#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1idm s LYS 2 N 0.00 3.25 -0.11 2.12 2.47 -1.25 0.24 119.74 126.45 1idm s LYS 2 Ca 0.00 -0.46 0.02 0.00 -1.56 0.00 0.00 55.97 53.96 1idm s LYS 2 Cb 0.00 -3.98 -0.01 0.00 -1.46 0.00 0.00 37.83 32.38 1idm s LYS 2 CO 0.00 -1.05 -0.16 0.08 0.16 0.00 0.00 175.35 174.38 1idm s VAL 3 N 2.80 2.81 -0.29 4.02 1.01 0.10 -0.82 120.40 130.03 1idm s VAL 3 Ca 0.21 -0.77 -0.13 0.00 0.00 0.00 0.00 61.98 61.30 1idm s VAL 3 Cb -0.15 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 1idm s VAL 3 CO 0.18 0.54 0.26 0.00 0.00 0.00 0.00 175.10 176.08 1idm s ALA 4 N 0.13 3.53 -0.21 5.51 0.00 0.14 -2.34 121.76 128.53 1idm s ALA 4 Ca -0.08 -1.05 -0.09 0.00 0.00 0.00 0.00 51.96 50.74 1idm s ALA 4 Cb -0.15 -2.59 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 1idm s ALA 4 CO 0.05 -0.66 0.10 0.08 0.00 0.00 0.00 175.76 175.33 1idm s VAL 5 N 1.87 4.98 -0.60 0.00 1.01 -0.37 -0.96 120.40 126.33 1idm s VAL 5 Ca 0.10 0.04 0.05 0.00 0.00 0.00 0.00 61.98 62.17 1idm s VAL 5 Cb -0.16 -3.28 0.18 0.00 0.00 0.00 0.00 36.38 33.12 1idm s VAL 5 CO 0.11 0.41 0.48 0.18 0.00 0.00 0.00 175.10 176.28 1idm n LEU 6 N 3.88 1.98 -0.33 3.92 4.32 0.05 -0.44 117.00 130.38 1idm n LEU 6 Ca -0.16 -4.98 0.18 0.00 -0.02 0.00 0.00 56.01 51.03 1idm n LEU 6 Cb 0.52 -0.31 0.39 0.00 -1.62 0.00 0.00 43.42 42.40 1idm n LEU 6 CO 0.35 1.84 1.10 1.55 -1.22 0.00 0.00 177.39 181.01 1idm h PRO 7 N 5.23 0.41 0.00 3.23 0.13 -1.79 -0.56 132.00 138.65 1idm h PRO 7 Ca 0.18 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1idm h PRO 7 Cb 0.79 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1idm h PRO 7 CO 0.62 0.27 0.00 0.41 -0.23 0.00 0.00 178.00 179.07 1idm n GLY 8 N -1.32 -0.47 3.94 1.56 0.00 -1.26 -2.31 105.19 105.33 1idm n GLY 8 Ca 0.27 -1.13 -0.23 0.00 0.00 0.00 0.00 46.02 44.93 1idm n GLY 8 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1idm s ASP 9 N -4.00 4.89 1.36 1.61 1.01 0.15 -4.45 116.67 117.25 1idm s ASP 9 Ca 0.00 -1.00 0.00 0.00 0.71 0.00 0.00 52.55 52.26 1idm s ASP 9 Cb 0.00 0.16 0.00 0.00 1.01 0.00 0.00 42.92 44.09 1idm s ASP 9 CO 0.00 -1.09 0.00 0.61 0.21 0.00 0.00 175.17 174.90 1idm n GLY 10 N -1.88 3.67 0.00 0.21 0.00 -1.26 -0.79 105.19 105.14 1idm n GLY 10 Ca 0.05 0.21 0.15 0.00 0.00 0.00 0.00 46.02 46.43 1idm n GLY 10 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1idm n ILE 11 N 0.00 0.01 -0.03 -0.61 -5.35 0.35 -4.31 119.36 109.43 1idm n ILE 11 Ca 0.00 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.33 1idm n ILE 11 Cb 0.00 -0.51 -0.10 0.00 -1.74 0.00 0.00 39.64 37.29 1idm n ILE 11 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1idm h GLY 12 N 4.93 -1.06 0.19 3.28 0.00 -1.13 -1.18 103.07 108.10 1idm h GLY 12 Ca 0.00 0.68 0.18 0.00 0.00 0.00 0.00 47.33 48.20 1idm h GLY 12 CO 0.00 -0.18 0.61 -2.55 0.00 0.00 0.00 176.54 174.42 1idm h PRO 13 N -0.55 0.72 -0.06 4.80 0.11 -1.75 -0.12 132.00 135.15 1idm h PRO 13 Ca 0.04 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 1idm h PRO 13 Cb 0.67 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.62 1idm h PRO 13 CO -0.46 0.47 -0.05 0.93 -0.21 0.00 0.00 178.00 178.68 1idm h GLU 14 N 0.74 0.14 -0.17 1.05 5.08 -1.66 -2.40 114.58 117.35 1idm h GLU 14 Ca 0.55 -0.07 -0.15 0.00 -1.00 0.00 0.00 59.36 58.70 1idm h GLU 14 Cb 0.90 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1idm h GLU 14 CO -0.33 0.57 -0.51 -0.39 -1.00 0.00 0.00 179.01 177.35 1idm h VAL 15 N -0.30 1.33 -0.45 3.13 -1.51 -0.90 -2.72 116.25 114.82 1idm h VAL 15 Ca 0.01 -1.75 -0.03 0.00 -1.23 0.00 0.00 66.70 63.70 1idm h VAL 15 Cb 0.55 1.75 -0.02 0.00 -2.13 0.00 0.00 31.29 31.44 1idm h VAL 15 CO 0.01 0.54 0.18 0.74 -1.23 0.00 0.00 177.57 177.81 1idm h THR 16 N 0.37 1.21 -0.56 7.19 2.02 -1.08 -2.26 112.91 119.80 1idm h THR 16 Ca 0.01 -0.64 -0.03 0.00 0.77 0.00 0.00 66.41 66.52 1idm h THR 16 Cb 1.03 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 1idm h THR 16 CO 0.09 0.24 0.22 -0.08 0.37 0.00 0.00 175.52 176.35 1idm h GLU 17 N 0.59 0.81 -0.52 6.66 4.57 -1.39 -1.14 114.58 124.16 1idm h GLU 17 Ca 0.15 -0.12 -0.03 0.00 -1.18 0.00 0.00 59.36 58.18 1idm h GLU 17 Cb 0.20 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 1idm h GLU 17 CO -0.01 0.67 0.19 0.00 -1.18 0.00 0.00 179.01 178.68 1idm h ALA 18 N 1.44 1.37 -0.42 2.92 0.00 -1.10 -0.13 119.26 123.34 1idm h ALA 18 Ca 0.19 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1idm h ALA 18 Cb 0.17 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1idm h ALA 18 CO -0.02 0.47 -0.32 0.00 0.00 0.00 0.00 179.25 179.39 1idm h ALA 19 N 1.48 0.60 -0.46 0.00 0.00 -0.78 -2.93 119.26 117.16 1idm h ALA 19 Ca 0.18 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1idm h ALA 19 Cb 0.17 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1idm h ALA 19 CO -0.01 0.66 0.15 -0.07 0.00 0.00 0.00 179.25 179.97 1idm h LEU 20 N 0.78 0.62 -1.07 0.00 3.38 -0.42 -0.08 115.31 118.52 1idm h LEU 20 Ca 0.08 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1idm h LEU 20 Cb 0.91 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1idm h LEU 20 CO 0.08 0.59 0.11 0.11 0.09 0.00 0.00 178.44 179.42 1idm h LYS 21 N 0.67 0.77 -0.11 1.13 1.57 -0.88 0.17 116.57 119.89 1idm h LYS 21 Ca 0.16 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 1idm h LYS 21 Cb 0.19 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1idm h LYS 21 CO -0.01 0.71 -0.44 0.28 -0.57 0.00 0.00 179.45 179.42 1idm h VAL 22 N 0.74 1.37 -0.72 0.50 2.07 -1.17 -2.54 116.25 116.51 1idm h VAL 22 Ca 0.16 -1.75 -0.05 0.00 0.82 0.00 0.00 66.70 65.88 1idm h VAL 22 Cb 0.30 2.15 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 1idm h VAL 22 CO 0.00 0.52 0.26 -0.07 0.02 0.00 0.00 177.57 178.31 1idm h LEU 23 N 0.09 1.00 -0.85 2.57 3.38 -0.72 -1.93 115.31 118.85 1idm h LEU 23 Ca -0.02 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.68 1idm h LEU 23 Cb 1.07 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1idm h LEU 23 CO 0.09 0.90 -0.32 0.03 0.09 0.00 0.00 178.44 179.24 1idm h ARG 24 N 1.05 0.48 -0.44 1.13 3.08 -0.70 -1.08 114.38 117.90 1idm h ARG 24 Ca 0.24 -0.20 -0.07 0.00 0.07 0.00 0.00 59.98 60.01 1idm h ARG 24 Cb 0.24 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1idm h ARG 24 CO -0.02 0.74 0.01 0.00 -1.07 0.00 0.00 179.97 179.63 1idm h ALA 25 N 1.25 0.59 -0.54 0.04 0.00 -1.04 -1.80 119.26 117.76 1idm h ALA 25 Ca 0.05 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 1idm h ALA 25 Cb 0.76 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1idm h ALA 25 CO 0.06 0.38 -0.08 -0.07 0.00 0.00 0.00 179.25 179.54 1idm h LEU 26 N 0.62 0.97 -0.79 0.00 3.38 -1.19 -2.40 115.31 115.90 1idm h LEU 26 Ca 0.13 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.83 1idm h LEU 26 Cb 0.48 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 1idm h LEU 26 CO 0.02 1.07 0.51 -0.78 0.09 0.00 0.00 178.44 179.34 1idm h ASP 27 N 0.88 0.84 -0.08 -0.43 3.58 -0.92 0.31 116.42 120.60 1idm h ASP 27 Ca 0.15 -0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.59 1idm h ASP 27 Cb 0.62 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.48 1idm h ASP 27 CO 0.04 0.58 0.03 -0.33 -2.88 0.00 0.00 179.24 176.68 1idm h GLU 28 N 0.98 0.12 -0.10 0.28 5.08 -1.17 0.26 114.58 120.03 1idm h GLU 28 Ca 0.32 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.56 1idm h GLU 28 Cb 0.01 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1idm h GLU 28 CO -0.11 0.25 -0.36 0.00 -1.00 0.00 0.00 179.01 177.79 1idm h ALA 29 N 0.86 1.20 0.00 3.43 0.00 -0.91 -3.34 119.26 120.49 1idm h ALA 29 Ca 0.03 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1idm h ALA 29 Cb 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1idm h ALA 29 CO -0.00 0.54 0.00 0.39 0.00 0.00 0.00 179.25 180.18 1idm n GLU 30 N -4.07 3.22 -3.30 0.00 4.71 0.10 -5.05 120.64 116.25 1idm n GLU 30 Ca -0.01 -0.22 -0.17 0.00 -0.01 0.00 0.00 57.16 56.75 1idm n GLU 30 Cb 0.44 -0.71 0.06 0.00 -1.01 0.00 0.00 31.44 30.22 1idm n GLU 30 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1idm n GLY 31 N 0.52 -1.15 0.10 0.62 0.00 0.92 -4.89 105.19 101.32 1idm n GLY 31 Ca 0.00 0.57 0.13 0.00 0.00 0.00 0.00 46.02 46.72 1idm n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1idm n LEU 32 N -3.30 0.74 -2.02 0.99 7.99 -1.24 -4.92 117.00 115.23 1idm n LEU 32 Ca -0.07 0.59 -0.10 0.00 -0.01 0.00 0.00 56.01 56.42 1idm n LEU 32 Cb 0.61 -0.37 0.04 0.00 -0.11 0.00 0.00 43.42 43.59 1idm n LEU 32 CO 0.60 -0.24 0.09 0.61 -1.51 0.00 0.00 177.39 176.94 1idm n GLY 33 N 1.08 0.18 3.75 -0.72 0.00 -1.26 -4.02 105.19 104.20 1idm n GLY 33 Ca 0.05 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1idm n GLY 33 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1idm s LEU 34 N -4.00 4.40 -0.22 0.99 0.20 -1.26 -1.69 118.68 117.10 1idm s LEU 34 Ca 0.18 2.63 -0.04 0.00 0.69 0.00 0.00 54.13 57.60 1idm s LEU 34 Cb -0.08 -3.63 0.10 0.00 -0.43 0.00 0.00 46.19 42.16 1idm s LEU 34 CO 0.34 -0.65 0.26 0.00 -0.29 0.00 0.00 176.35 176.01 1idm s ALA 35 N -0.17 -0.44 0.16 5.97 0.00 0.14 -4.92 121.76 122.50 1idm s ALA 35 Ca 0.57 0.35 0.07 0.00 0.00 0.00 0.00 51.96 52.96 1idm s ALA 35 Cb -0.41 -1.42 -0.04 0.00 0.00 0.00 0.00 23.12 21.25 1idm s ALA 35 CO 0.44 -1.25 -0.15 1.52 0.00 0.00 0.00 175.76 176.33 1idm s TYR 36 N 2.37 1.59 -0.02 0.00 1.13 -1.26 -0.72 117.35 120.44 1idm s TYR 36 Ca 0.08 -0.56 -0.01 0.00 -1.41 0.00 0.00 57.07 55.17 1idm s TYR 36 Cb -0.16 -0.79 0.01 0.00 -1.10 0.00 0.00 41.96 39.93 1idm s TYR 36 CO -0.14 0.25 0.05 -2.00 -2.51 0.00 0.00 175.55 171.21 1idm s GLU 37 N -3.12 0.04 -0.10 -3.49 2.12 -0.99 -4.97 118.70 108.18 1idm s GLU 37 Ca 0.16 0.12 -0.12 0.00 0.36 0.00 0.00 54.97 55.49 1idm s GLU 37 Cb -0.03 -0.05 -0.05 0.00 0.26 0.00 0.00 34.13 34.26 1idm s GLU 37 CO 0.05 -0.06 0.28 0.14 -0.54 0.00 0.00 175.26 175.13 1idm s VAL 38 N 0.36 5.28 0.19 3.70 -7.23 -1.26 -1.23 120.40 120.22 1idm s VAL 38 Ca -0.03 0.53 0.10 0.00 -1.81 0.00 0.00 61.98 60.77 1idm s VAL 38 Cb -0.04 -3.59 -0.04 0.00 0.56 0.00 0.00 36.38 33.27 1idm s VAL 38 CO -0.01 0.51 -0.20 -0.36 -0.31 0.00 0.00 175.10 174.73 1idm s PHE 39 N -0.41 2.02 0.17 2.82 0.40 0.41 -4.95 117.98 118.45 1idm s PHE 39 Ca 0.18 -0.42 -0.30 0.00 -0.60 0.00 0.00 56.93 55.78 1idm s PHE 39 Cb -0.14 -0.98 -0.08 0.00 0.51 0.00 0.00 43.02 42.34 1idm s PHE 39 CO 0.07 0.44 1.14 -1.25 0.70 0.00 0.00 175.22 176.31 1idm s PRO 40 N -2.94 4.55 -0.00 0.24 0.04 -1.26 -4.38 135.00 131.24 1idm s PRO 40 Ca 0.20 1.77 -0.19 0.00 0.04 0.00 0.00 61.00 62.82 1idm s PRO 40 Cb -0.06 -3.27 0.04 0.00 0.04 0.00 0.00 34.50 31.25 1idm s PRO 40 CO 0.09 -0.00 0.41 0.12 0.04 0.00 0.00 177.00 177.65 1idm s PHE 41 N -0.08 -0.29 0.00 0.56 5.36 -1.26 -4.61 117.98 117.65 1idm s PHE 41 Ca 0.51 0.41 0.00 0.00 -0.96 0.00 0.00 56.93 56.89 1idm s PHE 41 Cb -0.30 0.19 0.00 0.00 -0.34 0.00 0.00 43.02 42.56 1idm s PHE 41 CO 0.35 -0.48 0.00 0.41 -1.46 0.00 0.00 175.22 174.04 1idm n GLY 42 N 0.98 -0.32 0.36 13.12 0.00 -0.67 -3.77 105.19 114.90 1idm n GLY 42 Ca -0.20 -1.08 0.06 0.00 0.00 0.00 0.00 46.02 44.80 1idm n GLY 42 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1idm h GLY 43 N 0.00 1.10 1.06 -0.02 0.00 -1.90 -0.82 103.07 102.50 1idm h GLY 43 Ca 0.00 -0.34 0.02 0.00 0.00 0.00 0.00 47.33 47.00 1idm h GLY 43 CO 0.00 0.24 0.61 0.00 0.00 0.00 0.00 176.54 177.39 1idm h ALA 44 N 1.57 1.36 -0.39 3.60 0.00 -1.88 0.09 119.26 123.62 1idm h ALA 44 Ca 0.35 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 55.06 1idm h ALA 44 Cb 0.28 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1idm h ALA 44 CO -0.13 0.58 -0.34 0.00 0.00 0.00 0.00 179.25 179.37 1idm h ALA 45 N 1.43 0.67 -0.20 0.00 0.00 -1.27 -1.04 119.26 118.85 1idm h ALA 45 Ca 0.35 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1idm h ALA 45 Cb -0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1idm h ALA 45 CO -0.08 0.67 0.10 0.82 0.00 0.00 0.00 179.25 180.76 1idm h ILE 46 N 0.74 1.12 -0.11 0.00 2.04 -0.42 0.79 117.51 121.67 1idm h ILE 46 Ca 0.07 -0.33 -0.05 0.00 1.00 0.00 0.00 64.86 65.55 1idm h ILE 46 Cb 0.91 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 1idm h ILE 46 CO 0.08 0.11 -0.16 0.44 0.00 0.00 0.00 178.15 178.63 1idm h ASP 47 N 0.20 0.16 0.29 1.72 3.32 -0.89 0.51 116.42 121.72 1idm h ASP 47 Ca 0.07 -0.03 -0.26 0.00 0.02 0.00 0.00 57.03 56.83 1idm h ASP 47 Cb 0.09 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.55 1idm h ASP 47 CO -0.01 0.34 -1.95 0.00 -1.72 0.00 0.00 179.24 175.90 1idm n ALA 48 N -2.49 1.76 0.00 3.45 0.00 -0.41 -4.71 120.51 118.11 1idm n ALA 48 Ca -0.01 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.51 1idm n ALA 48 Cb 0.27 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.13 1idm n ALA 48 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1idm n PHE 49 N -2.80 0.00 0.00 0.00 3.72 0.27 -5.03 117.46 113.63 1idm n PHE 49 Ca -0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.20 1idm n PHE 49 Cb 0.99 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.53 1idm n PHE 49 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1idm n GLY 50 N 1.07 0.67 2.98 1.37 0.00 0.18 -4.97 105.19 106.48 1idm n GLY 50 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1idm n GLY 50 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1idm s GLU 51 N -0.96 0.30 0.55 1.61 -1.05 -1.24 -4.82 118.70 113.10 1idm s GLU 51 Ca 0.00 -0.55 0.34 0.00 -0.15 0.00 0.00 54.97 54.61 1idm s GLU 51 Cb 0.00 0.11 1.39 0.00 -0.44 0.00 0.00 34.13 35.19 1idm s GLU 51 CO 0.00 -0.05 2.00 -1.00 0.95 0.00 0.00 175.26 177.15 1idm h PRO 52 N 4.73 0.00 -2.30 -4.83 0.13 -1.83 -3.04 132.00 124.85 1idm h PRO 52 Ca -0.31 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.23 1idm h PRO 52 Cb 1.21 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.94 1idm h PRO 52 CO 0.42 0.02 -0.92 0.34 -0.23 0.00 0.00 178.00 177.62 1idm n PHE 53 N -3.12 0.44 -1.07 1.56 7.35 -1.26 -1.66 117.46 119.70 1idm n PHE 53 Ca 0.00 -3.65 -0.31 0.00 -0.76 0.00 0.00 57.45 52.73 1idm n PHE 53 Cb 0.30 -0.19 0.12 0.00 0.35 0.00 0.00 39.48 40.07 1idm n PHE 53 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 1idm s PRO 54 N -0.94 1.77 0.20 -7.13 0.04 -1.26 -4.74 135.00 122.94 1idm s PRO 54 Ca 0.34 1.38 -0.18 0.00 0.04 0.00 0.00 61.00 62.57 1idm s PRO 54 Cb 0.09 -1.83 0.17 0.00 0.04 0.00 0.00 34.50 32.98 1idm s PRO 54 CO -0.14 -2.04 1.60 1.49 0.04 0.00 0.00 177.00 177.95 1idm h GLU 55 N -1.32 -0.10 -0.49 4.56 4.57 -1.98 -0.74 114.58 119.08 1idm h GLU 55 Ca -0.44 0.01 0.08 0.00 -1.18 0.00 0.00 59.36 57.83 1idm h GLU 55 Cb 1.25 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.84 1idm h GLU 55 CO 0.47 -0.07 0.33 -1.00 -1.18 0.00 0.00 179.01 177.57 1idm h PRO 56 N -0.11 0.33 -0.12 0.92 0.13 -1.98 -1.54 132.00 129.63 1idm h PRO 56 Ca 0.26 -0.02 -0.21 0.00 -0.87 0.00 0.00 66.00 65.16 1idm h PRO 56 Cb 0.52 -0.07 0.01 0.00 0.13 0.00 0.00 31.00 31.59 1idm h PRO 56 CO -0.66 0.22 -0.75 1.15 -0.23 0.00 0.00 178.00 177.72 1idm h THR 57 N 0.34 1.30 -0.48 1.56 2.02 -1.47 -1.56 112.91 114.62 1idm h THR 57 Ca 0.22 -1.98 -0.01 0.00 0.77 0.00 0.00 66.41 65.41 1idm h THR 57 Cb 0.43 2.09 -0.02 0.00 -1.74 0.00 0.00 68.15 68.91 1idm h THR 57 CO -0.05 0.62 0.25 0.03 0.37 0.00 0.00 175.52 176.74 1idm h ARG 58 N 0.42 0.67 -0.64 6.66 3.08 -0.73 -0.08 114.38 123.77 1idm h ARG 58 Ca -0.06 -0.09 -0.09 0.00 0.07 0.00 0.00 59.98 59.82 1idm h ARG 58 Cb 1.39 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 1idm h ARG 58 CO 0.15 0.54 0.05 -0.22 -1.07 0.00 0.00 179.97 179.43 1idm h LYS 59 N 0.63 1.09 -0.77 0.04 3.64 -1.35 -2.26 116.57 117.59 1idm h LYS 59 Ca 0.17 -0.32 -0.04 0.00 -1.27 0.00 0.00 60.65 59.19 1idm h LYS 59 Cb 0.07 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 1idm h LYS 59 CO -0.02 1.03 0.34 0.78 -2.27 0.00 0.00 179.45 179.30 1idm h GLY 60 N 1.00 1.22 1.92 5.01 0.00 -0.63 -1.34 103.07 110.24 1idm h GLY 60 Ca 0.19 -0.64 -0.15 0.00 0.00 0.00 0.00 47.33 46.73 1idm h GLY 60 CO 0.02 0.60 -0.66 -0.39 0.00 0.00 0.00 176.54 176.11 1idm h VAL 61 N 1.10 1.45 -0.29 4.60 -1.51 -0.94 -2.71 116.25 117.96 1idm h VAL 61 Ca 0.26 -2.21 -0.12 0.00 -1.23 0.00 0.00 66.70 63.41 1idm h VAL 61 Cb 0.17 2.18 -0.01 0.00 -2.13 0.00 0.00 31.29 31.50 1idm h VAL 61 CO -0.03 0.64 -0.30 -0.08 -1.23 0.00 0.00 177.57 176.57 1idm h GLU 62 N 0.06 0.60 0.00 5.19 4.57 -1.02 -2.89 114.58 121.08 1idm h GLU 62 Ca -0.01 -0.26 0.00 0.00 -1.18 0.00 0.00 59.36 57.91 1idm h GLU 62 Cb 1.18 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 1idm h GLU 62 CO 0.09 0.83 -0.06 1.05 -1.18 0.00 0.00 179.01 179.74 1idm h GLU 63 N 0.51 0.00 -7.02 1.92 4.11 -1.16 -3.47 114.58 109.47 1idm h GLU 63 Ca 0.06 0.00 -0.47 0.00 0.07 0.00 0.00 59.36 59.03 1idm h GLU 63 Cb 0.78 0.00 0.05 0.00 0.50 0.00 0.00 28.75 30.08 1idm h GLU 63 CO 0.06 0.00 0.11 0.00 0.07 0.00 0.00 179.01 179.25 1idm s ALA 64 N -3.12 3.44 -0.40 1.06 0.00 -1.03 -5.01 121.76 116.69 1idm s ALA 64 Ca 0.10 -0.86 0.22 0.00 0.00 0.00 0.00 51.96 51.42 1idm s ALA 64 Cb 0.12 -2.45 -0.10 0.00 0.00 0.00 0.00 23.12 20.68 1idm s ALA 64 CO 0.62 -0.77 0.85 0.39 0.00 0.00 0.00 175.76 176.85 1idm n GLU 65 N -2.50 0.43 -3.47 0.00 1.02 0.00 -4.80 120.64 111.33 1idm n GLU 65 Ca 0.05 -0.04 -0.12 0.00 -0.02 0.00 0.00 57.16 57.02 1idm n GLU 65 Cb 0.58 -1.60 -0.03 0.00 -0.02 0.00 0.00 31.44 30.37 1idm n GLU 65 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1idm s ALA 66 N -3.31 -1.72 -0.08 0.62 0.00 -1.15 -4.39 121.76 111.73 1idm s ALA 66 Ca -0.00 0.88 0.04 0.00 0.00 0.00 0.00 51.96 52.88 1idm s ALA 66 Cb 0.14 0.46 0.00 0.00 0.00 0.00 0.00 23.12 23.72 1idm s ALA 66 CO 0.84 -0.63 -0.22 0.08 0.00 0.00 0.00 175.76 175.83 1idm s VAL 67 N -2.87 1.85 -0.30 0.00 1.01 -0.61 -0.68 120.40 118.80 1idm s VAL 67 Ca -0.01 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 61.01 1idm s VAL 67 Cb -0.01 -1.60 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1idm s VAL 67 CO -0.06 0.51 0.07 -0.22 0.00 0.00 0.00 175.10 175.40 1idm s LEU 68 N 0.32 3.91 -0.11 3.92 0.20 -0.13 -1.30 118.68 125.49 1idm s LEU 68 Ca -0.15 -0.88 -0.05 0.00 0.69 0.00 0.00 54.13 53.74 1idm s LEU 68 Cb -0.17 -1.84 -0.04 0.00 -0.43 0.00 0.00 46.19 43.71 1idm s LEU 68 CO 0.07 -0.23 0.07 -0.22 -0.29 0.00 0.00 176.35 175.75 1idm s LEU 69 N 1.44 3.95 0.00 -0.68 0.20 0.52 -0.77 118.68 123.34 1idm s LEU 69 Ca 0.01 0.28 0.00 0.00 0.69 0.00 0.00 54.13 55.11 1idm s LEU 69 Cb -0.18 -1.94 0.00 0.00 -0.43 0.00 0.00 46.19 43.64 1idm s LEU 69 CO 0.02 0.38 0.00 0.61 -0.29 0.00 0.00 176.35 177.06 1idm n GLY 70 N 2.18 1.34 3.14 7.98 0.00 -0.22 -4.14 105.19 115.47 1idm n GLY 70 Ca -0.19 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.72 1idm n GLY 70 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1idm s SER 71 N -1.00 0.01 0.06 1.61 1.04 -0.98 -4.27 113.70 110.17 1idm s SER 71 Ca 0.00 -0.21 0.05 0.00 0.48 0.00 0.00 55.95 56.27 1idm s SER 71 Cb 0.00 0.23 -0.03 0.00 0.10 0.00 0.00 66.02 66.32 1idm s SER 71 CO 0.00 -0.42 -0.14 -0.69 0.98 0.00 0.00 173.24 172.97 1idm s VAL 72 N -1.62 1.10 0.00 5.02 1.01 -1.26 0.34 120.40 124.99 1idm s VAL 72 Ca -0.13 -1.23 0.00 0.00 0.00 0.00 0.00 61.98 60.62 1idm s VAL 72 Cb -0.06 -1.05 0.00 0.00 0.00 0.00 0.00 36.38 35.27 1idm s VAL 72 CO 0.01 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.54 1idm n GLY 73 N 1.42 2.80 0.00 4.51 0.00 -1.26 -4.45 105.19 108.21 1idm n GLY 73 Ca -0.20 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 43.81 1idm n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1idm n GLY 74 N -0.27 2.91 0.35 -0.02 0.00 -1.26 -4.62 105.19 102.28 1idm n GLY 74 Ca 0.00 -0.46 0.18 0.00 0.00 0.00 0.00 46.02 45.74 1idm n GLY 74 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1idm h PRO 75 N 0.00 0.00 0.00 1.61 0.13 -2.01 -1.32 132.00 130.40 1idm h PRO 75 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 1idm h PRO 75 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 1idm h PRO 75 CO 0.00 0.00 -0.04 -0.22 -0.23 0.00 0.00 178.00 177.51 1idm h LYS 76 N 0.00 0.00 -0.66 0.86 3.64 -2.00 -2.93 116.57 115.48 1idm h LYS 76 Ca 0.09 0.00 -0.48 0.00 -1.27 0.00 0.00 60.65 58.99 1idm h LYS 76 Cb 0.72 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 32.14 1idm h LYS 76 CO -0.00 0.04 -0.84 0.91 -2.27 0.00 0.00 179.45 177.29 1idm n TRP 77 N -3.33 2.39 0.76 1.91 8.01 -0.50 -4.67 117.44 122.01 1idm n TRP 77 Ca -0.02 -2.16 0.07 0.00 -1.31 0.00 0.00 57.50 54.09 1idm n TRP 77 Cb 0.19 -0.32 0.21 0.00 -2.01 0.00 0.00 31.31 29.38 1idm n TRP 77 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1idm n GLY 78 N -0.71 0.86 3.05 6.99 0.00 -1.11 -4.60 105.19 109.67 1idm n GLY 78 Ca 0.38 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 1idm n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1idm s THR 79 N -1.50 0.36 0.00 2.61 2.01 -1.26 -5.11 115.64 112.74 1idm s THR 79 Ca 0.29 -1.23 0.00 0.00 0.31 0.00 0.00 61.69 61.05 1idm s THR 79 Cb 0.15 -0.75 0.00 0.00 0.01 0.00 0.00 72.50 71.91 1idm s THR 79 CO 0.20 -0.58 0.00 0.61 -0.69 0.00 0.00 174.62 174.16 1idm n GLY 80 N 1.12 1.64 0.09 4.40 0.00 -1.26 -4.83 105.19 106.36 1idm n GLY 80 Ca -0.21 -2.01 -0.11 0.00 0.00 0.00 0.00 46.02 43.70 1idm n GLY 80 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1idm h SER 81 N 0.00 -0.08 -2.26 1.61 4.64 -1.99 -3.42 113.55 112.05 1idm h SER 81 Ca 0.00 -0.54 -0.53 0.00 -0.47 0.00 0.00 61.79 60.25 1idm h SER 81 Cb 0.00 0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.08 1idm h SER 81 CO 0.00 0.61 1.35 -0.69 -0.87 0.00 0.00 176.83 177.22 1idm s VAL 82 N -2.91 3.37 -0.04 0.95 1.01 -1.26 -4.98 120.40 116.54 1idm s VAL 82 Ca -0.14 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.16 1idm s VAL 82 Cb -0.01 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1idm s VAL 82 CO 0.51 -0.59 -0.01 -0.13 0.00 0.00 0.00 175.10 174.89 1idm s ARG 83 N 6.53 2.85 0.51 2.72 1.81 -1.26 -4.95 118.95 127.16 1idm s ARG 83 Ca 0.76 -0.53 0.23 0.00 -1.72 0.00 0.00 55.73 54.48 1idm s ARG 83 Cb -0.18 -2.70 1.34 0.00 -0.45 0.00 0.00 34.95 32.96 1idm s ARG 83 CO 0.27 0.66 1.99 -1.35 -0.68 0.00 0.00 175.30 176.19 1idm h PRO 84 N 4.77 0.06 -0.03 3.54 0.11 -1.90 -2.13 132.00 136.42 1idm h PRO 84 Ca -0.50 -0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 1idm h PRO 84 Cb 1.18 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1idm h PRO 84 CO 0.55 0.04 -0.45 0.93 -0.21 0.00 0.00 178.00 178.86 1idm h GLU 85 N 0.06 0.07 0.00 1.05 3.07 -1.95 -2.51 114.58 114.38 1idm h GLU 85 Ca 0.26 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 59.08 1idm h GLU 85 Cb 0.95 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.86 1idm h GLU 85 CO -0.02 0.51 -0.01 -0.56 -1.40 0.00 0.00 179.01 177.54 1idm h GLN 86 N 0.06 0.00 -0.79 2.33 -0.00 -1.79 0.36 115.11 115.28 1idm h GLN 86 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.64 1idm h GLN 86 Cb 0.83 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 28.27 1idm h GLN 86 CO 0.06 0.01 0.44 0.78 -0.00 0.00 0.00 178.83 180.12 1idm h GLY 87 N 0.08 1.17 0.87 0.06 0.00 -1.58 0.60 103.07 104.26 1idm h GLY 87 Ca -0.00 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 1idm h GLY 87 CO 0.00 0.49 0.05 1.41 0.00 0.00 0.00 176.54 178.50 1idm h LEU 88 N 1.10 0.37 -0.13 3.11 -0.00 -1.07 -0.98 115.31 117.72 1idm h LEU 88 Ca 0.28 -0.24 0.02 0.00 -0.00 0.00 0.00 57.88 57.94 1idm h LEU 88 Cb 0.01 -0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 40.55 1idm h LEU 88 CO -0.05 0.51 0.01 -0.07 -0.00 0.00 0.00 178.44 178.85 1idm h LEU 89 N 0.21 -0.03 -0.72 1.67 3.38 -1.29 -0.42 115.31 118.11 1idm h LEU 89 Ca 0.08 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1idm