#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 1.38 -3.01 3.04 0.00 -1.26 -4.28 120.51 116.38 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 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.60 2.87 -3.34 0.00 5.02 -1.26 -4.11 118.16 116.75 1m9l n LYS 3 Ca 0.00 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.14 1m9l n LYS 3 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.94 1m9l n LYS 3 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1m9l s ALA 4 N -2.00 -0.63 0.00 7.82 0.00 -1.26 -4.95 121.76 120.74 1m9l s ALA 4 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.07 1m9l s ALA 4 Cb 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 23.12 20.98 1m9l s ALA 4 CO 0.00 -2.16 0.00 0.25 0.00 0.00 0.00 175.76 173.85 1m9l n THR 5 N 4.19 0.00 -2.98 0.00 -2.24 -1.26 -4.37 114.28 107.62 1m9l n THR 5 Ca 0.12 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.64 1m9l n THR 5 Cb 0.47 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.69 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 2.49 4.90 0.09 4.28 2.01 -1.26 -3.37 115.64 124.78 1m9l s THR 6 Ca 0.00 -0.15 -0.34 0.00 0.31 0.00 0.00 61.69 61.51 1m9l s THR 6 Cb 0.00 -3.83 -0.16 0.00 0.01 0.00 0.00 72.50 68.53 1m9l s THR 6 CO 0.00 -0.68 1.59 -0.29 -0.69 0.00 0.00 174.62 174.56 1m9l h ILE 7 N 0.46 0.17 0.11 1.82 -0.00 -1.91 0.20 117.51 118.36 1m9l h ILE 7 Ca -0.48 0.00 0.02 0.00 -0.00 0.00 0.00 64.86 64.40 1m9l h ILE 7 Cb 1.22 0.17 -0.04 0.00 -0.00 0.00 0.00 36.82 38.16 1m9l h ILE 7 CO 0.61 0.00 -0.38 0.11 -0.00 0.00 0.00 178.15 178.50 1m9l h LYS 8 N -0.91 -0.58 0.51 2.19 1.57 -1.96 0.18 116.57 117.57 1m9l h LYS 8 Ca -0.05 0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1m9l h LYS 8 Cb 0.78 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 1m9l h LYS 8 CO -0.01 -0.39 -0.41 -0.44 -0.57 0.00 0.00 179.45 177.64 1m9l h ASP 9 N -0.60 -1.08 -0.61 0.86 5.19 -1.96 -1.68 116.42 116.54 1m9l h ASP 9 Ca 0.03 0.08 0.12 0.00 -0.62 0.00 0.00 57.03 56.63 1m9l h ASP 9 Cb 0.64 0.34 -0.12 0.00 0.18 0.00 0.00 39.33 40.37 1m9l h ASP 9 CO -0.23 -0.57 -0.23 0.00 -3.12 0.00 0.00 179.24 175.09 1m9l h ALA 10 N -1.18 0.23 -0.66 3.45 0.00 -0.49 0.28 119.26 120.89 1m9l h ALA 10 Ca -0.07 0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1m9l h ALA 10 Cb 0.74 0.61 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 1m9l h ALA 10 CO 0.01 -0.53 0.22 0.82 0.00 0.00 0.00 179.25 179.77 1m9l h ILE 11 N -0.08 1.25 -0.23 0.00 2.04 -0.87 0.25 117.51 119.87 1m9l h ILE 11 Ca 0.28 -0.83 -0.08 0.00 1.00 0.00 0.00 64.86 65.23 1m9l h ILE 11 Cb 0.51 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1m9l h ILE 11 CO -0.67 0.32 -0.19 -0.09 0.00 0.00 0.00 178.15 177.53 1m9l h ARG 12 N 0.95 0.41 0.00 2.37 2.43 -0.33 -0.98 114.38 119.23 1m9l h ARG 12 Ca 0.21 -0.13 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1m9l h ARG 12 Cb 0.27 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1m9l h ARG 12 CO -0.01 0.59 -0.21 0.82 -1.51 0.00 0.00 179.97 179.64 1m9l h ILE 13 N 0.37 0.53 0.03 1.20 2.04 0.39 0.63 117.51 122.71 1m9l h ILE 13 Ca 0.06 -1.07 -0.23 0.00 1.00 0.00 0.00 64.86 64.63 1m9l h ILE 13 Cb 0.55 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 1m9l h ILE 13 CO 0.04 0.21 -1.09 -0.26 0.00 0.00 0.00 178.15 177.04 1m9l h PHE 14 N 0.00 0.10 0.00 1.37 0.04 0.37 0.17 116.94 119.00 1m9l h PHE 14 Ca -0.00 -0.07 -0.07 0.00 2.80 0.00 0.00 57.97 60.63 1m9l h PHE 14 Cb 0.72 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.86 1m9l h PHE 14 CO 0.00 1.06 -0.32 1.49 -0.60 0.00 0.00 178.31 179.94 1m9l h GLU 15 N 0.01 0.00 0.00 1.51 4.57 -0.49 0.37 114.58 120.55 1m9l h GLU 15 Ca -0.05 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1m9l h GLU 15 Cb 1.82 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.41 1m9l h GLU 15 CO 0.14 0.32 -0.73 0.39 -1.18 0.00 0.00 179.01 177.95 1m9l n GLU 16 N -3.51 0.48 0.05 1.92 1.02 0.15 -3.78 120.64 116.97 1m9l n GLU 16 Ca -0.00 0.37 -0.03 0.00 -0.02 0.00 0.00 57.16 57.47 1m9l n GLU 16 Cb 0.47 -1.54 -0.02 0.00 -0.02 0.00 0.00 31.44 30.34 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 -0.97 -0.22 -0.59 3.49 2.43 -0.82 -3.28 114.38 114.42 1m9l h ARG 17 Ca 0.00 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1m9l h ARG 17 Cb 0.73 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 1m9l h ARG 17 CO 0.00 -0.15 0.39 -0.22 -1.51 0.00 0.00 179.97 178.49 1m9l h LYS 18 N -0.93 0.70 -4.09 0.20 3.11 -1.54 -3.47 116.57 110.54 1m9l h LYS 18 Ca -0.02 -0.04 -0.13 0.00 -2.81 0.00 0.00 60.65 57.65 1m9l h LYS 18 Cb 0.17 -0.16 0.09 0.00 -1.00 0.00 0.00 32.23 31.34 1m9l h LYS 18 CO 0.04 0.46 -0.41 -1.13 -2.81 0.00 0.00 179.45 175.60 1m9l n SER 19 N -4.46 -3.76 -0.91 4.20 3.41 0.12 -4.98 113.62 107.24 1m9l n SER 19 Ca 0.07 -0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.34 1m9l n SER 19 Cb 0.11 -2.78 0.00 0.00 -0.26 0.00 0.00 64.21 61.29 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 -2.38 0.00 -3.75 -3.33 0.24 -0.73 -4.97 118.33 103.41 1m9l n VAL 20 Ca -0.06 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.87 1m9l n VAL 20 Cb 0.56 0.00 -0.12 0.00 -1.47 0.00 0.00 33.84 32.81 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 -2.34 3.73 -0.11 3.34 1.01 -1.26 -4.14 120.40 120.63 1m9l s VAL 21 Ca 0.00 -1.27 -0.13 0.00 0.00 0.00 0.00 61.98 60.58 1m9l s VAL 21 Cb 0.00 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 1m9l s VAL 21 CO 0.00 -0.26 -0.24 0.00 0.00 0.00 0.00 175.10 174.59 1m9l n ALA 22 N 4.79 1.11 0.00 5.51 0.00 -1.26 -3.87 120.51 126.79 1m9l n ALA 22 Ca -0.11 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.72 