.72 0.42 0.00 0.03 0.00 0.00 46.19 45.00 2jgm s LEU 289 CO 0.82 -0.41 1.74 1.55 0.23 0.00 0.00 176.35 180.28 2jgm h PRO 290 N 7.53 0.54 -0.58 1.29 0.13 -1.84 -3.44 132.00 135.62 2jgm h PRO 290 Ca -0.07 -0.18 -0.05 0.00 -0.87 0.00 0.00 66.00 64.82 2jgm h PRO 290 Cb 1.00 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 2jgm h PRO 290 CO 0.62 0.70 0.22 1.04 -0.23 0.00 0.00 178.00 180.35 2jgm n GLN 291 N -4.15 0.00 -0.13 0.86 6.02 -1.26 -4.66 117.38 114.05 2jgm n GLN 291 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.96 2jgm n GLN 291 Cb 0.37 -0.15 -0.01 0.00 1.02 0.00 0.00 30.24 31.47 2jgm n GLN 291 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2jgm n GLU 292 N 0.85 0.33 -1.54 -1.09 2.13 -1.26 -4.78 120.64 115.28 2jgm n GLU 292 Ca 0.08 -0.41 -0.11 0.00 0.66 0.00 0.00 57.16 57.38 2jgm n GLU 292 Cb 0.01 -1.83 0.06 0.00 0.27 0.00 0.00 31.44 29.95 2jgm n GLU 292 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2jgm n SER 293 N 3.89 0.63 -0.07 4.31 3.41 -1.26 -4.73 113.62 119.81 2jgm n SER 293 Ca 0.07 -1.54 -0.22 0.00 -0.26 0.00 0.00 58.87 56.92 2jgm n SER 293 Cb 0.07 -0.32 -0.12 0.00 -0.26 0.00 0.00 64.21 63.57 2jgm n SER 293 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2jgm n ILE 294 N -2.13 1.62 -1.52 -1.33 5.41 -1.26 -4.45 119.36 115.69 2jgm n ILE 294 Ca 0.08 -0.26 -0.29 0.00 1.00 0.00 0.00 62.75 63.29 2jgm n ILE 294 Cb 0.29 -1.93 -0.06 0.00 -0.71 0.00 0.00 39.64 37.23 2jgm n ILE 294 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 2jgm n PHE 295 N -4.10 1.64 0.87 1.39 3.01 -1.26 -4.54 117.46 114.47 2jgm n PHE 295 Ca -0.33 -2.16 0.02 0.00 1.01 0.00 0.00 57.45 55.98 2jgm n PHE 295 Cb 0.82 -1.60 0.07 0.00 -0.01 0.00 0.00 39.48 38.76 2jgm n PHE 295 CO 0.00 0.00 0.00 2.89 1.01 0.00 0.00 176.76 180.66 2jgm n ARG 296 N 1.52 1.63 -2.38 -1.08 1.85 -1.26 -4.87 116.66 112.08 2jgm n ARG 296 Ca 0.53 -0.57 -0.42 0.00 -1.00 0.00 0.00 57.85 56.40 2jgm n ARG 296 Cb 0.51 -1.51 -0.03 0.00 -1.05 0.00 0.00 32.46 30.38 2jgm n ARG 296 CO 0.00 0.00 0.00 -0.59 -0.01 0.00 0.00 177.63 177.03 2jgm s PHE 297 N -1.45 3.41 -0.08 2.89 -0.71 -1.26 -4.39 117.98 116.39 2jgm s PHE 297 Ca 0.10 1.27 0.21 0.00 -1.04 0.00 0.00 56.93 57.47 2jgm s PHE 297 Cb 0.07 -3.46 -0.31 0.00 -1.21 0.00 0.00 43.02 38.11 2jgm s PHE 297 CO 0.04 -1.43 0.35 0.43 -1.34 0.00 0.00 175.22 173.27 2jgm n SER 298 N 3.66 0.06 -4.04 1.98 7.64 -1.26 -4.80 113.62 116.86 2jgm n SER 298 Ca 0.08 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.64 2jgm n SER 298 Cb 0.45 1.69 -0.14 0.00 -1.01 0.00 0.00 64.21 65.20 2jgm n SER 298 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2jgm s PHE 299 N -3.19 3.73 0.28 1.43 0.08 -1.26 -5.00 117.98 114.05 2jgm s PHE 299 Ca -0.09 -2.90 0.02 0.00 0.12 0.00 0.00 56.93 54.09 2jgm s PHE 299 Cb 0.11 -2.98 -0.05 0.00 -0.57 0.00 0.00 43.02 39.54 2jgm s PHE 299 CO 0.88 -0.95 0.10 0.14 -0.10 0.00 0.00 175.22 175.29 2jgm s VAL 300 N 0.95 0.58 0.49 -0.44 -7.23 -1.26 -4.50 120.40 108.99 2jgm s VAL 300 Ca 0.10 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 58.05 2jgm s VAL 300 Cb -0.20 -2.62 -0.08 0.00 0.56 0.00 0.00 36.38 34.04 2jgm s VAL 300 CO -0.07 0.00 1.06 -2.65 -0.31 0.00 0.00 175.10 173.13 2jgm n PRO 301 N -0.53 1.32 -4.89 4.82 -0.02 -1.24 -4.73 135.00 129.73 2jgm n PRO 301 Ca -0.00 0.48 -0.33 0.00 -2.02 0.00 0.00 63.50 61.63 2jgm n PRO 301 Cb 0.66 -2.18 -0.14 0.00 -0.02 0.00 0.00 33.50 31.82 2jgm n PRO 301 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2jgm s VAL 302 N -1.35 2.97 -0.40 -1.45 0.11 -1.26 -1.98 120.40 117.03 2jgm s VAL 302 Ca 0.68 -0.73 -0.28 0.00 -2.93 0.00 0.00 61.98 58.71 2jgm s VAL 302 Cb -0.49 -2.18 -0.01 0.00 -1.53 0.00 0.00 36.38 32.17 2jgm s VAL 302 CO 0.53 0.57 1.69 -0.69 -3.33 0.00 0.00 175.10 173.87 2jgm s VAL 303 N -0.36 3.59 -0.28 2.04 1.01 0.67 -4.63 120.40 122.44 2jgm s VAL 303 Ca 0.03 0.57 0.03 0.00 0.00 0.00 0.00 61.98 62.61 2jgm s VAL 303 Cb -0.12 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.39 2jgm s VAL 303 CO 0.02 -0.61 0.47 -0.90 0.00 0.00 0.00 175.10 174.08 2jgm n ASP 304 N 10.22 0.97 0.00 3.32 5.75 -1.17 -3.21 116.55 132.43 2jgm n ASP 304 Ca 0.20 -0.98 0.00 0.00 -0.01 0.00 0.00 54.79 54.00 2jgm n ASP 304 Cb 0.48 0.23 0.00 0.00 -1.03 0.00 0.00 41.12 40.79 2jgm n ASP 304 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jgm n GLY 305 N 0.35 0.18 0.00 6.12 0.00 0.13 -4.77 105.19 107.19 2jgm n GLY 305 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2jgm n GLY 305 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jgm n ASP 306 N -0.30 0.00 0.03 1.61 -0.08 -1.26 -4.59 116.55 111.95 2jgm n ASP 306 Ca 0.00 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.16 2jgm n ASP 306 Cb 0.15 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.54 2jgm n ASP 306 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 2jgm h PHE 307 N 0.00 0.03 -3.21 -0.67 3.04 -1.92 -3.28 116.94 110.94 2jgm h PHE 307 Ca 0.00 0.00 -0.74 0.00 3.98 0.00 0.00 57.97 61.21 2jgm h PHE 307 Cb 0.00 -0.01 -0.26 0.00 2.56 0.00 0.00 35.95 38.24 2jgm h PHE 307 CO 0.00 0.04 -0.31 -0.51 -2.02 0.00 0.00 178.31 175.51 2jgm s LEU 308 N -10.14 5.90 0.30 0.59 1.43 -1.26 -4.55 118.68 110.94 2jgm s LEU 308 Ca -0.13 -1.78 0.21 0.00 -1.03 0.00 0.00 54.13 51.40 2jgm s LEU 308 Cb 0.06 -2.12 1.10 0.00 0.03 0.00 0.00 46.19 45.26 2jgm s LEU 308 CO 0.66 -0.76 1.64 -1.54 0.23 0.00 0.00 176.35 176.59 2jgm n SER 309 N 5.10 0.56 -3.62 2.29 3.41 -1.24 -0.69 113.62 119.43 2jgm n SER 309 Ca -0.11 0.74 -0.04 0.00 -0.26 0.00 0.00 58.87 59.20 2jgm n SER 309 Cb 0.41 -0.82 -0.02 0.00 -0.26 0.00 0.00 64.21 63.52 2jgm n SER 309 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2jgm s ASP 310 N -4.02 -0.09 0.37 4.04 -1.08 -1.26 -4.46 116.67 110.17 2jgm s ASP 310 Ca -0.01 0.01 -0.24 0.00 -0.52 0.00 0.00 52.55 51.79 2jgm s ASP 310 Cb 0.06 0.09 -0.13 0.00 -1.46 0.00 0.00 42.92 41.48 2jgm s ASP 310 CO 0.22 -0.14 0.63 0.35 0.52 0.00 0.00 175.17 176.75 2jgm n THR 311 N 0.02 1.83 -0.30 1.71 -2.24 -1.26 -4.56 114.28 109.49 2jgm n THR 311 Ca 0.02 -0.50 0.05 0.00 -2.27 0.00 0.00 64.05 61.35 2jgm n THR 311 Cb 0.58 -0.56 0.20 0.00 -2.10 0.00 0.00 70.33 68.44 2jgm n THR 311 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2jgm h PRO 312 N 1.06 0.69 -0.00 -0.78 0.11 -1.98 -0.11 132.00 130.99 2jgm h PRO 312 Ca -0.39 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.71 2jgm h PRO 312 Cb 1.39 -0.16 -0.06 0.00 0.11 0.00 0.00 31.00 32.29 2jgm h PRO 312 CO 0.54 0.46 -0.44 0.93 -0.21 0.00 0.00 178.00 179.28 2jgm h GLU 313 N 0.71 -0.57 -0.56 1.05 3.07 -1.89 0.99 114.58 117.38 2jgm h GLU 313 Ca 0.44 0.04 0.11 0.00 -0.50 0.00 0.00 59.36 59.44 2jgm h GLU 313 Cb 0.52 0.13 -0.11 0.00 -0.84 0.00 0.00 28.75 28.45 2jgm h GLU 313 CO -0.31 -0.38 -0.26 0.00 -1.40 0.00 0.00 179.01 176.66 2jgm h ALA 314 N -0.10 0.11 -0.50 3.43 0.00 -1.69 -1.64 119.26 118.87 2jgm h ALA 314 Ca 0.04 0.18 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 2jgm h ALA 314 Cb 0.67 0.64 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2jgm h ALA 314 CO -0.33 -0.59 -0.03 -0.07 0.00 0.00 0.00 179.25 178.23 2jgm h LEU 315 N -0.12 0.89 -1.29 0.00 3.38 0.90 -2.24 115.31 116.83 2jgm h LEU 315 Ca 0.25 -0.32 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 2jgm h LEU 315 Cb 0.51 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2jgm h LEU 315 CO -0.63 1.00 -0.34 0.16 0.09 0.00 0.00 178.44 178.72 2jgm h ILE 316 N 0.76 1.06 0.00 1.22 3.07 0.10 -2.34 117.51 121.38 2jgm h ILE 316 Ca 0.14 -1.23 -0.12 0.00 1.55 0.00 0.00 64.86 65.20 2jgm h ILE 316 Cb 0.56 1.70 -0.02 0.00 -0.27 0.00 0.00 36.82 38.79 2jgm h ILE 316 CO 0.03 0.33 -0.56 0.78 -1.05 0.00 0.00 178.15 177.68 2jgm h ASN 317 N 0.00 0.00 -0.01 2.16 4.21 -0.70 -3.33 115.58 117.91 2jgm h ASN 317 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2jgm h ASN 317 Cb 0.67 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.87 2jgm h ASN 317 CO 0.04 0.56 0.00 0.35 -1.29 0.00 0.00 177.43 177.09 2jgm n THR 318 N -3.78 0.11 -1.77 2.81 -2.24 -1.03 -5.04 114.28 103.33 2jgm n THR 318 Ca -0.01 -0.55 -0.30 0.00 -2.27 0.00 0.00 64.05 60.92 2jgm n THR 318 Cb 0.58 0.97 0.07 0.00 -2.10 0.00 0.00 70.33 69.85 2jgm n THR 318 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jgm s GLY 319 N -0.21 1.62 -0.30 3.38 0.00 -0.89 -5.06 107.32 105.87 2jgm s GLY 319 Ca 0.02 -0.35 -0.02 0.00 0.00 0.00 0.00 44.72 44.37 2jgm s GLY 319 CO 0.02 0.06 -0.01 -0.35 0.00 0.00 0.00 173.10 172.82 2jgm s ASP 320 N -4.24 4.85 -0.39 1.64 2.15 -1.26 -4.88 116.67 114.53 2jgm s ASP 320 Ca 0.60 -1.25 0.05 0.00 0.43 0.00 0.00 52.55 52.38 2jgm s ASP 320 Cb -0.12 -1.70 0.52 0.00 -0.30 0.00 0.00 42.92 41.31 2jgm s ASP 320 CO 0.52 -0.25 1.61 