h LEU 89 Cb 0.29 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1idm h LEU 89 CO 0.00 0.00 0.39 0.28 0.09 0.00 0.00 178.44 179.20 1idm h SER 90 N 0.05 0.91 0.28 -0.43 0.02 -0.82 -0.38 113.55 113.19 1idm h SER 90 Ca 0.06 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 1idm h SER 90 Cb 0.06 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.37 1idm h SER 90 CO -0.09 0.75 -0.17 0.25 -1.14 0.00 0.00 176.83 176.43 1idm h LEU 91 N 1.00 -0.43 -0.54 5.07 6.46 -0.81 0.99 115.31 127.05 1idm h LEU 91 Ca 0.25 0.03 0.05 0.00 -0.12 0.00 0.00 57.88 58.09 1idm h LEU 91 Cb 0.05 0.13 -0.05 0.00 -0.73 0.00 0.00 40.66 40.06 1idm h LEU 91 CO -0.04 -0.28 0.26 -0.09 -0.62 0.00 0.00 178.44 177.67 1idm h ARG 92 N -0.44 0.48 -0.38 1.25 2.43 -0.84 -2.78 114.38 114.10 1idm h ARG 92 Ca -0.03 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.00 1idm h ARG 92 Cb 0.36 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1idm h ARG 92 CO 0.03 0.32 -0.18 -0.22 -1.51 0.00 0.00 179.97 178.40 1idm h LYS 93 N 0.49 0.79 -0.08 0.20 3.64 -0.84 -2.19 116.57 118.58 1idm h LYS 93 Ca 0.24 -0.35 0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1idm h LYS 93 Cb 0.18 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1idm h LYS 93 CO -0.19 0.97 0.07 0.66 -2.27 0.00 0.00 179.45 178.69 1idm h SER 94 N 0.59 0.00 -0.19 4.20 4.64 -0.54 -1.81 113.55 120.43 1idm h SER 94 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1idm h SER 94 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1idm h SER 94 CO 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.02 1idm n GLN 95 N -4.28 1.86 -3.73 4.77 1.13 -1.10 -4.94 117.38 111.09 1idm n GLN 95 Ca -0.01 -1.80 -0.31 0.00 -1.94 0.00 0.00 57.00 52.94 1idm n GLN 95 Cb 0.17 -1.36 0.04 0.00 0.11 0.00 0.00 30.24 29.20 1idm n GLN 95 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1idm n ASP 96 N 1.00 -4.55 -4.59 1.08 8.00 -0.68 0.16 116.55 116.96 1idm n ASP 96 Ca 0.13 -1.03 -0.42 0.00 0.71 0.00 0.00 54.79 54.18 1idm n ASP 96 Cb 0.46 -3.27 -0.05 0.00 -0.02 0.00 0.00 41.12 38.23 1idm n ASP 96 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1idm s LEU 97 N -6.59 4.12 0.00 0.64 1.43 -0.96 -1.42 118.68 115.90 1idm s LEU 97 Ca 0.41 0.44 0.12 0.00 -1.03 0.00 0.00 54.13 54.07 1idm s LEU 97 Cb -0.15 -3.02 -0.06 0.00 0.03 0.00 0.00 46.19 42.99 1idm s LEU 97 CO 0.87 -0.67 0.63 2.22 0.23 0.00 0.00 176.35 179.62 1idm n PHE 98 N 6.30 0.00 -4.80 0.29 1.16 -0.43 -4.80 117.46 115.19 1idm n PHE 98 Ca 0.03 0.00 -0.25 0.00 -1.87 0.00 0.00 57.45 55.36 1idm n PHE 98 Cb 0.48 0.00 -0.16 0.00 -1.61 0.00 0.00 39.48 38.19 1idm n PHE 98 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1idm s ALA 99 N -1.84 1.45 -0.17 1.98 0.00 -0.64 -0.65 121.76 121.90 1idm s ALA 99 Ca 0.08 -0.67 -0.01 0.00 0.00 0.00 0.00 51.96 51.35 1idm s ALA 99 Cb 0.10 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.75 1idm s ALA 99 CO 0.40 0.28 -0.11 1.21 0.00 0.00 0.00 175.76 177.54 1idm s ASN 100 N -0.06 4.01 -0.22 0.00 3.04 -0.40 -0.93 114.94 120.39 1idm s ASN 100 Ca -0.01 -0.38 -0.06 0.00 0.04 0.00 0.00 52.86 52.44 1idm s ASN 100 Cb -0.10 -1.64 -0.03 0.00 -1.54 0.00 0.00 41.25 37.94 1idm s ASN 100 CO 0.01 0.08 0.04 -0.76 -3.04 0.00 0.00 177.10 173.44 1idm s LEU 101 N 0.84 3.44 -0.24 3.21 1.02 0.71 -0.68 118.68 126.97 1idm s LEU 101 Ca -0.03 -0.15 -0.01 0.00 0.02 0.00 0.00 54.13 53.96 1idm s LEU 101 Cb -0.15 -1.89 0.07 0.00 0.02 0.00 0.00 46.19 44.24 1idm s LEU 101 CO 0.00 0.05 0.03 -0.13 0.02 0.00 0.00 176.35 176.33 1idm s ARG 102 N 1.10 0.90 0.36 1.70 1.81 -0.20 -1.77 118.95 122.85 1idm s ARG 102 Ca 0.03 -0.77 -0.17 0.00 -1.72 0.00 0.00 55.73 53.10 1idm s ARG 102 Cb -0.14 -2.20 -0.10 0.00 -0.45 0.00 0.00 34.95 32.06 1idm s ARG 102 CO 0.02 -0.74 0.81 -2.14 -0.68 0.00 0.00 175.30 172.57 1idm s PRO 103 N 1.67 4.07 -0.11 3.54 0.02 -1.26 -1.39 135.00 141.54 1idm s PRO 103 Ca 0.01 0.81 -0.02 0.00 0.02 0.00 0.00 61.00 61.82 1idm s PRO 103 Cb -0.18 -2.35 0.04 0.00 0.02 0.00 0.00 34.50 32.04 1idm s PRO 103 CO -0.13 0.09 0.03 0.00 -0.33 0.00 0.00 177.00 176.67 1idm s ALA 104 N -2.05 0.63 -0.01 -1.55 0.00 -0.06 -4.77 121.76 113.95 1idm s ALA 104 Ca 0.57 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 52.32 1idm s ALA 104 Cb -0.10 -0.86 0.01 0.00 0.00 0.00 0.00 23.12 22.17 1idm s ALA 104 CO 0.16 -0.73 -0.02 0.21 0.00 0.00 0.00 175.76 175.38 1idm s LYS 105 N 2.01 0.26 -0.54 0.00 2.20 -1.26 -0.90 119.74 121.51 1idm s LYS 105 Ca 0.03 -0.05 -0.12 0.00 -0.36 0.00 0.00 55.97 55.47 1idm s LYS 105 Cb -0.14 -0.30 0.13 0.00 -1.51 0.00 0.00 37.83 36.01 1idm s LYS 105 CO -0.06 0.01 0.44 0.08 -0.36 0.00 0.00 175.35 175.46 1idm s VAL 106 N 0.25 4.66 0.26 4.02 1.01 -0.04 -4.65 120.40 125.90 1idm s VAL 106 Ca -0.02 -1.82 -0.31 0.00 0.00 0.00 0.00 61.98 59.84 1idm s VAL 106 Cb -0.05 -4.02 -0.11 0.00 0.00 0.00 0.00 36.38 32.20 1idm s VAL 106 CO -0.01 -0.84 1.62 -0.36 0.00 0.00 0.00 175.10 175.52 1idm s PHE 107 N 1.26 2.83 0.22 5.22 0.08 -1.26 -4.35 117.98 121.97 1idm s PHE 107 Ca 0.07 0.65 -0.31 0.00 0.12 0.00 0.00 56.93 57.46 1idm s PHE 107 Cb -0.26 -4.07 -0.15 0.00 -0.57 0.00 0.00 43.02 37.98 1idm s PHE 107 CO -0.00 -3.75 1.19 -0.35 -0.10 0.00 0.00 175.22 172.20 1idm n PRO 108 N 2.82 1.47 0.00 0.24 -0.04 -1.26 -0.89 135.00 137.34 1idm n PRO 108 Ca 0.11 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 1idm n PRO 108 Cb 0.37 -2.03 0.00 0.00 -0.04 0.00 0.00 33.50 31.80 1idm n PRO 108 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1idm n GLY 109 N 1.82 2.60 1.19 0.55 0.00 -1.26 -4.84 105.19 105.24 1idm n GLY 109 Ca 0.12 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.22 1idm n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1idm n LEU 110 N 0.00 4.39 0.29 0.99 4.77 -0.07 -4.55 117.00 122.83 1idm n LEU 110 Ca 0.00 -2.89 0.16 0.00 -0.03 0.00 0.00 56.01 53.25 1idm n LEU 110 Cb 0.00 -0.57 0.91 0.00 -2.33 0.00 0.00 43.42 41.43 1idm n LEU 110 CO 0.00 0.68 1.08 -0.33 -1.33 0.00 0.00 177.39 177.48 1idm h GLU 111 N 2.57 0.00 0.00 3.23 3.07 -1.89 -2.30 114.58 119.25 1idm h GLU 111 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1idm h GLU 111 Cb 1.55 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.46 1idm h GLU 111 CO 0.28 0.04 -0.01 0.07 -1.40 0.00 0.00 179.01 178.00 1idm h ARG 112 N 0.00 0.00 0.00 2.33 0.11 -1.94 -2.21 114.38 112.67 1idm h ARG 112 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1idm h ARG 112 Cb 0.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.23 1idm h ARG 112 CO 0.01 0.01 -0.52 1.28 0.10 0.00 0.00 179.97 180.85 1idm n LEU 113 N -3.15 0.66 -4.79 0.08 4.77 -0.87 -4.92 117.00 108.79 1idm n LEU 113 Ca -0.02 0.25 -0.34 0.00 -0.03 0.00 0.00 56.01 55.87 1idm n LEU 113 Cb 0.16 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 1idm n LEU 113 CO 0.23 -0.05 0.74 -0.55 -1.33 0.00 0.00 177.39 176.43 1idm s SER 114 N -4.07 6.20 0.38 -1.43 0.15 -0.83 -3.91 113.70 110.19 1idm s SER 114 Ca 0.08 2.00 0.27 0.00 0.70 0.00 0.00 55.95 59.00 1idm s SER 114 Cb 0.14 -2.57 0.88 0.00 -1.71 0.00 0.00 66.02 62.76 1idm s SER 114 CO 0.70 -0.88 1.78 -0.65 1.20 0.00 0.00 173.24 175.38 1idm h PRO 115 N 1.51 0.00 -6.77 5.44 0.11 -1.79 -3.45 132.00 127.05 1idm h PRO 115 Ca -0.50 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.12 1idm h PRO 115 Cb 1.23 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.35 1idm h PRO 115 CO 0.59 0.00 0.05 -0.51 -0.21 0.00 0.00 178.00 177.91 1idm s LEU 116 N -5.46 3.85 0.40 2.35 1.43 -1.26 -5.03 118.68 114.95 1idm s LEU 116 Ca 0.06 0.97 -0.27 0.00 -1.03 0.00 0.00 54.13 53.86 1idm s LEU 116 Cb 0.09 -3.85 -0.10 0.00 0.03 0.00 0.00 46.19 42.35 1idm s LEU 116 CO 0.56 -0.39 1.48 -0.54 0.23 0.00 0.00 176.35 177.69 1idm s LYS 117 N -3.98 3.96 0.45 1.70 1.02 -1.26 -4.67 119.74 116.95 1idm s LYS 117 Ca 0.48 2.55 0.23 0.00 0.02 0.00 0.00 55.97 59.26 1idm s LYS 117 Cb -0.10 -2.86 1.23 0.00 -0.52 0.00 0.00 37.83 35.58 1idm s LYS 117 CO 0.34 -0.65 1.81 0.93 -0.92 0.00 0.00 175.35 176.86 1idm h GLU 118 N 2.76 0.26 -0.76 1.68 5.08 -1.94 -0.04 114.58 121.63 1idm h GLU 118 Ca -0.51 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 57.83 1idm h GLU 118 Cb 1.25 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 1idm h GLU 118 CO 0.63 0.17 0.44 0.93 -1.00 0.00 0.00 179.01 180.19 1idm h GLU 119 N 0.27 1.03 0.00 2.33 3.07 -1.96 -1.58 114.58 117.73 1idm h GLU 119 Ca 0.54 -0.09 -0.23 0.00 -0.50 0.00 0.00 59.36 59.07 1idm h GLU 119 Cb 1.60 -0.21 -0.04 0.00 -0.84 0.00 0.00 28.75 29.25 1idm h GLU 119 CO -0.18 0.73 -1.62 1.51 -1.40 0.00 0.00 179.01 178.05 1idm n ILE 120 N -4.38 1.36 0.09 3.13 3.06 -0.14 -4.11 119.36 118.37 1idm n ILE 120 Ca 0.08 -0.74 -0.05 0.00 -2.50 0.00 0.00 62.75 59.54 1idm n ILE 120 Cb 0.07 -0.83 0.12 0.00 0.54 0.00 0.00 39.64 39.54 1idm n ILE 120 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1idm h ALA 121 N 1.22 0.84 -2.19 1.51 0.00 -1.08 -3.41 119.26 116.16 1idm h ALA 121 Ca -0.24 -0.56 -0.59 0.00 0.00 0.00 0.00 54.91 53.52 1idm h ALA 121 Cb 1.80 -0.09 0.04 0.00 0.00 0.00 0.00 17.79 19.55 1idm h ALA 121 CO 0.06 0.75 0.90 -2.13 0.00 0.00 0.00 179.25 178.82 1idm n ARG 122 N -3.85 2.15 -0.68 0.00 0.63 -0.61 -2.41 116.66 111.89 1idm n ARG 122 Ca -0.02 0.78 0.00 0.00 -0.92 0.00 0.00 57.85 57.69 1idm n ARG 122 Cb 0.63 -2.58 0.00 0.00 0.45 0.00 0.00 32.46 30.97 1idm n ARG 122 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1idm n GLY 123 N 3.74 0.83 3.71 5.14 0.00 -1.26 -4.82 105.19 112.53 1idm n GLY 123 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1idm n GLY 123 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1idm s VAL 124 N -3.31 2.66 -0.51 1.61 1.01 -1.01 -4.80 120.40 116.04 1idm s VAL 124 Ca 0.00 0.42 0.06 0.00 0.00 0.00 0.00 61.98 62.46 1idm s VAL 124 Cb 0.00 -3.27 0.21 0.00 0.00 0.00 0.00 36.38 33.32 1idm s VAL 124 CO 0.00 0.03 0.80 -0.67 0.00 0.00 0.00 175.10 175.26 1idm n ASP 125 N 4.33 -3.21 -4.60 3.32 2.03 -1.24 -0.86 116.55 116.31 1idm n ASP 125 Ca 0.14 -3.07 -0.31 0.00 0.52 0.00 0.00 54.79 52.07 1idm n ASP 125 Cb 0.39 1.78 -0.10 0.00 -0.72 0.00 0.00 41.12 42.47 1idm n ASP 125 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1idm s VAL 126 N 0.79 3.60 -0.21 5.18 0.11 -0.08 -4.57 120.40 125.22 1idm s VAL 126 Ca 0.31 -1.01 0.01 0.00 -2.93 0.00 0.00 61.98 58.36 1idm s VAL 126 Cb 0.10 -2.64 0.04 0.00 -1.53 0.00 0.00 36.38 32.36 1idm s VAL 126 CO -0.14 0.23 -0.12 -0.22 -3.33 0.00 0.00 175.10 171.53 1idm s LEU 127 N -1.89 2.46 -0.14 2.54 2.96 0.62 -0.88 118.68 124.35 1idm s LEU 127 Ca 0.20 -0.94 -0.19 0.00 -0.22 0.00 0.00 54.13 52.98 1idm s LEU 127 Cb -0.11 -1.33 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 1idm s LEU 127 CO 0.12 -0.13 0.51 -0.63 -1.32 0.00 0.00 176.35 174.90 1idm s ILE 128 N 1.33 5.15 -0.25 6.68 -1.09 -0.49 -0.97 121.20 131.56 1idm s ILE 128 Ca -0.02 1.00 -0.03 0.00 -2.23 0.00 0.00 60.65 59.38 1idm s ILE 128 Cb -0.16 -3.85 0.02 0.00 -1.58 0.00 0.00 42.46 36.89 1idm s ILE 128 CO -0.08 0.28 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.17 1idm s VAL 129 N 0.93 3.07 -0.13 2.92 1.01 0.16 -1.04 120.40 127.32 1idm s VAL 129 Ca 0.27 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 1idm s VAL 129 Cb -0.15 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 1idm s VAL 129 CO 0.11 0.21 -0.09 -0.60 0.00 0.00 0.00 175.10 174.72 1idm s ARG 130 N 1.36 3.40 0.06 2.72 3.52 0.14 -2.27 118.95 127.88 1idm s ARG 130 Ca 0.01 -0.61 -0.31 0.00 -0.13 0.00 0.00 55.73 54.69 1idm s ARG 130 Cb -0.16 -2.72 -0.07 0.00 -1.56 0.00 0.00 34.95 30.44 1idm s ARG 130 CO -0.03 0.28 1.41 -2.00 -0.81 0.00 0.00 175.30 174.15 1idm s GLU 131 N 0.20 4.30 -0.10 5.12 -6.30 -0.96 -1.27 118.70 119.68 1idm s GLU 131 Ca -0.05 2.04 0.20 0.00 -2.50 0.00 0.00 54.97 54.65 1idm s GLU 131 Cb -0.15 -3.44 -0.30 0.00 0.00 0.00 0.00 