1m9l n ALA 22 Cb 0.44 0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 -4.01 0.00 0.00 0.00 -1.04 -1.26 -1.62 114.28 106.36 1m9l n THR 23 Ca -0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.91 1m9l n THR 23 Cb 0.36 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.87 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 -1.24 -2.82 2.13 -1.26 -5.12 120.64 112.32 1m9l n GLU 24 Ca 0.00 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.51 1m9l n GLU 24 Cb 0.00 0.00 0.09 0.00 0.27 0.00 0.00 31.44 31.80 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 2.23 0.33 4.31 0.00 -0.64 -4.76 121.76 121.23 1m9l s ALA 25 Ca 0.00 0.27 0.01 0.00 0.00 0.00 0.00 51.96 52.24 1m9l s ALA 25 Cb 0.00 -3.28 0.58 0.00 0.00 0.00 0.00 23.12 20.42 1m9l s ALA 25 CO 0.00 -1.80 1.98 0.93 0.00 0.00 0.00 175.76 176.87 1m9l h GLU 26 N -1.15 0.92 -5.82 0.00 3.07 -1.89 -3.37 114.58 106.34 1m9l h GLU 26 Ca -0.44 -0.06 -0.61 0.00 -0.50 0.00 0.00 59.36 57.76 1m9l h GLU 26 Cb 1.23 -0.21 -0.12 0.00 -0.84 0.00 0.00 28.75 28.81 1m9l h GLU 26 CO 0.51 0.61 0.60 0.15 -1.40 0.00 0.00 179.01 179.48 1m9l s LYS 27 N -5.81 3.29 -0.34 2.33 1.02 -1.26 0.15 119.74 119.12 1m9l s LYS 27 Ca -0.11 -0.36 0.02 0.00 0.02 0.00 0.00 55.97 55.55 1m9l s LYS 27 Cb 0.18 -4.09 0.10 0.00 -0.52 0.00 0.00 37.83 33.49 1m9l s LYS 27 CO 0.78 -1.59 0.06 0.08 -0.92 0.00 0.00 175.35 173.76 1m9l s VAL 28 N 4.09 2.50 -0.88 3.17 1.01 -0.62 -4.79 120.40 124.87 1m9l s VAL 28 Ca 0.29 -2.18 -0.21 0.00 0.00 0.00 0.00 61.98 59.89 1m9l s VAL 28 Cb -0.13 -2.76 0.10 0.00 0.00 0.00 0.00 36.38 33.59 1m9l s VAL 28 CO 0.17 -0.54 1.16 -1.61 0.00 0.00 0.00 175.10 174.29 1m9l s GLU 29 N 0.98 3.48 0.00 2.72 2.02 -1.25 -1.50 118.70 125.16 1m9l s GLU 29 Ca 0.08 -1.38 0.00 0.00 0.02 0.00 0.00 54.97 53.69 1m9l s GLU 29 Cb -0.20 -4.84 0.00 0.00 0.10 0.00 0.00 34.13 29.19 1m9l s GLU 29 CO -0.07 -1.88 0.00 1.28 0.02 0.00 0.00 175.26 174.61 1m9l n LEU 30 N 7.37 0.00 0.00 1.80 4.77 -0.36 -4.43 117.00 126.16 1m9l n LEU 30 Ca 0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1m9l n LEU 30 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1m9l n LEU 30 CO 0.57 0.00 0.00 1.57 -1.33 0.00 0.00 177.39 178.20 1m9l n HIS 31 N 0.00 0.00 -3.83 -1.77 -0.00 -1.26 -4.59 115.22 103.77 1m9l n HIS 31 Ca 0.00 0.00 -0.07 0.00 0.46 0.00 0.00 57.72 58.11 1m9l n HIS 31 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 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 -0.61 0.09 -0.13 1.57 0.00 -1.26 -0.96 107.32 106.02 1m9l s GLY 32 Ca 0.00 -0.44 -0.17 0.00 0.00 0.00 0.00 44.72 44.11 1m9l s GLY 32 CO 0.00 0.02 0.45 -0.29 0.00 0.00 0.00 173.10 173.28 1m9l s MET 33 N -3.09 0.61 -0.00 2.90 1.75 -0.28 0.51 119.30 121.70 1m9l s MET 33 Ca 0.14 0.45 -0.30 0.00 -1.25 0.00 0.00 55.69 54.72 1m9l s MET 33 Cb -0.05 0.29 -0.03 0.00 2.84 0.00 0.00 34.83 37.88 1m9l s MET 33 CO 0.08 -0.11 0.98 0.96 -0.65 0.00 0.00 175.02 176.28 1m9l s ILE 34 N -0.18 4.87 0.25 10.11 -4.36 -1.26 -2.80 121.20 127.83 1m9l s ILE 34 Ca -0.04 2.05 -0.08 0.00 -0.26 0.00 0.00 60.65 62.33 1m9l s ILE 34 Cb -0.03 -4.32 0.33 0.00 1.25 0.00 0.00 42.46 39.69 1m9l s ILE 34 CO 0.02 0.16 1.60 -0.65 0.24 0.00 0.00 174.94 176.31 1m9l h PRO 35 N 6.81 0.03 0.00 0.37 0.11 -1.97 -1.85 132.00 135.50 1m9l h PRO 35 Ca -0.41 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1m9l h PRO 35 Cb 1.22 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1m9l h PRO 35 CO 0.75 0.02 0.00 -2.30 -0.21 0.00 0.00 178.00 176.26 1m9l n PRO 36 N -5.47 0.18 -1.50 1.05 -0.02 -1.26 -0.27 135.00 127.71 1m9l n PRO 36 Ca 0.14 0.00 -0.59 0.00 -2.02 0.00 0.00 63.50 61.03 1m9l n PRO 36 Cb 0.47 -1.36 -0.08 0.00 -0.02 0.00 0.00 33.50 32.51 1m9l n PRO 36 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1m9l n ILE 37 N -0.86 0.00 0.00 4.25 3.06 -0.70 -4.73 119.36 120.38 1m9l n ILE 37 Ca 0.03 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.28 1m9l n ILE 37 Cb 0.01 -0.34 0.00 0.00 0.54 0.00 0.00 39.64 39.85 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 3.03 0.00 -4.14 9.51 2.13 -1.26 -1.67 120.64 128.25 1m9l n GLU 38 Ca 0.25 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.72 1m9l n GLU 38 Cb -0.02 0.00 -0.09 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 0.03 3.45 -1.07 5.31 1.02 -1.26 -3.50 119.74 123.72 1m9l s LYS 39 Ca 0.00 -0.32 -0.03 0.00 0.02 0.00 0.00 55.97 55.63 1m9l s LYS 39 Cb 0.00 -3.03 0.31 0.00 -0.52 0.00 0.00 37.83 34.59 1m9l s LYS 39 CO 0.00 0.56 1.58 -0.12 -0.92 0.00 0.00 175.35 176.45 1m9l n MET 40 N 2.61 4.71 0.01 1.68 1.56 -1.26 -4.07 117.12 122.36 1m9l n MET 40 Ca -0.18 -4.57 0.20 0.00 -0.27 0.00 0.00 57.70 52.88 1m9l n MET 40 Cb 0.53 -2.51 0.71 0.00 2.15 0.00 0.00 33.22 34.10 1m9l n MET 40 CO 0.00 0.00 0.00 0.22 -0.73 0.00 0.00 175.97 175.46 1m9l h ASP 41 N 5.14 0.00 0.35 6.12 1.82 -1.88 -1.29 116.42 126.68 1m9l h ASP 41 Ca 0.28 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.91 1m9l h ASP 41 Cb 0.54 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.53 1m9l h ASP 41 CO 1.31 0.00 -0.37 0.00 -1.61 0.00 0.00 179.24 178.56 1m9l h ALA 42 N 1.71 -1.04 -0.41 -0.78 0.00 -1.80 -1.42 119.26 115.51 1m9l h ALA 42 Ca 0.24 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.10 1m9l h ALA 42 Cb 1.02 0.62 -0.09 0.00 0.00 0.00 0.00 17.79 19.33 1m9l h ALA 42 CO -0.00 -1.06 -0.29 1.15 0.00 0.00 0.00 179.25 179.04 1m9l h THR 43 N -0.72 0.27 -0.89 0.00 2.02 -1.68 0.10 112.91 112.01 1m9l h THR 43 Ca -0.04 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.31 1m9l h THR 43 Cb 0.63 0.27 -0.17 0.00 -1.74 0.00 0.00 68.15 67.15 1m9l h THR 43 CO -0.06 0.00 -0.24 