0.49 -0.17 0.00 0.00 175.17 177.38 2jgm n PHE 321 N 4.62 2.12 -0.14 -5.34 3.72 -0.74 -4.81 117.46 116.90 2jgm n PHE 321 Ca -0.13 -2.02 -0.06 0.00 -0.05 0.00 0.00 57.45 55.18 2jgm n PHE 321 Cb 0.43 -0.74 -0.00 0.00 -0.94 0.00 0.00 39.48 38.24 2jgm n PHE 321 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 2jgm h GLN 322 N 1.37 -0.20 -0.98 -1.08 1.08 -1.72 -2.82 115.11 110.76 2jgm h GLN 322 Ca 0.40 0.01 -0.66 0.00 -1.45 0.00 0.00 58.65 56.95 2jgm h GLN 322 Cb 1.72 0.04 -0.30 0.00 -0.05 0.00 0.00 27.48 28.89 2jgm h GLN 322 CO 0.81 -0.13 0.77 -0.25 -0.95 0.00 0.00 178.83 179.07 2jgm n ASP 323 N -5.42 7.22 -4.14 1.46 8.00 -1.26 -4.67 116.55 117.74 2jgm n ASP 323 Ca 0.02 -3.77 -0.29 0.00 0.71 0.00 0.00 54.79 51.46 2jgm n ASP 323 Cb 0.33 -0.93 -0.17 0.00 -0.02 0.00 0.00 41.12 40.33 2jgm n ASP 323 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2jgm s LEU 324 N -3.77 1.91 -0.10 0.64 2.96 -1.08 -5.01 118.68 114.23 2jgm s LEU 324 Ca 0.63 -0.47 -0.00 0.00 -0.22 0.00 0.00 54.13 54.07 2jgm s LEU 324 Cb 0.50 -1.19 -0.03 0.00 0.50 0.00 0.00 46.19 45.97 2jgm s LEU 324 CO 0.00 0.10 -0.08 -1.10 -1.32 0.00 0.00 176.35 173.95 2jgm s GLN 325 N 0.53 3.12 -0.02 1.98 1.11 -1.26 -0.42 119.66 124.70 2jgm s GLN 325 Ca -0.16 -0.58 0.00 0.00 0.01 0.00 0.00 55.36 54.63 2jgm s GLN 325 Cb -0.17 -2.67 0.02 0.00 -1.01 0.00 0.00 33.01 29.18 2jgm s GLN 325 CO 0.06 0.45 0.00 0.08 0.01 0.00 0.00 175.29 175.89 2jgm s VAL 326 N -0.23 0.07 -0.23 1.09 1.01 0.26 -2.49 120.40 119.89 2jgm s VAL 326 Ca 0.03 0.07 -0.05 0.00 0.00 0.00 0.00 61.98 62.02 2jgm s VAL 326 Cb -0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 2jgm s VAL 326 CO 0.03 0.08 0.01 -0.22 0.00 0.00 0.00 175.10 175.00 2jgm s LEU 327 N 0.62 3.19 0.10 3.92 2.96 -0.27 -0.87 118.68 128.33 2jgm s LEU 327 Ca -0.06 -0.28 0.06 0.00 -0.22 0.00 0.00 54.13 53.64 2jgm s LEU 327 Cb -0.08 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 2jgm s LEU 327 CO -0.01 -0.01 -0.16 0.68 -1.32 0.00 0.00 176.35 175.53 2jgm s VAL 328 N 1.43 1.35 0.17 1.68 -7.23 0.11 -1.16 120.40 116.76 2jgm s VAL 328 Ca 0.05 -1.56 -0.23 0.00 -1.81 0.00 0.00 61.98 58.43 2jgm s VAL 328 Cb -0.15 -1.40 0.07 0.00 0.56 0.00 0.00 36.38 35.47 2jgm s VAL 328 CO 0.01 -0.28 1.02 -0.83 -0.31 0.00 0.00 175.10 174.70 2jgm s GLY 329 N -2.12 -0.01 0.29 2.32 0.00 -1.05 -1.36 107.32 105.39 2jgm s GLY 329 Ca 0.05 -0.16 0.02 0.00 0.00 0.00 0.00 44.72 44.64 2jgm s GLY 329 CO 0.03 1.45 0.12 -1.34 0.00 0.00 0.00 173.10 173.36 2jgm s VAL 330 N -2.55 0.55 0.41 1.40 -7.23 -0.99 -1.43 120.40 110.56 2jgm s VAL 330 Ca 0.18 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.43 2jgm s VAL 330 Cb -0.02 -2.59 -0.02 0.00 0.56 0.00 0.00 36.38 34.31 2jgm s VAL 330 CO 0.04 0.00 0.37 0.68 -0.31 0.00 0.00 175.10 175.88 2jgm s VAL 331 N -3.61 2.75 0.33 1.32 -7.23 -1.26 0.12 120.40 112.81 2jgm s VAL 331 Ca 0.36 -1.35 0.06 0.00 -1.81 0.00 0.00 61.98 59.23 2jgm s VAL 331 Cb 0.07 -3.02 0.11 0.00 0.56 0.00 0.00 36.38 34.10 2jgm s VAL 331 CO 0.15 -0.02 1.81 0.50 -0.31 0.00 0.00 175.10 177.23 2jgm h LYS 332 N 1.06 0.38 -2.14 4.82 3.64 -0.52 -3.32 116.57 120.48 2jgm h LYS 332 Ca -0.42 -0.11 -0.55 0.00 -1.27 0.00 0.00 60.65 58.30 2jgm h LYS 332 Cb 1.26 -0.04 -0.41 0.00 -0.41 0.00 0.00 32.23 32.64 2jgm h LYS 332 CO 0.57 0.55 -0.90 -0.25 -2.27 0.00 0.00 179.45 177.16 2jgm n ASP 333 N -4.19 2.54 0.20 4.20 9.92 -0.15 -4.93 116.55 124.14 2jgm n ASP 333 Ca -0.00 -3.29 0.18 0.00 -0.53 0.00 0.00 54.79 51.14 2jgm n ASP 333 Cb 0.34 -0.61 0.83 0.00 -0.64 0.00 0.00 41.12 41.05 2jgm n ASP 333 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2jgm h GLU 334 N 3.25 0.00 0.00 -1.24 4.39 -1.75 -3.08 114.58 116.15 2jgm h GLU 334 Ca 0.12 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2jgm h GLU 334 Cb 0.74 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 2jgm h GLU 334 CO 0.66 0.00 -1.52 0.41 -1.16 0.00 0.00 179.01 177.40 2jgm n GLY 335 N -1.40 -1.11 0.06 -3.84 0.00 -1.25 -4.28 105.19 93.37 2jgm n GLY 335 Ca 0.02 -0.46 -0.11 0.00 0.00 0.00 0.00 46.02 45.47 2jgm n GLY 335 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jgm h SER 336 N 0.00 0.01 -0.89 1.61 4.64 -1.76 -2.78 113.55 114.37 2jgm h SER 336 Ca 0.00 0.01 0.23 0.00 -0.47 0.00 0.00 61.79 61.56 2jgm h SER 336 Cb 0.88 0.01 -0.13 0.00 -0.31 0.00 0.00 62.40 62.85 2jgm h SER 336 CO 0.00 0.02 0.35 0.22 -0.87 0.00 0.00 176.83 176.55 2jgm h TYR 337 N 0.04 0.56 0.00 4.77 3.20 -1.80 -2.42 116.97 121.32 2jgm h TYR 337 Ca 0.03 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 2jgm h TYR 337 Cb 0.02 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 2jgm h TYR 337 CO -0.10 -0.11 -0.03 0.74 -1.64 0.00 0.00 178.16 177.02 2jgm h PHE 338 N 0.33 0.00 -0.85 -3.82 -1.00 -1.78 -3.27 116.94 106.55 2jgm h PHE 338 Ca 0.56 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.32 2jgm h PHE 338 Cb 1.11 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.63 2jgm h PHE 338 CO -0.17 0.03 0.45 -0.07 -1.61 0.00 0.00 178.31 176.94 2jgm h LEU 339 N 0.00 1.08 0.00 1.54 3.38 -1.47 -1.98 115.31 117.86 2jgm h LEU 339 Ca -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2jgm h LEU 339 Cb 0.95 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2jgm h LEU 339 CO 0.00 0.88 0.00 1.33 0.09 0.00 0.00 178.44 180.75 2jgm n VAL 340 N -4.35 0.54 -0.04 1.22 0.24 -1.23 -1.78 118.33 112.92 2jgm n VAL 340 Ca 0.09 0.13 -0.17 0.00 -2.04 0.00 0.00 64.34 62.35 2jgm n VAL 340 Cb 0.11 -0.85 -0.14 0.00 -1.47 0.00 0.00 33.84 31.49 2jgm n VAL 340 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2jgm n TYR 341 N -1.31 0.80 0.02 6.34 4.02 -0.75 -4.85 117.16 121.44 2jgm n TYR 341 Ca 0.08 0.20 -0.00 0.00 -0.01 0.00 0.00 57.90 58.16 2jgm n TYR 341 Cb 0.14 -1.12 -0.00 0.00 -0.02 0.00 0.00 39.34 38.34 2jgm n TYR 341 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jgm n GLY 342 N 1.93 -0.03 3.66 2.72 0.00 -1.18 -5.06 105.19 107.24 2jgm n GLY 342 Ca -0.32 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 2jgm n GLY 342 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2jgm n VAL 343 N -3.25 0.77 -1.70 1.61 0.31 -0.73 -4.95 118.33 110.38 2jgm n VAL 343 Ca -0.01 -0.14 -0.41 0.00 -0.01 0.00 0.00 64.34 63.77 2jgm n VAL 343 Cb 0.29 -2.31 0.01 0.00 -0.91 0.00 0.00 33.84 30.92 2jgm n VAL 343 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2jgm n PRO 344 N 7.50 1.94 -0.02 5.55 -0.02 -1.26 -3.09 135.00 145.59 2jgm n PRO 344 Ca 0.20 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 2jgm n PRO 344 Cb 0.40 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 2jgm n PRO 344 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jgm n GLY 345 N 0.81 0.38 3.42 -1.23 0.00 -1.26 -4.94 105.19 102.37 2jgm n GLY 345 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 2jgm n GLY 345 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jgm s PHE 346 N -2.14 2.89 0.05 1.61 0.40 -1.18 -4.62 117.98 115.00 2jgm s PHE 346 Ca 0.00 -0.51 -0.12 0.00 -0.60 0.00 0.00 56.93 55.70 2jgm s PHE 346 Cb 0.00 -1.88 0.01 0.00 0.51 0.00 0.00 43.02 41.66 2jgm s PHE 346 CO 0.00 -0.14 0.26 0.45 0.70 0.00 0.00 175.22 176.48 2jgm s SER 347 N 0.34 -0.05 0.08 1.36 0.15 -1.26 -4.52 113.70 109.80 2jgm s SER 347 Ca -0.08 -0.31 0.23 0.00 0.70 0.00 0.00 55.95 56.49 2jgm s SER 347 Cb -0.15 0.34 0.91 0.00 -1.71 0.00 0.00 66.02 65.40 2jgm s SER 347 CO 0.05 -0.61 1.70 2.29 1.20 0.00 0.00 173.24 177.87 2jgm n LYS 348 N 0.52 0.08 0.01 5.44 2.85 -1.26 -3.89 118.16 121.91 2jgm n LYS 348 Ca -0.18 0.20 0.04 0.00 -1.05 0.00 0.00 58.31 57.32 2jgm n LYS 348 Cb 0.60 -1.61 -0.11 0.00 -0.65 0.00 0.00 35.03 33.25 2jgm n LYS 348 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2jgm n ASP 349 N -1.75 0.41 -1.87 -5.58 8.00 -1.26 -4.43 116.55 110.06 2jgm n ASP 349 Ca 0.05 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.72 2jgm n ASP 349 Cb 0.28 1.01 0.00 0.00 -0.02 0.00 0.00 41.12 42.38 2jgm n ASP 349 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2jgm n ASN 350 N -2.60 1.91 -0.36 -2.24 0.23 -1.25 -5.04 115.26 105.90 2jgm n ASN 350 Ca -0.10 -0.94 0.14 0.00 -0.53 0.00 0.00 54.58 53.16 2jgm n ASN 350 Cb 0.74 0.00 0.51 0.00 -2.08 0.00 0.00 39.78 38.95 2jgm n ASN 350 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2jgm n GLU 351 N -0.04 1.30 -2.04 -3.83 1.02 -1.26 -4.80 120.64 111.00 2jgm n GLU 351 Ca 0.00 -0.72 -0.15 0.00 -0.02 0.00 0.00 57.16 56.27 2jgm n GLU 351 Cb 0.00 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 29.90 2jgm n GLU 351 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2jgm n SER 352 N -0.22 -4.41 -4.56 1.62 7.64 -1.26 -4.88 113.62 107.55 2jgm n SER 352 Ca 0.17 0.22 -0.42 0.00 1.01 0.00 0.00 58.87 59.85 2jgm n SER 352 Cb 0.34 -3.83 -0.04 0.00 -1.01 