34.13 30.25 1idm s GLU 131 CO 0.04 -0.52 0.30 1.28 0.02 0.00 0.00 175.26 176.38 1idm n LEU 132 N 4.76 0.00 0.00 2.70 4.77 0.17 -2.98 117.00 126.42 1idm n LEU 132 Ca 0.13 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.22 1idm n LEU 132 Cb 0.43 0.21 -0.15 0.00 -2.33 0.00 0.00 43.42 41.58 1idm n LEU 132 CO 0.59 0.21 -0.64 0.35 -1.33 0.00 0.00 177.39 176.57 1idm n THR 133 N -2.46 0.06 -2.39 -5.08 -2.24 -1.26 -5.03 114.28 95.88 1idm n THR 133 Ca -0.16 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 1idm n THR 133 Cb 0.82 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 1idm n THR 133 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1idm n GLY 134 N 1.27 5.57 5.70 3.38 0.00 -1.26 -4.81 105.19 115.03 1idm n GLY 134 Ca -0.03 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1idm n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1idm n GLY 135 N 5.00 -1.90 0.26 -0.02 0.00 -1.17 -4.32 105.19 103.04 1idm n GLY 135 Ca 0.00 -1.52 0.10 0.00 0.00 0.00 0.00 46.02 44.61 1idm n GLY 135 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1idm h ILE 136 N 0.00 0.80 0.00 -0.61 2.10 -1.83 0.10 117.51 118.07 1idm h ILE 136 Ca 0.00 -0.31 -0.02 0.00 1.08 0.00 0.00 64.86 65.61 1idm h ILE 136 Cb 0.00 1.18 -0.00 0.00 -1.09 0.00 0.00 36.82 36.91 1idm h ILE 136 CO 0.00 0.08 -0.12 1.88 -1.08 0.00 0.00 178.15 178.91 1idm h TYR 137 N 0.00 0.00 0.00 2.19 0.05 -1.85 -3.19 116.97 114.17 1idm h TYR 137 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1idm h TYR 137 Cb 0.17 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.91 1idm h TYR 137 CO 0.00 0.12 0.00 1.19 -1.05 0.00 0.00 178.16 178.42 1idm n PHE 138 N -4.09 0.00 -1.94 4.88 3.72 -0.86 -5.09 117.46 114.08 1idm n PHE 138 Ca -0.02 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.01 1idm n PHE 138 Cb 0.20 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.78 1idm n PHE 138 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1idm s GLY 139 N -0.12 2.76 0.08 1.37 0.00 0.31 -4.98 107.32 106.74 1idm s GLY 139 Ca 0.00 1.05 0.08 0.00 0.00 0.00 0.00 44.72 45.85 1idm s GLY 139 CO 0.00 1.45 -0.21 -0.54 0.00 0.00 0.00 173.10 173.80 1idm s GLU 140 N -3.36 1.21 0.73 2.90 0.41 -1.26 -4.31 118.70 115.01 1idm s GLU 140 Ca 0.78 -1.09 -0.12 0.00 -0.41 0.00 0.00 54.97 54.14 1idm s GLU 140 Cb -0.32 -1.42 0.03 0.00 -1.78 0.00 0.00 34.13 30.64 1idm s GLU 140 CO 0.35 0.34 1.10 -1.25 -0.49 0.00 0.00 175.26 175.31 1idm s PRO 141 N -1.67 2.63 0.05 0.39 0.04 -1.26 -4.79 135.00 130.39 1idm s PRO 141 Ca 0.07 0.47 -0.14 0.00 0.04 0.00 0.00 61.00 61.44 1idm s PRO 141 Cb -0.10 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.47 1idm s PRO 141 CO 0.03 -1.20 0.30 -0.98 0.04 0.00 0.00 177.00 175.20 1idm s ARG 142 N -5.34 0.82 0.00 4.56 1.70 -1.26 -3.04 118.95 116.40 1idm s ARG 142 Ca 0.59 -0.53 0.00 0.00 -0.47 0.00 0.00 55.73 55.32 1idm s ARG 142 Cb -0.12 0.36 0.00 0.00 -0.57 0.00 0.00 34.95 34.62 1idm s ARG 142 CO 0.52 -0.27 0.00 0.41 -1.08 0.00 0.00 175.30 174.88 1idm n GLY 143 N 0.52 -1.46 3.53 3.88 0.00 -0.42 -4.96 105.19 106.28 1idm n GLY 143 Ca -0.18 -1.01 -0.17 0.00 0.00 0.00 0.00 46.02 44.65 1idm n GLY 143 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1idm s MET 144 N -1.17 0.99 0.00 1.61 1.75 -1.26 -1.70 119.30 119.51 1idm s MET 144 Ca 0.00 0.28 0.00 0.00 -1.25 0.00 0.00 55.69 54.72 1idm s MET 144 Cb 0.00 0.47 0.00 0.00 2.84 0.00 0.00 34.83 38.14 1idm s MET 144 CO 0.00 -0.30 0.00 -1.13 -0.65 0.00 0.00 175.02 172.94 1idm n SER 145 N 0.96 0.00 0.09 1.11 3.41 0.13 -4.97 113.62 114.36 1idm n SER 145 Ca -0.18 -0.52 -0.12 0.00 -0.26 0.00 0.00 58.87 57.79 1idm n SER 145 Cb 0.57 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.41 1idm n SER 145 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1idm h GLU 146 N 0.00 0.20 0.00 4.33 4.39 -2.05 -3.37 114.58 118.08 1idm h GLU 146 Ca 0.00 -0.31 -0.22 0.00 0.34 0.00 0.00 59.36 59.17 1idm h GLU 146 Cb 0.00 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 1idm h GLU 146 CO 0.00 1.11 -1.74 0.00 -1.16 0.00 0.00 179.01 177.23 1idm n ALA 147 N -2.48 1.82 -3.82 3.43 0.00 -1.26 -5.04 120.51 113.16 1idm n ALA 147 Ca -0.05 -0.76 -0.07 0.00 0.00 0.00 0.00 53.44 52.55 1idm n ALA 147 Cb 0.95 -0.75 -0.02 0.00 0.00 0.00 0.00 19.45 19.63 1idm n ALA 147 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1idm s GLU 148 N -2.81 1.81 -0.00 0.00 -1.05 -1.26 -5.17 118.70 110.22 1idm s GLU 148 Ca -0.05 -1.04 -0.06 0.00 -0.15 0.00 0.00 54.97 53.66 1idm s GLU 148 Cb 0.08 0.60 0.00 0.00 -0.44 0.00 0.00 34.13 34.38 1idm s GLU 148 CO 0.83 -0.83 0.12 0.00 0.95 0.00 0.00 175.26 176.33 1idm s ALA 149 N -3.79 -0.28 0.02 -0.84 0.00 -1.26 0.18 121.76 115.78 1idm s ALA 149 Ca 0.12 -0.13 -0.09 0.00 0.00 0.00 0.00 51.96 51.86 1idm s ALA 149 Cb -0.06 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.15 1idm s ALA 149 CO 0.08 -0.19 0.17 1.67 0.00 0.00 0.00 175.76 177.49 1idm s TRP 150 N -1.26 0.04 -0.04 0.00 -2.14 -0.69 -4.98 118.94 109.87 1idm s TRP 150 Ca -0.13 -0.17 -0.10 0.00 2.66 0.00 0.00 56.10 58.36 1idm s TRP 150 Cb -0.07 -0.03 0.02 0.00 -3.10 0.00 0.00 33.47 30.28 1idm s TRP 150 CO 0.01 -0.35 0.24 -0.80 -2.66 0.00 0.00 176.95 173.39 1idm s ASN 151 N -1.67 -0.16 -0.15 -2.66 0.01 -1.26 -1.30 114.94 107.75 1idm s ASN 151 Ca -0.11 0.19 -0.01 0.00 -0.71 0.00 0.00 52.86 52.22 1idm s ASN 151 Cb -0.05 0.37 -0.01 0.00 0.41 0.00 0.00 41.25 41.97 1idm s ASN 151 CO -0.00 -0.27 -0.11 -0.89 -1.51 0.00 0.00 177.10 174.31 1idm s THR 152 N -0.72 3.12 -0.62 1.60 2.01 -1.17 -5.00 115.64 114.86 1idm s THR 152 Ca -0.08 -0.63 -0.21 0.00 0.31 0.00 0.00 61.69 61.08 1idm s THR 152 Cb -0.04 -2.33 0.08 0.00 0.01 0.00 0.00 72.50 70.22 1idm s THR 152 CO 0.02 0.51 0.83 -1.61 -0.69 0.00 0.00 174.62 173.68 1idm s GLU 153 N 0.54 3.09 0.02 4.92 0.41 -1.26 -3.65 118.70 122.77 1idm s GLU 153 Ca -0.08 -1.03 0.07 0.00 -0.41 0.00 0.00 54.97 53.52 1idm s GLU 153 Cb -0.15 -4.23 -0.02 0.00 -1.78 0.00 0.00 34.13 27.94 1idm s GLU 153 CO 0.04 -1.66 -0.21 0.50 -0.49 0.00 0.00 175.26 173.44 1idm s ARG 154 N 3.38 1.49 -0.12 1.61 3.52 -1.26 -4.90 118.95 122.67 1idm s ARG 154 Ca 0.17 -0.86 -0.07 0.00 -0.13 0.00 0.00 55.73 54.84 1idm s ARG 154 Cb -0.20 -1.54 0.04 0.00 -1.56 0.00 0.00 34.95 31.69 1idm s ARG 154 CO 0.09 0.40 0.28 0.71 -0.81 0.00 0.00 175.30 175.98 1idm s TYR 155 N -0.68 -0.38 0.17 5.12 2.02 -1.26 -3.03 117.35 119.32 1idm s TYR 155 Ca 0.08 0.87 0.04 0.00 -0.37 0.00 0.00 57.07 57.69 1idm s TYR 155 Cb -0.08 0.10 -0.03 0.00 -0.40 0.00 0.00 41.96 41.54 1idm s TYR 155 CO 0.01 -0.23 0.26 -1.54 -1.57 0.00 0.00 175.55 172.47 1idm s SER 156 N 1.04 6.11 0.20 2.29 1.04 -1.26 -5.03 113.70 118.08 1idm s SER 156 Ca -0.07 0.06 -0.13 0.00 0.48 0.00 0.00 55.95 56.29 1idm s SER 156 Cb -0.08 -1.77 0.23 0.00 0.10 0.00 0.00 66.02 64.50 1idm s SER 156 CO -0.07 0.03 1.66 0.50 0.98 0.00 0.00 173.24 176.33 1idm h LYS 157 N 2.00 0.07 -0.93 4.02 3.64 -2.00 -2.26 116.57 121.10 1idm h LYS 157 Ca -0.49 -0.00 0.09 0.00 -1.27 0.00 0.00 60.65 58.98 1idm h LYS 157 Cb 1.20 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.94 1idm h LYS 157 CO 0.66 0.04 0.58 -1.35 -2.27 0.00 0.00 179.45 177.11 1idm h PRO 158 N 0.07 0.96 -0.57 1.90 0.11 -1.99 -0.30 132.00 132.19 1idm h PRO 158 Ca 0.29 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.33 1idm h PRO 158 Cb 0.45 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 31.32 1idm h PRO 158 CO -0.52 0.64 0.31 0.93 -0.21 0.00 0.00 178.00 179.14 1idm h GLU 159 N 0.99 0.79 -0.36 1.05 5.08 -1.82 -1.90 114.58 118.41 1idm h GLU 159 Ca 0.43 -0.10 -0.14 0.00 -1.00 0.00 0.00 59.36 58.56 1idm h GLU 159 Cb 0.32 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1idm h GLU 159 CO -0.22 0.61 -0.32 0.28 -1.00 0.00 0.00 179.01 178.36 1idm h VAL 160 N 0.76 1.28 -0.12 3.13 2.07 -1.35 -3.19 116.25 118.84 1idm h VAL 160 Ca 0.20 -1.49 0.02 0.00 0.82 0.00 0.00 66.70 66.25 1idm h VAL 160 Cb 0.05 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1idm h VAL 160 CO -0.03 0.49 -0.02 -0.33 0.02 0.00 0.00 177.57 177.71 1idm h GLU 161 N 0.66 0.02 -0.24 1.57 5.08 -0.79 -1.53 114.58 119.35 1idm h GLU 161 Ca 0.06 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1idm h GLU 161 Cb 0.91 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1idm h GLU 161 CO 0.08 0.01 0.03 0.07 -1.00 0.00 0.00 179.01 178.20 1idm h ARG 162 N 0.02 0.40 -0.62 2.33 0.11 -1.42 -1.82 114.38 113.37 1idm h ARG 162 Ca 0.06 -0.11 -0.06 0.00 0.10 0.00 0.00 59.98 59.97 1idm h ARG 162 Cb 0.08 -0.04 -0.03 0.00 1.11 0.00 0.00 29.97 31.09 1idm h ARG 162 CO -0.11 0.54 0.16 -0.24 0.10 0.00 0.00 179.97 180.42 1idm h VAL 163 N 0.20 1.24 -0.86 0.08 3.04 -1.56 -2.41 116.25 115.98 1idm h VAL 163 Ca 0.07 -0.88 -0.01 0.00 -1.01 0.00 0.00 66.70 64.87 1idm h VAL 163 Cb 0.34 0.60 -0.04 0.00 -2.01 0.00 0.00 31.29 30.18 1idm h VAL 163 CO 0.01 0.33 0.51 0.00 -1.01 0.00 0.00 177.57 177.41 1idm h ALA 164 N 1.24 1.10 -0.56 3.17 0.00 -1.11 -2.45 119.26 120.65 1idm h ALA 164 Ca 0.20 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1idm h ALA 164 Cb 0.32 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1idm h ALA 164 CO -0.00 0.57 0.15 0.00 0.00 0.00 0.00 179.25 179.97 1idm h ARG 165 N 1.19 0.85 -0.05 0.00 3.08 -0.84 -1.98 114.38 116.62 1idm h ARG 165 Ca 0.31 -0.17 -0.09 0.00 0.07 0.00 0.00 59.98 60.11 1idm h ARG 165 Cb -0.03 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1idm h ARG 165 CO -0.06 0.75 -0.36 -0.39 -1.07 0.00 0.00 179.97 178.84 1idm h VAL 166 N 0.82 1.28 -0.30 2.04 -1.51 -1.15 -1.20 116.25 116.23 1idm h VAL 166 Ca 0.18 -1.33 -0.04 0.00 -1.23 0.00 0.00 66.70 64.28 1idm h VAL 166 Cb 0.28 1.65 -0.01 0.00 -2.13 0.00 0.00 31.29 31.07 1idm h VAL 166 CO -0.00 0.39 0.02 0.00 -1.23 0.00 0.00 177.57 176.74 1idm h ALA 167 N 1.54 0.41 -0.20 5.19 0.00 -1.10 0.86 119.26 125.97 1idm h ALA 167 Ca 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1idm h ALA 167 Cb 0.69 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1idm h ALA 167 CO 0.05 0.13 0.05 0.74 0.00 0.00 0.00 179.25 180.22 1idm h PHE 168 N 0.33 0.33 -0.88 0.00 0.04 -1.11 0.28 116.94 115.93 1idm h PHE 168 Ca 0.09 -0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 1idm h PHE 168 Cb 0.40 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.41 1idm h PHE 168 CO 0.03 0.43 0.47 0.93 -0.60 0.00 0.00 178.31 179.57 1idm h GLU 169 N 0.13 1.23 -0.58 1.51 4.39 -1.16 -1.26 114.58 118.85 1idm h GLU 169 Ca 0.06 -0.15 -0.04 0.00 0.34 0.00 0.00 59.36 59.57 1idm h GLU 169 Cb 0.27 -0.24 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 1idm h GLU 169 CO 0.00 0.91 0.22 0.00 -1.16 0.00 0.00 179.01 178.98 1idm h ALA 170 N 1.25 0.75 -0.84 3.43 0.00 -0.67 -2.94 119.26 120.25 1idm h ALA 170 Ca 0.31 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1idm h ALA 170 Cb 0.05 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1idm h ALA 170 CO -0.05 0.38 0.50 0.00 0.00 0.00 0.00 179.25 180.08 1idm h ALA 171 N 1.07 1.07 -0.60 0.00 0.00 -0.30 -2.62 119.26 117.89 1idm h ALA 171 Ca 0.19 -0.10 0.13 0.00 0.00 0.00 0.00 54.91 55.14 1idm h ALA 171 Cb 0.22 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1idm h ALA 171 CO -0.01 0.53 0.41 0.00 0.00 0.00 0.00 179.25 180.18 1idm h ARG 172 N 1.15 0.24 -0.00 0.00 3.08 -1.07 0.12 114.38 117.90 1idm h ARG 172 Ca 0.30 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1idm h ARG 172 Cb -0.04 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1idm h ARG 172 CO -0.06 0.16 -0.11 1.63 -1.07 0.00 0.00 179.97 180.53 1idm n LYS 173 N -4.44 0.76 0.00 0.04 5.02 -0.99 -4.72 118.16 113.83 1idm n LYS 173 Ca 0.11 -0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 1idm n LYS 173 Cb 0.49 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 1idm n LYS 173 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1idm n