0.25 0.37 0.00 0.00 175.52 175.84 1m9l h LEU 44 N -0.21 -0.90 0.00 2.58 5.85 -0.86 0.44 115.31 122.21 1m9l h LEU 44 Ca 0.19 0.27 -0.10 0.00 0.84 0.00 0.00 57.88 59.08 1m9l h LEU 44 Cb 0.51 0.57 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 1m9l h LEU 44 CO -0.53 -0.30 -0.75 -1.28 -0.34 0.00 0.00 178.44 175.24 1m9l h SER 45 N -0.01 0.00 0.00 1.25 0.87 -0.91 -3.35 113.55 111.40 1m9l h SER 45 Ca 0.41 -0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1m9l h SER 45 Cb 0.64 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 1m9l h SER 45 CO -0.92 1.06 0.21 1.07 -0.53 0.00 0.00 176.83 177.73 1m9l n THR 46 N -4.55 1.08 -0.33 2.23 5.66 0.33 -1.80 114.28 116.89 1m9l n THR 46 Ca -0.17 0.56 -0.03 0.00 -3.05 0.00 0.00 64.05 61.36 1m9l n THR 46 Cb 0.43 -1.56 0.00 0.00 -1.55 0.00 0.00 70.33 67.65 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 -1.51 -0.64 -0.33 1.09 0.00 0.15 -0.35 117.00 115.41 1m9l n LEU 47 Ca -0.00 1.49 0.20 0.00 0.00 0.00 0.00 56.01 57.70 1m9l n LEU 47 Cb 0.22 -0.30 0.40 0.00 0.00 0.00 0.00 43.42 43.73 1m9l n LEU 47 CO 0.02 -1.30 0.92 0.11 0.00 0.00 0.00 177.39 177.14 1m9l h LYS 48 N 0.00 0.05 0.00 1.96 1.57 -1.64 0.26 116.57 118.77 1m9l h LYS 48 Ca 0.25 -0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.89 1m9l h LYS 48 Cb 0.46 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1m9l h LYS 48 CO -0.83 0.04 -1.59 0.00 -0.57 0.00 0.00 179.45 176.50 1m9l n ALA 49 N -2.75 2.12 -1.15 3.86 0.00 0.52 -5.04 120.51 118.07 1m9l n ALA 49 Ca 0.28 -0.60 -0.45 0.00 0.00 0.00 0.00 53.44 52.67 1m9l n ALA 49 Cb 0.93 -0.84 -0.06 0.00 0.00 0.00 0.00 19.45 19.48 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 1.93 0.00 -3.16 0.00 4.81 -1.23 -4.39 118.16 116.12 1m9l n LYS 51 Ca 0.18 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.19 1m9l n LYS 51 Cb 0.01 0.00 -0.00 0.00 0.02 0.00 0.00 35.03 35.06 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 -2.31 3.41 -2.74 5.64 -0.00 0.12 0.03 115.22 119.37 1m9l n HIS 52 Ca 0.00 -3.16 -0.43 0.00 -0.00 0.00 0.00 57.72 54.13 1m9l n HIS 52 Cb 0.00 -1.37 -0.03 0.00 -0.00 0.00 0.00 29.99 28.59 1m9l n HIS 52 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.34 175.17 1m9l s LEU 53 N -2.23 3.89 -0.22 0.27 2.96 -0.06 -1.60 118.68 121.70 1m9l s LEU 53 Ca 0.31 0.47 -0.00 0.00 -0.22 0.00 0.00 54.13 54.69 1m9l s LEU 53 Cb -0.00 -3.35 0.03 0.00 0.50 0.00 0.00 46.19 43.36 1m9l s LEU 53 CO 0.03 -1.02 -0.12 0.00 -1.32 0.00 0.00 176.35 173.92 1m9l s ALA 54 N 3.84 2.55 0.00 5.97 0.00 -0.56 -0.63 121.76 132.93 1m9l s ALA 54 Ca 0.41 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.98 1m9l s ALA 54 Cb -0.10 -1.48 0.00 0.00 0.00 0.00 0.00 23.12 21.54 1m9l s ALA 54 CO 0.24 -0.66 0.00 1.28 0.00 0.00 0.00 175.76 176.62 1m9l n LEU 55 N 4.63 0.00 0.00 0.00 7.99 -0.55 -1.22 117.00 127.84 1m9l n LEU 55 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.82 1m9l n LEU 55 Cb 0.48 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.79 1m9l n LEU 55 CO 0.26 0.00 0.00 -0.24 -1.51 0.00 0.00 177.39 175.90 1m9l n SER 56 N -0.09 0.00 -3.46 -1.43 2.88 -0.82 -4.61 113.62 106.08 1m9l n SER 56 Ca 0.00 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.26 1m9l n SER 56 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.35 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 -1.00 0.54 -0.21 2.46 -1.32 -0.13 -0.47 115.64 115.51 1m9l s THR 57 Ca 0.00 -2.59 -0.06 0.00 -1.21 0.00 0.00 61.69 57.83 1m9l s THR 57 Cb 0.00 -1.39 -0.03 0.00 -1.51 0.00 0.00 72.50 69.58 1m9l s THR 57 CO 0.00 -1.16 0.02 0.54 -2.21 0.00 0.00 174.62 171.81 1m9l s ASN 58 N 0.15 4.91 -0.05 8.08 2.20 -0.05 -1.12 114.94 129.07 1m9l s ASN 58 Ca 0.29 -0.20 0.03 0.00 -0.94 0.00 0.00 52.86 52.04 1m9l s ASN 58 Cb -0.03 -1.85 -0.03 0.00 -2.00 0.00 0.00 41.25 37.34 1m9l s ASN 58 CO -0.15 0.04 -0.12 0.20 -2.94 0.00 0.00 177.10 174.14 1m9l s ASN 59 N 1.15 4.25 -0.05 3.54 0.01 -1.12 -1.68 114.94 121.03 1m9l s ASN 59 Ca 0.03 -0.15 -0.02 0.00 -0.71 0.00 0.00 52.86 52.01 1m9l s ASN 59 Cb -0.14 -0.95 0.03 0.00 0.41 0.00 0.00 41.25 40.60 1m9l s ASN 59 CO 0.02 0.34 0.09 -0.63 -1.51 0.00 0.00 177.10 175.41 1m9l s ILE 60 N -0.78 -0.14 -0.18 0.60 1.01 -0.21 -3.85 121.20 117.65 1m9l s ILE 60 Ca 0.12 0.38 -0.15 0.00 0.00 0.00 0.00 60.65 61.00 1m9l s ILE 60 Cb -0.11 -0.18 -0.07 0.00 0.01 0.00 0.00 42.46 42.11 1m9l s ILE 60 CO 0.01 0.16 -0.26 -0.62 0.00 0.00 0.00 174.94 174.23 1m9l n GLU 61 N 5.13 0.52 -4.96 2.79 1.02 0.63 -3.84 120.64 121.94 1m9l n GLU 61 Ca -0.07 0.34 -0.27 0.00 -0.02 0.00 0.00 57.16 57.14 1m9l n GLU 61 Cb 0.50 -1.54 -0.16 0.00 -0.02 0.00 0.00 31.44 30.23 1m9l n GLU 61 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1m9l s LYS 62 N -2.62 1.71 -0.56 3.49 1.02 -0.67 -4.56 119.74 117.55 1m9l s LYS 62 Ca -0.26 -0.70 0.04 0.00 0.02 0.00 0.00 55.97 55.07 1m9l s LYS 62 Cb 0.05 -1.59 0.16 0.00 -0.52 0.00 0.00 37.83 35.93 1m9l s LYS 62 CO 0.39 0.38 0.40 -1.50 -0.92 0.00 0.00 175.35 174.10 1m9l s ILE 63 N -0.34 1.74 0.39 2.17 -1.16 -1.25 -4.10 121.20 118.65 1m9l s ILE 63 Ca 0.04 -3.43 0.12 0.00 -0.51 0.00 0.00 60.65 56.87 1m9l s ILE 63 Cb -0.09 -2.17 0.13 0.00 0.61 0.00 0.00 42.46 40.94 1m9l s ILE 63 CO 0.00 -1.07 1.88 -1.28 -2.81 0.00 0.00 174.94 171.66 1m9l h SER 64 N 5.68 0.09 -0.37 4.50 0.87 -1.92 -3.27 113.55 119.12 1m9l h SER 64 Ca 0.17 -0.02 -0.27 0.00 -1.23 0.00 0.00 61.79 60.44 1m9l h SER 64 Cb 0.84 -0.02 -0.10 0.00 -0.44 0.00 0.00 62.40 62.67 1m9l h SER 64 CO 0.56 0.36 0.02 -1.54 -0.53 0.00 0.00 176.83 175.69 1m9l n SER 65 N -4.19 5.79 -0.08 6.23 3.41 -1.26 -4.58 113.62 118.93 1m9l n SER 65 Ca -0.02 -2.76 -0.08 0.00 -0.26 