#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m9l n ALA 2 N 0.00 3.00 -3.05 3.04 0.00 -1.26 -4.32 120.51 117.92 1m9l n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1m9l n ALA 2 Cb 0.00 0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.71 1m9l n ALA 2 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1m9l n LYS 3 N -3.44 0.88 -2.84 0.00 5.02 -1.26 -4.49 118.16 112.03 1m9l n LYS 3 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 1m9l n LYS 3 Cb 0.05 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.07 1m9l n LYS 3 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1m9l n ALA 4 N -3.00 -1.04 -2.50 7.82 0.00 -1.26 -4.94 120.51 115.58 1m9l n ALA 4 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 53.44 51.96 1m9l n ALA 4 Cb 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.11 1m9l n ALA 4 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1m9l n THR 5 N 2.40 0.00 -2.30 0.00 -2.24 -1.25 -3.91 114.28 106.97 1m9l n THR 5 Ca 0.16 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.67 1m9l n THR 5 Cb 0.57 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.83 1m9l n THR 5 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1m9l s THR 6 N 2.52 3.87 0.05 4.28 2.01 -1.26 -2.36 115.64 124.73 1m9l s THR 6 Ca 0.00 0.17 -0.31 0.00 0.31 0.00 0.00 61.69 61.87 1m9l s THR 6 Cb 0.00 -3.54 -0.18 0.00 0.01 0.00 0.00 72.50 68.79 1m9l s THR 6 CO 0.00 -0.59 1.45 -0.29 -0.69 0.00 0.00 174.62 174.49 1m9l h ILE 7 N -0.22 0.31 0.38 1.82 -0.00 -1.91 0.12 117.51 118.01 1m9l h ILE 7 Ca -0.45 -0.17 -0.00 0.00 -0.00 0.00 0.00 64.86 64.23 1m9l h ILE 7 Cb 1.24 0.36 -0.03 0.00 -0.00 0.00 0.00 36.82 38.40 1m9l h ILE 7 CO 0.61 0.02 -0.49 0.11 -0.00 0.00 0.00 178.15 178.41 1m9l h LYS 8 N -0.99 -0.87 0.30 2.19 1.57 -1.96 0.06 116.57 116.87 1m9l h LYS 8 Ca -0.09 0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1m9l h LYS 8 Cb 0.70 0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 1m9l h LYS 8 CO 0.14 -0.58 -0.31 -0.44 -0.57 0.00 0.00 179.45 177.69 1m9l h ASP 9 N -0.90 -0.86 -0.52 0.86 3.32 -1.97 -1.61 116.42 114.73 1m9l h ASP 9 Ca -0.04 0.07 0.11 0.00 0.02 0.00 0.00 57.03 57.19 1m9l h ASP 9 Cb 0.82 0.28 -0.10 0.00 0.22 0.00 0.00 39.33 40.55 1m9l h ASP 9 CO -0.12 -0.41 -0.16 0.00 -1.72 0.00 0.00 179.24 176.84 1m9l h ALA 10 N -1.23 0.30 -0.70 3.45 0.00 -0.72 0.13 119.26 120.50 1m9l h ALA 10 Ca -0.04 0.20 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1m9l h ALA 10 Cb 0.53 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1m9l h ALA 10 CO -0.04 -0.47 0.25 0.82 0.00 0.00 0.00 179.25 179.81 1m9l h ILE 11 N -0.03 1.25 -0.59 0.00 2.04 -0.90 0.20 117.51 119.48 1m9l h ILE 11 Ca 0.25 -0.82 -0.07 0.00 1.00 0.00 0.00 64.86 65.22 1m9l h ILE 11 Cb 0.41 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1m9l h ILE 11 CO -0.55 0.32 0.10 -0.09 0.00 0.00 0.00 178.15 177.93 1m9l h ARG 12 N 1.01 0.98 0.00 2.37 2.43 -0.70 -1.03 114.38 119.43 1m9l h ARG 12 Ca 0.23 -0.26 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 1m9l h ARG 12 Cb 0.25 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1m9l h ARG 12 CO -0.01 0.93 -0.06 0.82 -1.51 0.00 0.00 179.97 180.13 1m9l h ILE 13 N 0.88 0.71 0.09 1.20 2.04 0.03 0.19 117.51 122.65 1m9l h ILE 13 Ca 0.18 -0.24 -0.27 0.00 1.00 0.00 0.00 64.86 65.53 1m9l h ILE 13 Cb 0.42 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1m9l h ILE 13 CO 0.01 0.06 -1.27 -0.26 0.00 0.00 0.00 178.15 176.69 1m9l h PHE 14 N 0.00 0.35 0.00 1.37 0.04 -0.01 0.15 116.94 118.83 1m9l h PHE 14 Ca -0.00 -0.25 -0.01 0.00 2.80 0.00 0.00 57.97 60.50 1m9l h PHE 14 Cb 0.14 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.28 1m9l h PHE 14 CO 0.00 1.22 -0.06 1.49 -0.60 0.00 0.00 178.31 180.36 1m9l h GLU 15 N 0.05 0.00 0.00 1.51 4.81 0.29 0.46 114.58 121.71 1m9l h GLU 15 Ca -0.13 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.06 1m9l h GLU 15 Cb 1.94 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.31 1m9l h GLU 15 CO 0.17 0.06 -1.09 0.39 -0.73 0.00 0.00 179.01 177.82 1m9l n GLU 16 N -3.23 0.52 0.00 1.92 1.02 0.47 -3.67 120.64 117.66 1m9l n GLU 16 Ca -0.00 0.21 -0.02 0.00 -0.02 0.00 0.00 57.16 57.32 1m9l n GLU 16 Cb 0.28 -1.40 -0.01 0.00 -0.02 0.00 0.00 31.44 30.29 1m9l n GLU 16 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1m9l h ARG 17 N -0.96 -0.11 -0.34 3.49 2.43 -0.85 -3.27 114.38 114.76 1m9l h ARG 17 Ca -0.05 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1m9l h ARG 17 Cb 1.01 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.57 1m9l h ARG 17 CO -0.03 -0.07 0.21 -0.22 -1.51 0.00 0.00 179.97 178.35 1m9l h LYS 18 N -0.93 0.46 -4.33 0.20 3.11 -1.57 -3.47 116.57 110.03 1m9l h LYS 18 Ca -0.01 -0.03 -0.14 0.00 -2.81 0.00 0.00 60.65 57.66 1m9l h LYS 18 Cb 0.09 -0.10 0.11 0.00 -1.00 0.00 0.00 32.23 31.32 1m9l h LYS 18 CO 0.02 0.32 -0.47 -1.13 -2.81 0.00 0.00 179.45 175.38 1m9l n SER 19 N -4.47 -4.52 -0.93 4.20 3.41 0.15 -4.96 113.62 106.50 1m9l n SER 19 Ca 0.02 -0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.25 1m9l n SER 19 Cb 0.07 -3.06 0.00 0.00 -0.26 0.00 0.00 64.21 60.97 1m9l n SER 19 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1m9l n VAL 20 N -2.44 0.00 -3.55 -3.33 0.24 -0.67 -4.94 118.33 103.64 1m9l n VAL 20 Ca -0.04 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.85 1m9l n VAL 20 Cb 0.56 0.00 -0.08 0.00 -1.47 0.00 0.00 33.84 32.85 1m9l n VAL 20 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1m9l s VAL 21 N -2.17 4.25 -0.11 3.34 1.01 -1.26 -4.20 120.40 121.25 1m9l s VAL 21 Ca 0.00 -1.90 -0.12 0.00 0.00 0.00 0.00 61.98 59.96 1m9l s VAL 21 Cb 0.00 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1m9l s VAL 21 CO 0.00 -0.80 -0.23 0.00 0.00 0.00 0.00 175.10 174.07 1m9l n ALA 22 N 4.77 0.94 0.00 5.51 0.00 -1.26 -3.84 120.51 126.62 1m9l n ALA 22 Ca -0.06 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.78 1m9l n ALA 22 Cb 0.41 0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1m9l n ALA 22 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1m9l n THR 23 N -3.89 0.00 0.00 0.00 -1.04 -1.26 -1.62 114.28 106.47 1m9l n THR 23 Ca -0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 1m9l n THR 23 Cb 0.35 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.86 1m9l n THR 23 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1m9l n GLU 24 N 0.00 0.00 -1.57 -2.82 2.13 -1.26 -5.12 120.64 112.00 1m9l n GLU 24 Ca 0.00 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.50 1m9l n GLU 24 Cb 0.00 0.00 0.06 0.00 0.27 0.00 0.00 31.44 31.77 1m9l n GLU 24 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1m9l s ALA 25 N -2.00 2.44 0.29 4.31 0.00 -0.64 -4.79 121.76 121.37 1m9l s ALA 25 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1m9l s ALA 25 Cb 0.00 -3.27 0.51 0.00 0.00 0.00 0.00 23.12 20.36 1m9l s