ARG 174 N -0.88 0.00 -0.58 1.97 1.74 0.31 -5.00 116.66 114.22 1idm n ARG 174 Ca 0.15 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.31 1idm n ARG 174 Cb 0.28 0.00 0.30 0.00 -1.02 0.00 0.00 32.46 32.02 1idm n ARG 174 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1idm n ARG 175 N 0.00 3.56 -4.10 5.56 1.74 -1.22 -4.99 116.66 117.22 1idm n ARG 175 Ca 0.00 -2.90 -0.32 0.00 -0.77 0.00 0.00 57.85 53.86 1idm n ARG 175 Cb 0.00 -1.94 -0.02 0.00 -1.02 0.00 0.00 32.46 29.48 1idm n ARG 175 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1idm n LYS 176 N -0.01 -3.63 -4.04 5.56 5.02 -0.47 -4.96 118.16 115.63 1idm n LYS 176 Ca 0.23 0.42 -0.19 0.00 -2.02 0.00 0.00 58.31 56.75 1idm n LYS 176 Cb 0.96 -5.02 -0.16 0.00 -0.02 0.00 0.00 35.03 30.78 1idm n LYS 176 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1idm s HIS 177 N -3.47 0.56 -0.03 2.13 2.46 -1.26 -1.07 115.29 114.61 1idm s HIS 177 Ca 0.53 -0.11 0.05 0.00 0.47 0.00 0.00 55.06 56.00 1idm s HIS 177 Cb -0.29 -0.57 -0.01 0.00 -0.13 0.00 0.00 32.58 31.59 1idm s HIS 177 CO 0.90 -0.17 -0.19 0.08 -2.47 0.00 0.00 174.74 172.89 1idm s VAL 178 N 1.04 1.53 -0.20 0.89 1.01 0.45 -1.90 120.40 123.23 1idm s VAL 178 Ca -0.09 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.10 1idm s VAL 178 Cb -0.14 -1.29 0.04 0.00 0.00 0.00 0.00 36.38 34.99 1idm s VAL 178 CO -0.01 0.44 -0.13 -0.69 0.00 0.00 0.00 175.10 174.71 1idm s VAL 179 N -0.23 1.82 -0.11 2.92 1.01 -0.00 -1.06 120.40 124.74 1idm s VAL 179 Ca 0.02 -1.07 -0.17 0.00 0.00 0.00 0.00 61.98 60.76 1idm s VAL 179 Cb -0.10 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1idm s VAL 179 CO 0.01 0.24 0.46 -0.55 0.00 0.00 0.00 175.10 175.26 1idm s SER 180 N 1.33 6.68 -0.15 3.32 0.15 -0.12 -1.31 113.70 123.60 1idm s SER 180 Ca -0.01 0.81 -0.03 0.00 0.70 0.00 0.00 55.95 57.42 1idm s SER 180 Cb -0.16 -2.27 -0.02 0.00 -1.71 0.00 0.00 66.02 61.85 1idm s SER 180 CO -0.09 0.05 -0.05 -0.69 1.20 0.00 0.00 173.24 173.65 1idm s VAL 181 N 0.41 3.73 0.00 4.45 1.01 -0.28 -1.29 120.40 128.43 1idm s VAL 181 Ca 0.25 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.81 1idm s VAL 181 Cb -0.15 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.60 1idm s VAL 181 CO 0.10 0.50 0.00 -0.90 0.00 0.00 0.00 175.10 174.80 1idm n ASP 182 N 3.56 0.00 -2.61 3.32 5.68 -0.05 -4.42 116.55 122.02 1idm n ASP 182 Ca -0.18 -0.56 -0.08 0.00 -0.50 0.00 0.00 54.79 53.47 1idm n ASP 182 Cb 0.52 0.00 0.04 0.00 -1.14 0.00 0.00 41.12 40.54 1idm n ASP 182 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1idm n LYS 183 N 0.00 2.14 -0.13 0.11 0.00 -1.26 -0.78 118.16 118.23 1idm n LYS 183 Ca 0.00 -3.67 0.23 0.00 0.00 0.00 0.00 58.31 54.87 1idm n LYS 183 Cb 0.00 -1.73 0.65 0.00 0.00 0.00 0.00 35.03 33.95 1idm n LYS 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1idm h ALA 184 N 2.59 2.54 0.00 3.14 0.00 -1.79 -1.23 119.26 124.51 1idm h ALA 184 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1idm h ALA 184 Cb 1.29 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1idm h ALA 184 CO 0.40 -0.76 0.00 0.27 0.00 0.00 0.00 179.25 179.16 1idm n ASN 185 N -4.37 0.01 0.00 0.00 6.94 -1.26 -4.05 115.26 112.52 1idm n ASN 185 Ca 0.15 0.50 0.00 0.00 -0.02 0.00 0.00 54.58 55.21 1idm n ASN 185 Cb 0.75 -0.50 0.00 0.00 -2.36 0.00 0.00 39.78 37.66 1idm n ASN 185 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1idm n VAL 186 N -1.51 0.00 -4.50 3.53 0.31 -0.88 -5.09 118.33 110.18 1idm n VAL 186 Ca 0.05 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.05 1idm n VAL 186 Cb 0.23 -0.45 -0.10 0.00 -0.91 0.00 0.00 33.84 32.61 1idm n VAL 186 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1idm s LEU 187 N -3.01 3.24 0.14 7.52 1.43 -0.52 -5.01 118.68 122.47 1idm s LEU 187 Ca 0.00 -0.05 -0.18 0.00 -1.03 0.00 0.00 54.13 52.86 1idm s LEU 187 Cb 0.00 -1.79 -0.01 0.00 0.03 0.00 0.00 46.19 44.42 1idm s LEU 187 CO 0.00 0.32 1.76 -0.33 0.23 0.00 0.00 176.35 178.33 1idm h GLU 188 N 4.85 0.23 -0.89 1.70 3.07 -1.88 -0.93 114.58 120.73 1idm h GLU 188 Ca -0.49 -0.01 0.09 0.00 -0.50 0.00 0.00 59.36 58.45 1idm h GLU 188 Cb 1.17 -0.05 -0.06 0.00 -0.84 0.00 0.00 28.75 28.97 1idm h GLU 188 CO 0.54 0.15 0.58 0.28 -1.40 0.00 0.00 179.01 179.16 1idm h VAL 189 N 0.24 0.98 -0.19 3.13 2.07 -1.93 0.14 116.25 120.68 1idm h VAL 189 Ca 0.11 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1idm h VAL 189 Cb 0.06 -0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.82 1idm h VAL 189 CO -0.10 0.16 0.05 1.23 0.02 0.00 0.00 177.57 178.93 1idm h GLY 190 N 0.90 0.32 1.03 2.17 0.00 -1.44 0.15 103.07 106.20 1idm h GLY 190 Ca 0.41 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.51 1idm h GLY 190 CO -0.17 0.18 0.35 -2.09 0.00 0.00 0.00 176.54 174.81 1idm h GLU 191 N 0.12 1.14 -0.18 4.80 4.81 -0.38 0.25 114.58 125.15 1idm h GLU 191 Ca 0.06 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1idm h GLU 191 Cb 0.25 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1idm h GLU 191 CO -0.00 0.90 0.06 0.35 -0.73 0.00 0.00 179.01 179.59 1idm h PHE 192 N 1.11 0.27 -0.07 0.92 3.57 -0.53 -1.37 116.94 120.85 1idm h PHE 192 Ca 0.27 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.77 1idm h PHE 192 Cb 0.15 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 1idm h PHE 192 CO 0.01 0.35 -0.11 2.35 -2.23 0.00 0.00 178.31 178.69 1idm h TRP 193 N 0.12 -0.26 -0.28 0.41 2.91 -0.32 -1.62 115.95 116.90 1idm h TRP 193 Ca 0.06 0.01 0.03 0.00 1.13 0.00 0.00 58.89 60.12 1idm h TRP 193 Cb 0.20 0.13 -0.03 0.00 -0.51 0.00 0.00 29.16 28.94 1idm h TRP 193 CO -0.01 -0.16 0.09 -0.09 -1.03 0.00 0.00 178.44 177.24 1idm h ARG 194 N -0.15 0.20 0.00 2.65 2.43 -0.80 -1.37 114.38 117.34 1idm h ARG 194 Ca 0.06 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.13 1idm h ARG 194 Cb 0.24 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1idm h ARG 194 CO -0.16 0.13 -0.42 1.57 -1.51 0.00 0.00 179.97 179.59 1idm h LYS 195 N 0.21 0.00 -0.21 0.20 2.10 -1.10 -1.40 116.57 116.36 1idm h LYS 195 Ca 0.13 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.61 1idm h LYS 195 Cb 0.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.44 1idm h LYS 195 CO -0.14 0.42 -0.51 1.15 -2.00 0.00 0.00 179.45 178.38 1idm h THR 196 N 0.00 1.31 -0.09 0.07 2.02 -0.94 -2.38 112.91 112.90 1idm h THR 196 Ca -0.00 -1.73 -0.12 0.00 0.77 0.00 0.00 66.41 65.33 1idm h THR 196 Cb 0.77 1.85 -0.01 0.00 -1.74 0.00 0.00 68.15 69.02 1idm h THR 196 CO 0.05 0.54 -0.49 0.58 0.37 0.00 0.00 175.52 176.58 1idm h VAL 197 N 0.42 1.34 -0.43 3.16 2.07 -1.08 -1.04 116.25 120.69 1idm h VAL 197 Ca -0.00 -1.70 -0.09 0.00 0.82 0.00 0.00 66.70 65.72 1idm h VAL 197 Cb 1.12 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 32.69 1idm h VAL 197 CO 0.11 0.50 -0.12 -0.08 0.02 0.00 0.00 177.57 178.01 1idm h GLU 198 N 0.18 0.78 0.15 1.57 4.57 -1.21 -0.53 114.58 120.09 1idm h GLU 198 Ca 0.01 -0.26 -0.01 0.00 -1.18 0.00 0.00 59.36 57.92 1idm h GLU 198 Cb 0.92 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.45 1idm h GLU 198 CO 0.07 0.86 -0.07 1.49 -1.18 0.00 0.00 179.01 180.19 1idm h GLU 199 N 0.70 -0.19 -0.95 1.92 4.81 -1.15 -3.14 114.58 116.59 1idm h GLU 199 Ca 0.12 0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.48 1idm h GLU 199 Cb 0.60 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.94 1idm h GLU 199 CO 0.04 0.23 0.60 0.28 -0.73 0.00 0.00 179.01 179.43 1idm h VAL 200 N -0.69 0.90 -0.20 0.32 2.07 -1.11 -1.64 116.25 115.89 1idm h VAL 200 Ca -0.02 -0.30 0.06 0.00 0.82 0.00 0.00 66.70 67.26 1idm h VAL 200 Cb 0.51 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1idm h VAL 200 CO 0.03 0.16 0.18 1.23 0.02 0.00 0.00 177.57 179.20 1idm h GLY 201 N 0.88 0.00 1.12 2.17 0.00 -1.04 -2.22 103.07 103.97 1idm h GLY 201 Ca 0.47 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.92 1idm h GLY 201 CO -0.23 0.00 0.33 3.21 0.00 0.00 0.00 176.54 179.84 1idm h ARG 202 N 0.00 0.00 -0.08 4.80 3.08 -1.30 0.65 114.38 121.53 1idm h ARG 202 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1idm h ARG 202 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1idm h ARG 202 CO -0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1idm n GLY 203 N -1.57 -0.39 2.32 0.04 0.00 -0.84 -4.19 105.19 100.56 1idm n GLY 203 Ca 0.07 -0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.59 1idm n GLY 203 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1idm n TYR 204 N -0.25 1.35 0.30 1.61 4.02 0.22 -4.95 117.16 119.46 1idm n TYR 204 Ca 0.14 -3.82 0.17 0.00 -0.01 0.00 0.00 57.90 54.38 1idm n TYR 204 Cb 0.18 -0.44 0.92 0.00 -0.02 0.00 0.00 39.34 39.99 1idm n TYR 204 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1idm h PRO 205 N 3.89 0.00 -0.00 -0.72 0.13 -1.73 -2.24 132.00 131.33 1idm h PRO 205 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1idm h PRO 205 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1idm h PRO 205 CO 0.62 0.04 -0.02 -0.40 -0.23 0.00 0.00 178.00 178.00 1idm n ASP 206 N -3.52 0.31 -4.32 1.44 5.75 -1.26 -4.81 116.55 110.14 1idm n ASP 206 Ca -0.02 -0.83 -0.32 0.00 -0.01 0.00 0.00 54.79 53.61 1idm n ASP 206 Cb 0.14 -0.06 -0.16 0.00 -1.03 0.00 0.00 41.12 40.01 1idm n ASP 206 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1idm s VAL 207 N -2.20 2.30 0.08 2.12 1.01 -0.84 -4.92 120.40 117.94 1idm s VAL 207 Ca 0.39 -0.99 -0.23 0.00 0.00 0.00 0.00 61.98 61.15 1idm s VAL 207 Cb 0.21 -1.85 -0.06 0.00 0.00 0.00 0.00 36.38 34.68 1idm s VAL 207 CO 0.40 0.57 0.70 0.00 0.00 0.00 0.00 175.10 176.78 1idm s ALA 208 N -0.34 3.46 -0.07 5.51 0.00 -0.23 -4.96 121.76 125.13 1idm s ALA 208 Ca 0.02 0.21 0.05 0.00 0.00 0.00 0.00 51.96 52.24 1idm s ALA 208 Cb -0.12 -2.87 -0.00 0.00 0.00 0.00 0.00 23.12 20.12 1idm s ALA 208 CO 0.02 0.22 -0.22 -1.17 0.00 0.00 0.00 175.76 174.60 1idm s LEU 209 N -0.61 2.01 0.10 0.00 2.96 -1.26 -0.41 118.68 121.48 1idm s LEU 209 Ca 0.34 -0.48 0.03 0.00 -0.22 0.00 0.00 54.13 53.81 1idm s LEU 209 Cb -0.21 -1.27 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 1idm s LEU 209 CO 0.22 0.18 -0.09 -0.70 -1.32 0.00 0.00 176.35 174.65 1idm s GLU 210 N 0.10 0.87 0.03 1.98 2.12 -0.22 -4.99 118.70 118.59 1idm s GLU 210 Ca -0.10 -1.25 0.07 0.00 0.36 0.00 0.00 54.97 54.06 1idm s GLU 210 Cb -0.15 -0.43 -0.02 0.00 0.26 0.00 0.00 34.13 33.78 1idm s GLU 210 CO 0.05 0.05 -0.22 -1.01 -0.54 0.00 0.00 175.26 173.59 1idm s HIS 211 N -2.93 1.92 -0.01 5.30 3.76 -1.26 -0.95 115.29 121.12 1idm s HIS 211 Ca 0.09 -0.38 -0.08 0.00 -0.15 0.00 0.00 55.06 54.54 1idm s HIS 211 Cb 0.00 -1.16 0.01 0.00 1.11 0.00 0.00 32.58 32.53 1idm s HIS 211 CO -0.01 0.07 0.17 -0.65 -0.85 0.00 0.00 174.74 173.47 1idm s GLN 212 N -1.05 0.48 0.24 1.40 -1.52 -0.41 -4.93 119.66 113.87 1idm s GLN 212 Ca 0.08 -0.29 -0.26 0.00 -1.95 0.00 0.00 55.36 52.94 1idm s GLN 212 Cb -0.09 0.20 -0.09 0.00 -0.22 0.00 0.00 33.01 32.82 1idm s GLN 212 CO 0.01 -0.11 0.86 0.71 -0.25 0.00 0.00 175.29 176.51 1idm s TYR 213 N -1.20 3.81 0.33 0.91 2.02 -1.26 -0.87 117.35 121.09 1idm s TYR 213 Ca -0.13 1.71 0.06 0.00 -0.37 0.00 0.00 57.07 58.33 1idm s TYR 213 Cb -0.07 -2.84 0.71 0.00 -0.40 0.00 0.00 41.96 39.36 1idm s TYR 213 CO 0.02 0.38 1.87 -0.24 -1.57 0.00 0.00 175.55 176.00 1idm h VAL 214 N 2.95 0.89 -0.46 0.71 3.04 -1.30 0.50 116.25 122.58 1idm h VAL 214 Ca -0.47 -0.28 -0.09 0.00 -1.01 0.00 0.00 66.70 64.86 1idm h VAL 214 Cb 1.20 -0.00 -0.02 0.00 -2.01 0.00 0.00 31.29 30.46 1idm h VAL 214 CO 0.66 0.15 -0.07 -2.24 -1.01 0.00 0.00 177.57 175.06 1idm h ASP 215 N 0.82 0.78 0.32 3.17 2.03 -1.93 -1.56 116.42 120.04 1idm h ASP 215 Ca 0.45 -0.21 -0.21 0.00 -0.73 0.00 0.00 57.03 56.33 1idm h ASP 215 Cb 0.59 -0.21 -0.00 0.00 -0.83 0.00 0.00 39.33 38.88 1idm h ASP 215 CO -0.22 0.88 -0.87 0.00 -1.03 0.00 0.00 179.24 178.00 1idm h ALA 216 N 1.20 0.44 -0.55 4.15 0.00 -1.66 -3.14 