0.00 0.00 58.87 55.75 1m9l n SER 65 Cb 0.34 -1.26 -0.01 0.00 -0.26 0.00 0.00 64.21 63.01 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 3.99 0.24 -0.94 1.04 8.10 -1.86 -1.04 115.31 124.85 1m9l h LEU 66 Ca 0.23 0.01 0.00 0.00 0.11 0.00 0.00 57.88 58.23 1m9l h LEU 66 Cb 1.11 -0.04 0.00 0.00 -0.44 0.00 0.00 40.66 41.29 1m9l h LEU 66 CO 0.45 0.18 0.00 -0.24 -4.11 0.00 0.00 178.44 174.72 1m9l n SER 67 N -4.94 0.45 -0.02 0.17 2.88 -1.26 -1.02 113.62 109.87 1m9l n SER 67 Ca -0.01 0.68 -0.22 0.00 -1.33 0.00 0.00 58.87 57.99 1m9l n SER 67 Cb 0.06 -0.75 -0.13 0.00 -0.75 0.00 0.00 64.21 62.64 1m9l n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1m9l n GLY 68 N -0.99 -0.63 0.31 0.46 0.00 -0.50 -3.60 105.19 100.24 1m9l n GLY 68 Ca -0.00 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.23 0.00 -3.65 1.61 2.86 -0.36 -3.05 114.93 112.11 1m9l h MET 69 Ca -0.41 0.00 -0.50 0.00 -2.06 0.00 0.00 59.70 56.73 1m9l h MET 69 Cb 1.84 0.00 0.02 0.00 0.06 0.00 0.00 31.60 33.52 1m9l h MET 69 CO 0.00 0.00 2.74 -1.91 1.06 0.00 0.00 176.91 178.81 1m9l n GLU 70 N -4.40 2.22 0.00 1.72 2.13 -0.19 -1.25 120.64 120.87 1m9l n GLU 70 Ca 0.01 -1.72 0.00 0.00 0.66 0.00 0.00 57.16 56.11 1m9l n GLU 70 Cb 0.27 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.32 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 4.99 0.00 -4.74 4.31 2.85 -1.15 -4.93 115.26 116.59 1m9l n ASN 71 Ca 0.51 0.00 -0.35 0.00 -0.11 0.00 0.00 54.58 54.63 1m9l n ASN 71 Cb 0.22 0.00 0.07 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 -0.72 3.45 0.14 1.20 2.96 -0.38 -4.75 118.68 120.57 1m9l s LEU 72 Ca 0.00 2.33 0.00 0.00 -0.22 0.00 0.00 54.13 56.24 1m9l s LEU 72 Cb 0.00 -4.59 0.00 0.00 0.50 0.00 0.00 46.19 42.10 1m9l s LEU 72 CO 0.00 -1.94 0.00 0.54 -1.32 0.00 0.00 176.35 173.63 1m9l n ARG 73 N -2.27 0.00 -2.97 1.98 1.74 -1.23 -3.74 116.66 110.16 1m9l n ARG 73 Ca 0.13 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.77 1m9l n ARG 73 Cb 0.50 -0.35 -0.03 0.00 -1.02 0.00 0.00 32.46 31.56 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 -1.93 4.73 -0.47 0.55 1.01 0.10 -1.21 121.20 123.99 1m9l s ILE 74 Ca 0.00 -1.32 -0.19 0.00 0.00 0.00 0.00 60.65 59.14 1m9l s ILE 74 Cb 0.00 -4.69 0.04 0.00 0.01 0.00 0.00 42.46 37.82 1m9l s ILE 74 CO 0.00 -1.40 0.58 -0.22 0.00 0.00 0.00 174.94 173.90 1m9l s LEU 75 N 2.76 4.85 -0.77 2.97 0.20 -0.42 -0.88 118.68 127.39 1m9l s LEU 75 Ca 0.26 -0.73 0.03 0.00 0.69 0.00 0.00 54.13 54.38 1m9l s LEU 75 Cb -0.11 -2.49 0.26 0.00 -0.43 0.00 0.00 46.19 43.43 1m9l s LEU 75 CO -0.03 -0.79 0.94 -1.20 -0.29 0.00 0.00 176.35 174.98 1m9l n SER 76 N 6.03 4.49 -1.90 3.68 7.64 0.20 -1.17 113.62 132.59 1m9l n SER 76 Ca -0.06 -3.43 0.00 0.00 1.01 0.00 0.00 58.87 56.40 1m9l n SER 76 Cb 0.46 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 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 1.04 0.00 0.21 -3.43 7.94 0.08 -1.49 117.00 121.35 1m9l n LEU 77 Ca 0.28 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.18 1m9l n LEU 77 Cb 0.39 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.34 1m9l n LEU 77 CO 0.49 -0.27 0.00 0.61 -1.11 0.00 0.00 177.39 177.11 1m9l n GLY 78 N 5.00 -1.69 3.06 -3.96 0.00 -1.26 -4.51 105.19 101.83 1m9l n GLY 78 Ca 0.00 0.35 -0.32 0.00 0.00 0.00 0.00 46.02 46.06 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 2.51 0.04 1.61 3.00 0.38 0.09 118.95 124.58 1m9l s ARG 79 Ca 0.00 -0.82 -0.16 0.00 -1.00 0.00 0.00 55.73 53.74 1m9l s ARG 79 Cb 0.00 -2.45 0.03 0.00 0.00 0.00 0.00 34.95 32.53 1m9l s ARG 79 CO 0.00 -0.31 0.37 0.54 0.00 0.00 0.00 175.30 175.90 1m9l s ASN 80 N 1.34 -0.22 -0.16 -2.12 2.20 -0.10 -0.87 114.94 115.00 1m9l s ASN 80 Ca 0.02 -0.07 0.01 0.00 -0.94 0.00 0.00 52.86 51.87 1m9l s ASN 80 Cb -0.14 0.40 0.01 0.00 -2.00 0.00 0.00 41.25 39.51 1m9l s ASN 80 CO -0.10 -0.64 -0.18 -0.76 -2.94 0.00 0.00 177.10 172.47 1m9l s LEU 81 N -2.02 2.29 -0.07 3.54 1.02 -0.68 -0.93 118.68 121.83 1m9l s LEU 81 Ca -0.05 -0.56 0.02 0.00 0.02 0.00 0.00 54.13 53.56 1m9l s LEU 81 Cb -0.01 -1.52 0.01 0.00 0.02 0.00 0.00 46.19 44.70 1m9l s LEU 81 CO -0.03 0.05 -0.14 -0.63 0.02 0.00 0.00 176.35 175.62 1m9l s ILE 82 N 1.02 1.27 0.01 -0.59 1.01 -0.54 -1.04 121.20 122.34 1m9l s ILE 82 Ca -0.02 -0.56 -0.04 0.00 0.00 0.00 0.00 60.65 60.04 1m9l s ILE 82 Cb -0.15 -1.15 -0.01 0.00 0.01 0.00 0.00 42.46 41.16 1m9l s ILE 82 CO -0.05 0.39 -0.07 0.29 0.00 0.00 0.00 174.94 175.50 1m9l n LYS 83 N 3.81 0.11 0.00 2.79 5.02 -1.25 -4.10 118.16 124.54 1m9l n LYS 83 Ca -0.22 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.11 1m9l n LYS 83 Cb 0.52 -0.57 0.00 0.00 -0.02 0.00 0.00 35.03 34.96 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 -3.33 3.00 -3.30 1.97 4.76 -1.26 -4.46 118.16 115.53 1m9l n LYS 84 Ca -0.03 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.32 1m9l n LYS 84 Cb 0.11 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.24 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 1.01 -0.64 0.02 -0.18 -1.16 -1.26 -4.79 121.20 114.19 1m9l s ILE 85 Ca 0.00 -0.28 0.00 0.00 -0.51 0.00 0.00 60.65 59.86 1m9l s ILE 85 Cb 0.00 -0.98 0.00 0.00 0.61 0.00 0.00 42.46 42.09 1m9l s ILE 85 CO 0.00 -0.27 0.00 -0.62 -2.81 0.00 0.00 174.94 171.24 1m9l n GLU 86 N 5.36 0.00 0.13 3.50 1.02 -1.26 -4.89 120.64 124.49 1m9l n GLU 86 Ca 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.20 1m9l n GLU 86 Cb 0.49 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 31.95 1m9l n GLU 86 CO 0.00 0.00 0.00 -2.95 1.18 0.00 0.00 177.13 175.36 1m9l h ASN 87 N 0.00 0.00 -0.42 1.62 -1.07 -1.91 -3.35 115.58 110.45 1m9l h ASN 87 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.36 