ALA 25 CO 0.00 -1.41 1.88 0.93 0.00 0.00 0.00 175.76 177.16 1m9l h GLU 26 N -0.47 1.02 -5.61 0.00 3.07 -1.88 -3.39 114.58 107.31 1m9l h GLU 26 Ca -0.45 -0.06 -0.61 0.00 -0.50 0.00 0.00 59.36 57.74 1m9l h GLU 26 Cb 1.23 -0.23 -0.11 0.00 -0.84 0.00 0.00 28.75 28.80 1m9l h GLU 26 CO 0.54 0.68 0.27 0.15 -1.40 0.00 0.00 179.01 179.24 1m9l s LYS 27 N -5.95 4.06 -0.24 2.33 1.02 -1.26 -0.02 119.74 119.69 1m9l s LYS 27 Ca -0.12 0.59 -0.00 0.00 0.02 0.00 0.00 55.97 56.46 1m9l s LYS 27 Cb 0.21 -3.68 0.07 0.00 -0.52 0.00 0.00 37.83 33.91 1m9l s LYS 27 CO 0.81 -0.51 -0.01 0.08 -0.92 0.00 0.00 175.35 174.80 1m9l s VAL 28 N 2.68 1.25 -1.00 3.17 1.01 -0.63 -4.79 120.40 122.07 1m9l s VAL 28 Ca 0.29 -1.14 -0.16 0.00 0.00 0.00 0.00 61.98 60.96 1m9l s VAL 28 Cb -0.15 -1.64 0.16 0.00 0.00 0.00 0.00 36.38 34.74 1m9l s VAL 28 CO 0.10 -0.22 1.17 -1.83 0.00 0.00 0.00 175.10 174.32 1m9l s GLU 29 N 1.51 3.76 0.00 2.72 -1.05 -1.25 -1.03 118.70 123.36 1m9l s GLU 29 Ca -0.02 -2.13 0.00 0.00 -0.15 0.00 0.00 54.97 52.67 1m9l s GLU 29 Cb -0.18 -4.89 0.00 0.00 -0.44 0.00 0.00 34.13 28.62 1m9l s GLU 29 CO -0.09 -1.70 0.00 1.28 0.95 0.00 0.00 175.26 175.70 1m9l n LEU 30 N 5.86 0.00 0.00 1.83 4.77 -0.54 -4.45 117.00 124.46 1m9l n LEU 30 Ca 0.26 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 1m9l n LEU 30 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1m9l n LEU 30 CO 0.52 0.00 0.00 1.57 -1.33 0.00 0.00 177.39 178.15 1m9l n HIS 31 N 0.00 0.00 -3.49 -1.77 -0.00 -1.26 -4.71 115.22 103.99 1m9l n HIS 31 Ca 0.00 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.07 1m9l n HIS 31 Cb 0.00 0.00 -0.02 0.00 -0.12 0.00 0.00 29.99 29.85 1m9l n HIS 31 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 1m9l s GLY 32 N -0.64 -0.53 -0.03 1.57 0.00 -1.26 -1.39 107.32 105.05 1m9l s GLY 32 Ca 0.00 0.42 -0.17 0.00 0.00 0.00 0.00 44.72 44.96 1m9l s GLY 32 CO 0.00 0.14 0.37 -0.29 0.00 0.00 0.00 173.10 173.32 1m9l s MET 33 N -3.72 0.72 0.13 2.90 0.00 -0.51 -0.09 119.30 118.73 1m9l s MET 33 Ca 0.03 -0.09 -0.30 0.00 0.00 0.00 0.00 55.69 55.33 1m9l s MET 33 Cb -0.02 0.33 -0.06 0.00 0.00 0.00 0.00 34.83 35.08 1m9l s MET 33 CO -0.10 -0.20 0.96 0.96 0.00 0.00 0.00 175.02 176.64 1m9l s ILE 34 N -1.24 4.44 0.27 10.11 -4.36 -1.26 -3.51 121.20 125.64 1m9l s ILE 34 Ca -0.13 2.06 -0.02 0.00 -0.26 0.00 0.00 60.65 62.31 1m9l s ILE 34 Cb -0.04 -4.32 0.29 0.00 1.25 0.00 0.00 42.46 39.64 1m9l s ILE 34 CO 0.05 0.33 1.65 -0.65 0.24 0.00 0.00 174.94 176.56 1m9l h PRO 35 N 5.43 0.18 -0.10 0.37 0.11 -1.96 -1.85 132.00 134.18 1m9l h PRO 35 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1m9l h PRO 35 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1m9l h PRO 35 CO 0.71 0.12 0.00 -0.35 -0.21 0.00 0.00 178.00 178.27 1m9l n PRO 36 N -5.25 0.67 -1.42 1.05 -0.04 -1.26 -0.92 135.00 127.83 1m9l n PRO 36 Ca 0.18 0.00 -0.55 0.00 -0.04 0.00 0.00 63.50 63.08 1m9l n PRO 36 Cb 0.57 -1.05 -0.08 0.00 -0.04 0.00 0.00 33.50 32.90 1m9l n PRO 36 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 1m9l n ILE 37 N -0.40 0.00 0.00 0.52 3.06 -0.70 -4.74 119.36 117.10 1m9l n ILE 37 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1m9l n ILE 37 Cb 0.02 -0.39 0.00 0.00 0.54 0.00 0.00 39.64 39.81 1m9l n ILE 37 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 1m9l n GLU 38 N 3.18 0.00 -3.76 9.51 2.13 -1.24 -1.53 120.64 128.93 1m9l n GLU 38 Ca 0.25 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.70 1m9l n GLU 38 Cb -0.04 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.60 1m9l n GLU 38 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1m9l s LYS 39 N 0.57 3.79 -1.10 5.31 1.02 -1.25 -2.69 119.74 125.39 1m9l s LYS 39 Ca 0.00 -0.08 -0.07 0.00 0.02 0.00 0.00 55.97 55.84 1m9l s LYS 39 Cb 0.00 -3.29 0.29 0.00 -0.52 0.00 0.00 37.83 34.31 1m9l s LYS 39 CO 0.00 0.57 1.20 -1.33 -0.92 0.00 0.00 175.35 174.88 1m9l n MET 40 N 2.58 3.76 0.23 1.68 2.81 -1.26 -3.85 117.12 123.08 1m9l n MET 40 Ca -0.17 -4.49 0.12 0.00 -1.81 0.00 0.00 57.70 51.34 1m9l n MET 40 Cb 0.54 -2.53 0.72 0.00 -0.71 0.00 0.00 33.22 31.23 1m9l n MET 40 CO 0.00 0.00 0.00 0.22 1.51 0.00 0.00 175.97 177.70 1m9l h ASP 41 N 6.27 0.00 0.15 7.83 3.58 -1.76 -1.48 116.42 131.01 1m9l h ASP 41 Ca 0.18 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.63 1m9l h ASP 41 Cb 0.80 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.84 1m9l h ASP 41 CO 1.10 0.00 -0.17 0.00 -2.88 0.00 0.00 179.24 177.29 1m9l h ALA 42 N 1.95 -0.86 -0.69 -0.78 0.00 -1.77 -1.37 119.26 115.74 1m9l h ALA 42 Ca 0.04 -0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.02 1m9l h ALA 42 Cb 0.16 0.43 -0.13 0.00 0.00 0.00 0.00 17.79 18.25 1m9l h ALA 42 CO -0.00 -0.88 -0.23 1.15 0.00 0.00 0.00 179.25 179.30 1m9l h THR 43 N -0.32 0.24 -0.69 0.00 2.02 -1.81 0.23 112.91 112.57 1m9l h THR 43 Ca -0.02 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.27 1m9l h THR 43 Cb 0.28 0.24 -0.12 0.00 -1.74 0.00 0.00 68.15 66.82 1m9l h THR 43 CO -0.03 0.00 -0.41 0.25 0.37 0.00 0.00 175.52 175.70 1m9l h LEU 44 N -0.05 -1.44 0.00 2.58 5.85 -0.95 0.41 115.31 121.71 1m9l h LEU 44 Ca 0.31 0.26 -0.08 0.00 0.84 0.00 0.00 57.88 59.21 1m9l h LEU 44 Cb 0.53 0.69 -0.01 0.00 0.37 0.00 0.00 40.66 42.24 1m9l h LEU 44 CO -0.73 -0.31 -0.53 0.28 -0.34 0.00 0.00 178.44 176.81 1m9l h SER 45 N -0.15 0.00 0.00 1.25 0.02 -0.72 -3.32 113.55 110.63 1m9l h SER 45 Ca 0.23 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 1m9l h SER 45 Cb 0.56 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.10 1m9l h SER 45 CO -0.76 1.04 0.26 1.07 -1.14 0.00 0.00 176.83 177.30 1m9l n THR 46 N -4.58 0.78 -0.35 -2.27 5.66 0.76 -1.75 114.28 112.53 1m9l n THR 46 Ca -0.15 0.69 -0.00 0.00 -3.05 0.00 0.00 64.05 61.53 1m9l n THR 46 Cb 0.43 -1.69 0.05 0.00 -1.55 0.00 0.00 70.33 67.57 1m9l n THR 46 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1m9l n LEU 47 N -1.89 -0.57 -0.32 1.09 0.00 0.14 -0.15 117.00 115.31 1m9l n LEU 47 Ca -0.01 1.59 0.20 0.00 0.00 0.00 0.00 56.01 57.80 1m9l n LEU 47 Cb 0.27 -0.38 0.39 0.00 0.00 0.00 0.00 43.42 43.71 1m9l n LEU 47 CO 0.05 -1.44 0.95 0.11 0.00 0.00 0.00 177.39 177.06 1m9l h LYS 48 N 0.00 0.10 0.00 1.96 1.57 -1.62 0.37 116.57 118.95 1m9l h LYS 48 Ca 0.33 -0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 58.99 1m9l h LYS 48 Cb 0.56 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.83 1m9l h LYS 48 CO -0.91 0.07 -1.49 0.00 -0.57 0.00 0.00 179.45 176.55 1m9l n ALA 49 N -2.67 2.17 -1.24 3.86 0.00 0.79 -5.04 120.51 118.38 1m9l n ALA 49 Ca 0.28 -0.53 -0.48 0.00 0.00 0.00 0.00 53.44 52.70 1m9l n ALA 49 Cb 0.91 -0.89 -0.07 0.00 0.00 0.00 0.00 19.45 19.39 1m9l n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m9l n LYS 51 N 2.35 0.00 -3.54 0.00 4.81 -1.22 -4.50 118.16 116.06 1m9l n LYS 51 Ca 0.20 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.27 