119.26 119.70 1idm h ALA 216 Ca 0.13 -0.68 -0.05 0.00 0.00 0.00 0.00 54.91 54.31 1idm h ALA 216 Cb 0.54 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1idm h ALA 216 CO 0.03 0.81 0.14 1.98 0.00 0.00 0.00 179.25 182.21 1idm h MET 217 N 0.24 0.84 -0.89 0.00 -1.53 -0.63 -0.58 114.93 112.38 1idm h MET 217 Ca -0.06 -0.17 0.01 0.00 -3.44 0.00 0.00 59.70 56.04 1idm h MET 217 Cb 1.49 -0.13 -0.04 0.00 -0.55 0.00 0.00 31.60 32.37 1idm h MET 217 CO 0.15 0.75 0.58 0.00 0.14 0.00 0.00 176.91 178.53 1idm h ALA 218 N 1.34 1.35 -0.15 0.39 0.00 -1.25 -0.79 119.26 120.16 1idm h ALA 218 Ca 0.18 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 1idm h ALA 218 Cb 0.28 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1idm h ALA 218 CO -0.00 0.60 -0.33 0.52 0.00 0.00 0.00 179.25 180.03 1idm h MET 219 N 1.21 0.48 -1.00 0.00 2.86 -1.41 -3.27 114.93 113.80 1idm h MET 219 Ca 0.32 -0.32 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1idm h MET 219 Cb -0.12 0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.53 1idm h MET 219 CO -0.07 0.93 0.66 0.45 1.06 0.00 0.00 176.91 179.95 1idm h HIS 220 N 0.09 1.25 0.00 -0.22 3.86 -0.63 0.10 115.15 119.61 1idm h HIS 220 Ca -0.00 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1idm h HIS 220 Cb 0.93 -0.42 -0.00 0.00 1.06 0.00 0.00 27.41 28.98 1idm h HIS 220 CO 0.10 0.79 -0.07 -0.07 0.86 0.00 0.00 177.93 179.54 1idm h LEU 221 N 1.35 0.00 0.02 2.43 3.38 -1.22 0.16 115.31 121.43 1idm h LEU 221 Ca 0.37 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.97 1idm h LEU 221 Cb -0.16 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.53 1idm h LEU 221 CO -0.08 0.07 -2.28 0.52 0.09 0.00 0.00 178.44 176.76 1idm n VAL 222 N -3.41 1.51 0.09 1.22 0.31 -0.78 -3.82 118.33 113.45 1idm n VAL 222 Ca -0.02 -0.72 -0.23 0.00 -0.01 0.00 0.00 64.34 63.36 1idm n VAL 222 Cb 0.21 -1.05 -0.15 0.00 -0.91 0.00 0.00 33.84 31.93 1idm n VAL 222 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1idm h ARG 223 N 0.01 0.44 -0.89 5.55 3.08 -0.71 -3.43 114.38 118.42 1idm h ARG 223 Ca -0.51 -0.74 -0.36 0.00 0.07 0.00 0.00 59.98 58.44 1idm h ARG 223 Cb 2.06 0.28 -0.26 0.00 0.08 0.00 0.00 29.97 32.13 1idm h ARG 223 CO 0.00 1.35 -0.77 -1.13 -1.07 0.00 0.00 179.97 178.35 1idm n SER 224 N -3.62 -1.20 0.28 7.04 3.41 0.53 -4.97 113.62 115.08 1idm n SER 224 Ca -0.22 -3.24 0.16 0.00 -0.26 0.00 0.00 58.87 55.31 1idm n SER 224 Cb 1.08 0.77 0.77 0.00 -0.26 0.00 0.00 64.21 66.58 1idm n SER 224 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1idm h PRO 225 N 3.44 0.00 0.00 4.33 0.13 -1.56 -3.01 132.00 135.33 1idm h PRO 225 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1idm h PRO 225 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1idm h PRO 225 CO 0.34 0.07 0.00 0.00 -0.23 0.00 0.00 178.00 178.17 1idm h ALA 226 N 1.93 1.00 -0.11 -0.56 0.00 -1.87 -2.96 119.26 116.69 1idm h ALA 226 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1idm h ALA 226 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1idm h ALA 226 CO 0.01 0.00 0.00 2.89 0.00 0.00 0.00 179.25 182.15 1idm n ARG 227 N -2.48 1.40 -4.29 0.00 1.85 -1.14 -4.82 116.66 107.18 1idm n ARG 227 Ca 0.01 -0.60 -0.23 0.00 -1.00 0.00 0.00 57.85 56.03 1idm n ARG 227 Cb 0.18 -1.30 -0.07 0.00 -1.05 0.00 0.00 32.46 30.22 1idm n ARG 227 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1idm s PHE 228 N -1.86 2.70 0.00 2.89 0.08 -1.12 -5.07 117.98 115.60 1idm s PHE 228 Ca 0.26 -0.22 0.00 0.00 0.12 0.00 0.00 56.93 57.09 1idm s PHE 228 Cb 0.13 -1.20 0.00 0.00 -0.57 0.00 0.00 43.02 41.38 1idm s PHE 228 CO 0.20 0.62 0.00 -3.47 -0.10 0.00 0.00 175.22 172.47 1idm n ASP 229 N -0.90 0.00 -4.63 1.36 2.03 -1.26 -4.45 116.55 108.70 1idm n ASP 229 Ca -0.06 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 54.90 1idm n ASP 229 Cb 0.59 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.89 1idm n ASP 229 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1idm s VAL 230 N 0.00 4.45 -0.09 5.18 1.01 -0.80 -0.28 120.40 129.88 1idm s VAL 230 Ca 0.00 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 61.84 1idm s VAL 230 Cb 0.00 -2.95 0.01 0.00 0.00 0.00 0.00 36.38 33.44 1idm s VAL 230 CO 0.00 0.52 -0.17 -0.69 0.00 0.00 0.00 175.10 174.76 1idm s VAL 231 N -0.11 1.55 -0.04 2.92 1.01 -0.15 -0.82 120.40 124.76 1idm s VAL 231 Ca 0.05 -0.71 0.05 0.00 0.00 0.00 0.00 61.98 61.37 1idm s VAL 231 Cb -0.12 -1.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.87 1idm s VAL 231 CO 0.02 0.45 -0.19 0.54 0.00 0.00 0.00 175.10 175.92 1idm s VAL 232 N 0.65 1.54 0.38 2.92 0.11 -0.42 0.40 120.40 125.97 1idm s VAL 232 Ca -0.14 -0.79 -0.15 0.00 -2.93 0.00 0.00 61.98 57.98 1idm s VAL 232 Cb -0.16 -1.31 0.05 0.00 -1.53 0.00 0.00 36.38 33.43 1idm s VAL 232 CO 0.04 0.44 0.76 0.28 -3.33 0.00 0.00 175.10 173.29 1idm s THR 233 N -0.08 0.00 1.18 5.04 -1.32 -0.96 -1.13 115.64 118.37 1idm s THR 233 Ca -0.02 -1.05 -0.19 0.00 -1.21 0.00 0.00 61.69 59.23 1idm s THR 233 Cb -0.11 -2.82 0.28 0.00 -1.51 0.00 0.00 72.50 68.34 1idm s THR 233 CO 0.02 0.00 1.11 -0.83 -2.21 0.00 0.00 174.62 172.71 1idm s GLY 234 N -3.08 1.58 0.03 6.08 0.00 -1.26 -2.28 107.32 108.41 1idm s GLY 234 Ca 0.16 -0.91 -0.13 0.00 0.00 0.00 0.00 44.72 43.85 1idm s GLY 234 CO 0.12 -0.05 1.20 -0.57 0.00 0.00 0.00 173.10 173.80 1idm h ASN 235 N -2.52 -0.55 -0.74 1.64 -0.73 -1.80 0.25 115.58 111.14 1idm h ASN 235 Ca -0.46 0.05 -0.03 0.00 1.87 0.00 0.00 56.30 57.73 1idm h ASN 235 Cb 1.30 0.20 -0.03 0.00 0.27 0.00 0.00 38.32 40.05 1idm h ASN 235 CO 0.36 -0.21 0.33 -0.29 -0.37 0.00 0.00 177.43 177.25 1idm h ILE 236 N -0.30 1.24 -0.58 2.57 2.10 -1.89 -0.91 117.51 119.73 1idm h ILE 236 Ca -0.01 -0.72 -0.07 0.00 1.08 0.00 0.00 64.86 65.14 1idm h ILE 236 Cb 0.29 0.35 -0.02 0.00 -1.09 0.00 0.00 36.82 36.34 1idm h ILE 236 CO -0.08 0.30 0.07 -0.26 -1.08 0.00 0.00 178.15 177.10 1idm h PHE 237 N 1.04 1.01 -0.10 2.19 0.04 -1.93 -2.02 116.94 117.18 1idm h PHE 237 Ca 0.25 -0.13 -0.09 0.00 2.80 0.00 0.00 57.97 60.80 1idm h PHE 237 Cb 0.15 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.01 1idm h PHE 237 CO 0.01 0.87 -0.34 0.78 -0.60 0.00 0.00 178.31 179.03 1idm h GLY 238 N 1.02 0.22 0.73 -1.45 0.00 -0.07 0.02 103.07 103.54 1idm h GLY 238 Ca 0.18 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 1idm h GLY 238 CO 0.01 0.17 -0.10 -1.80 0.00 0.00 0.00 176.54 174.83 1idm h ASP 239 N 0.18 -0.24 0.16 0.19 1.82 -0.71 0.36 116.42 118.18 1idm h ASP 239 Ca 0.02 -0.19 -0.01 0.00 -0.39 0.00 0.00 57.03 56.46 1idm h ASP 239 Cb 0.70 0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.77 1idm h ASP 239 CO 0.05 0.07 -0.08 0.40 -1.61 0.00 0.00 179.24 178.07 1idm h ILE 240 N -0.56 0.89 0.00 2.25 2.04 -1.26 -2.46 117.51 118.42 1idm h ILE 240 Ca -0.03 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 1idm h ILE 240 Cb 0.41 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 1idm h ILE 240 CO 0.05 0.05 -0.19 -0.07 0.00 0.00 0.00 178.15 177.99 1idm h LEU 241 N -0.32 0.00 -0.26 1.44 3.38 -1.03 -1.48 115.31 117.04 1idm h LEU 241 Ca -0.02 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1idm h LEU 241 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1idm h LEU 241 CO 0.04 0.19 -0.19 0.28 0.09 0.00 0.00 178.44 178.85 1idm h SER 242 N 0.00 0.62 -0.42 -0.43 0.02 -0.77 -1.77 113.55 110.80 1idm h SER 242 Ca -0.00 -0.44 -0.11 0.00 -0.84 0.00 0.00 61.79 60.40 1idm h SER 242 Cb 0.35 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1idm h SER 242 CO 0.02 0.93 -0.15 0.44 -1.14 0.00 0.00 176.83 176.93 1idm h ASP 243 N 0.32 0.86 -0.04 3.07 3.32 -1.11 -0.12 116.42 122.71 1idm h ASP 243 Ca 0.05 -0.39 0.01 0.00 0.02 0.00 0.00 57.03 56.73 1idm h ASP 243 Cb 0.72 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1idm h ASP 243 CO 0.05 1.05 -0.03 0.25 -1.72 0.00 0.00 179.24 178.84 1idm h LEU 244 N 0.66 -0.09 -1.16 1.55 6.46 -1.28 -2.14 115.31 119.32 1idm h LEU 244 Ca 0.10 0.02 -0.05 0.00 -0.12 0.00 0.00 57.88 57.83 1idm h LEU 244 Cb 0.70 0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.66 1idm h LEU 244 CO 0.05 -0.04 0.05 0.00 -0.62 0.00 0.00 178.44 177.89 1idm h ALA 245 N 1.01 1.32 -0.03 1.25 0.00 -1.25 -2.77 119.26 118.78 1idm h ALA 245 Ca 0.03 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1idm h ALA 245 Cb 0.07 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1idm h ALA 245 CO -0.06 0.47 0.03 0.66 0.00 0.00 0.00 179.25 180.36 1idm h SER 246 N 0.62 0.00 1.34 0.00 4.64 -0.32 -1.21 113.55 118.62 1idm h SER 246 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1idm h SER 246 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1idm h SER 246 CO 0.00 0.00 -0.21 -0.37 -0.87 0.00 0.00 176.83 175.38 1idm h VAL 247 N 0.00 0.00 -0.54 0.95 -1.51 -1.38 -3.37 116.25 110.41 1idm h VAL 247 Ca 0.02 -0.56 0.10 0.00 -1.23 0.00 0.00 66.70 65.03 1idm h VAL 247 Cb 0.08 1.42 -0.08 0.00 -2.13 0.00 0.00 31.29 30.58 1idm h VAL 247 CO -0.00 0.00 0.09 -0.07 -1.23 0.00 0.00 177.57 176.36 1idm h LEU 248 N 0.00 -0.04 -1.55 4.19 4.07 -1.31 -1.80 115.31 118.86 1idm h LEU 248 Ca 0.00 0.10 -0.01 0.00 0.08 0.00 0.00 57.88 58.06 1idm h LEU 248 Cb 0.78 0.15 -0.00 0.00 1.08 0.00 0.00 40.66 42.67 1idm h LEU 248 CO 0.00 0.00 -0.04 -0.65 -1.08 0.00 0.00 178.44 176.67 1idm h PRO 249 N 0.22 0.00 0.00 1.13 0.11 -1.76 -3.37 132.00 128.33 1idm h PRO 249 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1idm h PRO 249 Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1idm h PRO 249 CO -0.38 0.04 0.00 0.41 -0.21 0.00 0.00 178.00 177.86 1idm n GLY 250 N -0.07 0.47 3.15 -0.55 0.00 -0.68 -3.72 105.19 103.79 1idm n GLY 250 Ca 0.00 -0.81 0.05 0.00 0.00 0.00 0.00 46.02 45.26 1idm n GLY 250 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1idm s SER 251 N -2.73 -1.01 0.58 1.61 0.15 -1.26 -4.82 113.70 106.22 1idm s SER 251 Ca 0.00 0.13 0.27 0.00 0.70 0.00 0.00 55.95 57.05 1idm s SER 251 Cb 0.00 1.64 1.64 0.00 -1.71 0.00 0.00 66.02 67.59 1idm s SER 251 CO 0.00 -0.18 2.14 -0.07 1.20 0.00 0.00 173.24 176.33 1idm h LEU 252 N 7.63 0.00 -1.36 3.45 4.07 -1.95 -2.36 115.31 124.79 1idm h LEU 252 Ca -0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.90 1idm h LEU 252 Cb 1.18 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.92 1idm h LEU 252 CO 0.02 0.00 0.00 1.23 -1.08 0.00 0.00 178.44 178.61 1idm h GLY 253 N 0.00 0.00 -0.39 0.83 0.00 -1.97 -2.61 103.07 98.92 1idm h GLY 253 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1idm h GLY 253 CO -0.00 0.00 -0.05 1.04 0.00 0.00 0.00 176.54 177.53 1idm n LEU 254 N -2.53 1.47 -4.70 3.11 4.77 -0.89 -3.76 117.00 114.47 1idm n LEU 254 Ca 0.00 -0.48 -0.38 0.00 -0.03 0.00 0.00 56.01 55.12 1idm n LEU 254 Cb 0.17 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.18 1idm n LEU 254 CO 0.19 0.25 0.23 -0.76 -1.33 0.00 0.00 177.39 175.96 1idm s LEU 255 N -2.10 4.24 0.44 2.23 1.43 -0.98 -4.32 118.68 119.62 1idm s LEU 255 Ca 0.35 0.83 0.08 0.00 -1.03 0.00 0.00 54.13 54.36 1idm s LEU 255 Cb 0.21 -2.76 0.01 0.00 0.03 0.00 0.00 46.19 43.68 1idm s LEU 255 CO 0.37 -0.07 0.50 -2.16 0.23 0.00 0.00 176.35 175.22 1idm s PRO 256 N 0.94 2.60 0.19 1.29 0.04 -1.26 -0.60 135.00 138.21 1idm s PRO 256 Ca 0.27 -1.47 -0.22 0.00 0.04 0.00 0.00 61.00 59.63 1idm s PRO 256 Cb -0.16 -2.54 0.05 0.00 0.04 0.00 0.00 34.50 31.90 1idm s PRO 256 CO 0.11 -0.32 0.62 -1.54 0.04 0.00 0.00 177.00 175.90 1idm s SER 257 N -4.28 -0.46 0.02 6.66 1.04 -0.02 -4.22 113.70 112.45 1idm s SER 257 Ca 0.51 -0.20 -0.10 0.00 0.48 0.00 0.00 55.95 56.65 1idm s SER 257 Cb -0.06 0.63 0.01 0.00 0.10 0.00 0.00 66.02 66.69 1idm s SER 257 CO 0.31 -1.06 0.20 0.00 0.98 0.00 0.00 173.24 173.66 1idm s ALA 258 N -3.80 -0.42 -0.13 5.32 0.00 -0.73 -1.17 121.76 120.83 1idm s ALA 258 Ca 0.04 -0.16 -0.00 0.00 0.00 0.00 0.00 51.96 51.84 1idm s ALA 258 Cb -0.02 0.22 0.02 0.00 0.00 