1m9l h ASN 87 Cb 0.00 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.23 1m9l h ASN 87 CO 0.00 0.33 0.22 -0.07 0.07 0.00 0.00 177.43 177.98 1m9l h LEU 88 N 0.00 0.53 -1.26 6.14 3.38 -1.94 -1.33 115.31 120.85 1m9l h LEU 88 Ca -0.03 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1m9l h LEU 88 Cb 1.28 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 1m9l h LEU 88 CO 0.04 0.48 0.41 -0.78 0.09 0.00 0.00 178.44 178.68 1m9l h ASP 89 N 0.54 0.81 0.21 -0.43 3.58 -1.91 -0.09 116.42 119.13 1m9l h ASP 89 Ca 0.15 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.55 1m9l h ASP 89 Cb 0.07 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 40.92 1m9l h ASP 89 CO -0.02 0.62 -0.10 0.00 -2.88 0.00 0.00 179.24 176.86 1m9l h ALA 90 N 1.52 -0.28 -0.94 -0.78 0.00 -1.56 0.39 119.26 117.60 1m9l h ALA 90 Ca 0.25 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1m9l h ALA 90 Cb -0.04 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 1m9l h ALA 90 CO -0.05 -0.42 0.61 -0.39 0.00 0.00 0.00 179.25 179.00 1m9l h VAL 91 N -0.77 1.11 -0.42 0.00 -1.51 -1.24 -0.66 116.25 112.77 1m9l h VAL 91 Ca -0.03 -0.39 -0.02 0.00 -1.23 0.00 0.00 66.70 65.03 1m9l h VAL 91 Cb 0.51 -0.13 -0.02 0.00 -2.13 0.00 0.00 31.29 29.52 1m9l h VAL 91 CO 0.05 0.21 0.16 0.00 -1.23 0.00 0.00 177.57 176.76 1m9l h ALA 92 N 1.41 1.50 -0.29 5.19 0.00 -0.93 0.42 119.26 126.57 1m9l h ALA 92 Ca 0.39 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 1m9l h ALA 92 Cb 0.09 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1m9l h ALA 92 CO -0.15 0.39 -0.43 -0.44 0.00 0.00 0.00 179.25 178.62 1m9l h ASP 93 N 0.59 0.87 0.00 0.00 5.19 0.58 -3.44 116.42 120.22 1m9l h ASP 93 Ca 0.15 -0.51 0.00 0.00 -0.62 0.00 0.00 57.03 56.04 1m9l h ASP 93 Cb 0.13 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 39.39 1m9l h ASP 93 CO -0.01 1.22 -0.31 1.07 -3.12 0.00 0.00 179.24 178.08 1m9l n THR 94 N -4.13 0.00 -0.76 0.35 5.66 -0.70 -5.10 114.28 109.61 1m9l n THR 94 Ca -0.04 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.65 1m9l n THR 94 Cb 0.56 -0.29 0.16 0.00 -1.55 0.00 0.00 70.33 69.21 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 -1.89 2.80 0.00 1.09 0.20 0.15 -4.93 118.68 116.09 1m9l s LEU 95 Ca 0.00 2.12 0.00 0.00 0.69 0.00 0.00 54.13 56.94 1m9l s LEU 95 Cb 0.00 -4.52 0.00 0.00 -0.43 0.00 0.00 46.19 41.24 1m9l s LEU 95 CO 0.00 -3.02 0.00 1.21 -0.29 0.00 0.00 176.35 174.25 1m9l n GLU 96 N -4.18 0.00 -3.48 1.98 2.13 -1.24 -4.65 120.64 111.20 1m9l n GLU 96 Ca 0.11 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.52 1m9l n GLU 96 Cb 0.52 -0.61 -0.04 0.00 0.27 0.00 0.00 31.44 31.58 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 -1.83 3.51 -1.26 5.31 2.02 -0.35 -1.60 118.70 124.50 1m9l s GLU 97 Ca 0.00 -2.92 -0.15 0.00 0.02 0.00 0.00 54.97 51.92 1m9l s GLU 97 Cb 0.00 -4.22 0.13 0.00 0.10 0.00 0.00 34.13 30.14 1m9l s GLU 97 CO 0.00 -1.25 1.62 1.28 0.02 0.00 0.00 175.26 176.94 1m9l n LEU 98 N 3.06 5.35 -4.38 1.80 4.77 -0.55 -1.31 117.00 125.75 1m9l n LEU 98 Ca 0.18 -4.28 -0.45 0.00 -0.03 0.00 0.00 56.01 51.42 1m9l n LEU 98 Cb 0.40 -1.65 -0.03 0.00 -2.33 0.00 0.00 43.42 39.82 1m9l n LEU 98 CO 0.38 0.62 0.65 0.26 -1.33 0.00 0.00 177.39 177.96 1m9l s TRP 99 N 2.43 3.41 -0.40 -1.77 0.51 -0.31 -1.33 118.94 121.48 1m9l s TRP 99 Ca 0.47 -1.63 0.11 0.00 -2.12 0.00 0.00 56.10 52.93 1m9l s TRP 99 Cb 0.02 -4.03 0.41 0.00 -0.81 0.00 0.00 33.47 29.06 1m9l s TRP 99 CO 0.02 -1.23 0.95 0.44 -0.51 0.00 0.00 176.95 176.63 1m9l n ILE 100 N 4.78 1.48 0.00 2.03 -5.35 -0.56 -0.74 119.36 121.00 1m9l n ILE 100 Ca 0.15 -4.27 0.00 0.00 -0.27 0.00 0.00 62.75 58.36 1m9l n ILE 100 Cb 0.47 -0.38 0.00 0.00 -1.74 0.00 0.00 39.64 38.00 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 -0.14 0.00 -4.20 7.28 7.64 -1.16 -3.13 113.62 119.90 1m9l n SER 101 Ca 0.24 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.71 1m9l n SER 101 Cb 0.68 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.80 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 -3.46 3.46 0.03 1.43 6.14 0.11 -0.55 117.35 124.51 1m9l s TYR 102 Ca 0.00 -1.99 0.08 0.00 0.64 0.00 0.00 57.07 55.80 1m9l s TYR 102 Cb 0.00 -3.48 -0.02 0.00 0.42 0.00 0.00 41.96 38.88 1m9l s TYR 102 CO 0.00 -0.98 -0.23 0.54 0.64 0.00 0.00 175.55 175.52 1m9l s ASN 103 N 2.41 2.76 -0.10 4.32 2.20 -0.46 -0.93 114.94 125.15 1m9l s ASN 103 Ca 0.08 -0.52 0.03 0.00 -0.94 0.00 0.00 52.86 51.51 1m9l s ASN 103 Cb -0.24 -0.26 0.01 0.00 -2.00 0.00 0.00 41.25 38.75 1m9l s ASN 103 CO -0.02 0.23 -0.20 -1.10 -2.94 0.00 0.00 177.10 173.07 1m9l s GLN 104 N -1.03 2.69 0.25 3.55 -0.21 -0.10 -1.12 119.66 123.70 1m9l s GLN 104 Ca 0.09 -0.75 -0.08 0.00 0.02 0.00 0.00 55.36 54.64 1m9l s GLN 104 Cb -0.09 -2.12 0.03 0.00 1.00 0.00 0.00 33.01 31.84 1m9l s GLN 104 CO 0.01 0.08 0.49 1.51 -2.12 0.00 0.00 175.29 175.26 1m9l n ILE 105 N 3.79 0.00 -0.53 1.08 3.06 -0.78 -1.47 119.36 124.51 1m9l n ILE 105 Ca -0.20 -0.73 0.00 0.00 -2.50 0.00 0.00 62.75 59.32 1m9l n ILE 105 Cb 0.52 0.66 0.00 0.00 0.54 0.00 0.00 39.64 41.36 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 -1.42 0.00 -2.64 1.51 0.00 -1.26 -4.51 120.51 112.19 1m9l n ALA 106 Ca -0.11 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.91 1m9l n ALA 106 Cb 0.39 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.81 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 7.17 0.15 0.00 1.04 -1.26 -4.96 113.70 115.83 1m9l s SER 107 Ca 0.00 1.53 -0.13 0.00 0.48 0.00 0.00 55.95 57.83 1m9l s SER 107 Cb 0.00 -2.55 0.02 0.00 0.10 0.00 0.00 66.02 63.59 1m9l s SER 107 CO 0.00 -0.54 1.64 -0.07 0.98 