0.00 0.00 64.21 59.67 2jgm n SER 352 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2jgm n LEU 353 N -2.54 2.77 -4.95 -3.43 4.77 -1.26 -4.77 117.00 107.59 2jgm n LEU 353 Ca -0.17 0.05 -0.24 0.00 -0.03 0.00 0.00 56.01 55.62 2jgm n LEU 353 Cb 0.59 -1.50 -0.02 0.00 -2.33 0.00 0.00 43.42 40.15 2jgm n LEU 353 CO 0.22 -0.93 -0.01 0.27 -1.33 0.00 0.00 177.39 175.62 2jgm s ILE 354 N 9.21 5.24 0.64 -0.08 -4.36 -1.23 -4.98 121.20 125.64 2jgm s ILE 354 Ca 1.03 -0.70 -0.13 0.00 -0.26 0.00 0.00 60.65 60.59 2jgm s ILE 354 Cb -0.40 -3.81 -0.02 0.00 1.25 0.00 0.00 42.46 39.49 2jgm s ILE 354 CO 0.35 -0.28 1.05 -0.94 0.24 0.00 0.00 174.94 175.36 2jgm s SER 355 N -3.64 5.76 0.14 4.36 1.04 -1.26 -4.24 113.70 115.86 2jgm s SER 355 Ca 0.36 1.62 -0.19 0.00 0.48 0.00 0.00 55.95 58.22 2jgm s SER 355 Cb -0.10 -2.50 -0.00 0.00 0.10 0.00 0.00 66.02 63.52 2jgm s SER 355 CO 0.30 -1.18 1.71 -0.09 0.98 0.00 0.00 173.24 174.95 2jgm h ARG 356 N -0.21 0.03 -0.75 4.02 2.43 -1.91 -1.77 114.38 116.22 2jgm h ARG 356 Ca -0.45 -0.00 0.11 0.00 -0.81 0.00 0.00 59.98 58.83 2jgm h ARG 356 Cb 1.21 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.67 2jgm h ARG 356 CO 0.58 0.02 0.37 0.00 -1.51 0.00 0.00 179.97 179.43 2jgm h ALA 357 N 1.23 1.06 -0.98 2.80 0.00 -2.00 0.11 119.26 121.49 2jgm h ALA 357 Ca 0.12 0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.20 2jgm h ALA 357 Cb 0.17 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.85 2jgm h ALA 357 CO -0.23 -0.07 0.61 1.96 0.00 0.00 0.00 179.25 181.53 2jgm h GLN 358 N 0.59 0.97 -0.44 0.00 4.20 -1.81 -1.68 115.11 116.94 2jgm h GLN 358 Ca 0.38 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.92 2jgm h GLN 358 Cb 0.46 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 2jgm h GLN 358 CO -0.31 0.64 -0.19 0.35 -0.67 0.00 0.00 178.83 178.65 2jgm h PHE 359 N 0.99 0.96 -0.06 2.96 3.04 0.04 0.29 116.94 125.16 2jgm h PHE 359 Ca 0.47 -0.21 -0.18 0.00 3.98 0.00 0.00 57.97 62.03 2jgm h PHE 359 Cb 0.42 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.69 2jgm h PHE 359 CO -0.01 0.97 -0.75 -0.07 -2.02 0.00 0.00 178.31 176.43 2jgm h LEU 360 N 0.75 0.41 -0.54 0.59 3.38 -0.63 -1.66 115.31 117.61 2jgm h LEU 360 Ca 0.11 -0.28 -0.13 0.00 0.09 0.00 0.00 57.88 57.67 2jgm h LEU 360 Cb 0.72 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2jgm h LEU 360 CO 0.06 1.02 -0.26 0.00 0.09 0.00 0.00 178.44 179.35 2jgm h ALA 361 N 0.97 0.73 -0.74 1.53 0.00 -1.19 -3.07 119.26 117.48 2jgm h ALA 361 Ca -0.03 -0.40 0.09 0.00 0.00 0.00 0.00 54.91 54.57 2jgm h ALA 361 Cb 1.32 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.89 2jgm h ALA 361 CO 0.12 0.66 0.39 0.78 0.00 0.00 0.00 179.25 181.21 2jgm h GLY 362 N 0.89 1.13 1.03 0.00 0.00 -0.02 -2.75 103.07 103.34 2jgm h GLY 362 Ca 0.09 -0.26 -0.06 0.00 0.00 0.00 0.00 47.33 47.11 2jgm h GLY 362 CO 0.07 0.09 0.17 -2.08 0.00 0.00 0.00 176.54 174.79 2jgm h VAL 363 N 0.67 1.25 0.00 4.60 2.07 -1.24 0.14 116.25 123.75 2jgm h VAL 363 Ca 0.36 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.99 2jgm h VAL 363 Cb 0.35 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 2jgm h VAL 363 CO -0.25 0.34 0.00 0.54 0.02 0.00 0.00 177.57 178.22 2jgm n ARG 364 N -4.34 0.09 -0.13 1.57 5.12 -1.05 -0.84 116.66 117.08 2jgm n ARG 364 Ca 0.04 0.42 -0.28 0.00 -1.93 0.00 0.00 57.85 56.11 2jgm n ARG 364 Cb 0.23 -1.71 -0.10 0.00 -1.16 0.00 0.00 32.46 29.71 2jgm n ARG 364 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2jgm n ILE 365 N -1.90 1.53 0.08 0.55 5.41 -0.90 -4.03 119.36 120.10 2jgm n ILE 365 Ca 0.02 -0.29 0.02 0.00 1.00 0.00 0.00 62.75 63.49 2jgm n ILE 365 Cb 0.14 -1.93 0.36 0.00 -0.71 0.00 0.00 39.64 37.50 2jgm n ILE 365 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2jgm h GLY 366 N -1.00 0.35 -7.04 7.39 0.00 -0.83 -3.22 103.07 98.72 2jgm h GLY 366 Ca -0.61 -0.21 -0.63 0.00 0.00 0.00 0.00 47.33 45.88 2jgm h GLY 366 CO -0.37 0.20 -0.53 -0.62 0.00 0.00 0.00 176.54 175.22 2jgm n VAL 367 N -4.28 1.81 0.41 4.60 0.31 -0.02 -4.91 118.33 116.26 2jgm n VAL 367 Ca -0.00 -4.92 0.13 0.00 -0.01 0.00 0.00 64.34 59.54 2jgm n VAL 367 Cb 0.26 -2.20 0.46 0.00 -0.91 0.00 0.00 33.84 31.45 2jgm n VAL 367 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2jgm h PRO 368 N 5.34 0.00 -0.37 5.55 0.13 -1.69 -2.12 132.00 138.84 2jgm h PRO 368 Ca 0.15 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.26 2jgm h PRO 368 Cb 0.75 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.86 2jgm h PRO 368 CO 0.74 0.00 0.14 1.96 -0.23 0.00 0.00 178.00 180.61 2jgm h GLN 369 N 0.00 0.53 -6.63 0.86 7.50 -1.91 -3.47 115.11 111.99 2jgm h GLN 369 Ca 0.00 -0.07 -0.52 0.00 0.50 0.00 0.00 58.65 58.56 2jgm h GLN 369 Cb 0.59 -0.10 0.05 0.00 0.05 0.00 0.00 27.48 28.07 2jgm h GLN 369 CO 0.00 0.45 0.99 0.00 -1.50 0.00 0.00 178.83 178.77 2jgm s ALA 370 N -5.24 3.89 0.90 3.87 0.00 -0.80 -5.04 121.76 119.35 2jgm s ALA 370 Ca -0.08 1.53 -0.13 0.00 0.00 0.00 0.00 51.96 53.28 2jgm s ALA 370 Cb 0.16 -3.68 0.13 0.00 0.00 0.00 0.00 23.12 19.73 2jgm s ALA 370 CO 0.75 -0.91 1.16 -1.54 0.00 0.00 0.00 175.76 175.21 2jgm s SER 371 N 1.29 3.61 0.21 0.00 1.04 -1.26 -4.78 113.70 113.82 2jgm s SER 371 Ca 0.74 0.86 -0.13 0.00 0.48 0.00 0.00 55.95 57.91 2jgm s SER 371 Cb -0.48 -1.37 0.25 0.00 0.10 0.00 0.00 66.02 64.52 2jgm s SER 371 CO 0.32 -2.48 1.64 0.44 0.98 0.00 0.00 173.24 174.15 2jgm h ASP 372 N -1.45 -0.46 -0.25 7.02 5.19 -1.99 -0.55 116.42 123.93 2jgm h ASP 372 Ca -0.49 0.17 -0.04 0.00 -0.62 0.00 0.00 57.03 56.05 2jgm h ASP 372 Cb 1.32 0.34 -0.01 0.00 0.18 0.00 0.00 39.33 41.16 2jgm h ASP 372 CO 0.60 -0.17 -0.01 0.25 -3.12 0.00 0.00 179.24 176.79 2jgm h LEU 373 N 0.04 0.45 -1.40 1.55 5.85 -1.95 -0.35 115.31 119.50 2jgm h LEU 373 Ca 0.30 -0.32 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2jgm h LEU 373 Cb 0.48 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 2jgm h LEU 373 CO -0.59 0.66 0.03 0.00 -0.34 0.00 0.00 178.44 178.20 2jgm h ALA 374 N 0.80 1.51 -0.24 1.25 0.00 -1.73 0.15 119.26 121.00 2jgm h ALA 374 Ca 0.07 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2jgm h ALA 374 Cb 0.44 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2jgm h ALA 374 CO 0.02 0.36 0.00 0.00 0.00 0.00 0.00 179.25 179.62 2jgm h ALA 375 N 1.62 0.33 -0.40 0.00 0.00 -0.91 -1.43 119.26 118.46 2jgm h ALA 375 Ca 0.10 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 54.87 2jgm h ALA 375 Cb 0.23 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 2jgm h ALA 375 CO 0.00 0.06 -0.11 1.49 0.00 0.00 0.00 179.25 180.69 2jgm h GLU 376 N 0.20 -0.01 -0.40 0.00 4.57 0.18 -0.23 114.58 118.89 2jgm h GLU 376 Ca 0.07 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.30 2jgm h GLU 376 Cb 0.41 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.95 2jgm h GLU 376 CO 0.01 -0.01 0.12 0.00 -1.18 0.00 0.00 179.01 177.95 2jgm h ALA 377 N 1.37 0.46 0.14 2.92 0.00 -0.57 0.33 119.26 123.91 2jgm h ALA 377 Ca 0.19 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2jgm h ALA 377 Cb 0.31 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2jgm h ALA 377 CO -0.42 -0.28 -0.07 0.28 0.00 0.00 0.00 179.25 178.76 2jgm h VAL 378 N 0.26 0.94 -0.51 0.00 2.07 -0.40 0.12 116.25 118.73 2jgm h VAL 378 Ca 0.19 -0.31 0.08 0.00 0.82 0.00 0.00 66.70 67.48 2jgm h VAL 378 Cb 0.20 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.04 2jgm h VAL 378 CO -0.22 0.07 0.15 0.58 0.02 0.00 0.00 177.57 178.18 2jgm h VAL 379 N -0.33 0.78 -0.49 2.57 2.07 -0.82 -1.40 116.25 118.63 2jgm h VAL 379 Ca -0.02 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.46 2jgm h VAL 379 Cb 0.26 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.41 2jgm h VAL 379 CO 0.03 0.06 0.18 -0.07 0.02 0.00 0.00 177.57 177.79 2jgm h LEU 380 N 0.31 0.19 -0.89 2.57 -0.00 0.13 -1.07 115.31 116.56 2jgm h LEU 380 Ca 0.25 0.06 -0.07 0.00 -0.00 0.00 0.00 57.88 58.12 2jgm h LEU 380 Cb 0.31 0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 40.98 2jgm h LEU 380 CO -0.29 0.14 0.06 -0.74 -0.00 0.00 0.00 178.44 177.62 2jgm h HIS 381 N 0.36 0.94 -0.00 1.13 2.76 -0.07 -3.25 115.15 117.02 2jgm h HIS 381 Ca 0.23 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 58.28 2jgm h HIS 381 Cb 0.23 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 28.93 2jgm h HIS 381 CO -0.15 0.82 -0.84 0.66 -1.30 0.00 0.00 177.93 177.12 2jgm n TYR 382 N -4.23 0.00 -2.30 5.26 4.02 -0.59 -4.88 117.16 114.44 2jgm n TYR 382 Ca 0.03 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.51 2jgm n TYR 382 Cb 0.28 -0.05 -0.03 0.00 -0.02 0.00 0.00 39.34 39.51 2jgm n TYR 382 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2jgm s THR 383 N -2.95 3.39 -0.74 -0.72 2.01 -0.43 -4.88 115.64 111.32 2jgm s THR 383 