1m9l n LYS 51 Cb -0.01 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 34.99 1m9l n LYS 51 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 1m9l n HIS 52 N -2.27 4.24 -2.55 5.64 -0.00 0.97 -0.27 115.22 120.99 1m9l n HIS 52 Ca 0.00 -4.00 -0.43 0.00 0.46 0.00 0.00 57.72 53.75 1m9l n HIS 52 Cb 0.00 -1.21 -0.02 0.00 -0.12 0.00 0.00 29.99 28.64 1m9l n HIS 52 CO 0.00 0.00 0.00 -1.17 0.46 0.00 0.00 176.34 175.63 1m9l s LEU 53 N -1.53 3.92 -0.22 0.27 2.96 -0.32 -1.61 118.68 122.15 1m9l s LEU 53 Ca 0.29 1.13 -0.00 0.00 -0.22 0.00 0.00 54.13 55.33 1m9l s LEU 53 Cb -0.05 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.12 1m9l s LEU 53 CO -0.10 -0.96 -0.12 0.00 -1.32 0.00 0.00 176.35 173.85 1m9l s ALA 54 N 3.93 2.54 0.00 5.97 0.00 -0.20 -0.31 121.76 133.69 1m9l s ALA 54 Ca 0.50 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1m9l s ALA 54 Cb -0.14 -1.46 0.00 0.00 0.00 0.00 0.00 23.12 21.52 1m9l s ALA 54 CO 0.19 -0.62 0.00 -0.11 0.00 0.00 0.00 175.76 175.21 1m9l n LEU 55 N 4.63 0.00 0.00 0.00 -0.00 -0.60 -1.47 117.00 119.56 1m9l n LEU 55 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.83 1m9l n LEU 55 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.90 1m9l n LEU 55 CO 0.26 0.00 0.00 -0.24 -0.00 0.00 0.00 177.39 177.41 1m9l n SER 56 N -0.39 0.00 -4.50 1.96 2.88 -1.19 -4.63 113.62 107.75 1m9l n SER 56 Ca 0.00 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 1m9l n SER 56 Cb 0.00 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.38 1m9l n SER 56 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1m9l s THR 57 N 0.00 5.06 0.26 2.46 -1.32 -0.48 -0.81 115.64 120.80 1m9l s THR 57 Ca 0.00 -0.17 -0.16 0.00 -1.21 0.00 0.00 61.69 60.15 1m9l s THR 57 Cb 0.00 -4.03 0.01 0.00 -1.51 0.00 0.00 72.50 66.97 1m9l s THR 57 CO 0.00 -0.38 0.57 0.54 -2.21 0.00 0.00 174.62 173.14 1m9l s ASN 58 N 1.82 -0.16 0.04 8.08 4.22 -0.48 -1.43 114.94 127.03 1m9l s ASN 58 Ca 0.14 -0.78 0.02 0.00 -2.14 0.00 0.00 52.86 50.10 1m9l s ASN 58 Cb -0.16 0.64 -0.02 0.00 1.28 0.00 0.00 41.25 42.98 1m9l s ASN 58 CO 0.14 -1.21 -0.07 0.20 -2.04 0.00 0.00 177.10 174.11 1m9l s ASN 59 N -2.97 0.80 -0.22 3.54 0.01 -1.23 -1.56 114.94 113.30 1m9l s ASN 59 Ca 0.17 -0.51 -0.03 0.00 -0.71 0.00 0.00 52.86 51.79 1m9l s ASN 59 Cb -0.03 0.03 0.07 0.00 0.41 0.00 0.00 41.25 41.73 1m9l s ASN 59 CO 0.08 -0.19 0.05 -0.63 -1.51 0.00 0.00 177.10 174.90 1m9l s ILE 60 N -1.29 0.56 -0.17 0.60 1.01 0.15 -3.81 121.20 118.27 1m9l s ILE 60 Ca -0.09 -0.72 -0.22 0.00 0.00 0.00 0.00 60.65 59.62 1m9l s ILE 60 Cb -0.09 -1.15 -0.23 0.00 0.01 0.00 0.00 42.46 41.00 1m9l s ILE 60 CO 0.00 -0.31 0.43 -0.33 0.00 0.00 0.00 174.94 174.73 1m9l h GLU 61 N 8.22 0.05 -3.73 2.79 5.08 -1.21 -3.32 114.58 122.46 1m9l h GLU 61 Ca -0.16 -0.09 -0.26 0.00 -1.00 0.00 0.00 59.36 57.85 1m9l h GLU 61 Cb 1.10 0.03 -0.30 0.00 0.50 0.00 0.00 28.75 30.08 1m9l h GLU 61 CO 0.37 1.04 -0.73 0.21 -1.00 0.00 0.00 179.01 178.90 1m9l s LYS 62 N -2.35 0.04 -0.60 2.33 2.20 -0.59 -4.68 119.74 116.10 1m9l s LYS 62 Ca -0.24 0.03 0.05 0.00 -0.36 0.00 0.00 55.97 55.45 1m9l s LYS 62 Cb 0.03 -0.11 0.18 0.00 -1.51 0.00 0.00 37.83 36.42 1m9l s LYS 62 CO 0.65 -0.03 0.48 1.51 -0.36 0.00 0.00 175.35 177.60 1m9l n ILE 63 N 3.36 0.76 0.24 5.43 0.00 -1.25 -3.68 119.36 124.22 1m9l n ILE 63 Ca -0.16 -4.44 0.09 0.00 0.00 0.00 0.00 62.75 58.23 1m9l n ILE 63 Cb 0.57 -2.01 0.59 0.00 0.00 0.00 0.00 39.64 38.79 1m9l n ILE 63 CO 0.00 0.00 0.00 -1.28 0.00 0.00 0.00 176.55 175.27 1m9l h SER 64 N 5.26 0.00 -0.06 9.51 0.87 -1.87 -3.32 113.55 123.93 1m9l h SER 64 Ca 0.19 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.57 1m9l h SER 64 Cb 0.79 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.69 1m9l h SER 64 CO 0.62 0.19 -0.26 -1.54 -0.53 0.00 0.00 176.83 175.30 1m9l n SER 65 N -3.87 5.34 -0.26 6.23 3.41 -1.26 -4.56 113.62 118.65 1m9l n SER 65 Ca -0.02 -2.51 0.01 0.00 -0.26 0.00 0.00 58.87 56.09 1m9l n SER 65 Cb 0.28 -1.35 0.14 0.00 -0.26 0.00 0.00 64.21 63.02 1m9l n SER 65 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 1m9l h LEU 66 N 4.53 0.60 -1.15 1.04 8.10 -1.85 -1.29 115.31 125.29 1m9l h LEU 66 Ca 0.17 0.04 0.00 0.00 0.11 0.00 0.00 57.88 58.20 1m9l h LEU 66 Cb 1.37 -0.07 0.00 0.00 -0.44 0.00 0.00 40.66 41.52 1m9l h LEU 66 CO 0.23 0.36 0.00 0.77 -4.11 0.00 0.00 178.44 175.69 1m9l h SER 67 N 0.73 0.00 0.15 0.17 4.64 -1.92 -0.05 113.55 117.27 1m9l h SER 67 Ca 0.36 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.32 1m9l h SER 67 Cb 0.30 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.34 1m9l h SER 67 CO -0.23 0.00 -2.13 0.61 -0.87 0.00 0.00 176.83 174.21 1m9l n GLY 68 N -0.26 -0.69 0.30 -0.77 0.00 -0.71 -3.64 105.19 99.42 1m9l n GLY 68 Ca 0.01 -0.21 0.09 0.00 0.00 0.00 0.00 46.02 45.91 1m9l n GLY 68 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1m9l h MET 69 N 0.02 0.19 -3.94 1.61 2.86 -0.90 -3.10 114.93 111.67 1m9l h MET 69 Ca -0.46 -0.01 -0.56 0.00 -2.06 0.00 0.00 59.70 56.61 1m9l h MET 69 Cb 2.04 -0.04 0.03 0.00 0.06 0.00 0.00 31.60 33.68 1m9l h MET 69 CO 0.03 0.13 2.63 -1.91 1.06 0.00 0.00 176.91 178.85 1m9l n GLU 70 N -4.49 2.04 0.00 1.72 2.13 -0.07 -1.02 120.64 120.95 1m9l n GLU 70 Ca 0.02 -1.83 0.00 0.00 0.66 0.00 0.00 57.16 56.01 1m9l n GLU 70 Cb 0.18 -2.79 0.00 0.00 0.27 0.00 0.00 31.44 29.10 1m9l n GLU 70 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1m9l n ASN 71 N 5.86 0.00 -4.77 4.31 2.85 -1.17 -4.93 115.26 117.41 1m9l n ASN 71 Ca 0.50 0.00 -0.40 0.00 -0.11 0.00 0.00 54.58 54.57 1m9l n ASN 71 Cb 0.29 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.31 1m9l n ASN 71 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 1m9l s LEU 72 N 0.00 4.21 -0.02 1.20 2.96 -0.19 -4.79 118.68 122.06 1m9l s LEU 72 Ca 0.00 2.78 -0.07 0.00 -0.22 0.00 0.00 54.13 56.62 1m9l s LEU 72 Cb 0.00 -3.87 -0.03 0.00 0.50 0.00 0.00 46.19 42.80 1m9l s LEU 72 CO 0.00 -0.93 -0.14 0.54 -1.32 0.00 0.00 176.35 174.50 1m9l n ARG 73 N 0.12 0.21 -3.21 1.98 1.74 -1.24 -3.90 116.66 112.36 1m9l n ARG 73 Ca 0.03 0.09 -0.46 0.00 -0.77 0.00 0.00 57.85 56.74 1m9l n ARG 73 Cb 0.42 -0.87 -0.03 0.00 -1.02 0.00 0.00 32.46 30.96 1m9l n ARG 73 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1m9l s ILE 74 N -2.34 5.18 -0.36 0.55 1.01 0.63 -1.11 121.20 124.75 1m9l s ILE 74 Ca -0.12 -1.71 -0.19 0.00 0.00 0.00 0.00 60.65 58.63 1m9l s ILE 74 Cb 0.02 -4.48 0.00 0.00 0.01 0.00 0.00 42.46 38.01 1m9l s ILE 74 CO 0.17 -1.08 0.57 -0.22 0.00 0.00 0.00 174.94 174.39 1m9l s LEU 75 N 1.53 4.34 -0.70 2.97 0.20 -0.63 -1.18 118.68 125.22 1m9l s LEU 75 Ca 0.14 -0.02 0.05 0.00 0.69 0.00 0.00 54.13 54.99 1m9l s LEU 75 Cb -0.18 -2.67 0.25 0.00 -0.43 0.00 0.00 46.19 43.15 1m9l s LEU 75 CO -0.02 -0.56 0.80 -1.20 -0.29 0.00 0.00 176.35 175.09 1m9l n SER 76 N 5.91 4.00 -2.71 3.68 7.64 0.58 -0.98 113.62 131.74 1m9l n SER 76 Ca -0.03 -3.41 -0.10 0.00 1.01 0.00 0.00 58.87 56.34 1m9l n SER 76 Cb 0.49 -0.76 0.06 0.00 -1.01 0.00 0.00 64.21 62.99 1m9l n SER 76 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1m9l n LEU 77 N 1.07 0.00 0.08 -3.43 7.94 0.05 -1.55 117.00 121.16 1m9l n LEU 77 Ca 0.28 -0.55 0.00 0.00 -1.11 0.00 0.00 56.01 54.63 1m9l n LEU 77 Cb 0.39 -0.32 0.00 0.00 0.53 0.00 0.00 43.42 44.02 1m9l n LEU 77 CO 0.43 -0.79 0.00 0.61 -1.11 0.00 0.00 177.39 176.52 1m9l n GLY 78 N 2.08 -1.08 2.66 -3.96 0.00 -1.26 -4.38 105.19 99.25 1m9l n GLY 78 Ca 0.06 0.19 -0.28 0.00 0.00 0.00 0.00 46.02 45.99 1m9l n GLY 78 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1m9l s ARG 79 N -2.00 0.44 0.36 1.61 3.00 0.01 -0.18 118.95 122.18 1m9l s ARG 79 Ca 0.00 -0.54 -0.17 0.00 -1.00 0.00 0.00 55.73 54.02 1m9l s ARG 79 Cb 0.00 -1.77 0.05 0.00 0.00 0.00 0.00 34.95 33.23 1m9l s ARG 79 CO 0.00 -0.83 0.78 0.54 0.00 0.00 0.00 175.30 175.79 1m9l s ASN 80 N 1.92 -0.05 -0.01 -2.12 6.03 -0.45 -1.38 114.94 118.88 1m9l s ASN 80 Ca 0.05 -1.03 0.05 0.00 -1.03 0.00 0.00 52.86 50.89 1m9l s ASN 80 Cb -0.17 0.82 -0.01 0.00 -3.03 0.00 0.00 41.25 38.86 1m9l s ASN 80 CO -0.20 -1.61 -0.17 -0.76 -2.03 0.00 0.00 177.10 172.33 1m9l s LEU 81 N -3.05 2.03 0.03 3.54 1.02 -0.60 -1.60 118.68 120.05 1m9l s LEU 81 Ca 0.15 -0.30 0.02 0.00 0.02 0.00 0.00 54.13 54.02 1m9l s LEU 81 Cb -0.05 -0.87 -0.02 0.00 0.02 0.00 0.00 46.19 45.27 1m9l s LEU 81 CO 0.10 0.20 -0.08 -0.63 0.02 0.00 0.00 176.35 175.97 1m9l s ILE 82 N -0.38 0.60 0.10 -0.59 1.01 -0.12 -0.67 121.20 121.16 1m9l s ILE 82 Ca 0.06 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 59.91 1m9l s ILE 82 Cb -0.07 -0.60 0.00 0.00 0.01 0.00 0.00 42.46 41.80 1m9l s ILE 82 CO -0.01 -0.16 0.00 0.29 0.00 0.00 0.00 174.94 175.07 1m9l n LYS 83 N 2.00 0.00 0.00 2.79 5.02 -1.25 -4.02 118.16 122.70 1m9l n LYS 83 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 1m9l n LYS 83 Cb 0.56 -0.39 0.00 0.00 -0.02 0.00 0.00 35.03 35.18 1m9l n LYS 83 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1m9l n LYS 84 N -3.30 2.58 -3.40 1.97 4.76 -1.26 -4.42 118.16 115.08 1m9l n LYS 84 Ca 0.00 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.39 1m9l n LYS 84 Cb 0.13 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.25 1m9l n LYS 84 CO 0.00 0.00 0.00 -1.50 -1.37 0.00 0.00 177.40 174.53 1m9l s ILE 85 N 1.02 -0.75 0.00 -0.18 -1.16 -1.26 -4.76 121.20 114.11 1m9l s ILE 85 Ca 0.00 0.01 0.00 0.00 -0.51 0.00 0.00 60.65 60.15 1m9l s ILE 85 Cb 0.00 -0.84 0.00 0.00 0.61 0.00 0.00 42.46 42.23 1m9l s ILE 85 CO 0.00 -0.03 0.00 1.21 -2.81 0.00 0.00 174.94 173.31 1m9l n GLU 86 N 5.40 0.00 0.12 3.50 2.13 -1.26 -4.91 120.64 125.62 1m9l n GLU 86 Ca -0.05 0.00 0.12 0.00 0.66 0.00 0.00 57.16 57.89 1m9l n GLU 86 Cb 0.50 0.00 0.05 0.00 0.27 0.00 0.00 31.44 32.26 1m9l n GLU 86 CO 0.00 0.00 0.00 -2.95 -0.41 0.00 0.00 177.13 173.77 1m9l h ASN 87 N 0.00 0.00 -0.57 4.31 -1.07 -1.93 -3.37 115.58 112.95 1m9l h ASN 87 Ca 0.00 -0.03 -0.01 0.00 0.07 0.00 0.00 56.30 56.33 1m9l h ASN 87 Cb 0.00 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 36.22 1m9l h ASN 87 CO 0.00 0.01 0.32 -0.07 0.07 0.00 0.00 177.43 177.76 1m9l h LEU 88 N 0.00 0.71 -1.24 6.14 3.38 -1.92 -1.32 115.31 121.05 1m9l h LEU 88 Ca 0.00 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1m9l h LEU 88 Cb 0.97 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 1m9l h LEU 88 CO 0.00 0.59 0.32 0.44 0.09 0.00 0.00 178.44 179.88 1m9l h ASP 89 N 0.77 0.75 -0.01 -0.43 5.19 -1.90 -0.11 116.42 120.67 1m9l h ASP 89 Ca 0.20 -0.06 -0.01 0.00 -0.62 0.00 0.00 57.03 56.54 1m9l h ASP 89 Cb 0.04 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 39.36 1m9l h ASP 89 CO -0.03 0.62 -0.03 0.00 -3.12 0.00 0.00 179.24 176.68 1m9l h ALA 90 N 1.50 0.02 -0.79 3.45 0.00 -1.62 -0.47 119.26 121.36 1m9l h ALA 90 Ca 0.21 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1m9l h ALA 90 Cb 0.05 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1m9l h ALA 90 CO -0.03 -0.17 0.44 -0.39 0.00 0.00 0.00 179.25 179.10 1m9l h VAL 91 N -0.50 1.23 -0.70 0.00 -1.51 -1.16 -0.88 116.25 112.72 1m9l h VAL 91 Ca 0.00 -0.55 -0.01 0.00 -1.23 0.00 0.00 66.70 64.91 1m9l h VAL 91 Cb 0.60 0.15 -0.03 0.00 -2.13 0.00 0.00 31.29 29.87 1m9l h VAL 91 CO 0.01 0.25 0.40 0.00 -1.23 0.00 0.00 177.57 176.99 1m9l h ALA 92 N 1.39 1.38 -0.23 5.19 0.00 -0.95 0.39 119.26 126.43 1m9l h ALA 92 Ca 0.28 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1m9l h ALA 92 Cb 0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1m9l h ALA 92 CO -0.05 0.52 0.01 0.22 0.00 0.00 0.00 179.25 179.95 1m9l h ASP 93 N 0.97 0.39 0.00 0.00 3.58 0.26 -3.43 116.42 118.20 1m9l h ASP 93 Ca 0.25 -0.30 0.00 0.00 0.42 0.00 0.00 57.03 57.40 1m9l h ASP 93 Cb 0.00 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 40.95 1m9l h ASP 93 CO -0.04 0.59 -0.13 1.07 -2.88 0.00 0.00 179.24 177.85 1m9l n THR 94 N -4.67 0.00 -2.03 2.25 5.66 -0.66 -5.09 114.28 109.74 1m9l n THR 94 Ca -0.04 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.58 1m9l n THR 94 Cb 0.23 -0.03 0.01 0.00 -1.55 0.00 0.00 70.33 68.99 1m9l n THR 94 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1m9l s LEU 95 N -0.88 3.99 -0.02 1.09 0.20 0.14 -4.90 118.68 118.29 1m9l s LEU 95 Ca 0.00 2.55 -0.01 0.00 0.69 0.00 0.00 54.13 57.36 1m9l s LEU 95 Cb 0.00 -4.19 -0.01 0.00 -0.43 0.00 0.00 46.19 41.56 1m9l s LEU 95 CO 0.00 -1.16 -0.02 1.21 -0.29 0.00 0.00 176.35 176.09 1m9l n GLU 96 N -0.59 0.05 -3.45 1.98 2.13 -1.24 -4.52 120.64 115.00 1m9l n GLU 96 Ca 0.08 0.02 -0.42 0.00 0.66 0.00 0.00 57.16 57.49 1m9l n GLU 96 Cb 0.46 -0.77 -0.03 0.00 0.27 0.00 0.00 31.44 31.37 1m9l n GLU 96 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1m9l s GLU 97 N -2.04 3.67 -0.94 5.31 2.02 -0.27 -1.60 118.70 124.85 1m9l s GLU 97 Ca -0.03 -2.98 -0.20 0.00 0.02 0.00 0.00 54.97 51.77 1m9l s GLU 97 Cb 0.01 -4.30 0.10 0.00 0.10 0.00 0.00 34.13 30.04 1m9l s GLU 97 CO 0.04 -1.25 1.22 -0.51 0.02 0.00 0.00 175.26 174.78 1m9l s LEU 98 N -0.82 4.49 -0.64 1.80 1.43 -0.61 -1.60 118.68 122.72 1m9l s LEU 98 Ca 0.25 -1.77 -0.14 0.00 -1.03 0.00 0.00 54.13 51.45 1m9l s LEU 98 Cb -0.10 -2.46 0.16 0.00 0.03 0.00 0.00 46.19 43.82 1m9l s LEU 98 CO -0.09 -1.24 0.58 0.26 0.23 0.00 0.00 176.35 176.09 1m9l s TRP 99 N 3.55 3.47 -0.36 0.29 0.51 -0.15 -0.78 118.94 125.47 1m9l s TRP 99 Ca 0.36 -1.70 0.14 0.00 -2.12 0.00 0.00 56.10 52.78 1m9l s TRP 99 Cb -0.04 -3.74 0.44 0.00 -0.81 0.00 0.00 33.47 29.33 1m9l s TRP 99 CO -0.08 -1.00 0.99 0.44 -0.51 0.00 0.00 176.95 176.79 1m9l n ILE 100 N 4.63 1.35 0.00 2.03 -5.35 -0.65 -0.77 119.36 120.61 1m9l n ILE 100 Ca -0.02 -3.63 0.00 0.00 -0.27 0.00 0.00 62.75 58.83 1m9l n ILE 100 Cb 0.43 0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 1m9l n ILE 100 