0.00 0.00 23.12 23.34 1idm s ALA 258 CO -0.07 -0.32 -0.10 -1.12 0.00 0.00 0.00 175.76 174.15 1idm s SER 259 N -1.84 2.39 0.22 0.00 0.01 0.03 -0.21 113.70 114.31 1idm s SER 259 Ca -0.08 -0.38 0.08 0.00 1.31 0.00 0.00 55.95 56.88 1idm s SER 259 Cb -0.03 -0.98 -0.04 0.00 0.21 0.00 0.00 66.02 65.18 1idm s SER 259 CO -0.02 -0.09 0.00 -0.76 0.41 0.00 0.00 173.24 172.78 1idm s LEU 260 N 1.62 3.25 0.00 2.44 1.02 -0.10 -1.85 118.68 125.07 1idm s LEU 260 Ca 0.05 -0.52 0.00 0.00 0.02 0.00 0.00 54.13 53.68 1idm s LEU 260 Cb -0.13 -1.84 0.00 0.00 0.02 0.00 0.00 46.19 44.24 1idm s LEU 260 CO -0.09 0.04 0.00 0.61 0.02 0.00 0.00 176.35 176.93 1idm n GLY 261 N -0.52 -0.89 0.09 -3.19 0.00 -1.26 -1.31 105.19 98.11 1idm n GLY 261 Ca -0.08 -0.16 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 1idm n GLY 261 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1idm h ARG 262 N 0.00 0.19 0.00 1.61 3.08 -1.27 -3.47 114.38 114.51 1idm h ARG 262 Ca 0.00 -0.32 0.00 0.00 0.07 0.00 0.00 59.98 59.73 1idm h ARG 262 Cb 0.00 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1idm h ARG 262 CO 0.00 1.14 0.00 0.41 -1.07 0.00 0.00 179.97 180.45 1idm n GLY 263 N 1.49 1.52 3.69 0.04 0.00 0.12 -5.02 105.19 107.03 1idm n GLY 263 Ca -0.07 -1.86 -0.42 0.00 0.00 0.00 0.00 46.02 43.67 1idm n GLY 263 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1idm s THR 264 N 1.98 3.29 0.57 2.61 2.01 -1.26 -4.99 115.64 119.85 1idm s THR 264 Ca 0.00 0.70 -0.18 0.00 0.31 0.00 0.00 61.69 62.52 1idm s THR 264 Cb 0.00 -3.45 -0.04 0.00 0.01 0.00 0.00 72.50 69.01 1idm s THR 264 CO 0.00 -0.00 1.13 -2.16 -0.69 0.00 0.00 174.62 172.89 1idm s PRO 265 N 2.59 3.22 -0.09 4.92 0.04 -1.26 -4.87 135.00 139.56 1idm s PRO 265 Ca 0.70 1.56 0.03 0.00 0.04 0.00 0.00 61.00 63.34 1idm s PRO 265 Cb -0.37 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.17 1idm s PRO 265 CO 0.30 -0.95 -0.18 0.08 0.04 0.00 0.00 177.00 176.29 1idm s VAL 266 N -1.90 2.63 -0.07 -0.36 1.01 -0.77 -1.57 120.40 119.37 1idm s VAL 266 Ca 0.71 -0.84 0.04 0.00 0.00 0.00 0.00 61.98 61.89 1idm s VAL 266 Cb -0.23 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.11 1idm s VAL 266 CO 0.30 0.56 -0.20 -0.36 0.00 0.00 0.00 175.10 175.40 1idm s PHE 267 N -0.06 2.09 -0.05 5.22 0.08 -0.42 -0.79 117.98 124.05 1idm s PHE 267 Ca -0.04 -0.74 -0.28 0.00 0.12 0.00 0.00 56.93 55.98 1idm s PHE 267 Cb -0.14 -1.41 0.06 0.00 -0.57 0.00 0.00 43.02 40.95 1idm s PHE 267 CO 0.04 -0.29 0.61 -1.83 -0.10 0.00 0.00 175.22 173.66 1idm s GLU 268 N 0.25 0.98 0.51 0.44 -1.05 -0.32 -0.36 118.70 119.16 1idm s GLU 268 Ca -0.12 0.20 -0.20 0.00 -0.15 0.00 0.00 54.97 54.71 1idm s GLU 268 Cb -0.15 0.46 -0.07 0.00 -0.44 0.00 0.00 34.13 33.93 1idm s GLU 268 CO 0.05 -0.30 1.07 -1.25 0.95 0.00 0.00 175.26 175.78 1idm s PRO 269 N -1.16 3.61 0.15 -4.83 0.04 -1.26 -0.84 135.00 130.71 1idm s PRO 269 Ca -0.11 1.42 -0.01 0.00 0.04 0.00 0.00 61.00 62.34 1idm s PRO 269 Cb -0.01 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.44 1idm s PRO 269 CO 0.09 -0.60 1.36 0.28 0.04 0.00 0.00 177.00 178.17 1idm h VAL 270 N 1.33 1.42 -3.31 -0.36 2.07 -1.13 -3.46 116.25 112.81 1idm h VAL 270 Ca -0.49 -2.41 -0.48 0.00 0.82 0.00 0.00 66.70 64.13 1idm h VAL 270 Cb 1.23 2.35 0.22 0.00 -1.52 0.00 0.00 31.29 33.57 1idm h VAL 270 CO 0.58 0.72 -0.30 0.00 0.02 0.00 0.00 177.57 178.59 1idm n HIS 271 N -3.74 -0.82 -1.75 1.57 1.44 -1.26 -5.04 115.22 105.61 1idm n HIS 271 Ca -0.05 0.12 -0.23 0.00 -2.01 0.00 0.00 57.72 55.55 1idm n HIS 271 Cb 0.79 -1.76 0.16 0.00 0.12 0.00 0.00 29.99 29.30 1idm n HIS 271 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1idm n GLY 272 N 1.15 -1.33 0.12 -1.39 0.00 -1.26 -4.90 105.19 97.58 1idm n GLY 272 Ca 0.05 -1.71 0.13 0.00 0.00 0.00 0.00 46.02 44.49 1idm n GLY 272 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1idm h SER 273 N -1.32 0.00 -7.02 1.61 4.64 -1.86 -3.46 113.55 106.13 1idm h SER 273 Ca -0.33 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.55 1idm h SER 273 Cb 0.92 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.00 1idm h SER 273 CO 0.24 0.00 -0.75 0.00 -0.87 0.00 0.00 176.83 175.45 1idm n ALA 274 N -1.80 -2.20 0.28 5.18 0.00 -1.26 -0.49 120.51 120.22 1idm n ALA 274 Ca 0.04 -0.42 0.17 0.00 0.00 0.00 0.00 53.44 53.24 1idm n ALA 274 Cb 0.37 -1.73 0.94 0.00 0.00 0.00 0.00 19.45 19.03 1idm n ALA 274 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1idm h PRO 275 N -1.00 0.00 0.00 0.00 0.13 -1.92 -2.00 132.00 127.21 1idm h PRO 275 Ca -0.52 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1idm h PRO 275 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1idm h PRO 275 CO 0.37 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.74 1idm n ASP 276 N -3.62 0.00 -0.10 1.44 5.75 -1.26 -2.95 116.55 115.82 1idm n ASP 276 Ca -0.01 0.24 0.06 0.00 -0.01 0.00 0.00 54.79 55.06 1idm n ASP 276 Cb 0.18 -0.41 -0.04 0.00 -1.03 0.00 0.00 41.12 39.82 1idm n ASP 276 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 1idm n ILE 277 N -1.41 0.00 -1.68 2.12 5.41 -0.76 -4.99 119.36 118.06 1idm n ILE 277 Ca 0.09 -0.28 -0.44 0.00 1.00 0.00 0.00 62.75 63.12 1idm n ILE 277 Cb 0.27 1.05 -0.02 0.00 -0.71 0.00 0.00 39.64 40.24 1idm n ILE 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1idm n ALA 278 N -0.88 1.09 -0.06 -1.39 0.00 -1.15 -2.35 120.51 115.77 1idm n ALA 278 Ca 0.03 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1idm n ALA 278 Cb 0.21 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.41 1idm n ALA 278 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1idm n GLY 279 N 1.46 2.04 0.08 0.00 0.00 -1.26 -4.82 105.19 102.68 1idm n GLY 279 Ca 0.08 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1idm n GLY 279 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1idm n LYS 280 N -2.00 0.22 0.00 1.61 5.02 -0.99 -5.01 118.16 117.01 1idm n LYS 280 Ca 0.00 0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 1idm n LYS 280 Cb 0.00 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.29 1idm n LYS 280 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1idm n GLY 281 N 1.35 0.88 3.36 0.72 0.00 -1.26 -4.93 105.19 105.31 1idm n GLY 281 Ca 0.05 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.94 1idm n GLY 281 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1idm n ILE 282 N 0.00 0.00 -1.71 -0.61 -5.35 -1.26 -4.72 119.36 105.71 1idm n ILE 282 Ca 0.00 0.00 -0.43 0.00 -0.27 0.00 0.00 62.75 62.05 1idm n ILE 282 Cb 0.00 0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 37.88 1idm n ILE 282 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1idm n ALA 283 N 0.05 1.77 -2.56 -1.28 0.00 -1.26 -4.47 120.51 112.76 1idm n ALA 283 Ca 0.00 0.38 -0.43 0.00 0.00 0.00 0.00 53.44 53.39 1idm n ALA 283 Cb 0.00 -2.35 -0.02 0.00 0.00 0.00 0.00 19.45 17.08 1idm n ALA 283 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1idm s ASN 284 N 0.19 6.81 0.00 0.00 3.04 -1.26 -3.95 114.94 119.77 1idm s ASN 284 Ca 0.63 1.04 0.23 0.00 0.04 0.00 0.00 52.86 54.79 1idm s ASN 284 Cb -0.56 -2.54 0.92 0.00 -1.54 0.00 0.00 41.25 37.52 1idm s ASN 284 CO 0.53 -0.99 1.64 -0.81 -3.04 0.00 0.00 177.10 174.44 1idm n PRO 285 N 7.14 1.59 -0.12 0.43 -0.04 -1.26 -4.47 135.00 138.26 1idm n PRO 285 Ca 0.13 -0.87 -0.06 0.00 -0.04 0.00 0.00 63.50 62.66 1idm n PRO 285 Cb 0.47 -1.41 0.01 0.00 -0.04 0.00 0.00 33.50 32.53 1idm n PRO 285 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1idm h THR 286 N 1.86 0.34 -0.66 0.52 2.02 -1.91 -0.35 112.91 114.73 1idm h THR 286 Ca 0.00 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 1idm h THR 286 Cb 0.40 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 1idm h THR 286 CO 0.00 0.00 0.44 0.00 0.37 0.00 0.00 175.52 176.33 1idm h ALA 287 N 1.03 1.57 -0.04 6.16 0.00 -1.75 0.61 119.26 126.84 1idm h ALA 287 Ca 0.20 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.85 1idm h ALA 287 Cb 0.48 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1idm h ALA 287 CO -0.52 0.38 -0.87 0.00 0.00 0.00 0.00 179.25 178.24 1idm h ALA 288 N 1.60 0.39 -0.44 0.00 0.00 -1.62 -1.16 119.26 118.03 1idm h ALA 288 Ca 0.25 -0.66 -0.14 0.00 0.00 0.00 0.00 54.91 54.36 1idm h ALA 288 Cb -0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1idm h ALA 288 CO -0.06 0.77 -0.26 0.82 0.00 0.00 0.00 179.25 180.51 1idm h ILE 289 N 0.31 1.27 0.00 0.00 2.04 -0.53 -2.19 117.51 118.41 1idm h ILE 289 Ca -0.07 -1.43 -0.05 0.00 1.00 0.00 0.00 64.86 64.32 1idm h ILE 289 Cb 1.49 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 38.78 1idm h ILE 289 CO 0.16 0.48 -0.22 -0.07 0.00 0.00 0.00 178.15 178.51 1idm h LEU 290 N 0.79 0.00 -0.42 1.44 3.38 -0.81 -1.52 115.31 118.18 1idm h LEU 290 Ca 0.09 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.89 1idm h LEU 290 Cb 0.83 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1idm h LEU 290 CO 0.07 0.22 -0.64 0.28 0.09 0.00 0.00 178.44 178.46 1idm h SER 291 N 0.00 0.64 -0.34 -0.43 0.02 -0.86 -1.25 113.55 111.33 1idm h SER 291 Ca -0.00 -0.38 -0.08 0.00 -0.84 0.00 0.00 61.79 60.49 1idm h SER 291 Cb 0.62 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 1idm h SER 291 CO 0.03 1.12 -0.05 0.00 -1.14 0.00 0.00 176.83 176.78 1idm h ALA 292 N 0.88 1.10 -0.41 3.77 0.00 -0.71 -0.03 119.26 123.86 1idm h ALA 292 Ca -0.01 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 1idm h ALA 292 Cb 1.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1idm h ALA 292 CO 0.12 0.57 -0.00 0.00 0.00 0.00 0.00 179.25 179.93 1idm h ALA 293 N 1.26 0.55 -0.58 0.00 0.00 -1.14 -1.90 119.26 117.44 1idm h ALA 293 Ca 0.13 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.78 1idm h ALA 293 Cb 0.50 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1idm h ALA 293 CO 0.03 0.33 0.39 0.52 0.00 0.00 0.00 179.25 180.51 1idm h MET 294 N 0.55 0.76 0.10 0.00 2.86 -0.56 -1.41 114.93 117.24 1idm h MET 294 Ca 0.11 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 1idm h MET 294 Cb 0.48 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.97 1idm h MET 294 CO 0.02 0.50 -0.05 1.98 1.06 0.00 0.00 176.91 180.43 1idm h MET 295 N 0.78 -0.13 -0.75 1.72 -1.53 -0.66 0.37 114.93 114.74 1idm h MET 295 Ca 0.21 0.01 0.11 0.00 -3.44 0.00 0.00 59.70 56.59 1idm h MET 295 Cb -0.09 0.03 -0.08 0.00 -0.55 0.00 0.00 31.60 30.92 1idm h MET 295 CO -0.05 0.05 0.37 -0.07 0.14 0.00 0.00 176.91 177.35 1idm h LEU 296 N -0.29 0.47 0.18 3.39 3.38 -0.71 0.88 115.31 122.61 1idm h LEU 296 Ca -0.01 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1idm h LEU 296 Cb 0.24 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1idm h LEU 296 CO 0.02 0.25 -0.09 -0.08 0.09 0.00 0.00 178.44 178.64 1idm h GLU 297 N 0.61 -0.24 0.04 1.13 4.81 -1.12 0.15 114.58 119.96 1idm h GLU 297 Ca 0.38 0.02 -0.28 0.00 -0.13 0.00 0.00 59.36 59.34 1idm h GLU 297 Cb 0.44 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 1idm h GLU 297 CO -0.30 0.18 -1.50 0.45 -0.73 0.00 0.00 179.01 177.11 1idm h HIS 298 N -0.83 0.14 0.00 0.92 3.86 -0.86 -2.22 115.15 116.16 1idm h HIS 298 Ca -0.02 -0.11 -0.30 0.00 -1.16 0.00 0.00 60.37 58.78 1idm h HIS 298 Cb 0.52 -0.01 -0.05 0.00 1.06 0.00 0.00 27.41 28.93 1idm h HIS 298 CO 0.07 1.15 -1.75 0.00 0.86 0.00 0.00 177.93 178.26 1idm n ALA 299 N -2.56 1.49 0.02 2.45 0.00 0.29 -4.52 120.51 117.68 1idm n ALA 299 Ca -0.13 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.52 1idm n ALA 299 Cb 1.02 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.66 1idm n ALA 299 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1idm n PHE 300 N -3.03 0.00 -1.08 0.00 3.72 -1.10 -5.01 117.46 110.95 1idm n PHE 300 Ca -0.18 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.19 1idm n PHE 300 Cb 1.06 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.59 1idm n PHE 300 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1idm