Ca 0.10 1.16 -0.22 0.00 0.31 0.00 0.00 61.69 63.04 2jgm s THR 383 Cb 0.17 -3.74 0.08 0.00 0.01 0.00 0.00 72.50 69.02 2jgm s THR 383 CO 0.80 0.18 1.04 -0.62 -0.69 0.00 0.00 174.62 175.34 2jgm s ASP 384 N 0.22 6.29 0.00 3.53 -1.08 -1.26 -4.89 116.67 119.48 2jgm s ASP 384 Ca 0.55 -1.23 0.10 0.00 -0.52 0.00 0.00 52.55 51.44 2jgm s ASP 384 Cb -0.35 -2.43 0.53 0.00 -1.46 0.00 0.00 42.92 39.22 2jgm s ASP 384 CO 0.38 -1.38 1.12 0.79 0.52 0.00 0.00 175.17 176.59 2jgm n TRP 385 N 7.59 0.00 -0.05 -5.34 7.02 -1.26 -1.06 117.44 124.34 2jgm n TRP 385 Ca 0.05 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.39 2jgm n TRP 385 Cb 0.47 -0.15 -0.14 0.00 -2.42 0.00 0.00 31.31 29.06 2jgm n TRP 385 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 2jgm n LEU 386 N -1.15 1.38 -3.27 -0.99 7.94 -1.26 -4.43 117.00 115.22 2jgm n LEU 386 Ca 0.06 0.18 -0.26 0.00 -1.11 0.00 0.00 56.01 54.88 2jgm n LEU 386 Cb 0.06 -0.21 -0.07 0.00 0.53 0.00 0.00 43.42 43.73 2jgm n LEU 386 CO 0.06 0.61 -0.02 1.41 -1.11 0.00 0.00 177.39 178.34 2jgm n HIS 387 N -3.10 2.49 0.57 1.96 8.25 -0.22 -4.97 115.22 120.19 2jgm n HIS 387 Ca -0.29 -3.96 0.08 0.00 -0.26 0.00 0.00 57.72 53.29 2jgm n HIS 387 Cb 1.07 -0.49 0.35 0.00 1.12 0.00 0.00 29.99 32.04 2jgm n HIS 387 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2jgm n PRO 388 N 0.76 0.02 -0.00 -0.41 -0.04 -0.40 -2.92 135.00 132.00 2jgm n PRO 388 Ca 0.28 0.22 0.03 0.00 -0.04 0.00 0.00 63.50 63.98 2jgm n PRO 388 Cb 0.46 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.37 2jgm n PRO 388 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2jgm n GLU 389 N -1.48 1.14 -1.68 0.54 -0.58 -1.26 -4.88 120.64 112.44 2jgm n GLU 389 Ca 0.04 -0.04 -0.52 0.00 -0.42 0.00 0.00 57.16 56.22 2jgm n GLU 389 Cb 0.18 -1.06 -0.06 0.00 -0.57 0.00 0.00 31.44 29.94 2jgm n GLU 389 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2jgm n ASP 390 N -1.58 3.02 0.18 1.62 2.03 -1.15 -4.68 116.55 115.99 2jgm n ASP 390 Ca -0.01 0.96 0.03 0.00 0.52 0.00 0.00 54.79 56.30 2jgm n ASP 390 Cb 0.13 -1.29 0.35 0.00 -0.72 0.00 0.00 41.12 39.59 2jgm n ASP 390 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2jgm h PRO 391 N 8.83 0.00 -0.56 -0.67 0.13 -1.92 -2.38 132.00 135.43 2jgm h PRO 391 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2jgm h PRO 391 Cb 1.29 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.39 2jgm h PRO 391 CO 0.96 0.40 0.36 1.15 -0.23 0.00 0.00 178.00 180.64 2jgm h THR 392 N 0.00 1.16 -0.24 1.56 2.02 -1.89 -1.10 112.91 114.42 2jgm h THR 392 Ca -0.00 -0.32 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 2jgm h THR 392 Cb 0.76 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 2jgm h THR 392 CO 0.05 0.16 -0.02 0.45 0.37 0.00 0.00 175.52 176.53 2jgm h HIS 393 N 0.76 0.47 -0.53 3.16 3.86 -1.83 -1.13 115.15 119.91 2jgm h HIS 393 Ca 0.20 -0.09 -0.05 0.00 -1.16 0.00 0.00 60.37 59.27 2jgm h HIS 393 Cb -0.05 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.27 2jgm h HIS 393 CO -0.03 0.62 0.12 -0.07 0.86 0.00 0.00 177.93 179.43 2jgm h LEU 394 N 0.19 0.77 0.59 2.43 3.38 -1.35 0.62 115.31 121.95 2jgm h LEU 394 Ca 0.07 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 2jgm h LEU 394 Cb 0.44 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.99 2jgm h LEU 394 CO 0.02 0.76 -0.28 -0.09 0.09 0.00 0.00 178.44 178.93 2jgm h ARG 395 N 0.79 -0.77 -0.91 1.13 1.12 -1.14 -0.82 114.38 113.79 2jgm h ARG 395 Ca 0.17 0.05 0.04 0.00 -1.11 0.00 0.00 59.98 59.13 2jgm h ARG 395 Cb 0.31 0.17 -0.05 0.00 -0.01 0.00 0.00 29.97 30.39 2jgm h ARG 395 CO 0.00 -0.46 0.59 -0.44 -3.11 0.00 0.00 179.97 176.56 2jgm h ASP 396 N -0.97 0.97 -0.07 -3.80 3.32 -0.86 -2.22 116.42 112.79 2jgm h ASP 396 Ca -0.08 -0.01 0.03 0.00 0.02 0.00 0.00 57.03 56.99 2jgm h ASP 396 Cb 0.66 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.96 2jgm h ASP 396 CO 0.13 0.66 -0.10 0.00 -1.72 0.00 0.00 179.24 178.22 2jgm h ALA 397 N 1.47 -0.05 -0.60 3.45 0.00 0.29 -0.89 119.26 122.93 2jgm h ALA 397 Ca 0.36 0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.40 2jgm h ALA 397 Cb 0.04 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 17.95 2jgm h ALA 397 CO -0.11 -0.57 0.21 1.98 0.00 0.00 0.00 179.25 180.76 2jgm h MET 398 N -0.14 0.37 -0.27 0.00 1.85 -0.56 0.49 114.93 116.67 2jgm h MET 398 Ca 0.06 -0.02 0.03 0.00 -0.61 0.00 0.00 59.70 59.16 2jgm h MET 398 Cb 0.23 -0.08 -0.03 0.00 0.43 0.00 0.00 31.60 32.14 2jgm h MET 398 CO -0.15 0.25 0.07 1.03 -0.40 0.00 0.00 176.91 177.70 2jgm h SER 399 N 0.38 0.05 -0.45 1.39 0.87 -1.21 -2.46 113.55 112.13 2jgm h SER 399 Ca 0.31 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.93 2jgm h SER 399 Cb 0.39 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.36 2jgm h SER 399 CO -0.32 0.06 0.25 0.00 -0.53 0.00 0.00 176.83 176.29 2jgm h ALA 400 N 1.19 0.57 -0.66 6.23 0.00 0.48 0.43 119.26 127.49 2jgm h ALA 400 Ca 0.12 0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.14 2jgm h ALA 400 Cb 0.11 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 17.72 2jgm h ALA 400 CO -0.15 -0.08 0.27 0.28 0.00 0.00 0.00 179.25 179.57 2jgm h VAL 401 N 0.50 0.76 0.02 0.00 2.07 0.09 0.15 116.25 119.84 2jgm h VAL 401 Ca 0.18 -0.16 -0.19 0.00 0.82 0.00 0.00 66.70 67.36 2jgm h VAL 401 Cb 0.05 0.26 0.02 0.00 -1.52 0.00 0.00 31.29 30.10 2jgm h VAL 401 CO -0.10 0.08 -0.76 0.58 0.02 0.00 0.00 177.57 177.39 2jgm h VAL 402 N 0.46 1.39 0.57 2.57 2.07 -0.88 -1.69 116.25 120.74 2jgm h VAL 402 Ca 0.34 -2.17 -0.02 0.00 0.82 0.00 0.00 66.70 65.66 2jgm h VAL 402 Cb 0.43 2.60 -0.00 0.00 -1.52 0.00 0.00 31.29 32.79 2jgm h VAL 402 CO -0.32 0.64 -0.34 1.23 0.02 0.00 0.00 177.57 178.80 2jgm h GLY 403 N 0.02 -0.93 0.56 2.17 0.00 -0.81 -2.56 103.07 101.51 2jgm h GLY 403 Ca -0.10 0.38 0.04 0.00 0.00 0.00 0.00 47.33 47.65 2jgm h GLY 403 CO 0.15 -0.34 -0.10 -0.55 0.00 0.00 0.00 176.54 175.70 2jgm h ASP 404 N -0.87 -0.32 -0.72 0.19 3.32 -0.76 0.42 116.42 117.69 2jgm h ASP 404 Ca -0.07 0.07 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 2jgm h ASP 404 Cb 0.70 0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.39 2jgm h ASP 404 CO 0.08 -0.13 0.23 -0.74 -1.72 0.00 0.00 179.24 176.95 2jgm h HIS 405 N -0.10 1.15 0.00 4.55 2.76 -1.34 -1.34 115.15 120.82 2jgm h HIS 405 Ca 0.09 -0.11 -0.03 0.00 -2.20 0.00 0.00 60.37 58.12 2jgm h HIS 405 Cb 0.23 -0.33 -0.00 0.00 1.55 0.00 0.00 27.41 28.86 2jgm h HIS 405 CO -0.23 0.91 -1.67 0.09 -1.30 0.00 0.00 177.93 175.73 2jgm n ASN 406 N -4.29 0.32 0.08 3.26 3.02 -0.97 -4.54 115.26 112.14 2jgm n ASN 406 Ca 0.05 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 2jgm n ASN 406 Cb 0.22 1.36 0.00 0.00 -0.61 0.00 0.00 39.78 40.75 2jgm n ASN 406 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2jgm n VAL 407 N -2.45 0.39 -0.05 2.41 0.31 0.14 -4.73 118.33 114.35 2jgm n VAL 407 Ca -0.04 0.13 -0.09 0.00 -0.01 0.00 0.00 64.34 64.33 2jgm n VAL 407 Cb 0.60 -0.82 -0.02 0.00 -0.91 0.00 0.00 33.84 32.69 2jgm n VAL 407 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2jgm h VAL 408 N 0.00 0.95 -0.14 2.52 2.07 -1.46 0.33 116.25 120.51 2jgm h VAL 408 Ca 0.00 -0.06 -0.11 0.00 0.82 0.00 0.00 66.70 67.35 2jgm h VAL 408 Cb 0.00 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2jgm h VAL 408 CO 0.00 0.03 -0.34 0.00 0.02 0.00 0.00 177.57 177.28 2jgm h PRO 410 N 0.10 0.20 -0.44 0.00 0.11 -1.70 0.11 132.00 130.39 2jgm h PRO 410 Ca -0.00 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.04 2jgm h PRO 410 Cb 0.95 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.99 2jgm h PRO 410 CO 0.07 0.14 0.05 0.28 -0.21 0.00 0.00 178.00 178.33 2jgm h VAL 411 N 0.21 1.22 0.17 3.15 2.07 0.10 -1.38 116.25 121.78 2jgm h VAL 411 Ca 0.36 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 2jgm h VAL 411 Cb 0.60 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 2jgm h VAL 411 CO -0.50 0.30 -0.08 0.00 0.02 0.00 0.00 177.57 177.31 2jgm h ALA 412 N 1.40 -0.22 -0.86 1.67 0.00 -0.45 -1.80 119.26 118.99 2jgm h ALA 412 Ca 0.14 -0.20 0.21 0.00 0.00 0.00 0.00 54.91 55.06 2jgm h ALA 412 Cb 0.34 0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.06 2jgm h ALA 412 CO 0.01 -0.42 -0.01 0.37 0.00 0.00 0.00 179.25 179.20 2jgm h GLN 413 N -0.64 0.06 -0.17 0.00 5.75 -0.57 0.63 115.11 120.18 2jgm h GLN 413 Ca -0.02 -0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.37 2jgm h GLN 413 Cb 0.47 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.01 2jgm h GLN 413 CO 0.04 0.04 -0.31 1.25 -2.65 0.00 0.00 178.83 177.20 2jgm h LEU 414 N 0.07 0.56 -0.45 -2.39 5.85 -1.25 -1.52 115.31 116.18 2jgm h LEU 414 Ca 0.48 -0.54 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2jgm h LEU 414 Cb 0.89 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 