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1m9l n SER 101 N -0.17 0.00 -4.21 7.28 7.64 -1.25 -3.62 113.62 119.30 1m9l n SER 101 Ca 0.18 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.70 1m9l n SER 101 Cb 0.77 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.84 1m9l n SER 101 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1m9l s TYR 102 N -3.66 3.30 -0.04 1.43 6.14 0.74 -0.45 117.35 124.81 1m9l s TYR 102 Ca 0.00 -1.76 -0.01 0.00 0.64 0.00 0.00 57.07 55.94 1m9l s TYR 102 Cb 0.00 -2.31 0.03 0.00 0.42 0.00 0.00 41.96 40.10 1m9l s TYR 102 CO 0.00 -0.80 0.08 0.54 0.64 0.00 0.00 175.55 176.01 1m9l s ASN 103 N 1.39 0.13 -0.14 4.32 2.20 -0.48 -1.34 114.94 121.02 1m9l s ASN 103 Ca -0.02 0.15 -0.10 0.00 -0.94 0.00 0.00 52.86 51.95 1m9l s ASN 103 Cb -0.20 0.03 -0.05 0.00 -2.00 0.00 0.00 41.25 39.04 1m9l s ASN 103 CO 0.00 -0.15 0.18 -1.10 -2.94 0.00 0.00 177.10 173.09 1m9l s GLN 104 N 1.27 3.82 0.28 3.55 -0.21 -0.63 -1.43 119.66 126.31 1m9l s GLN 104 Ca -0.07 -0.08 -0.10 0.00 0.02 0.00 0.00 55.36 55.13 1m9l s GLN 104 Cb -0.12 -3.29 0.04 0.00 1.00 0.00 0.00 33.01 30.63 1m9l s GLN 104 CO -0.04 0.55 0.56 1.51 -2.12 0.00 0.00 175.29 175.76 1m9l n ILE 105 N 2.64 0.00 -1.38 1.08 3.06 -0.68 -0.94 119.36 123.14 1m9l n ILE 105 Ca -0.17 -0.72 0.00 0.00 -2.50 0.00 0.00 62.75 59.36 1m9l n ILE 105 Cb 0.53 0.71 0.00 0.00 0.54 0.00 0.00 39.64 41.43 1m9l n ILE 105 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1m9l n ALA 106 N -1.26 0.00 -2.64 1.51 0.00 -1.26 -4.42 120.51 112.44 1m9l n ALA 106 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.89 1m9l n ALA 106 Cb 0.43 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.85 1m9l n ALA 106 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1m9l s SER 107 N 0.00 7.20 0.07 0.00 1.04 -1.26 -4.96 113.70 115.78 1m9l s SER 107 Ca 0.00 1.56 -0.19 0.00 0.48 0.00 0.00 55.95 57.80 1m9l s SER 107 Cb 0.00 -2.55 -0.10 0.00 0.10 0.00 0.00 66.02 63.46 1m9l s SER 107 CO 0.00 -0.50 1.47 -0.07 0.98 0.00 0.00 173.24 175.12 1m9l h LEU 108 N 8.23 0.39 -0.47 2.42 3.38 -1.98 -1.35 115.31 125.93 1m9l h LEU 108 Ca -0.30 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.29 1m9l h LEU 108 Cb 1.14 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1m9l h LEU 108 CO 0.87 0.66 0.21 -1.28 0.09 0.00 0.00 178.44 178.99 1m9l h SER 109 N 0.12 0.63 0.90 -0.43 0.87 -1.99 -1.48 113.55 112.18 1m9l h SER 109 Ca 0.05 -0.15 -0.04 0.00 -1.23 0.00 0.00 61.79 60.42 1m9l h SER 109 Cb 0.48 -0.16 0.01 0.00 -0.44 0.00 0.00 62.40 62.28 1m9l h SER 109 CO 0.02 0.60 -0.46 1.23 -0.53 0.00 0.00 176.83 177.69 1m9l h GLY 110 N 0.61 -1.31 0.62 5.77 0.00 -1.89 -1.81 103.07 105.06 1m9l h GLY 110 Ca 0.16 0.50 0.07 0.00 0.00 0.00 0.00 47.33 48.06 1m9l h GLY 110 CO -0.02 -0.47 0.46 0.16 0.00 0.00 0.00 176.54 176.67 1m9l h ILE 111 N -1.24 0.96 -0.32 2.60 -0.00 -1.28 -0.78 117.51 117.45 1m9l h ILE 111 Ca -0.12 -0.28 0.06 0.00 -0.00 0.00 0.00 64.86 64.52 1m9l h ILE 111 Cb 0.96 0.08 -0.06 0.00 -0.00 0.00 0.00 36.82 37.80 1m9l h ILE 111 CO 0.19 0.15 -0.08 -0.08 -0.00 0.00 0.00 178.15 178.32 1m9l h GLU 112 N 0.81 -0.00 0.45 0.16 4.22 -1.07 -0.04 114.58 119.11 1m9l h GLU 112 Ca 0.36 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.78 1m9l h GLU 112 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1m9l h GLU 112 CO -0.21 -0.00 -0.22 0.87 -2.18 0.00 0.00 179.01 177.27 1m9l h LYS 113 N -0.00 -0.58 -0.14 1.92 1.79 -0.59 -1.00 116.57 117.96 1m9l h LYS 113 Ca 0.15 0.04 0.04 0.00 -2.18 0.00 0.00 60.65 58.70 1m9l h LYS 113 Cb 0.24 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.01 1m9l h LYS 113 CO -0.33 -0.39 0.16 1.37 -1.08 0.00 0.00 179.45 179.18 1m9l h LEU 114 N -0.83 0.00 0.18 2.94 8.10 -1.19 0.18 115.31 124.71 1m9l h LEU 114 Ca -0.06 0.00 -0.25 0.00 0.11 0.00 0.00 57.88 57.67 1m9l h LEU 114 Cb 0.46 0.00 0.03 0.00 -0.44 0.00 0.00 40.66 40.71 1m9l h LEU 114 CO 0.10 0.00 -1.14 0.58 -4.11 0.00 0.00 178.44 173.87 1m9l h VAL 115 N 0.00 1.37 -0.67 0.15 2.07 -1.04 -3.24 116.25 114.89 1m9l h VAL 115 Ca 0.07 -2.58 0.19 0.00 0.82 0.00 0.00 66.70 65.20 1m9l h VAL 115 Cb 0.38 3.09 -0.03 0.00 -1.52 0.00 0.00 31.29 33.21 1m9l h VAL 115 CO -0.00 0.76 0.55 -1.13 0.02 0.00 0.00 177.57 177.77 1m9l h ASN 116 N -0.16 0.00 -1.06 0.57 -1.24 0.42 -3.43 115.58 110.67 1m9l h ASN 116 Ca -0.21 0.00 -0.37 0.00 0.71 0.00 0.00 56.30 56.44 1m9l h ASN 116 Cb 1.86 0.00 0.20 0.00 0.73 0.00 0.00 38.32 41.11 1m9l h ASN 116 CO 0.19 0.00 -2.00 -0.11 -1.29 0.00 0.00 177.43 174.22 1m9l n LEU 117 N -4.05 -2.71 -0.01 0.34 0.00 -0.64 -4.91 117.00 105.03 1m9l n LEU 117 Ca 0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 56.01 56.13 1m9l n LEU 117 Cb 0.80 -0.52 -0.00 0.00 0.00 0.00 0.00 43.42 43.70 1m9l n LEU 117 CO 0.34 -2.41 0.02 -0.09 0.00 0.00 0.00 177.39 175.25 1m9l h ARG 118 N -1.30 -0.02 -4.55 1.96 9.65 -1.79 -3.43 114.38 114.89 1m9l h ARG 118 Ca -0.30 0.00 -0.60 0.00 -1.10 0.00 0.00 59.98 57.98 1m9l h ARG 118 Cb 1.06 0.00 -0.37 0.00 -1.39 0.00 0.00 29.97 29.28 1m9l h ARG 118 CO 0.17 -0.01 -0.82 0.54 2.80 0.00 0.00 179.97 182.64 1m9l s VAL 119 N -1.34 1.51 -0.04 0.20 0.11 -0.62 -1.85 120.40 118.36 1m9l s VAL 119 Ca -0.00 -0.74 0.01 0.00 -2.93 0.00 0.00 61.98 58.32 1m9l s VAL 119 Cb 0.00 -1.51 0.02 0.00 -1.53 0.00 0.00 36.38 33.37 1m9l s VAL 119 CO 0.01 0.32 -0.03 -1.48 -3.33 0.00 0.00 175.10 170.59 1m9l s LEU 120 N 1.49 1.23 -0.13 2.54 2.34 -0.69 -1.57 118.68 123.88 1m9l s LEU 120 Ca 0.02 -0.11 0.02 0.00 0.06 0.00 0.00 54.13 54.13 1m9l s LEU 120 Cb -0.14 -0.41 0.01 0.00 -0.56 0.00 0.00 46.19 45.09 1m9l s LEU 120 CO -0.09 -0.08 -0.21 -0.31 -1.06 0.00 0.00 176.35 174.61 1m9l s TYR 121 N 1.04 2.52 -0.31 3.48 2.02 0.04 -1.47 117.35 124.66 1m9l s TYR 121 Ca -0.09 -1.25 0.02 0.00 -0.37 0.00 0.00 57.07 55.37 1m9l s TYR 121 Cb -0.14 -1.73 0.16 0.00 -0.40 0.00 0.00 41.96 39.85 1m9l s TYR 121 CO -0.01 -0.58 0.39 0.00 -1.57 0.00 0.00 175.55 173.78 1m9l s MET 122 N 0.84 0.45 0.23 -0.62 0.23 0.31 -1.64 119.30 119.10 1m9l s MET 122 Ca -0.07 -0.10 0.25 0.00 -1.03 0.00 0.00 55.69 54.74 1m9l s MET 122 Cb -0.15 -0.43 0.87 0.00 -1.53 0.00 0.00 34.83 33.59 1m9l s MET 122 CO -0.02 -1.07 1.76 -1.13 -2.03 0.00 0.00 175.02 172.53 1m9l n SER 123 N 5.13 0.78 -3.74 -1.18 3.41 -0.83 -0.80 113.62 116.40 1m9l n SER 123 Ca 0.02 0.61 -0.14 0.00 -0.26 0.00 0.00 58.87 59.11 1m9l n SER 123 Cb 0.48 -0.81 -0.14 0.00 -0.26 0.00 0.00 64.21 63.48 1m9l n SER 123 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1m9l s ASN 124 N -4.47 -0.08 0.31 4.04 0.01 0.41 -1.23 114.94 113.94 1m9l s ASN 124 Ca 0.08 0.34 -0.14 0.00 -0.71 0.00 0.00 52.86 52.43 1m9l s ASN 124 Cb 0.11 0.23 0.02 0.00 0.41 0.00 0.00 41.25 42.02 1m9l s ASN 124 CO 0.52 -0.16 0.62 0.54 -1.51 0.00 0.00 177.10 177.12 1m9l s ASN 125 N 1.27 0.07 -0.30 -1.22 2.20 -0.02 -1.39 114.94 115.55 1m9l s ASN 