0.00 0.00 173.24 175.25 1m9l h LEU 108 N 8.52 0.76 -0.53 2.42 4.07 -1.98 -1.54 115.31 127.04 1m9l h LEU 108 Ca -0.28 -0.25 -0.02 0.00 0.08 0.00 0.00 57.88 57.41 1m9l h LEU 108 Cb 1.12 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.64 1m9l h LEU 108 CO 0.90 0.82 0.25 -1.28 -1.08 0.00 0.00 178.44 178.04 1m9l h SER 109 N 0.68 0.70 0.09 -0.43 0.87 -1.99 -1.38 113.55 112.08 1m9l h SER 109 Ca 0.15 -0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1m9l h SER 109 Cb 0.37 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1m9l h SER 109 CO 0.01 0.64 -0.07 1.23 -0.53 0.00 0.00 176.83 178.10 1m9l h GLY 110 N 0.71 -0.63 -0.06 5.77 0.00 -1.85 -1.85 103.07 105.15 1m9l h GLY 110 Ca 0.18 0.27 0.20 0.00 0.00 0.00 0.00 47.33 47.98 1m9l h GLY 110 CO -0.02 -0.23 0.42 0.16 0.00 0.00 0.00 176.54 176.87 1m9l h ILE 111 N -0.16 0.56 0.30 2.60 -0.00 -1.34 -1.05 117.51 118.41 1m9l h ILE 111 Ca -0.01 -0.16 -0.01 0.00 -0.00 0.00 0.00 64.86 64.68 1m9l h ILE 111 Cb 0.13 0.04 -0.01 0.00 -0.00 0.00 0.00 36.82 36.98 1m9l h ILE 111 CO 0.00 0.09 -0.20 -0.08 -0.00 0.00 0.00 178.15 177.96 1m9l h GLU 112 N 0.48 -0.47 0.69 0.16 4.22 -1.11 -0.88 114.58 117.66 1m9l h GLU 112 Ca 0.53 0.03 -0.03 0.00 0.08 0.00 0.00 59.36 59.97 1m9l h GLU 112 Cb 0.94 0.11 0.01 0.00 0.50 0.00 0.00 28.75 30.30 1m9l h GLU 112 CO -0.47 -0.32 -0.33 0.87 -2.18 0.00 0.00 179.01 176.58 1m9l h LYS 113 N -0.49 -0.90 -0.87 1.92 1.79 -0.65 -0.31 116.57 117.06 1m9l h LYS 113 Ca -0.03 0.06 0.08 0.00 -2.18 0.00 0.00 60.65 58.58 1m9l h LYS 113 Cb 0.42 0.20 -0.06 0.00 -1.58 0.00 0.00 32.23 31.21 1m9l h LYS 113 CO 0.02 -0.60 0.57 1.37 -1.08 0.00 0.00 179.45 179.73 1m9l h LEU 114 N -1.15 0.82 -0.11 2.94 8.10 -1.30 -0.54 115.31 124.08 1m9l h LEU 114 Ca -0.10 0.01 -0.23 0.00 0.11 0.00 0.00 57.88 57.68 1m9l h LEU 114 Cb 0.71 -0.16 0.01 0.00 -0.44 0.00 0.00 40.66 40.79 1m9l h LEU 114 CO 0.16 0.51 -0.82 0.58 -4.11 0.00 0.00 178.44 174.76 1m9l h VAL 115 N 0.92 1.29 -0.05 0.15 2.07 -1.21 -3.02 116.25 116.40 1m9l h VAL 115 Ca 0.39 -2.03 0.01 0.00 0.82 0.00 0.00 66.70 65.90 1m9l h VAL 115 Cb 0.30 2.11 -0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1m9l h VAL 115 CO -0.15 0.64 0.23 -1.13 0.02 0.00 0.00 177.57 177.17 1m9l h ASN 116 N 0.46 0.00 -1.16 0.57 -1.24 0.45 -3.43 115.58 111.23 1m9l h ASN 116 Ca -0.07 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.86 1m9l h ASN 116 Cb 1.46 0.00 0.05 0.00 0.73 0.00 0.00 38.32 40.56 1m9l h ASN 116 CO 0.17 0.00 -0.04 -0.11 -1.29 0.00 0.00 177.43 176.16 1m9l n LEU 117 N -3.11 0.00 -0.00 0.34 7.94 -0.47 -4.92 117.00 116.78 1m9l n LEU 117 Ca -0.01 -0.19 -0.00 0.00 -1.11 0.00 0.00 56.01 54.69 1m9l n LEU 117 Cb 0.30 -0.31 -0.00 0.00 0.53 0.00 0.00 43.42 43.94 1m9l n LEU 117 CO 0.18 -1.75 0.00 0.03 -1.11 0.00 0.00 177.39 174.74 1m9l h ARG 118 N 0.00 -0.00 -4.98 1.96 -0.00 -1.83 -3.43 114.38 106.11 1m9l h ARG 118 Ca -0.09 0.00 -0.62 0.00 -0.50 0.00 0.00 59.98 58.77 1m9l h ARG 118 Cb 0.29 0.00 -0.34 0.00 0.00 0.00 0.00 29.97 29.93 1m9l h ARG 118 CO 0.05 -0.00 -0.85 0.54 0.00 0.00 0.00 179.97 179.71 1m9l s VAL 119 N -1.05 1.71 -0.03 2.04 0.11 -0.63 -1.78 120.40 120.77 1m9l s VAL 119 Ca -0.00 -0.79 -0.02 0.00 -2.93 0.00 0.00 61.98 58.24 1m9l s VAL 119 Cb 0.00 -1.52 0.02 0.00 -1.53 0.00 0.00 36.38 33.35 1m9l s VAL 119 CO 0.00 0.48 0.08 -1.48 -3.33 0.00 0.00 175.10 170.85 1m9l s LEU 120 N 0.67 1.27 -0.23 2.54 2.34 -0.60 -1.48 118.68 123.19 1m9l s LEU 120 Ca -0.12 0.15 0.01 0.00 0.06 0.00 0.00 54.13 54.22 1m9l s LEU 120 Cb -0.16 0.17 0.03 0.00 -0.56 0.00 0.00 46.19 45.68 1m9l s LEU 120 CO 0.03 -0.09 -0.12 -0.31 -1.06 0.00 0.00 176.35 174.80 1m9l s TYR 121 N 0.66 3.04 -0.45 3.48 2.02 -0.44 -1.28 117.35 124.37 1m9l s TYR 121 Ca -0.05 -1.83 0.04 0.00 -0.37 0.00 0.00 57.07 54.86 1m9l s TYR 121 Cb -0.07 -1.97 0.17 0.00 -0.40 0.00 0.00 41.96 39.68 1m9l s TYR 121 CO -0.03 -0.80 0.36 -1.64 -1.57 0.00 0.00 175.55 171.87 1m9l s MET 122 N 1.24 1.11 0.32 -0.62 -1.94 0.29 -1.50 119.30 118.20 1m9l s MET 122 Ca -0.01 -2.26 0.26 0.00 -1.71 0.00 0.00 55.69 51.97 1m9l s MET 122 Cb -0.17 -1.69 0.82 0.00 2.01 0.00 0.00 34.83 35.80 1m9l s MET 122 CO -0.07 -1.37 1.75 0.66 -0.01 0.00 0.00 175.02 175.98 1m9l h SER 123 N 5.65 0.00 -3.45 3.03 4.64 -1.49 0.16 113.55 122.10 1m9l h SER 123 Ca 0.24 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.28 1m9l h SER 123 Cb 0.89 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.64 1m9l h SER 123 CO 0.42 0.00 -0.68 0.20 -0.87 0.00 0.00 176.83 175.89 1m9l s ASN 124 N -4.98 0.14 0.27 4.97 0.01 0.29 -1.97 114.94 113.67 1m9l s ASN 124 Ca 0.07 0.14 -0.17 0.00 -0.71 0.00 0.00 52.86 52.20 1m9l s ASN 124 Cb 0.10 0.03 0.01 0.00 0.41 0.00 0.00 41.25 41.79 1m9l s ASN 124 CO 0.56 -0.15 0.61 0.54 -1.51 0.00 0.00 177.10 177.14 1m9l s ASN 125 N 1.27 -0.14 -0.29 -1.22 2.20 0.19 -1.35 114.94 115.61 1m9l s ASN 125 Ca -0.07 -0.81 0.01 0.00 -0.94 0.00 0.00 52.86 51.05 1m9l s ASN 125 Cb -0.12 0.67 0.09 0.00 -2.00 0.00 0.00 41.25 39.88 1m9l s ASN 125 CO -0.04 -1.27 0.04 -0.54 -2.94 0.00 0.00 177.10 172.34 1m9l s LYS 126 N -3.85 1.15 -0.16 3.55 -0.14 -0.27 -4.04 119.74 115.98 1m9l s LYS 126 Ca 0.17 -1.20 -0.11 0.00 -1.36 0.00 0.00 55.97 53.47 1m9l s LYS 126 Cb -0.03 -2.47 0.05 0.00 -1.68 0.00 0.00 37.83 33.70 1m9l s LYS 126 CO 0.09 -0.84 0.40 0.42 -0.76 0.00 0.00 175.35 174.66 1m9l s ILE 127 N 1.40 -0.01 0.00 2.17 1.01 -1.26 -1.86 121.20 122.64 1m9l s ILE 127 Ca 0.05 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.75 1m9l s ILE 127 Cb -0.18 -0.59 0.00 0.00 0.01 0.00 0.00 42.46 41.70 1m9l s ILE 127 CO -0.14 0.02 0.09 0.35 0.00 0.00 0.00 174.94 175.26 1m9l n THR 128 N 