2jgm h LEU 414 CO -0.78 1.00 0.27 0.00 -0.34 0.00 0.00 178.44 178.58 2jgm h ALA 415 N 0.58 0.57 -0.03 1.25 0.00 -0.29 1.00 119.26 122.33 2jgm h ALA 415 Ca 0.01 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2jgm h ALA 415 Cb 0.90 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2jgm h ALA 415 CO 0.07 0.06 -0.11 0.78 0.00 0.00 0.00 179.25 180.05 2jgm h GLY 416 N 0.59 -0.10 1.27 0.00 0.00 -0.96 -2.04 103.07 101.83 2jgm h GLY 416 Ca 0.16 0.13 -0.09 0.00 0.00 0.00 0.00 47.33 47.53 2jgm h GLY 416 CO -0.03 -0.11 -0.05 3.21 0.00 0.00 0.00 176.54 179.55 2jgm h ARG 417 N -0.17 0.88 -0.66 4.80 2.47 -0.67 -0.32 114.38 120.71 2jgm h ARG 417 Ca 0.05 -0.28 -0.03 0.00 -1.26 0.00 0.00 59.98 58.46 2jgm h ARG 417 Cb 0.24 -0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.45 2jgm h ARG 417 CO -0.13 0.91 0.29 -0.07 0.56 0.00 0.00 179.97 181.53 2jgm h LEU 418 N 0.80 0.88 0.07 3.04 3.38 -0.76 -0.96 115.31 121.76 2jgm h LEU 418 Ca 0.14 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jgm h LEU 418 Cb 0.56 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2jgm h LEU 418 CO 0.03 0.79 -0.03 0.00 0.09 0.00 0.00 178.44 179.32 2jgm h ALA 419 N 1.13 -0.09 -0.56 1.53 0.00 -1.13 0.27 119.26 120.42 2jgm h ALA 419 Ca 0.22 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 55.07 2jgm h ALA 419 Cb 0.16 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.88 2jgm h ALA 419 CO -0.02 -0.38 -0.05 0.00 0.00 0.00 0.00 179.25 178.80 2jgm h ALA 420 N 0.48 0.48 -0.58 0.00 0.00 -0.94 -1.45 119.26 117.24 2jgm h ALA 420 Ca -0.01 0.19 -0.27 0.00 0.00 0.00 0.00 54.91 54.82 2jgm h ALA 420 Cb 0.37 0.34 -0.16 0.00 0.00 0.00 0.00 17.79 18.34 2jgm h ALA 420 CO 0.01 -0.41 0.34 1.04 0.00 0.00 0.00 179.25 180.24 2jgm n GLN 421 N -5.30 2.13 0.00 0.00 3.00 -0.37 -4.91 117.38 111.92 2jgm n GLN 421 Ca 0.07 -1.93 0.00 0.00 -0.01 0.00 0.00 57.00 55.12 2jgm n GLN 421 Cb 0.31 -1.80 0.00 0.00 0.00 0.00 0.00 30.24 28.75 2jgm n GLN 421 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jgm n GLY 422 N -0.37 0.33 3.68 1.08 0.00 -0.55 -1.79 105.19 107.58 2jgm n GLY 422 Ca 0.34 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.07 2jgm n GLY 422 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jgm s ALA 423 N -2.00 1.02 -0.24 4.61 0.00 0.90 -4.15 121.76 121.89 2jgm s ALA 423 Ca 0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.19 2jgm s ALA 423 Cb 0.00 -2.96 0.03 0.00 0.00 0.00 0.00 23.12 20.19 2jgm s ALA 423 CO 0.00 -3.09 -0.08 0.50 0.00 0.00 0.00 175.76 173.09 2jgm s ARG 424 N -5.31 2.80 -0.10 0.00 3.52 0.44 -4.55 118.95 115.75 2jgm s ARG 424 Ca 0.69 -0.99 0.03 0.00 -0.13 0.00 0.00 55.73 55.32 2jgm s ARG 424 Cb -0.12 -2.94 -0.01 0.00 -1.56 0.00 0.00 34.95 30.32 2jgm s ARG 424 CO 0.56 -0.39 -0.18 0.08 -0.81 0.00 0.00 175.30 174.55 2jgm s VAL 425 N 1.30 2.61 -0.07 7.11 1.01 -1.26 -0.57 120.40 130.53 2jgm s VAL 425 Ca -0.00 -0.84 0.05 0.00 0.00 0.00 0.00 61.98 61.19 2jgm s VAL 425 Cb -0.17 -2.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.17 2jgm s VAL 425 CO -0.05 0.55 -0.24 -0.31 0.00 0.00 0.00 175.10 175.05 2jgm s TYR 426 N 0.08 2.50 0.01 5.22 1.51 -0.05 0.19 117.35 126.81 2jgm s TYR 426 Ca -0.08 -0.79 0.04 0.00 -1.01 0.00 0.00 57.07 55.23 2jgm s TYR 426 Cb -0.15 -1.64 -0.01 0.00 -0.11 0.00 0.00 41.96 40.04 2jgm s TYR 426 CO 0.05 -0.26 -0.12 0.00 -1.11 0.00 0.00 175.55 174.12 2jgm s ALA 427 N -0.02 0.99 0.26 3.71 0.00 -1.25 0.10 121.76 125.55 2jgm s ALA 427 Ca -0.08 -0.61 0.03 0.00 0.00 0.00 0.00 51.96 51.30 2jgm s ALA 427 Cb -0.15 -0.21 -0.05 0.00 0.00 0.00 0.00 23.12 22.71 2jgm s ALA 427 CO 0.05 0.21 0.04 1.52 0.00 0.00 0.00 175.76 177.59 2jgm s TYR 428 N -0.51 1.65 -0.05 0.00 -0.85 -0.47 -1.60 117.35 115.53 2jgm s TYR 428 Ca 0.03 -1.02 0.03 0.00 -0.52 0.00 0.00 57.07 55.59 2jgm s TYR 428 Cb -0.06 -1.00 0.01 0.00 0.38 0.00 0.00 41.96 41.29 2jgm s TYR 428 CO 0.00 -0.13 -0.12 -1.50 -1.52 0.00 0.00 175.55 172.28 2jgm s ILE 429 N -3.50 1.09 -0.31 -3.49 2.07 -0.40 -2.35 121.20 114.30 2jgm s ILE 429 Ca 0.33 -0.48 -0.15 0.00 -1.41 0.00 0.00 60.65 58.95 2jgm s ILE 429 Cb 0.07 -0.98 -0.02 0.00 0.13 0.00 0.00 42.46 41.66 2jgm s ILE 429 CO 0.12 0.34 0.36 0.12 -1.91 0.00 0.00 174.94 173.97 2jgm s PHE 430 N 0.47 3.22 -0.11 3.50 2.19 0.12 -0.47 117.98 126.90 2jgm s PHE 430 Ca -0.10 0.15 0.04 0.00 0.33 0.00 0.00 56.93 57.34 2jgm s PHE 430 Cb -0.14 -2.63 0.08 0.00 -1.31 0.00 0.00 43.02 39.02 2jgm s PHE 430 CO 0.03 -0.35 1.05 0.39 1.83 0.00 0.00 175.22 178.17 2jgm n GLU 431 N 5.37 2.77 -3.77 10.12 1.02 0.06 -0.01 120.64 136.19 2jgm n GLU 431 Ca -0.09 -1.72 -0.36 0.00 -0.02 0.00 0.00 57.16 54.97 2jgm n GLU 431 Cb 0.50 -1.11 -0.11 0.00 -0.02 0.00 0.00 31.44 30.70 2jgm n GLU 431 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2jgm s HIS 432 N -1.27 3.19 -0.26 -0.32 2.46 -1.25 -4.94 115.29 112.90 2jgm s HIS 432 Ca 0.07 -0.06 -0.21 0.00 0.47 0.00 0.00 55.06 55.33 2jgm s HIS 432 Cb 0.05 -2.24 -0.02 0.00 -0.13 0.00 0.00 32.58 30.25 2jgm s HIS 432 CO 0.02 -0.11 0.64 0.50 -2.47 0.00 0.00 174.74 173.32 2jgm s ARG 433 N 1.24 4.08 0.13 2.88 3.52 -1.26 -4.92 118.95 124.61 2jgm s ARG 433 Ca 0.06 0.53 -0.34 0.00 -0.13 0.00 0.00 55.73 55.84 2jgm s ARG 433 Cb -0.14 -3.66 -0.14 0.00 -1.56 0.00 0.00 34.95 29.44 2jgm s ARG 433 CO 0.05 -0.45 1.56 0.00 -0.81 0.00 0.00 175.30 175.64 2jgm n ALA 434 N 5.77 0.95 -0.07 6.12 0.00 -1.26 -4.86 120.51 127.15 2jgm n ALA 434 Ca -0.00 0.45 0.10 0.00 0.00 0.00 0.00 53.44 53.99 2jgm n ALA 434 Cb 0.49 -2.31 0.48 0.00 0.00 0.00 0.00 19.45 18.11 2jgm n ALA 434 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2jgm h SER 435 N 5.90 0.40 -0.23 0.00 4.64 -1.96 -2.11 113.55 120.19 2jgm h SER 435 Ca -0.46 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2jgm h SER 435 Cb 1.27 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2jgm h SER 435 CO 0.87 0.25 0.00 0.35 -0.87 0.00 0.00 176.83 177.43 2jgm n THR 436 N -4.47 0.81 -2.35 2.95 -2.24 -1.26 -4.95 114.28 102.76 2jgm n THR 436 Ca 0.09 -0.47 -0.37 0.00 -2.27 0.00 0.00 64.05 61.02 2jgm n THR 436 Cb 0.31 -0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 68.30 2jgm n THR 436 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2jgm s LEU 437 N -1.01 4.14 0.00 3.22 2.96 -0.80 -4.95 118.68 122.24 2jgm s LEU 437 Ca 0.20 2.25 0.08 0.00 -0.22 0.00 0.00 54.13 56.44 2jgm s LEU 437 Cb 0.13 -4.11 0.10 0.00 0.50 0.00 0.00 46.19 42.81 2jgm s LEU 437 CO 0.08 -0.68 0.85 0.35 -1.32 0.00 0.00 176.35 175.64 2jgm n THR 438 N -0.08 0.22 -2.09 3.68 -2.24 -1.26 -4.98 114.28 107.52 2jgm n THR 438 Ca 0.05 -0.61 -0.29 0.00 -2.27 0.00 0.00 64.05 60.93 2jgm n THR 438 Cb 0.48 1.02 0.03 0.00 -2.10 0.00 0.00 70.33 69.76 2jgm n THR 438 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 2jgm s TRP 439 N -0.75 3.41 0.77 4.78 0.52 -1.26 -4.84 118.94 121.56 2jgm s TRP 439 Ca 0.11 0.99 -0.12 0.00 0.02 0.00 0.00 56.10 57.10 2jgm s TRP 439 Cb 0.07 -2.82 0.05 0.00 -1.15 0.00 0.00 33.47 29.63 2jgm s TRP 439 CO 0.11 -0.87 1.14 -1.25 0.02 0.00 0.00 176.95 176.09 2jgm s PRO 440 N -5.16 2.34 0.33 4.98 0.04 -1.26 -4.93 135.00 131.35 2jgm s PRO 440 Ca 0.55 0.30 0.04 0.00 0.04 0.00 0.00 61.00 61.93 2jgm s PRO 440 Cb -0.11 -1.98 0.66 0.00 0.04 0.00 0.00 34.50 33.11 2jgm s PRO 440 CO 0.50 -1.37 1.92 -0.07 0.04 0.00 0.00 177.00 178.02 2jgm h LEU 441 N -0.89 0.78 0.00 -3.56 3.38 -1.95 -2.20 115.31 110.87 2jgm h LEU 441 Ca -0.46 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2jgm h LEU 441 Cb 1.29 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2jgm h LEU 441 CO 0.65 0.48 0.00 -2.67 0.09 0.00 0.00 178.44 176.99 2jgm n TRP 442 N -4.50 0.00 1.10 1.13 4.27 -1.26 -1.06 117.44 117.11 2jgm n TRP 442 Ca 0.13 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.87 2jgm n TRP 442 Cb 0.26 -0.34 0.34 0.00 -1.36 0.00 0.00 31.31 30.21 2jgm n TRP 442 CO 0.00 0.00 0.00 -1.33 -2.29 0.00 0.00 177.69 174.07 2jgm n MET 443 N -1.34 0.27 0.00 -2.67 2.81 -0.83 -4.99 117.12 110.38 2jgm n MET 443 Ca 0.02 -0.15 0.00 0.00 -1.81 0.00 0.00 57.70 55.76 2jgm n MET 443 Cb 0.05 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.06 2jgm n MET 443 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jgm n GLY 444 N 1.44 3.51 3.20 3.03 0.00 -0.23 -3.62 105.19 112.53 2jgm n GLY 444 Ca 0.08 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 2jgm n GLY 444 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jgm s VAL 445 N 0.00 4.10 0.49 1.61 1.01 -1.26 -4.87 120.40 121.48 2jgm s VAL 445 Ca 0.00 -1.92 -0.08 0.00 0.00 0.00 0.00 61.98 59.98 2jgm s VAL 445 Cb 0.00 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 2jgm s VAL 445 CO 0.00 -0.78 0.83 -2.84 0.00 0.00 0.00 175.10 172.31 2jgm s PRO 446 N 1.21 3.61 -0.11 