125 Ca -0.08 -1.01 0.01 0.00 -0.94 0.00 0.00 52.86 50.84 1m9l s ASN 125 Cb -0.11 0.71 0.09 0.00 -2.00 0.00 0.00 41.25 39.94 1m9l s ASN 125 CO -0.06 -1.37 0.04 -0.75 -2.94 0.00 0.00 177.10 172.02 1m9l s LYS 126 N -3.35 1.20 -0.15 3.55 2.20 -0.52 -4.02 119.74 118.65 1m9l s LYS 126 Ca 0.19 -1.33 -0.12 0.00 -0.36 0.00 0.00 55.97 54.36 1m9l s LYS 126 Cb -0.03 -2.57 0.05 0.00 -1.51 0.00 0.00 37.83 33.77 1m9l s LYS 126 CO 0.11 -0.87 0.40 0.42 -0.36 0.00 0.00 175.35 175.05 1m9l s ILE 127 N 1.31 -0.01 0.00 5.43 1.01 -1.26 -1.68 121.20 126.00 1m9l s ILE 127 Ca 0.06 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.75 1m9l s ILE 127 Cb -0.18 -0.57 0.00 0.00 0.01 0.00 0.00 42.46 41.72 1m9l s ILE 127 CO -0.14 0.02 0.10 0.35 0.00 0.00 0.00 174.94 175.27 1m9l n THR 128 N 3.45 0.00 -0.83 2.92 -2.24 -1.26 -1.67 114.28 114.65 1m9l n THR 128 Ca -0.18 -0.15 -0.08 0.00 -2.27 0.00 0.00 64.05 61.37 1m9l n THR 128 Cb 0.56 1.46 -0.12 0.00 -2.10 0.00 0.00 70.33 70.14 1m9l n THR 128 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1m9l n ASN 129 N -0.10 5.17 -0.30 3.42 3.02 -1.26 -4.63 115.26 120.58 1m9l n ASN 129 Ca 0.00 -2.44 0.12 0.00 -0.03 0.00 0.00 54.58 52.24 1m9l n ASN 129 Cb 0.12 -1.30 0.27 0.00 -0.61 0.00 0.00 39.78 38.26 1m9l n ASN 129 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1m9l h TRP 130 N 2.44 0.26 -0.99 3.10 7.01 -1.94 0.12 115.95 125.95 1m9l h TRP 130 Ca 0.13 0.05 0.17 0.00 2.11 0.00 0.00 58.89 61.35 1m9l h TRP 130 Cb 1.33 0.03 -0.17 0.00 -2.10 0.00 0.00 29.16 28.25 1m9l h TRP 130 CO 1.30 -0.24 -0.34 0.41 -2.79 0.00 0.00 178.44 176.78 1m9l n GLY 131 N -1.39 -1.92 0.02 2.65 0.00 -1.26 -1.24 105.19 102.04 1m9l n GLY 131 Ca 0.21 1.09 -0.02 0.00 0.00 0.00 0.00 46.02 47.30 1m9l n GLY 131 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1m9l n GLU 132 N -5.50 0.14 -0.25 1.61 4.71 -0.77 -4.67 120.64 115.91 1m9l n GLU 132 Ca 0.12 0.18 0.11 0.00 -0.01 0.00 0.00 57.16 57.55 1m9l n GLU 132 Cb 0.43 -0.88 0.21 0.00 -1.01 0.00 0.00 31.44 30.19 1m9l n GLU 132 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 1m9l n ILE 133 N -3.02 -0.30 -0.34 -3.67 5.41 0.34 -1.28 119.36 116.50 1m9l n ILE 133 Ca -0.03 1.57 0.01 0.00 1.00 0.00 0.00 62.75 65.29 1m9l n ILE 133 Cb 0.12 -2.29 0.07 0.00 -0.71 0.00 0.00 39.64 36.82 1m9l n ILE 133 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1m9l h ASP 134 N 0.00 -1.20 0.00 4.38 3.58 -1.35 -1.22 116.42 120.61 1m9l h ASP 134 Ca 0.43 0.29 -0.31 0.00 0.42 0.00 0.00 57.03 57.86 1m9l h ASP 134 Cb 0.90 0.67 -0.05 0.00 1.72 0.00 0.00 39.33 42.57 1m9l h ASP 134 CO -0.67 -0.30 -1.93 0.29 -2.88 0.00 0.00 179.24 173.76 1m9l n LYS 135 N -5.51 0.57 -0.46 0.28 4.76 -0.94 -4.58 118.16 112.27 1m9l n LYS 135 Ca 0.11 0.32 0.41 0.00 -2.87 0.00 0.00 58.31 56.28 1m9l n LYS 135 Cb 0.42 -1.53 0.67 0.00 -1.84 0.00 0.00 35.03 32.75 1m9l n LYS 135 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1m9l h LEU 136 N -1.00 0.00 -1.97 -0.35 5.85 -1.10 -1.67 115.31 115.07 1m9l h LEU 136 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1m9l h LEU 136 Cb 1.38 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.41 1m9l h LEU 136 CO -0.29 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 177.81 1m9l n ALA 137 N -2.64 2.48 -3.48 1.25 0.00 -0.47 -4.75 120.51 112.91 1m9l n ALA 137 Ca 0.34 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.52 1m9l n ALA 137 Cb 1.72 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 20.21 1m9l n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m9l n ALA 138 N 0.50 -1.16 1.86 0.00 0.00 -0.71 -4.14 120.51 116.86 1m9l n ALA 138 Ca 0.00 0.25 0.12 0.00 0.00 0.00 0.00 53.44 53.82 1m9l n ALA 138 Cb 0.48 -4.26 0.66 0.00 0.00 0.00 0.00 19.45 16.33 1m9l n ALA 138 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1m9l n LEU 139 N -4.40 0.35 -1.36 0.00 7.94 -0.73 -1.69 117.00 117.11 1m9l n LEU 139 Ca -0.02 -0.13 0.12 0.00 -1.11 0.00 0.00 56.01 54.86 1m9l n LEU 139 Cb 0.56 -0.01 0.32 0.00 0.53 0.00 0.00 43.42 44.83 1m9l n LEU 139 CO 0.60 0.07 0.78 0.47 -1.11 0.00 0.00 177.39 178.20 1m9l n ASP 140 N -0.63 3.97 0.00 1.96 8.00 -1.26 -4.68 116.55 123.91 1m9l n ASP 140 Ca 0.18 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.68 1m9l n ASP 140 Cb 0.14 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 1m9l n ASP 140 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1m9l n LYS 141 N 1.66 0.00 -0.08 -1.24 2.85 -1.15 -4.88 118.16 115.31 1m9l n LYS 141 Ca 0.25 0.00 -0.03 0.00 -1.05 0.00 0.00 58.31 57.48 1m9l n LYS 141 Cb 0.62 -0.18 -0.00 0.00 -0.65 0.00 0.00 35.03 34.82 1m9l n LYS 141 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 1m9l n LEU 142 N -1.74 -0.08 0.00 -5.58 0.00 -0.68 -1.52 117.00 107.40 1m9l n LEU 142 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 56.01 56.08 1m9l n LEU 142 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 43.42 43.36 1m9l n LEU 142 CO 0.00 -0.18 0.00 -0.62 0.00 0.00 0.00 177.39 176.59 1m9l n GLU 143 N 0.06 0.00 -3.98 1.96 4.71 -1.26 -3.08 120.64 119.05 1m9l n GLU 143 Ca 0.01 0.17 -0.34 0.00 -0.01 0.00 0.00 57.16 56.98 1m9l n GLU 143 Cb 0.02 -0.65 -0.15 0.00 -1.01 0.00 0.00 31.44 29.64 1m9l n GLU 143 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1m9l s ASP 144 N -3.58 3.97 -0.11 1.62 1.01 -0.77 -1.61 116.67 117.20 1m9l s ASP 144 Ca 0.00 -0.56 -0.16 0.00 0.71 0.00 0.00 52.55 52.54 1m9l s ASP 144 Cb 0.00 -1.65 0.04 0.00 1.01 0.00 0.00 42.92 42.32 1m9l s ASP 144 CO 0.00 -0.04 0.40 -1.48 0.21 0.00 0.00 175.17 174.26 1m9l s LEU 145 N 1.39 0.48 -0.17 1.23 2.34 -0.50 -1.70 118.68 121.75 1m9l s LEU 145 Ca 0.04 0.60 -0.04 0.00 0.06 0.00 0.00 54.13 54.79 1m9l s LEU 145 Cb -0.14 1.44 0.06 0.00 -0.56 0.00 0.00 46.19 46.99 1m9l s LEU 145 CO -0.06 -0.27 0.07 -0.22 -1.06 0.00 0.00 176.35 174.81 1m9l s LEU 146 N -0.34 0.56 -0.40 1.48 2.96 -0.54 -0.69 118.68 121.71 1m9l s LEU 146 Ca -0.05 -0.63 0.07 0.00 -0.22 0.00 0.00 54.13 53.30 1m9l s LEU 146 Cb -0.03 -0.34 0.22 0.00 0.50 0.00 0.00 46.19 46.54 1m9l s LEU 146 CO 0.02 -0.33 0.47 0.00 -1.32 0.00 0.00 176.35 175.19 1m9l n LEU 147 N 5.22 0.05 -4.95 -0.68 -0.00 -1.25 -0.53 117.00 114.85 1m9l n LEU 147 Ca -0.07 -4.61 -0.23 0.00 -0.00 0.00 0.00 56.01 51.10 1m9l n LEU 147 Cb 0.49 0.57 0.02 0.00 -0.00 0.00 0.00 43.42 44.50 1m9l n LEU 147 CO 0.11 2.00 0.16 0.00 -0.00 0.00 0.00 177.39 179.66 1m9l s ALA 148 N -0.81 4.50 -0.90 1.47 0.00 0.02 -4.72 121.76 121.32 1m9l s ALA 148 Ca 0.34 -1.69 -0.01 0.00 0.00 0.00 0.00 51.96 50.60 1m9l s ALA 148 Cb 0.13 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 22.17 1m9l s ALA 148 CO -0.14 -0.57 0.76 0.41 0.00 0.00 0.00 175.76 176.21 1m9l n GLY 149 N -1.93 -0.15 3.52 0.00 0.00 -0.36 -1.91 105.19 104.36 1m9l n GLY 149 Ca 0.06 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 1m9l n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1m9l