n GLY 301 N 0.12 0.41 2.41 1.37 0.00 -0.84 -4.89 105.19 103.78 1idm n GLY 301 Ca 0.00 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 1idm n GLY 301 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1idm n LEU 302 N -0.33 8.35 -0.24 0.99 4.32 0.48 -4.75 117.00 125.82 1idm n LEU 302 Ca -0.03 -4.60 0.03 0.00 -0.02 0.00 0.00 56.01 51.39 1idm n LEU 302 Cb 0.38 -1.47 0.15 0.00 -1.62 0.00 0.00 43.42 40.86 1idm n LEU 302 CO 0.04 2.03 1.03 0.58 -1.22 0.00 0.00 177.39 179.85 1idm h VAL 303 N 2.87 0.75 -0.47 4.08 2.07 -1.82 -2.42 116.25 121.32 1idm h VAL 303 Ca 0.78 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 68.19 1idm h VAL 303 Cb 0.31 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 1idm h VAL 303 CO 1.65 0.09 0.17 1.05 0.02 0.00 0.00 177.57 180.55 1idm h GLU 304 N 0.49 0.34 -0.42 1.57 9.09 -1.96 -1.54 114.58 122.15 1idm h GLU 304 Ca 0.37 -0.02 -0.12 0.00 0.05 0.00 0.00 59.36 59.63 1idm h GLU 304 Cb 0.48 -0.08 -0.01 0.00 -1.65 0.00 0.00 28.75 27.49 1idm h GLU 304 CO -0.33 0.22 -0.24 -0.07 0.05 0.00 0.00 179.01 178.64 1idm h LEU 305 N 0.35 0.88 -0.78 3.06 3.38 -1.87 -1.79 115.31 118.54 1idm h LEU 305 Ca 0.22 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1idm h LEU 305 Cb 0.21 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 1idm h LEU 305 CO -0.22 1.07 0.50 0.00 0.09 0.00 0.00 178.44 179.89 1idm h ALA 306 N 0.99 1.02 -0.19 1.53 0.00 -1.05 0.57 119.26 122.13 1idm h ALA 306 Ca 0.10 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1idm h ALA 306 Cb 0.78 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1idm h ALA 306 CO 0.06 0.33 -0.28 0.00 0.00 0.00 0.00 179.25 179.37 1idm h ARG 307 N 0.99 0.36 -0.36 0.00 2.47 -1.11 -0.49 114.38 116.24 1idm h ARG 307 Ca 0.31 -0.13 -0.04 0.00 -1.26 0.00 0.00 59.98 58.86 1idm h ARG 307 Cb -0.02 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.27 1idm h ARG 307 CO -0.10 0.61 0.08 -0.22 0.56 0.00 0.00 179.97 180.90 1idm h LYS 308 N 0.32 0.58 -0.30 0.04 3.64 -0.26 -1.24 116.57 119.35 1idm h LYS 308 Ca 0.05 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.25 1idm h LYS 308 Cb 0.66 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 1idm h LYS 308 CO 0.05 0.63 0.05 0.28 -2.27 0.00 0.00 179.45 178.19 1idm h VAL 309 N 0.43 1.23 -0.29 2.00 2.07 -0.64 -2.22 116.25 118.84 1idm h VAL 309 Ca 0.11 -0.81 0.05 0.00 0.82 0.00 0.00 66.70 66.88 1idm h VAL 309 Cb 0.32 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 31.21 1idm h VAL 309 CO 0.00 0.26 -0.04 -0.33 0.02 0.00 0.00 177.57 177.49 1idm h GLU 310 N 0.32 0.04 -0.62 1.57 5.08 -0.92 -0.94 114.58 119.12 1idm h GLU 310 Ca 0.09 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1idm h GLU 310 Cb 0.34 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1idm h GLU 310 CO 0.01 0.03 0.30 -0.44 -1.00 0.00 0.00 179.01 177.90 1idm h ASP 311 N 0.04 0.78 -0.01 1.42 3.32 -1.18 -1.25 116.42 119.54 1idm h ASP 311 Ca 0.14 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.12 1idm h ASP 311 Cb 0.20 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1idm h ASP 311 CO -0.26 0.66 -0.03 0.00 -1.72 0.00 0.00 179.24 177.88 1idm h ALA 312 N 1.47 -0.02 -0.02 3.45 0.00 -0.57 -1.15 119.26 122.40 1idm h ALA 312 Ca 0.22 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 1idm h ALA 312 Cb 0.08 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1idm h ALA 312 CO -0.03 -0.53 -0.52 -0.39 0.00 0.00 0.00 179.25 177.79 1idm h VAL 313 N -0.05 1.37 0.13 0.00 -1.51 -1.03 -0.90 116.25 114.26 1idm h VAL 313 Ca 0.02 -1.77 0.00 0.00 -1.23 0.00 0.00 66.70 63.72 1idm h VAL 313 Cb 0.08 1.93 -0.01 0.00 -2.13 0.00 0.00 31.29 31.16 1idm h VAL 313 CO -0.04 0.51 -0.13 0.00 -1.23 0.00 0.00 177.57 176.68 1idm h ALA 314 N 1.44 -0.25 -0.38 5.19 0.00 -0.79 0.18 119.26 124.65 1idm h ALA 314 Ca -0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1idm h ALA 314 Cb 0.93 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1idm h ALA 314 CO 0.07 -0.66 0.23 0.87 0.00 0.00 0.00 179.25 179.76 1idm h LYS 315 N -0.28 0.52 -0.95 0.00 1.57 -1.05 -2.50 116.57 113.88 1idm h LYS 315 Ca 0.00 -0.05 0.09 0.00 -1.87 0.00 0.00 60.65 58.82 1idm h LYS 315 Cb 0.27 -0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.40 1idm h LYS 315 CO -0.03 0.39 0.61 0.00 -0.57 0.00 0.00 179.45 179.85 1idm h ALA 316 N 1.10 1.54 -0.57 3.86 0.00 -0.67 0.90 119.26 125.42 1idm h ALA 316 Ca 0.14 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1idm h ALA 316 Cb 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1idm h ALA 316 CO -0.03 0.28 0.25 -0.07 0.00 0.00 0.00 179.25 179.69 1idm h LEU 317 N 1.00 0.73 0.23 0.00 3.38 -0.19 0.16 115.31 120.63 1idm h LEU 317 Ca 0.43 -0.08 -0.33 0.00 0.09 0.00 0.00 57.88 57.99 1idm h LEU 317 Cb 0.34 -0.19 0.03 0.00 0.09 0.00 0.00 40.66 40.93 1idm h LEU 317 CO -0.19 0.64 -1.48 -0.07 0.09 0.00 0.00 178.44 177.43 1idm h LEU 318 N 0.80 0.77 0.31 1.67 -0.00 -1.18 -3.21 115.31 114.47 1idm h LEU 318 Ca 0.20 -0.85 -0.02 0.00 -0.00 0.00 0.00 57.88 57.21 1idm h LEU 318 Cb 0.12 -0.25 0.00 0.00 -0.00 0.00 0.00 40.66 40.53 1idm h LEU 318 CO -0.02 1.67 -0.15 -0.08 -0.00 0.00 0.00 178.44 179.86 1idm h GLU 319 N 0.13 -0.40 -2.15 1.13 4.81 -0.53 -3.39 114.58 114.17 1idm h GLU 319 Ca -0.25 0.03 -0.58 0.00 -0.13 0.00 0.00 59.36 58.43 1idm h GLU 319 Cb 2.14 0.09 -0.40 0.00 0.63 0.00 0.00 28.75 31.22 1idm h GLU 319 CO 0.26 -0.07 -0.92 0.25 -0.73 0.00 0.00 179.01 177.80 1idm n THR 320 N -5.09 0.22 -1.68 0.32 -2.24 0.53 -5.07 114.28 101.26 1idm n THR 320 Ca -0.09 -4.33 -0.43 0.00 -2.27 0.00 0.00 64.05 56.93 1idm n THR 320 Cb 0.27 -1.98 -0.01 0.00 -2.10 0.00 0.00 70.33 66.51 1idm n THR 320 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1idm n PRO 321 N 1.43 2.08 -1.06 -0.78 -0.04 -1.21 -4.59 135.00 130.84 1idm n PRO 321 Ca 0.24 0.73 -0.29 0.00 -0.04 0.00 0.00 63.50 64.14 1idm n PRO 321 Cb 0.48 -2.34 0.16 0.00 -0.04 0.00 0.00 33.50 31.76 1idm n PRO 321 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1idm s PRO 322 N -1.24 0.76 0.22 0.54 0.02 -1.26 -2.60 135.00 131.44 1idm s PRO 322 Ca 0.61 0.83 -0.08 0.00 0.02 0.00 0.00 61.00 62.38 1idm s PRO 322 Cb -0.60 -1.75 0.31 0.00 0.02 0.00 0.00 34.50 32.47 1idm s PRO 322 CO 0.57 -2.58 1.76 -1.35 -0.33 0.00 0.00 177.00 175.06 1idm h PRO 323 N -1.80 0.47 0.00 5.54 0.11 -1.62 0.58 132.00 135.28 1idm h PRO 323 Ca -0.52 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1idm h PRO 323 Cb 1.30 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1idm h PRO 323 CO 0.53 0.31 0.00 -0.40 -0.21 0.00 0.00 178.00 178.24 1idm n ASP 324 N -4.94 0.00 -0.55 -2.05 5.75 -1.26 -0.01 116.55 113.48 1idm n ASP 324 Ca 0.10 0.27 0.06 0.00 -0.01 0.00 0.00 54.79 55.21 1idm n ASP 324 Cb 0.28 -0.29 0.19 0.00 -1.03 0.00 0.00 41.12 40.27 1idm n ASP 324 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1idm n LEU 325 N -1.29 3.05 0.00 -2.12 4.32 0.11 -4.94 117.00 116.14 1idm n LEU 325 Ca 0.01 -3.41 0.00 0.00 -0.02 0.00 0.00 56.01 52.59 1idm n LEU 325 Cb 0.01 -0.51 0.00 0.00 -1.62 0.00 0.00 43.42 41.30 1idm n LEU 325 CO 0.01 0.98 0.00 0.61 -1.22 0.00 0.00 177.39 177.77 1idm n GLY 326 N -1.13 0.65 0.00 -0.72 0.00 0.98 -4.84 105.19 100.14 1idm n GLY 326 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1idm n GLY 326 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1idm n GLY 327 N -2.42 2.01 0.02 -0.02 0.00 -0.69 -4.97 105.19 99.12 1idm n GLY 327 Ca 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.94 1idm n GLY 327 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1idm n SER 328 N -1.42 0.54 -4.71 1.61 3.41 -1.11 -3.46 113.62 108.48 1idm n SER 328 Ca 0.00 -1.32 -0.42 0.00 -0.26 0.00 0.00 58.87 56.87 1idm n SER 328 Cb 0.00 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 63.91 1idm n SER 328 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1idm s ALA 329 N -0.29 3.59 0.75 7.33 0.00 -1.07 -4.78 121.76 127.28 1idm s ALA 329 Ca 0.00 1.10 -0.06 0.00 0.00 0.00 0.00 51.96 53.00 1idm s ALA 329 Cb 0.00 -3.54 0.10 0.00 0.00 0.00 0.00 23.12 19.68 1idm s ALA 329 CO 0.00 -0.63 1.05 0.20 0.00 0.00 0.00 175.76 176.38 1idm s GLY 330 N 1.17 1.73 0.17 0.00 0.00 -1.26 -3.65 107.32 105.48 1idm s GLY 330 Ca 0.65 -1.19 -0.22 0.00 0.00 0.00 0.00 44.72 43.96 1idm s GLY 330 CO 0.30 -0.69 1.60 -0.84 0.00 0.00 0.00 173.10 173.47 1idm h THR 331 N -0.73 0.24 -0.61 0.90 2.02 -1.78 0.60 112.91 113.54 1idm h THR 331 Ca -0.42 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.68 1idm h THR 331 Cb 1.29 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 1idm h THR 331 CO 0.51 0.00 0.09 -0.08 0.37 0.00 0.00 175.52 176.41 1idm h GLU 332 N -0.21 1.01 0.10 6.66 4.57 -1.94 -2.08 114.58 122.68 1idm h GLU 332 Ca 0.19 -0.27 0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1idm h GLU 332 Cb 0.53 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 1idm h GLU 332 CO -0.57 0.95 -0.14 0.00 -1.18 0.00 0.00 179.01 178.08 1idm h ALA 333 N 1.02 -0.24 -0.45 2.92 0.00 -1.62 0.15 119.26 121.04 1idm h ALA 333 Ca 0.18 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1idm h ALA 333 Cb 0.43 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1idm h ALA 333 CO 0.01 -0.66 0.25 0.35 0.00 0.00 0.00 179.25 179.20 1idm h PHE 334 N -0.28 0.47 -0.81 0.00 3.57 -0.85 -2.42 116.94 116.61 1idm h PHE 334 Ca 0.01 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 1idm h PHE 334 Cb 0.29 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.84 1idm h PHE 334 CO -0.14 0.26 0.41 1.15 -2.23 0.00 0.00 178.31 177.76 1idm h THR 335 N 0.50 1.24 -0.26 4.41 2.02 -1.08 -2.23 112.91 117.52 1idm h THR 335 Ca 0.18 -0.65 0.04 0.00 0.77 0.00 0.00 66.41 66.75 1idm h THR 335 Cb 0.04 0.18 -0.03 0.00 -1.74 0.00 0.00 68.15 66.60 1idm h THR 335 CO -0.10 0.28 0.04 0.00 0.37 0.00 0.00 175.52 176.12 1idm h ALA 336 N 1.31 0.26 -0.03 6.16 0.00 -0.48 -0.44 119.26 126.05 1idm h ALA 336 Ca 0.28 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.16 1idm h ALA 336 Cb 0.07 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1idm h ALA 336 CO -0.04 -0.37 -0.40 0.00 0.00 0.00 0.00 179.25 178.43 1idm h THR 337 N 0.14 1.29 -0.22 0.00 1.03 -1.26 -0.89 112.91 113.01 1idm h THR 337 Ca 0.12 -1.41 -0.01 0.00 -0.01 0.00 0.00 66.41 65.11 1idm h THR 337 Cb 0.13 1.72 -0.01 0.00 -1.07 0.00 0.00 68.15 68.92 1idm h THR 337 CO -0.17 0.41 0.11 0.58 -0.01 0.00 0.00 175.52 176.44 1idm h VAL 338 N 0.05 1.13 -0.70 0.00 2.07 -0.74 -2.05 116.25 116.00 1idm h VAL 338 Ca 0.00 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1idm h VAL 338 Cb 0.73 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1idm h VAL 338 CO 0.05 0.12 0.44 -0.07 0.02 0.00 0.00 177.57 178.14 1idm h LEU 339 N 0.23 0.83 -1.15 2.57 3.38 -0.62 -1.78 115.31 118.75 1idm h LEU 339 Ca 0.07 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1idm h LEU 339 Cb 0.10 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1idm h LEU 339 CO -0.01 0.62 -0.14 0.08 0.09 0.00 0.00 178.44 179.08 1idm h ARG 340 N 0.96 0.43 -0.00 1.13 0.11 -0.65 -1.71 114.38 114.65 1idm h ARG 340 Ca 0.26 -0.12 0.00 0.00 0.10 0.00 0.00 59.98 60.22 1idm h ARG 340 Cb -0.07 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 30.97 1idm h ARG 340 CO -0.05 0.56 -0.07 0.72 0.10 0.00 0.00 179.97 181.23 1idm n HIS 341 N -4.21 0.00 0.74 4.08 8.25 -0.72 -3.25 115.22 120.11 1idm n HIS 341 Ca 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.58 1idm n HIS 341 Cb 0.32 -0.13 0.12 0.00 1.12 0.00 0.00 29.99 31.41 1idm n HIS 341 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1idm n LEU 342 N -0.83 0.62 0.00 2.41 7.94 -0.65 -4.80 117.00 121.70 1idm n LEU 342 Ca 0.17 0.00 0.12 0.00 -1.11 0.00 0.00 56.01 55.19 1idm n LEU 342 Cb 0.26 -0.16 0.74 0.00 0.53 0.00 0.00 43.42 44.79 1idm n LEU 342 CO 0.22 0.07 0.92 0.00 -1.11 0.00 0.00 177.39 177.48