2.72 0.02 -1.24 -0.98 135.00 140.22 2jgm s PRO 446 Ca 0.07 0.37 -0.38 0.00 0.02 0.00 0.00 61.00 61.08 2jgm s PRO 446 Cb -0.25 -2.32 -0.18 0.00 0.02 0.00 0.00 34.50 31.77 2jgm s PRO 446 CO -0.02 -0.24 1.09 1.58 -0.33 0.00 0.00 177.00 179.09 2jgm n HIS 447 N -2.15 0.84 0.00 6.54 -0.00 -1.25 -1.90 115.22 117.30 2jgm n HIS 447 Ca 0.02 0.99 0.00 0.00 -0.00 0.00 0.00 57.72 58.73 2jgm n HIS 447 Cb 0.55 -1.94 0.00 0.00 -0.00 0.00 0.00 29.99 28.60 2jgm n HIS 447 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2jgm n GLY 448 N 1.93 1.89 1.94 1.57 0.00 -1.26 -4.95 105.19 106.32 2jgm n GLY 448 Ca 0.21 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.05 2jgm n GLY 448 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2jgm n TYR 449 N -2.00 2.36 -0.01 1.61 4.02 -0.80 -3.00 117.16 119.35 2jgm n TYR 449 Ca 0.00 -1.52 0.03 0.00 -0.01 0.00 0.00 57.90 56.40 2jgm n TYR 449 Cb 0.00 -0.78 -0.06 0.00 -0.02 0.00 0.00 39.34 38.48 2jgm n TYR 449 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 2jgm n GLU 450 N -0.75 0.56 -0.11 -0.72 0.00 -1.26 -4.69 120.64 113.68 2jgm n GLU 450 Ca 0.46 -0.06 -0.05 0.00 0.00 0.00 0.00 57.16 57.50 2jgm n GLU 450 Cb 1.40 -1.18 0.01 0.00 0.00 0.00 0.00 31.44 31.68 2jgm n GLU 450 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 2jgm h ILE 451 N 0.00 0.68 -0.35 3.84 2.04 -1.91 -0.91 117.51 120.89 2jgm h ILE 451 Ca -0.02 -0.02 0.08 0.00 1.00 0.00 0.00 64.86 65.90 2jgm h ILE 451 Cb 0.48 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 2jgm h ILE 451 CO 0.00 0.01 0.25 1.05 0.00 0.00 0.00 178.15 179.46 2jgm h GLU 452 N 0.05 0.11 0.03 2.37 4.11 -1.79 0.02 114.58 119.47 2jgm h GLU 452 Ca 0.18 -0.01 -0.12 0.00 0.07 0.00 0.00 59.36 59.48 2jgm h GLU 452 Cb 0.26 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.50 2jgm h GLU 452 CO -0.34 0.07 -0.48 0.74 0.07 0.00 0.00 179.01 179.07 2jgm h PHE 453 N 0.11 0.44 -0.78 2.06 0.04 -1.51 -0.82 116.94 116.48 2jgm h PHE 453 Ca 0.16 -0.26 0.08 0.00 2.80 0.00 0.00 57.97 60.76 2jgm h PHE 453 Cb 0.51 -0.04 -0.07 0.00 2.20 0.00 0.00 35.95 38.55 2jgm h PHE 453 CO -0.00 1.10 0.44 0.82 -0.60 0.00 0.00 178.31 180.07 2jgm h ILE 454 N -0.35 0.93 0.00 -0.55 1.08 -0.25 -2.35 117.51 116.03 2jgm h ILE 454 Ca -0.07 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 2jgm h ILE 454 Cb 1.25 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 35.09 2jgm h ILE 454 CO 0.09 0.14 0.00 0.49 -0.69 0.00 0.00 178.15 178.18 2jgm n PHE 455 N -4.75 0.50 -0.33 1.37 3.01 -0.11 -4.43 117.46 112.72 2jgm n PHE 455 Ca 0.12 0.16 0.00 0.00 1.01 0.00 0.00 57.45 58.74 2jgm n PHE 455 Cb 0.25 -0.76 0.00 0.00 -0.01 0.00 0.00 39.48 38.95 2jgm n PHE 455 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jgm n GLY 456 N 0.92 0.80 0.37 1.37 0.00 -0.88 -3.97 105.19 103.80 2jgm n GLY 456 Ca 0.05 -0.33 0.01 0.00 0.00 0.00 0.00 46.02 45.75 2jgm n GLY 456 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jgm h LEU 457 N 0.00 1.05 -0.47 0.99 3.38 -1.38 -1.43 115.31 117.46 2jgm h LEU 457 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jgm h LEU 457 Cb 0.00 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.51 2jgm h LEU 457 CO 0.00 0.72 0.00 -2.65 0.09 0.00 0.00 178.44 176.60 2jgm n PRO 458 N -4.44 0.05 0.06 1.13 -0.02 -1.26 -1.64 135.00 128.89 2jgm n PRO 458 Ca 0.13 0.52 0.11 0.00 -2.02 0.00 0.00 63.50 62.24 2jgm n PRO 458 Cb 0.10 -1.66 0.44 0.00 -0.02 0.00 0.00 33.50 32.37 2jgm n PRO 458 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2jgm n LEU 459 N -1.76 0.38 -4.53 2.45 4.77 -0.54 -4.52 117.00 113.26 2jgm n LEU 459 Ca -0.00 0.57 -0.43 0.00 -0.03 0.00 0.00 56.01 56.12 2jgm n LEU 459 Cb 0.03 -0.49 -0.07 0.00 -2.33 0.00 0.00 43.42 40.56 2jgm n LEU 459 CO 0.05 -0.30 0.36 -0.62 -1.33 0.00 0.00 177.39 175.55 2jgm s ASP 460 N -3.72 6.34 0.42 -1.43 -1.08 -0.65 -4.81 116.67 111.74 2jgm s ASP 460 Ca 0.08 -0.24 0.13 0.00 -0.52 0.00 0.00 52.55 52.01 2jgm s ASP 460 Cb 0.12 -2.31 0.88 0.00 -1.46 0.00 0.00 42.92 40.14 2jgm s ASP 460 CO 0.42 -0.72 1.93 -0.65 0.52 0.00 0.00 175.17 176.66 2jgm h PRO 461 N 8.77 0.01 0.00 4.34 0.11 -1.88 -2.20 132.00 141.16 2jgm h PRO 461 Ca -0.26 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2jgm h PRO 461 Cb 1.10 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2jgm h PRO 461 CO 0.87 0.27 0.00 -1.13 -0.21 0.00 0.00 178.00 177.80 2jgm n SER 462 N -4.24 0.00 -0.29 -2.05 3.41 -1.26 -2.66 113.62 106.53 2jgm n SER 462 Ca -0.02 -0.06 0.06 0.00 -0.26 0.00 0.00 58.87 58.59 2jgm n SER 462 Cb 0.31 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2jgm n SER 462 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jgm n LEU 463 N -0.98 1.41 -1.46 1.04 4.77 -0.83 -5.01 117.00 115.94 2jgm n LEU 463 Ca 0.01 -0.77 -0.14 0.00 -0.03 0.00 0.00 56.01 55.08 2jgm n LEU 463 Cb 0.01 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 2jgm n LEU 463 CO 0.01 0.28 -0.17 0.59 -1.33 0.00 0.00 177.39 176.77 2jgm n ASN 464 N -0.16 -4.26 -4.74 -1.43 3.02 -1.09 -5.01 115.26 101.59 2jgm n ASN 464 Ca 0.05 0.04 -0.41 0.00 -0.03 0.00 0.00 54.58 54.24 2jgm n ASN 464 Cb 0.27 -3.36 -0.05 0.00 -0.61 0.00 0.00 39.78 36.03 2jgm n ASN 464 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2jgm s TYR 465 N -2.65 3.82 0.77 3.10 2.02 -1.26 -4.83 117.35 118.32 2jgm s TYR 465 Ca 0.00 1.80 -0.15 0.00 -0.37 0.00 0.00 57.07 58.35 2jgm s TYR 465 Cb 0.00 -3.07 0.01 0.00 -0.40 0.00 0.00 41.96 38.50 2jgm s TYR 465 CO 0.00 0.13 0.79 0.25 -1.57 0.00 0.00 175.55 175.15 2jgm n THR 466 N 2.37 1.88 0.23 -0.71 -2.24 -1.26 -4.75 114.28 109.80 2jgm n THR 466 Ca 0.01 -0.32 0.07 0.00 -2.27 0.00 0.00 64.05 61.55 2jgm n THR 466 Cb 0.48 -0.93 0.53 0.00 -2.10 0.00 0.00 70.33 68.31 2jgm n THR 466 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jgm h THR 467 N -0.63 0.95 -0.37 4.28 1.03 -1.97 -1.61 112.91 114.59 2jgm h THR 467 Ca -0.46 -0.82 -0.09 0.00 -0.01 0.00 0.00 66.41 65.03 2jgm h THR 467 Cb 1.32 1.47 -0.01 0.00 -1.07 0.00 0.00 68.15 69.86 2jgm h THR 467 CO 0.43 0.22 -0.13 -0.33 -0.01 0.00 0.00 175.52 175.70 2jgm h GLU 468 N 0.00 0.74 -0.76 0.00 3.07 -2.01 -3.13 114.58 112.49 2jgm h GLU 468 Ca -0.00 -0.30 -0.00 0.00 -0.50 0.00 0.00 59.36 58.55 2jgm h GLU 468 Cb 0.45 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.29 2jgm h GLU 468 CO 0.03 0.91 0.46 0.93 -1.40 0.00 0.00 179.01 179.94 2jgm h GLU 469 N 0.54 1.03 -0.13 2.33 5.08 -1.65 -1.24 114.58 120.54 2jgm h GLU 469 Ca 0.09 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2jgm h GLU 469 Cb 0.66 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2jgm h GLU 469 CO 0.04 0.72 -0.12 -0.09 -1.00 0.00 0.00 179.01 178.56 2jgm h ARG 470 N 1.05 0.20 -0.00 2.33 1.12 -1.38 -0.20 114.38 117.50 2jgm h ARG 470 Ca 0.27 -0.04 -0.06 0.00 -1.11 0.00 0.00 59.98 59.05 2jgm h ARG 470 Cb -0.04 -0.03 0.00 0.00 -0.01 0.00 0.00 29.97 29.89 2jgm h ARG 470 CO -0.05 0.33 -0.22 0.82 -3.11 0.00 0.00 179.97 177.74 2jgm h ILE 471 N 0.19 1.55 -0.85 1.20 2.04 -1.24 -2.63 117.51 117.78 2jgm h ILE 471 Ca 0.04 -1.92 0.20 0.00 1.00 0.00 0.00 64.86 64.18 2jgm h ILE 471 Cb 0.34 2.77 -0.12 0.00 -0.74 0.00 0.00 36.82 39.07 2jgm h ILE 471 CO 0.02 0.52 0.31 0.15 0.00 0.00 0.00 178.15 179.15 2jgm h PHE 472 N -0.53 0.50 -0.45 1.37 3.57 -1.07 -0.64 116.94 119.68 2jgm h PHE 472 Ca -0.03 0.04 -0.12 0.00 3.53 0.00 0.00 57.97 61.40 2jgm h PHE 472 Cb 0.97 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.61 2jgm h PHE 472 CO 0.18 -0.07 -0.20 0.00 -2.23 0.00 0.00 178.31 175.99 2jgm h ALA 473 N 1.68 0.79 -0.58 2.41 0.00 -1.02 -1.43 119.26 121.12 2jgm h ALA 473 Ca 0.51 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2jgm h ALA 473 Cb 0.95 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 2jgm h ALA 473 CO -0.54 0.65 0.33 1.96 0.00 0.00 0.00 179.25 181.66 2jgm h GLN 474 N 0.78 0.79 -0.27 0.00 4.20 -0.78 -0.72 115.11 119.11 2jgm h GLN 474 Ca 0.11 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.65 2jgm h GLN 474 Cb 0.74 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 2jgm h GLN 474 CO 0.06 0.57 -0.20 -0.09 -0.67 0.00 0.00 178.83 178.50 2jgm h ARG 475 N 0.80 0.62 -0.50 1.46 2.43 -0.73 -1.93 114.38 116.52 2jgm h ARG 475 Ca 0.21 -0.30 -0.10 0.00 -0.81 0.00 0.00 59.98 58.98 2jgm h ARG 475 Cb -0.01 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 2jgm h ARG 475 CO -0.04 0.89 -0.09 -0.07 -1.51 0.00 0.00 179.97 179.15 2jgm h LEU 476 N 0.35 0.90 -1.82 3.80 3.38 -0.79 -1.20 115.31 119.92 2jgm h LEU 476 Ca 0.05 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 2jgm h LEU 476 Cb 0.74 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 2jgm h LEU 476 CO 0.05 1.01 -0.05 0.24 0.09 0.00 0.00 178.44 179.78 2jgm h MET 477 N 0.82 0.05 -0.01 1.13 2.86 -1.00 -0.54 