s ASN 150 N -3.91 -0.64 0.13 1.61 2.20 -1.26 -0.84 114.94 112.23 1m9l s ASN 150 Ca 0.05 0.99 -0.25 0.00 -0.94 0.00 0.00 52.86 52.71 1m9l s ASN 150 Cb -0.02 0.95 -0.06 0.00 -2.00 0.00 0.00 41.25 40.12 1m9l s ASN 150 CO 0.54 -0.40 1.30 -2.65 -2.94 0.00 0.00 177.10 172.95 1m9l n PRO 151 N 1.89 -0.36 -0.02 3.55 -0.02 -1.25 -1.21 135.00 137.58 1m9l n PRO 151 Ca -0.16 1.28 -0.00 0.00 -2.02 0.00 0.00 63.50 62.59 1m9l n PRO 151 Cb 0.56 -1.88 -0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1m9l n PRO 151 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1m9l n LEU 152 N -4.98 -0.05 0.03 2.45 -0.00 -0.67 0.31 117.00 114.09 1m9l n LEU 152 Ca 0.02 0.87 -0.10 0.00 -0.00 0.00 0.00 56.01 56.79 1m9l n LEU 152 Cb 0.21 -0.40 -0.04 0.00 -0.00 0.00 0.00 43.42 43.19 1m9l n LEU 152 CO -0.13 -0.46 0.78 0.22 -0.00 0.00 0.00 177.39 177.80 1m9l h TYR 153 N 0.00 -0.31 0.00 1.96 3.20 -1.70 -1.13 116.97 118.99 1m9l h TYR 153 Ca 0.01 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 1m9l h TYR 153 Cb 0.02 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.44 1m9l h TYR 153 CO -0.79 -0.18 -0.01 -0.91 -1.64 0.00 0.00 178.16 174.63 1m9l h ASN 154 N -0.18 0.00 0.20 -2.11 4.21 -0.72 -1.56 115.58 115.42 1m9l h ASN 154 Ca 0.06 0.00 -0.30 0.00 1.21 0.00 0.00 56.30 57.28 1m9l h ASN 154 Cb 0.27 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 37.49 1m9l h ASN 154 CO -0.16 0.01 -1.37 0.44 -1.29 0.00 0.00 177.43 175.06 1m9l h ASP 155 N 0.00 0.65 0.60 5.81 3.32 0.10 -3.30 116.42 123.60 1m9l h ASP 155 Ca -0.00 -0.92 -0.02 0.00 0.02 0.00 0.00 57.03 56.10 1m9l h ASP 155 Cb 0.11 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1m9l h ASP 155 CO 0.00 1.64 -0.42 0.22 -1.72 0.00 0.00 179.24 178.97 1m9l h TYR 156 N -0.05 -1.11 0.00 4.55 3.20 -0.59 -3.47 116.97 119.50 1m9l h TYR 156 Ca -0.25 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.61 1m9l h TYR 156 Cb 1.98 0.41 0.00 0.00 1.54 0.00 0.00 36.73 40.65 1m9l h TYR 156 CO 0.14 -0.61 0.00 1.63 -1.64 0.00 0.00 178.16 177.68 1m9l n LYS 157 N -5.54 0.00 0.17 1.82 4.76 -0.66 -4.68 118.16 114.03 1m9l n LYS 157 Ca -0.13 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.32 1m9l n LYS 157 Cb 0.43 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.63 1m9l n LYS 157 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1m9l n GLU 158 N 0.00 0.02 -0.79 1.97 0.28 -1.22 -1.47 120.64 119.43 1m9l n GLU 158 Ca 0.00 0.54 -0.01 0.00 -0.16 0.00 0.00 57.16 57.53 1m9l n GLU 158 Cb 0.00 -1.45 -0.01 0.00 1.43 0.00 0.00 31.44 31.41 1m9l n GLU 158 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1m9l n ASN 159 N -1.66 -0.06 0.00 -1.84 5.15 -1.26 -4.81 115.26 110.77 1m9l n ASN 159 Ca 0.00 -1.66 0.00 0.00 -0.60 0.00 0.00 54.58 52.33 1m9l n ASN 159 Cb 0.58 -0.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.80 1m9l n ASN 159 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1m9l n ASN 160 N 0.09 0.00 -0.04 1.20 2.85 -0.60 -4.80 115.26 113.96 1m9l n ASN 160 Ca -0.06 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.45 1m9l n ASN 160 Cb 0.71 0.00 -0.16 0.00 1.24 0.00 0.00 39.78 41.57 1m9l n ASN 160 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1m9l n ALA 161 N -1.10 2.34 -0.05 5.20 0.00 -0.54 -3.76 120.51 122.60 1m9l n ALA 161 Ca 0.00 -0.78 -0.14 0.00 0.00 0.00 0.00 53.44 52.52 1m9l n ALA 161 Cb 0.00 -0.53 -0.07 0.00 0.00 0.00 0.00 19.45 18.85 1m9l n ALA 161 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1m9l h THR 162 N 0.00 1.36 -0.66 0.00 2.02 -1.83 0.72 112.91 114.51 1m9l h THR 162 Ca -0.19 -1.58 -0.05 0.00 0.77 0.00 0.00 66.41 65.36 1m9l h THR 162 Cb 1.40 1.98 -0.03 0.00 -1.74 0.00 0.00 68.15 69.77 1m9l h THR 162 CO 0.01 0.47 0.20 0.77 0.37 0.00 0.00 175.52 177.34 1m9l h SER 163 N 0.11 0.95 -0.53 4.18 4.64 -1.82 -1.48 113.55 119.60 1m9l h SER 163 Ca 0.00 -0.17 -0.06 0.00 -0.47 0.00 0.00 61.79 61.09 1m9l h SER 163 Cb 0.92 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.73 1m9l h SER 163 CO 0.07 0.89 0.11 -0.08 -0.87 0.00 0.00 176.83 176.95 1m9l h GLU 164 N 0.98 0.91 0.50 4.77 4.22 -1.63 -1.01 114.58 123.33 1m9l h GLU 164 Ca 0.22 -0.21 -0.02 0.00 0.08 0.00 0.00 59.36 59.42 1m9l h GLU 164 Cb 0.29 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1m9l h GLU 164 CO -0.01 0.84 -0.24 1.88 -2.18 0.00 0.00 179.01 179.30 1m9l h TYR 165 N 0.87 -0.63 -0.92 0.92 0.05 -0.03 -0.93 116.97 116.31 1m9l h TYR 165 Ca 0.18 -0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.96 1m9l h TYR 165 Cb 0.36 0.21 -0.05 0.00 1.01 0.00 0.00 36.73 38.26 1m9l h TYR 165 CO 0.02 -0.38 0.61 -0.09 -1.05 0.00 0.00 178.16 177.27 1m9l h ARG 166 N -0.71 1.21 -0.30 4.88 1.12 -1.10 0.54 114.38 120.01 1m9l h ARG 166 Ca -0.07 -0.08 0.03 0.00 -1.11 0.00 0.00 59.98 58.75 1m9l h ARG 166 Cb 0.54 -0.27 -0.03 0.00 -0.01 0.00 0.00 29.97 30.19 1m9l h ARG 166 CO 0.11 0.81 0.13 0.82 -3.11 0.00 0.00 179.97 178.73 1m9l h ILE 167 N 1.25 0.96 0.00 1.20 2.04 -1.08 -0.51 117.51 121.37 1m9l h ILE 167 Ca 0.34 -0.10 -0.04 0.00 1.00 0.00 0.00 64.86 66.06 1m9l h ILE 167 Cb -0.14 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1m9l h ILE 167 CO -0.07 0.05 -0.21 -0.08 0.00 0.00 0.00 178.15 177.84 1m9l h GLU 168 N 0.28 0.00 0.00 2.37 4.81 -0.27 0.15 114.58 121.92 1m9l h GLU 168 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1m9l h GLU 168 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1m9l h GLU 168 CO -0.11 0.21 0.00 0.28 -0.73 0.00 0.00 179.01 178.66 1m9l n VAL 169 N -3.92 0.00 0.13 0.32 0.31 0.10 -0.63 118.33 114.63 1m9l n VAL 169 Ca -0.02 0.76 0.19 0.00 -0.01 0.00 0.00 64.34 65.26 1m9l n VAL 169 Cb 0.30 -1.49 0.72 0.00 -0.91 0.00 0.00 33.84 32.46 1m9l n VAL 169 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 1m9l h VAL 170 N 0.00 0.25 0.00 2.52 3.04 -1.18 0.37 116.25 121.25 1m9l h VAL 170 Ca 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 66.70 65.62 1m9l h VAL 170 Cb 0.00 0.59 -0.01 0.00 -2.01 0.00 0.00 31.29 29.86 1m9l h VAL 170 CO 0.00 0.00 -0.65 0.50 -1.01 0.00 0.00 177.57 176.41 1m9l h LYS 171 N 0.00 0.00 0.00 4.17 3.64 -1.06 -3.46 116.57 119.86 1m9l h LYS 171 Ca 0.16 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.23 1m9l h LYS 171 Cb 1.14 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.90 1m9l h LYS 171 CO -0.00 0.38 -2.17 -2.13 -2.27 0.00 0.00 179.45 173.25 1m9l n ARG 172 N -4.58 0.51 -3.89 1.90 0.63 0.20 -4.99 116.66 106.44 1m9l n ARG 172 Ca -0.14 0.12 -0.36 0.00 -0.92 0.00 0.00 57.85 56.55 1m9l n ARG 172 Cb 0.38 -1.40 -0.07 0.00 0.45 0.00 0.00 32.46 31.81 1m9l n ARG 172 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1m9l s LEU 173 N -6.25 4.22 0.07 6.15 1.43 0.07 -5.00 118.68 119.37 1m9l s LEU 173 Ca -0.28 0.34 0.24 0.00 -1.03 0.00 0.00 54.13 53.40 1m9l s LEU 173 Cb 0.07 -2.04 0.28 0.00 0.03 0.00 0.00 46.19 44.53 1m9l s LEU 173 