114.93 118.24 2jgm h MET 477 Ca 0.14 -0.01 -0.25 0.00 -2.06 0.00 0.00 59.70 57.52 2jgm h MET 477 Cb 0.61 -0.01 0.02 0.00 0.06 0.00 0.00 31.60 32.28 2jgm h MET 477 CO 0.04 0.11 -0.99 0.87 1.06 0.00 0.00 176.91 178.00 2jgm h LYS 478 N 0.05 0.69 0.16 1.72 1.57 -0.63 -2.34 116.57 117.78 2jgm h LYS 478 Ca 0.01 -0.73 0.01 0.00 -1.87 0.00 0.00 60.65 58.07 2jgm h LYS 478 Cb 0.12 0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 2jgm h LYS 478 CO 0.01 1.31 -0.18 1.88 -0.57 0.00 0.00 179.45 181.89 2jgm h TYR 479 N 0.36 -0.48 -0.41 -1.35 0.05 -0.49 0.14 116.97 114.79 2jgm h TYR 479 Ca -0.12 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.66 2jgm h TYR 479 Cb 1.64 0.19 -0.02 0.00 1.01 0.00 0.00 36.73 39.55 2jgm h TYR 479 CO 0.11 -0.27 0.24 -1.49 -1.05 0.00 0.00 178.16 175.69 2jgm h TRP 480 N -0.38 0.56 0.00 4.88 -0.00 -1.19 -0.18 115.95 119.63 2jgm h TRP 480 Ca 0.01 -0.01 -0.13 0.00 -0.00 0.00 0.00 58.89 58.76 2jgm h TRP 480 Cb 0.37 -0.18 -0.02 0.00 -0.00 0.00 0.00 29.16 29.33 2jgm h TRP 480 CO -0.16 0.41 -0.63 1.79 -0.00 0.00 0.00 178.44 179.85 2jgm h THR 481 N 0.54 1.23 -0.36 1.49 1.35 -1.39 0.12 112.91 115.89 2jgm h THR 481 Ca 0.15 -2.36 -0.12 0.00 -0.55 0.00 0.00 66.41 63.52 2jgm h THR 481 Cb 0.03 2.36 -0.01 0.00 -1.73 0.00 0.00 68.15 68.80 2jgm h THR 481 CO -0.03 0.62 -0.25 0.78 -0.25 0.00 0.00 175.52 176.40 2jgm h ASN 482 N 0.00 0.84 -0.89 5.36 2.35 -0.54 0.24 115.58 122.94 2jgm h ASN 482 Ca -0.01 -0.44 0.01 0.00 -0.55 0.00 0.00 56.30 55.32 2jgm h ASN 482 Cb 1.31 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 39.40 2jgm h ASN 482 CO 0.08 1.09 0.58 0.15 -1.65 0.00 0.00 177.43 177.69 2jgm h PHE 483 N 0.59 1.12 0.11 1.19 3.57 -0.86 -1.09 116.94 121.55 2jgm h PHE 483 Ca 0.07 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 2jgm h PHE 483 Cb 0.82 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 39.18 2jgm h PHE 483 CO 0.06 0.70 -0.05 0.00 -2.23 0.00 0.00 178.31 176.80 2jgm h ALA 484 N 1.32 -0.14 -0.85 2.41 0.00 -0.28 0.29 119.26 122.00 2jgm h ALA 484 Ca 0.32 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.17 2jgm h ALA 484 Cb -0.14 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 2jgm h ALA 484 CO -0.07 -0.53 0.56 0.00 0.00 0.00 0.00 179.25 179.22 2jgm h ARG 485 N -0.25 1.10 0.00 0.00 3.08 -0.39 -3.39 114.38 114.52 2jgm h ARG 485 Ca -0.01 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2jgm h ARG 485 Cb 0.20 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2jgm h ARG 485 CO 0.02 0.73 -0.11 0.25 -1.07 0.00 0.00 179.97 179.79 2jgm n THR 486 N -4.42 0.00 -0.77 2.04 -2.24 -0.43 -5.01 114.28 103.46 2jgm n THR 486 Ca 0.10 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2jgm n THR 486 Cb 0.05 0.78 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 2jgm n THR 486 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jgm n GLY 487 N 0.56 0.86 2.78 3.38 0.00 0.10 -5.01 105.19 107.85 2jgm n GLY 487 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2jgm n GLY 487 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jgm s ASP 488 N -2.91 2.08 0.05 1.61 -1.08 -1.26 -4.85 116.67 110.32 2jgm s ASP 488 Ca 0.00 -0.35 0.15 0.00 -0.52 0.00 0.00 52.55 51.83 2jgm s ASP 488 Cb 0.00 -0.54 0.63 0.00 -1.46 0.00 0.00 42.92 41.55 2jgm s ASP 488 CO 0.00 -0.22 1.46 -0.81 0.52 0.00 0.00 175.17 176.12 2jgm n PRO 489 N 5.09 0.03 -2.64 4.34 -0.04 -1.26 -3.01 135.00 137.52 2jgm n PRO 489 Ca -0.08 0.31 -0.41 0.00 -0.04 0.00 0.00 63.50 63.27 2jgm n PRO 489 Cb 0.49 -1.57 -0.04 0.00 -0.04 0.00 0.00 33.50 32.34 2jgm n PRO 489 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2jgm s ASN 490 N -3.21 7.40 -0.30 3.54 0.01 -1.26 -4.35 114.94 116.78 2jgm s ASN 490 Ca 0.06 1.93 -0.29 0.00 -0.71 0.00 0.00 52.86 53.85 2jgm s ASN 490 Cb 0.09 -2.60 -0.02 0.00 0.41 0.00 0.00 41.25 39.13 2jgm s ASN 490 CO 0.26 -0.12 1.72 -0.62 -1.51 0.00 0.00 177.10 176.83 2jgm s ASP 491 N -0.09 6.07 0.00 -1.22 -1.08 -1.26 -4.88 116.67 114.22 2jgm s ASP 491 Ca 0.48 1.39 0.20 0.00 -0.52 0.00 0.00 52.55 54.10 2jgm s ASP 491 Cb -0.26 -2.53 1.20 0.00 -1.46 0.00 0.00 42.92 39.87 2jgm s ASP 491 CO 0.32 -1.55 1.64 -0.81 0.52 0.00 0.00 175.17 175.29 2jgm n PRO 492 N 8.17 0.77 -2.80 4.34 -0.04 -1.26 -1.38 135.00 142.80 2jgm n PRO 492 Ca 0.21 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.42 2jgm n PRO 492 Cb 0.46 -1.41 -0.02 0.00 -0.04 0.00 0.00 33.50 32.49 2jgm n PRO 492 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2jgm n ARG 493 N -0.91 3.03 -3.28 0.54 5.12 -1.26 -4.89 116.66 115.02 2jgm n ARG 493 Ca 0.15 -4.57 -0.16 0.00 -1.93 0.00 0.00 57.85 51.35 2jgm n ARG 493 Cb 0.07 -2.16 -0.06 0.00 -1.16 0.00 0.00 32.46 29.15 2jgm n ARG 493 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2jgm s ASP 494 N -3.40 0.69 0.07 0.55 -1.08 -0.48 -5.02 116.67 108.01 2jgm s ASP 494 Ca 0.47 -1.82 -0.31 0.00 -0.52 0.00 0.00 52.55 50.37 2jgm s ASP 494 Cb 0.33 0.66 -0.18 0.00 -1.46 0.00 0.00 42.92 42.27 2jgm s ASP 494 CO -0.14 -0.21 1.65 -1.28 0.52 0.00 0.00 175.17 175.71 2jgm h SER 495 N 6.52 -0.61 -2.22 -0.34 0.87 -1.90 -3.44 113.55 112.43 2jgm h SER 495 Ca 0.09 0.02 -0.59 0.00 -1.23 0.00 0.00 61.79 60.08 2jgm h SER 495 Cb 1.05 0.16 0.05 0.00 -0.44 0.00 0.00 62.40 63.21 2jgm h SER 495 CO 0.19 -0.43 0.85 1.17 -0.53 0.00 0.00 176.83 178.08 2jgm n LYS 496 N -5.40 2.14 -3.57 2.24 3.00 -1.26 -4.96 118.16 110.35 2jgm n LYS 496 Ca -0.12 0.78 -0.16 0.00 -0.00 0.00 0.00 58.31 58.80 2jgm n LYS 496 Cb 0.30 -2.56 -0.06 0.00 0.00 0.00 0.00 35.03 32.70 2jgm n LYS 496 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2jgm s SER 497 N 1.54 -0.54 0.00 3.14 0.01 -1.26 -4.89 113.70 111.70 2jgm s SER 497 Ca 0.82 0.52 0.00 0.00 1.31 0.00 0.00 55.95 58.59 2jgm s SER 497 Cb -0.68 0.49 0.00 0.00 0.21 0.00 0.00 66.02 66.03 2jgm s SER 497 CO 0.41 -0.59 0.00 -2.65 0.41 0.00 0.00 173.24 170.81 2jgm n PRO 498 N 0.91 0.00 -3.95 12.44 -0.02 -1.26 -5.17 135.00 137.95 2jgm n PRO 498 Ca -0.19 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 60.96 2jgm n PRO 498 Cb 0.57 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 34.00 2jgm n PRO 498 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2jgm s GLN 499 N 0.00 3.34 -0.49 -0.52 -1.52 -1.26 -4.95 119.66 114.26 2jgm s GLN 499 Ca 0.00 -0.40 -0.25 0.00 -1.95 0.00 0.00 55.36 52.76 2jgm s GLN 499 Cb 0.00 -3.02 0.03 0.00 -0.22 0.00 0.00 33.01 29.80 2jgm s GLN 499 CO 0.00 0.65 0.93 -0.46 -0.25 0.00 0.00 175.29 176.15 2jgm s TRP 500 N -1.35 2.88 0.31 0.91 -0.11 -1.26 -4.95 118.94 115.36 2jgm s TRP 500 Ca 0.29 0.25 -0.28 0.00 1.22 0.00 0.00 56.10 57.59 2jgm s TRP 500 Cb -0.13 -3.99 -0.09 0.00 -1.50 0.00 0.00 33.47 27.76 2jgm s TRP 500 CO 0.20 -1.18 1.01 -2.14 -4.62 0.00 0.00 176.95 170.23 2jgm s PRO 501 N 3.81 4.58 0.44 5.86 0.02 -1.26 -4.90 135.00 143.54 2jgm s PRO 501 Ca 0.35 1.54 -0.26 0.00 0.02 0.00 0.00 61.00 62.65 2jgm s PRO 501 Cb -0.11 -2.98 -0.09 0.00 0.02 0.00 0.00 34.50 31.35 2jgm s PRO 501 CO 0.24 0.24 1.41 -2.14 -0.33 0.00 0.00 177.00 176.42 2jgm s PRO 502 N -1.75 3.76 -0.18 5.54 0.02 -1.26 -4.67 135.00 136.46 2jgm s PRO 502 Ca 0.48 2.39 -0.29 0.00 0.02 0.00 0.00 61.00 63.60 2jgm s PRO 502 Cb -0.25 -2.69 -0.01 0.00 0.02 0.00 0.00 34.50 31.57 2jgm s PRO 502 CO 0.31 -0.75 1.21 -0.47 -0.33 0.00 0.00 177.00 176.98 2jgm s TYR 503 N -1.20 2.95 0.10 6.54 6.14 0.51 -4.54 117.35 127.85 2jgm s TYR 503 Ca 0.60 1.11 0.08 0.00 0.64 0.00 0.00 57.07 59.49 2jgm s TYR 503 Cb -0.43 -3.45 -0.03 0.00 0.42 0.00 0.00 41.96 38.46 2jgm s TYR 503 CO 0.56 -1.43 -0.20 0.95 0.64 0.00 0.00 175.55 176.06 2jgm s THR 504 N 3.44 1.66 0.34 4.34 -4.23 -1.26 -4.32 115.64 115.61 2jgm s THR 504 Ca 0.52 -1.55 0.14 0.00 -1.18 0.00 0.00 61.69 59.62 2jgm s THR 504 Cb -0.20 -1.53 0.09 0.00 1.34 0.00 0.00 72.50 72.20 2jgm s THR 504 CO 0.13 -0.10 1.80 0.71 -0.54 0.00 0.00 174.62 176.62 2jgm h THR 505 N 4.04 1.22 0.40 3.99 1.35 -1.91 0.36 112.91 122.35 2jgm h THR 505 Ca -0.45 -1.38 -0.02 0.00 -0.55 0.00 0.00 66.41 64.01 2jgm h THR 505 Cb 1.18 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 69.36 2jgm h THR 505 CO 0.40 0.39 -0.19 0.00 -0.25 0.00 0.00 175.52 175.87 2jgm h ALA 506 N 1.61 -1.02 0.01 6.62 0.00 -1.99 -3.38 119.26 121.11 2jgm h ALA 506 Ca -0.00 -0.12 -0.27 0.00 0.00 0.00 0.00 54.91 54.52 2jgm h ALA 506 Cb 0.72 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2jgm h ALA 506 CO 0.05 -0.98 -1.52 0.00 0.00 0.00 0.00 179.25 176.80 2jgm h ALA 507 N -1.70 0.62 -4.05 0.00 0.00 -1.96 -3.49 119.26 108.68 2jgm h ALA 507 Ca -0.05 -1.30 -0.33 0.00 0.00 0.00 0.00 54.91 53.23 2jgm h ALA 507 Cb 0.41 0.31 0.07 0.00 0.00 0.00 0.00 17.79 18.58 2jgm h ALA 507 CO 0.09 1.46 -0.51 1.04 0.00 0.00 0.00 179.25 181.33 2jgm n GLN 508 N -3.17 -4.70 -2.74 0.00 6.02 0.12 -4.47 117.38 108.45 2jgm n GLN 508 Ca -0.13 0.72 -0.40 0.00 -0.01 0.00 0.00 57.00 57.18 2jgm n GLN 508 Cb 1.02 -5.25 -0.06 0.00 1.02 0.00 0.00 30.24 26.98 2jgm n GLN 508 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2jgm s GLN 509 N -5.64 4.82 0.34 -1.09 -0.21 -1.26 -0.10 119.66 116.52 2jgm s GLN 509 Ca 0.31 1.49 0.05 0.00 0.02 0.00 0.00 55.36 57.24 2jgm s GLN 509 Cb -0.14 -3.30 -0.03 0.00 1.00 0.00 0.00 33.01 30.55 2jgm s GLN 509 CO 0.39 0.45 0.21 1.52 -2.12 0.00 0.00 175.29 175.74 2jgm s TYR 510 N -0.96 1.70 0.22 0.91 1.13 -0.05 -4.03 117.35 116.28 2jgm s TYR 510 Ca 0.42 -1.51 0.10 0.00 -1.41 0.00 0.00 57.07 54.68 2jgm s TYR 510 Cb -0.26 -0.84 -0.05 0.00 -1.10 0.00 0.00 41.96 39.71 2jgm s TYR 510 CO 0.32 -0.66 -0.18 0.14 -2.51 0.00 0.00 175.55 172.66 2jgm s VAL 511 N -3.45 2.11 -0.27 -3.49 -7.23 -0.63 -1.28 120.40 106.16 2jgm s VAL 511 Ca 0.35 -2.20 -0.15 0.00 -1.81 0.00 0.00 61.98 58.17 2jgm s VAL 511 Cb 0.03 -2.11 -0.04 0.00 0.56 0.00 0.00 36.38 34.83 2jgm s VAL 511 CO 0.22 -0.41 0.38 -0.94 -0.31 0.00 0.00 175.10 174.04 2jgm s SER 512 N -3.18 6.27 -0.48 4.85 1.04 -0.76 -1.28 113.70 120.16 2jgm s SER 512 Ca 0.24 0.31 -0.20 0.00 0.48 0.00 0.00 55.95 56.77 2jgm s SER 512 Cb -0.04 -2.21 0.04 0.00 0.10 0.00 0.00 66.02 63.90 2jgm s SER 512 CO 0.10 -0.19 0.66 -0.76 0.98 0.00 0.00 173.24 174.03 2jgm s LEU 513 N 2.06 4.67 0.00 2.42 1.43 0.38 -4.14 118.68 125.50 2jgm s LEU 513 Ca 0.15 -0.60 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 2jgm s LEU 513 Cb -0.16 -2.60 0.00 0.00 0.03 0.00 0.00 46.19 43.46 2jgm s LEU 513 CO 0.10 -0.87 0.00 -0.46 0.23 0.00 0.00 176.35 175.35 2jgm n ASN 514 N 6.32 0.00 0.02 2.29 0.23 -1.26 -0.76 115.26 122.10 2jgm n ASN 514 Ca -0.04 -0.41 -0.12 0.00 -0.53 0.00 0.00 54.58 53.49 2jgm n ASN 514 Cb 0.47 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.17 2jgm n ASN 514 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 2jgm h LEU 515 N 0.00 0.66-10.14 -4.53 3.38 -1.93 -3.43 115.31 99.31 2jgm h LEU 515 Ca 0.00 -0.41 -0.52 0.00 0.09 0.00 0.00 57.88 57.04 2jgm h LEU 515 Cb 0.00 -0.19 0.11 0.00 0.09 0.00 0.00 40.66 40.67 2jgm h LEU 515 CO 0.00 1.17 0.42 -0.54 0.09 0.00 0.00 178.44 179.57 2jgm s LYS 516 N -3.75 2.83 0.89 1.13 1.02 -1.26 -5.00 119.74 115.60 2jgm s LYS 516 Ca -0.07 1.63 -0.10 0.00 0.02 0.00 0.00 55.97 57.44 2jgm s LYS 516 Cb 0.10 -1.93 0.13 0.00 -0.52 0.00 0.00 37.83 35.61 2jgm s LYS 516 CO 0.86 -1.27 1.15 -2.14 -0.92 0.00 0.00 175.35 173.03 2jgm s PRO 517 N -3.68 1.23 0.10 -1.68 0.02 -1.26 -4.84 135.00 124.88 2jgm s PRO 517 Ca 0.72 1.53 -0.35 0.00 0.02 0.00 0.00 61.00 62.92 2jgm s PRO 517 Cb -0.26 -1.75 -0.18 0.00 0.02 0.00 0.00 34.50 32.33 2jgm s PRO 517 CO 0.37 -2.47 1.03 1.28 -0.33 0.00 0.00 177.00 176.87 2jgm n LEU 518 N -4.05 0.39 -4.20 -5.54 4.77 -1.26 -4.97 117.00 102.14 2jgm n LEU 518 Ca 0.12 1.14 -0.32 0.00 -0.03 0.00 0.00 56.01 56.93 2jgm n LEU 518 Cb 0.52 -1.04 -0.17 0.00 -2.33 0.00 0.00 43.42 40.40 2jgm n LEU 518 CO 0.50 -1.84 -0.55 -0.70 -1.33 0.00 0.00 177.39 173.47 2jgm s GLU 519 N -0.23 2.94 -0.17 3.23 2.12 -1.26 -4.84 118.70 120.48 2jgm s GLU 519 Ca 0.80 -0.84 -0.22 0.00 0.36 0.00 0.00 54.97 55.07 2jgm s GLU 519 Cb -1.05 -2.25 -0.02 0.00 0.26 0.00 0.00 34.13 31.06 2jgm s GLU 519 CO 0.54 0.13 0.70 0.08 -0.54 0.00 0.00 175.26 176.17 2jgm s VAL 520 N 0.45 4.99 0.24 3.70 1.01 -1.26 -1.82 120.40 127.71 2jgm s VAL 520 Ca -0.17 1.35 0.12 0.00 0.00 0.00 0.00 61.98 63.28 2jgm s VAL 520 Cb -0.17 -4.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 2jgm s VAL 520 CO 0.07 0.11 -0.21 -0.13 0.00 0.00 0.00 175.10 174.94 2jgm s ARG 521 N 1.80 1.64 -0.06 2.72 0.52 -0.41 -4.99 118.95 120.17 2jgm s ARG 521 Ca 0.33 -1.66 0.06 0.00 -0.52 0.00 0.00 55.73 53.93 2jgm s ARG 521 Cb -0.16 -1.82 -0.01 0.00 0.52 0.00 0.00 34.95 33.48 2jgm s ARG 521 CO 0.12 0.36 -0.24 1.03 0.02 0.00 0.00 175.30 176.59 2jgm s ARG 522 N -3.18 2.63 0.00 3.54 0.52 -1.26 -0.87 118.95 120.32 2jgm s ARG 522 Ca 0.26 -0.89 0.00 0.00 -0.52 0.00 0.00 55.73 54.59 2jgm s ARG 522 Cb -0.06 -2.20 0.00 0.00 0.52 0.00 0.00 34.95 33.21 2jgm s ARG 522 CO 0.13 0.37 0.00 0.41 0.02 0.00 0.00 175.30 176.23 2jgm n GLY 523 N 3.00 -1.86 3.49 -3.53 0.00 0.86 -4.93 105.19 102.22 2jgm n GLY 523 Ca -0.18 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 2jgm n GLY 523 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jgm s LEU 524 N 0.00 4.62 -1.21 0.99 2.96 -1.26 -4.21 118.68 120.58 2jgm s LEU 524 Ca 0.00 -2.27 -0.00 0.00 -0.22 0.00 0.00 54.13 51.64 2jgm s LEU 524 Cb 0.00 -2.45 0.00 0.00 0.50 0.00 0.00 46.19 44.24 2jgm s LEU 524 CO 0.00 -1.06 0.98 0.54 -1.32 0.00 0.00 176.35 175.49 2jgm n ARG 525 N 6.93 -6.53 -0.02 1.98 5.12 -1.26 -4.81 116.66 118.06 2jgm n ARG 525 Ca 0.33 0.84 -0.10 0.00 -1.93 0.00 0.00 57.85 56.99 2jgm n ARG 525 Cb 0.47 -5.83 -0.04 0.00 -1.16 0.00 0.00 32.46 25.90 2jgm n ARG 525 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2jgm h ALA 526 N 0.90 0.17 -0.09 7.54 0.00 -1.94 0.86 119.26 126.69 2jgm h ALA 526 Ca -0.59 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.27 2jgm h ALA 526 Cb 1.34 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2jgm h ALA 526 CO 0.50 -0.40 -0.21 1.96 0.00 0.00 0.00 179.25 181.10 2jgm h GLN 527 N 0.11 0.31 -0.76 0.00 1.08 -1.96 -2.42 115.11 111.48 2jgm h GLN 527 Ca 0.07 -0.21 -0.04 0.00 -1.45 0.00 0.00 58.65 57.02 2jgm h GLN 527 Cb 0.05 0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.48 2jgm h GLN 527 CO -0.08 0.81 0.31 1.15 -0.95 0.00 0.00 178.83 180.07 2jgm h THR 528 N -0.14 1.25 0.00 -0.54 2.02 -1.92 -1.98 112.91 111.60 2jgm h THR 528 Ca 0.00 -0.78 -0.10 0.00 0.77 0.00 0.00 66.41 66.30 2jgm h THR 528 Cb 0.81 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2jgm h THR 528 CO 0.05 0.32 -0.48 0.00 0.37 0.00 0.00 175.52 175.78 2jgm h ALA 530 N 1.52 1.30 -0.15 0.00 0.00 -0.95 0.20 119.26 121.19 2jgm h ALA 530 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2jgm h ALA 530 Cb 1.18 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2jgm h ALA 530 CO 0.06 0.56 0.09 0.35 0.00 0.00 0.00 179.25 180.31 2jgm h PHE 531 N 1.03 0.19 -0.13 0.00 3.57 -0.64 -0.49 116.94 120.46 2jgm h PHE 531 Ca 0.26 0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.57 2jgm h PHE 531 Cb 0.04 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.72 2jgm h PHE 531 CO 0.01 0.14 -0.70 -1.49 -2.23 0.00 0.00 178.31 174.04 2jgm h TRP 532 N 0.18 0.77 0.00 0.41 4.06 -1.01 -2.09 115.95 118.28 2jgm h TRP 532 Ca 0.05 -0.32 -0.31 0.00 2.06 0.00 0.00 58.89 60.37 2jgm h TRP 532 Cb 0.01 -0.13 -0.05 0.00 -1.00 0.00 0.00 29.16 27.99 2jgm h TRP 532 CO -0.06 1.10 -1.88 0.09 -3.56 0.00 0.00 178.44 174.13 2jgm n ASN 533 N -3.90 0.63 -0.08 -3.49 3.02 0.65 -4.39 115.26 107.71 2jgm n ASN 533 Ca -0.05 0.30 -0.12 0.00 -0.03 0.00 0.00 54.58 54.68 2jgm n ASN 533 Cb 0.70 0.24 -0.07 0.00 -0.61 0.00 0.00 39.78 40.03 2jgm n ASN 533 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2jgm n ARG 534 N -2.96 0.40 -0.06 3.52 1.74 -0.21 -4.72 116.66 114.38 2jgm n ARG 534 Ca -0.21 0.10 -0.04 0.00 -0.77 0.00 0.00 57.85 56.93 2jgm n ARG 534 Cb 1.07 -1.31 -0.02 0.00 -1.02 0.00 0.00 32.46 31.18 2jgm n ARG 534 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2jgm h PHE 535 N -0.04 0.00 -0.70 -1.55 3.57 -1.33 -3.37 116.94 113.52 2jgm h PHE 535 Ca -0.37 0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.25 2jgm h PHE 535 Cb 1.55 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 40.21 2jgm h PHE 535 CO 0.01 0.11 0.29 1.25 -2.23 0.00 0.00 178.31 177.75 2jgm h LEU 536 N -1.00 0.30 -0.63 0.59 5.85 -1.59 -0.59 115.31 118.24 2jgm h LEU 536 Ca -0.02 0.09 0.11 0.00 0.84 0.00 0.00 57.88 58.90 2jgm h LEU 536 Cb 0.33 0.06 -0.12 0.00 0.37 0.00 0.00 40.66 41.30 2jgm h LEU 536 CO -0.01 0.15 -0.34 -0.65 -0.34 0.00 0.00 178.44 177.25 2jgm h PRO 537 N 0.47 -0.14 -0.51 5.25 0.11 -1.77 -1.95 132.00 133.46 2jgm h PRO 537 Ca 0.37 0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.50 2jgm h PRO 537 Cb 0.50 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.61 2jgm h PRO 537 CO -0.35 -0.10 0.34 0.87 -0.21 0.00 0.00 178.00 178.55 2jgm h LYS 538 N -0.15 0.65 -0.27 1.05 1.57 -1.28 -2.08 116.57 116.06 2jgm h LYS 538 Ca 0.24 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2jgm h LYS 538 Cb 0.55 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2jgm h LYS 538 CO -0.71 0.43 0.00 -0.11 -0.57 0.00 0.00 179.45 178.50 2jgm n LEU 539 N -4.46 0.27 0.00 2.94 7.94 -0.73 -5.15 117.00 117.81 2jgm n LEU 539 Ca 0.05 -0.14 0.00 0.00 -1.11 0.00 0.00 56.01 54.81 2jgm n LEU 539 Cb 0.06 -0.14 0.00 0.00 0.53 0.00 0.00 43.42 43.88 2jgm n LEU 539 CO 0.35 0.07 0.00 0.18 -1.11 0.00 0.00 177.39 176.88