CO 0.47 0.32 1.25 -0.81 0.23 0.00 0.00 176.35 177.81 1m9l n PRO 174 N 2.57 0.23 0.00 1.29 -0.04 -1.26 -4.52 135.00 133.28 1m9l n PRO 174 Ca -0.18 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 1m9l n PRO 174 Cb 0.54 -1.62 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 1m9l n PRO 174 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1m9l n ASN 175 N -1.95 0.00 0.00 3.54 4.13 -1.26 -4.92 115.26 114.80 1m9l n ASN 175 Ca 0.03 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.29 1m9l n ASN 175 Cb 0.42 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.66 1m9l n ASN 175 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1m9l n LEU 176 N 0.00 0.00 -0.13 3.41 4.32 -0.57 -4.94 117.00 119.09 1m9l n LEU 176 Ca 0.00 0.00 -0.26 0.00 -0.02 0.00 0.00 56.01 55.73 1m9l n LEU 176 Cb 0.00 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 41.71 1m9l n LEU 176 CO 0.00 0.00 -1.34 0.29 -1.22 0.00 0.00 177.39 175.12 1m9l n LYS 177 N 0.00 0.54 -3.56 3.23 5.02 -0.89 -4.77 118.16 117.73 1m9l n LYS 177 Ca 0.00 0.24 -0.33 0.00 -2.02 0.00 0.00 58.31 56.20 1m9l n LYS 177 Cb 0.00 -1.41 -0.07 0.00 -0.02 0.00 0.00 35.03 33.53 1m9l n LYS 177 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1m9l n LYS 178 N -4.17 2.67 -2.44 1.97 4.76 -0.64 -5.00 118.16 115.32 1m9l n LYS 178 Ca -0.48 -4.55 -0.41 0.00 -2.87 0.00 0.00 58.31 49.99 1m9l n LYS 178 Cb 0.83 -2.36 -0.01 0.00 -1.84 0.00 0.00 35.03 31.66 1m9l n LYS 178 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1m9l n LEU 179 N 1.70 4.93 0.00 -0.35 7.94 -1.26 -1.41 117.00 128.54 1m9l n LEU 179 Ca 0.24 -3.86 0.00 0.00 -1.11 0.00 0.00 56.01 51.28 1m9l n LEU 179 Cb 0.37 -1.73 0.00 0.00 0.53 0.00 0.00 43.42 42.59 1m9l n LEU 179 CO 0.40 0.04 0.00 -0.67 -1.11 0.00 0.00 177.39 176.05 1m9l n ASP 180 N 8.75 0.00 0.00 1.96 2.03 0.14 -4.63 116.55 124.80 1m9l n ASP 180 Ca 0.49 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.80 1m9l n ASP 180 Cb 0.45 -0.37 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 1m9l n ASP 180 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1m9l n GLY 181 N -2.00 -0.19 0.08 0.27 0.00 -1.26 -4.42 105.19 97.68 1m9l n GLY 181 Ca 0.00 0.21 0.02 0.00 0.00 0.00 0.00 46.02 46.25 1m9l n GLY 181 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1m9l n MET 182 N 0.00 -0.02 -0.04 1.61 2.81 -1.26 -1.69 117.12 118.53 1m9l n MET 182 Ca 0.00 0.36 0.19 0.00 -1.81 0.00 0.00 57.70 56.45 1m9l n MET 182 Cb 0.00 -0.56 0.32 0.00 -0.71 0.00 0.00 33.22 32.28 1m9l n MET 182 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1m9l h PRO 183 N 0.00 0.00 0.00 0.03 0.13 -1.87 -3.16 132.00 127.14 1m9l h PRO 183 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1m9l h PRO 183 Cb 0.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.36 1m9l h PRO 183 CO -0.23 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 178.87 1m9l n VAL 184 N -3.03 0.00 -1.04 1.56 0.24 -0.68 -4.52 118.33 110.85 1m9l n VAL 184 Ca 0.16 1.35 -0.04 0.00 -2.04 0.00 0.00 64.34 63.76 1m9l n VAL 184 Cb 1.33 -1.97 -0.02 0.00 -1.47 0.00 0.00 33.84 31.72 1m9l n VAL 184 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1m9l n ASP 185 N -2.18 -1.16 0.00 -1.34 8.00 -1.20 -0.89 116.55 117.79 1m9l n ASP 185 Ca 0.00 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.60 1m9l n ASP 185 Cb 0.00 -1.38 0.00 0.00 -0.02 0.00 0.00 41.12 39.72 1m9l n ASP 185 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1m9l n VAL 186 N -1.20 0.00 0.05 2.53 3.14 -1.26 -4.90 118.33 116.69 1m9l n VAL 186 Ca -0.04 0.00 -0.06 0.00 -2.96 0.00 0.00 64.34 61.28 1m9l n VAL 186 Cb 0.14 0.00 -0.11 0.00 -1.06 0.00 0.00 33.84 32.81 1m9l n VAL 186 CO 0.00 0.00 0.00 -0.78 -6.46 0.00 0.00 176.83 169.59 1m9l h ASP 187 N 0.00 0.00 0.21 6.55 3.58 -1.30 -3.22 116.42 122.24 1m9l h ASP 187 Ca 0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 1m9l h ASP 187 Cb 0.00 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 1m9l h ASP 187 CO 0.00 0.91 -0.02 -0.33 -2.88 0.00 0.00 179.24 176.93 1m9l h GLU 188 N 0.00 0.00 -0.03 0.28 4.39 -1.71 0.32 114.58 117.82 1m9l h GLU 188 Ca -0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1m9l h GLU 188 Cb 1.77 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.42 1m9l h GLU 188 CO 0.10 0.02 0.00 -2.13 -1.16 0.00 0.00 179.01 175.84 1m9l n ARG 189 N -3.28 1.85 0.01 2.33 3.00 -1.22 -3.00 116.66 116.35 1m9l n ARG 189 Ca -0.02 -1.23 -0.00 0.00 -0.00 0.00 0.00 57.85 56.59 1m9l n ARG 189 Cb 0.13 -1.47 -0.00 0.00 0.00 0.00 0.00 32.46 31.12 1m9l n ARG 189 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1m9l n GLU 190 N 0.50 0.02 0.02 -0.14 2.13 0.22 -4.40 120.64 118.98 1m9l n GLU 190 Ca 0.18 0.01 -0.13 0.00 0.66 0.00 0.00 57.16 57.88 1m9l n GLU 190 Cb 0.42 -0.21 -0.09 0.00 0.27 0.00 0.00 31.44 31.83 1m9l n GLU 190 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 1m9l h GLN 191 N -0.03 -0.08 0.00 5.31 4.15 -0.73 -0.37 115.11 123.35 1m9l h GLN 191 Ca 0.00 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 1m9l h GLN 191 Cb 0.03 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.74 1m9l h GLN 191 CO 0.00 0.37 -0.00 0.00 -1.93 0.00 0.00 178.83 177.26 1m9l h ALA 192 N 0.33 1.01 0.18 3.38 0.00 -1.57 0.08 119.26 122.67 1m9l h ALA 192 Ca -0.01 -0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.56 1m9l h ALA 192 Cb 0.48 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1m9l h ALA 192 CO 0.01 0.01 -1.66 -0.97 0.00 0.00 0.00 179.25 176.64 1m9l h ASN 193 N 0.00 0.61 -0.35 0.00 -1.24 -1.43 -0.50 115.58 112.67 1m9l h ASN 193 Ca -0.00 -0.84 -0.15 0.00 0.71 0.00 0.00 56.30 56.02 1m9l h ASN 193 Cb 0.25 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 39.10 1m9l h ASN 193 CO 0.00 1.70 -0.36 0.58 -1.29 0.00 0.00 177.43 178.06 1m9l h VAL 194 N 0.11 1.28 -0.20 2.57 2.07 -0.65 -0.83 116.25 120.60 1m9l h VAL 194 Ca -0.31 -1.53 -0.20 0.00 0.82 0.00 0.00 66.70 65.48 1m9l h VAL 194 Cb 2.09 1.46 0.01 0.00 -1.52 0.00 0.00 31.29 33.33 1m9l h VAL 194 CO 0.19 0.51 -0.67 0.00 0.02 0.00 0.00 177.57 177.62 1m9l h ALA 195 N 0.75 0.35 -0.04 1.67 0.00 -1.09 -2.74 119.26 118.15 1m9l h ALA 195 Ca 0.05 -0.56 0.03 0.00 0.00 0.00 0.00 54.91 54.43 1m9l h ALA 195 Cb 0.95 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1m9l h ALA 195 CO 0.09 0.65 -0.14 -0.09 0.00 0.00 0.00 179.25 179.76 1m9l h ARG 196 N 0.55 -0.21 0.00 0.00 9.65 -1.06 -3.45 114.38 119.86 1m9l h ARG 196 Ca -0.03 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1m9l h ARG 196 Cb 1.29 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.92 1m9l h ARG 196 CO 0.14 -0.14 0.00 0.41 2.80 0.00 0.00 179.97 183.18 1m9l n GLY 197 N -1.28 -1.58 0.00 2.80 0.00 -0.54 -5.07 105.19 99.52 1m9l n GLY 197 Ca -0.04 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.56 1m9l n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93