3.66 0.00 -1.03 2.92 -2.24 -1.26 -1.74 114.28 114.58 1m9l n THR 128 Ca -0.19 -0.15 -0.16 0.00 -2.27 0.00 0.00 64.05 61.27 1m9l n THR 128 Cb 0.56 1.40 -0.15 0.00 -2.10 0.00 0.00 70.33 70.05 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 -0.13 5.72 -0.31 3.42 3.02 -1.26 -4.63 115.26 121.09 1m9l n ASN 129 Ca 0.00 -2.48 0.15 0.00 -0.03 0.00 0.00 54.58 52.22 1m9l n ASN 129 Cb 0.10 -1.42 0.34 0.00 -0.61 0.00 0.00 39.78 38.19 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 3.37 0.62 -0.68 3.10 7.01 -1.93 0.28 115.95 127.71 1m9l h TRP 130 Ca 0.30 0.04 0.10 0.00 2.11 0.00 0.00 58.89 61.44 1m9l h TRP 130 Cb 1.30 -0.13 -0.11 0.00 -2.10 0.00 0.00 29.16 28.13 1m9l h TRP 130 CO 1.80 -0.12 -0.28 0.41 -2.79 0.00 0.00 178.44 177.45 1m9l n GLY 131 N -1.34 -1.45 0.28 2.65 0.00 -1.26 -1.45 105.19 102.63 1m9l n GLY 131 Ca 0.24 0.77 -0.05 0.00 0.00 0.00 0.00 46.02 46.97 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 -4.98 0.31 -0.26 1.61 1.02 -0.78 -4.74 120.64 112.82 1m9l n GLU 132 Ca 0.06 0.12 0.21 0.00 -0.02 0.00 0.00 57.16 57.54 1m9l n GLU 132 Cb 0.26 -1.01 0.40 0.00 -0.02 0.00 0.00 31.44 31.07 1m9l n GLU 132 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1m9l n ILE 133 N -3.80 -0.34 -0.32 -3.67 5.41 0.90 -1.45 119.36 116.09 1m9l n ILE 133 Ca -0.08 1.66 -0.10 0.00 1.00 0.00 0.00 62.75 65.23 1m9l n ILE 133 Cb 0.30 -2.61 -0.09 0.00 -0.71 0.00 0.00 39.64 36.53 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 -1.87 0.02 4.38 3.58 -1.40 -0.90 116.42 120.22 1m9l h ASP 134 Ca 0.62 0.28 -0.24 0.00 0.42 0.00 0.00 57.03 58.11 1m9l h ASP 134 Cb 1.54 0.82 -0.03 0.00 1.72 0.00 0.00 39.33 43.38 1m9l h ASP 134 CO -0.66 -0.23 -1.28 0.11 -2.88 0.00 0.00 179.24 174.30 1m9l h LYS 135 N -0.07 0.05 -0.99 0.28 1.79 -1.71 -3.39 116.57 112.53 1m9l h LYS 135 Ca 0.13 -0.09 0.29 0.00 -2.18 0.00 0.00 60.65 58.80 1m9l h LYS 135 Cb 0.40 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.04 1m9l h LYS 135 CO -0.78 1.04 1.09 1.25 -1.08 0.00 0.00 179.45 180.98 1m9l h LEU 136 N -0.82 0.00 0.00 2.94 5.85 -1.15 0.43 115.31 122.57 1m9l h LEU 136 Ca -0.33 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1m9l h LEU 136 Cb 1.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.44 1m9l h LEU 136 CO -0.14 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 177.96 1m9l n ALA 137 N -2.32 1.74 -2.44 1.25 0.00 -0.35 -4.65 120.51 113.74 1m9l n ALA 137 Ca 0.22 -0.04 -0.07 0.00 0.00 0.00 0.00 53.44 53.56 1m9l n ALA 137 Cb 1.40 -1.09 0.01 0.00 0.00 0.00 0.00 19.45 19.76 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 -0.94 -0.28 -0.16 0.00 0.00 0.07 -3.75 120.51 115.45 1m9l n ALA 138 Ca 0.04 0.08 0.01 0.00 0.00 0.00 0.00 53.44 53.57 1m9l n ALA 138 Cb 0.02 -1.46 0.27 0.00 0.00 0.00 0.00 19.45 18.28 1m9l n ALA 138 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1m9l h LEU 139 N -0.37 0.77 -0.63 0.00 5.85 -1.63 -1.94 115.31 117.37 1m9l h LEU 139 Ca -0.16 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.52 1m9l h LEU 139 Cb 1.11 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.95 1m9l h LEU 139 CO 0.17 0.60 0.00 0.47 -0.34 0.00 0.00 178.44 179.34 1m9l n ASP 140 N -4.40 0.73 0.00 1.25 8.00 -1.26 -4.36 116.55 116.50 1m9l n ASP 140 Ca 0.06 -2.03 0.00 0.00 0.71 0.00 0.00 54.79 53.54 1m9l n ASP 140 Cb 0.08 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 40.92 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 -0.18 0.00 -0.29 -1.24 2.85 -1.07 -4.92 118.16 113.31 1m9l n LYS 141 Ca 0.02 0.00 -0.09 0.00 -1.05 0.00 0.00 58.31 57.18 1m9l n LYS 141 Cb 0.17 -0.05 0.00 0.00 -0.65 0.00 0.00 35.03 34.49 1m9l n LYS 141 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1m9l n LEU 142 N -2.31 -0.84 0.00 -5.58 4.77 -0.75 -1.63 117.00 110.66 1m9l n LEU 142 Ca 0.00 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 1m9l n LEU 142 Cb 0.00 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1m9l n LEU 142 CO 0.00 -1.10 0.00 -0.62 -1.33 0.00 0.00 177.39 174.34 1m9l n GLU 143 N 0.35 0.00 -3.77 3.23 4.71 -1.26 -3.02 120.64 120.87 1m9l n GLU 143 Ca 0.02 0.11 -0.36 0.00 -0.01 0.00 0.00 57.16 56.92 1m9l n GLU 143 Cb 0.11 -0.51 -0.11 0.00 -1.01 0.00 0.00 31.44 29.92 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 -2.92 5.18 -0.43 1.62 1.01 -0.74 -1.54 116.67 118.86 1m9l s ASP 144 Ca 0.00 -2.40 0.03 0.00 0.71 0.00 0.00 52.55 50.89 1m9l s ASP 144 Cb 0.00 -1.82 0.12 0.00 1.01 0.00 0.00 42.92 42.23 1m9l s ASP 144 CO 0.00 -0.46 0.17 -1.48 0.21 0.00 0.00 175.17 173.61 1m9l s LEU 145 N 0.60 4.03 -0.39 1.23 2.34 -0.59 -1.55 118.68 124.35 1m9l s LEU 145 Ca 0.12 -2.53 -0.15 0.00 0.06 0.00 0.00 54.13 51.63 1m9l s LEU 145 Cb -0.22 -1.47 0.01 0.00 -0.56 0.00 0.00 46.19 43.95 1m9l s LEU 145 CO -0.04 -0.31 0.30 -0.22 -1.06 0.00 0.00 176.35 175.03 1m9l s LEU 146 N 0.39 4.95 -0.41 1.48 2.96 -0.41 -0.53 118.68 127.12 1m9l s LEU 146 Ca 0.14 -0.76 0.07 0.00 -0.22 0.00 0.00 54.13 53.36 1m9l s LEU 146 Cb -0.23 -2.18 0.24 0.00 0.50 0.00 0.00 46.19 44.53 1m9l s LEU 146 CO -0.05 -0.41 0.58 0.00 -1.32 0.00 0.00 176.35 175.14 1m9l n LEU 147 N 5.19 -0.48 -4.96 -0.68 -0.00 -1.25 -0.55 117.00 114.26 1m9l n LEU 147 Ca -0.11 -4.40 -0.19 0.00 -0.00 0.00 0.00 56.01 51.31 1m9l n LEU 147 Cb 0.48 0.67 0.00 0.00 -0.00 0.00 0.00 43.42 44.57 1m9l n LEU 147 CO 0.40 2.04 0.12 0.00 -0.00 0.00 0.00 177.39 179.96 1m9l s ALA 148 N -0.73 4.40 -0.52 1.47 0.00 0.56 -4.75 121.76 122.20 1m9l s ALA 148 Ca 0.34 -1.79 -0.02 0.00 0.00 0.00 0.00 51.96 50.50 1m9l s ALA 148 Cb 0.17 -1.36 0.00 0.00 0.00 0.00 0.00 23.12 21.93 1m9l s ALA 148 CO -0.14 -0.36 0.44 0.41 0.00 0.00 0.00 175.76 176.11 1m9l n GLY 149 N -1.81 0.22 3.50 0.00 0.00 -0.83 -1.94 105.19 104.33 1m9l n GLY 149 Ca 0.07 -0.27 -0.17 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.37 -0.61 0.13 1.61 2.20 -1.26 -0.63 114.94 113.00 1m9l s ASN 150 Ca 0.11 0.73 -0.27 0.00 -0.94 0.00 0.00 52.86 52.49 1m9l s ASN 150 Cb -0.05 0.62 -0.07 0.00 -2.00 0.00 0.00 41.25 39.75 1m9l s ASN 150 CO 0.30 -0.55 1.46 -0.65 -2.94 0.00 0.00 177.10 174.72 1m9l h PRO 151 N 3.35 -0.12 -0.62 3.55 0.11 -1.78 -0.39 132.00 136.10 1m9l h PRO 151 Ca -0.27 0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.90 1m9l h PRO 151 Cb 1.15 0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.21 1m9l h PRO 151 CO 0.35 -0.08 -0.37 -0.11 -0.21 0.00 0.00 178.00 177.58 1m9l n LEU 152 N -4.92 -0.66 0.25 2.35 -0.00 -0.71 0.42 117.00 113.73 1m9l n LEU 152 Ca -0.00 1.42 -0.16 0.00 -0.00 0.00 0.00 56.01 57.27 1m9l n LEU 152 Cb 0.25 -0.30 -0.08 0.00 -0.00 0.00 0.00 43.42 43.28 1m9l n LEU 152 CO -0.08 -1.06 0.73 0.22 -0.00 0.00 0.00 177.39 177.20 1m9l h TYR 153 N 0.00 -0.53 0.00 1.96 3.20 -1.76 -1.84 116.97 117.99 1m9l h TYR 153 Ca 0.10 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1m9l h TYR 153 Cb 0.26 0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.70 1m9l h TYR 153 CO -0.94 -0.33 0.00 -0.91 -1.64 0.00 0.00 178.16 174.34 1m9l h ASN 154 N -0.57 0.00 0.08 -2.11 4.21 -0.74 -1.28 115.58 115.17 1m9l h ASN 154 Ca -0.06 0.00 -0.16 0.00 1.21 0.00 0.00 56.30 57.29 1m9l h ASN 154 Cb 0.44 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 37.66 1m9l h ASN 154 CO 0.09 0.00 -0.69 0.44 -1.29 0.00 0.00 177.43 175.98 1m9l h ASP 155 N 0.00 0.47 0.31 5.81 3.32 0.75 -3.21 116.42 123.87 1m9l h ASP 155 Ca 0.00 -0.87 0.00 0.00 0.02 0.00 0.00 57.03 56.18 1m9l h ASP 155 Cb 0.08 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 1m9l h ASP 155 CO 0.00 1.30 -0.40 0.22 -1.72 0.00 0.00 179.24 178.64 1m9l h TYR 156 N -0.29 -1.10 0.00 4.55 3.20 -0.58 -3.47 116.97 119.28 1m9l h TYR 156 Ca -0.11 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.78 1m9l h TYR 156 Cb 1.47 0.44 0.00 0.00 1.54 0.00 0.00 36.73 40.19 1m9l h TYR 156 CO 0.18 -0.54 0.00 1.63 -1.64 0.00 0.00 178.16 177.79 1m9l n LYS 157 N -5.48 0.00 -0.13 1.82 4.76 -0.57 -4.56 118.16 114.00 1m9l n LYS 157 Ca -0.09 0.00 0.15 0.00 -2.87 0.00 0.00 58.31 55.50 1m9l n LYS 157 Cb 0.39 0.00 0.24 0.00 -1.84 0.00 0.00 35.03 33.81 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 0.01 -0.76 1.97 0.00 -1.23 -1.26 120.64 119.37 1m9l n GLU 158 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 57.16 57.70 1m9l n GLU 158 Cb 0.00 -1.32 -0.00 0.00 0.00 0.00 0.00 31.44 30.12 1m9l n GLU 158 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1m9l n ASN 159 N -2.34 0.15 0.00 -1.84 5.15 -1.26 -4.69 115.26 110.42 1m9l n ASN 159 Ca 0.13 -1.82 0.00 0.00 -0.60 0.00 0.00 54.58 52.29 1m9l n ASN 159 Cb 0.81 -0.15 0.00 0.00 -0.53 0.00 0.00 39.78 39.92 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 0.11 0.08 -0.08 1.20 4.05 -0.38 -4.71 115.26 115.53 1m9l n ASN 160 Ca -0.01 0.00 -0.08 0.00 0.45 0.00 0.00 54.58 54.95 1m9l n ASN 160 Cb 0.76 0.00 -0.15 0.00 1.23 0.00 0.00 39.78 41.63 1m9l n ASN 160 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1m9l n ALA 161 N -1.99 1.63 -0.12 5.20 0.00 -0.45 -3.36 120.51 121.42 1m9l n ALA 161 Ca 0.00 -1.17 -0.11 0.00 0.00 0.00 0.00 53.44 52.16 1m9l n ALA 161 Cb 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 19.45 19.26 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 1.28 -0.54 0.00 2.02 -1.70 -0.35 112.91 113.62 1m9l h THR 162 Ca -0.46 -1.18 -0.02 0.00 0.77 0.00 0.00 66.41 65.51 1m9l h THR 162 Cb 2.05 1.30 -0.03 0.00 -1.74 0.00 0.00 68.15 69.73 1m9l h THR 162 CO 0.03 0.39 0.24 -1.28 0.37 0.00 0.00 175.52 175.26 1m9l h SER 163 N 0.49 0.69 -0.40 4.18 0.87 -1.80 -0.55 113.55 117.04 1m9l h SER 163 Ca 0.09 -0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.54 1m9l h SER 163 Cb 0.62 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 1m9l h SER 163 CO 0.04 0.61 0.12 -0.08 -0.53 0.00 0.00 176.83 176.99 1m9l h GLU 164 N 0.76 0.62 -0.24 2.24 4.81 -1.46 -0.97 114.58 120.34 1m9l h GLU 164 Ca 0.19 -0.14 -0.18 0.00 -0.13 0.00 0.00 59.36 59.10 1m9l h GLU 164 Cb 0.12 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 1m9l h GLU 164 CO -0.02 0.62 -0.58 1.88 -0.73 0.00 0.00 179.01 180.18 1m9l h TYR 165 N 0.50 0.98 -0.60 0.92 -1.99 -0.61 0.44 116.97 116.60 1m9l h TYR 165 Ca 0.13 -0.36 -0.05 0.00 2.00 0.00 0.00 58.73 60.45 1m9l h TYR 165 Cb 0.26 -0.18 -0.03 0.00 2.00 0.00 0.00 36.73 38.79 1m9l h TYR 165 CO 0.01 1.17 0.19 -0.09 -0.00 0.00 0.00 178.16 179.44 1m9l h ARG 166 N 0.59 0.94 -0.73 4.88 1.12 -1.07 0.25 114.38 120.34 1m9l h ARG 166 Ca 0.00 -0.20 0.00 0.00 -1.11 0.00 0.00 59.98 58.68 1m9l h ARG 166 Cb 1.18 -0.14 -0.04 0.00 -0.01 0.00 0.00 29.97 30.96 1m9l h ARG 166 CO 0.12 0.83 0.47 0.82 -3.11 0.00 0.00 179.97 179.11 1m9l h ILE 167 N 0.86 1.19 -0.03 1.20 2.04 -1.06 -1.05 117.51 120.66 1m9l h ILE 167 Ca 0.20 -0.37 -0.09 0.00 1.00 0.00 0.00 64.86 65.60 1m9l h ILE 167 Cb 0.28 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 1m9l h ILE 167 CO -0.01 0.19 -0.38 -0.08 0.00 0.00 0.00 178.15 177.87 1m9l h GLU 168 N 1.00 0.06 0.00 2.37 4.81 -0.31 0.48 114.58 122.99 1m9l h GLU 168 Ca 0.27 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.47 1m9l h GLU 168 Cb -0.09 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.28 1m9l h GLU 168 CO -0.06 0.44 0.00 0.28 -0.73 0.00 0.00 179.01 178.94 1m9l n VAL 169 N -4.08 0.00 0.05 0.32 0.31 0.82 -0.48 118.33 115.27 1m9l n VAL 169 Ca -0.02 0.97 0.21 0.00 -0.01 0.00 0.00 64.34 65.50 1m9l n VAL 169 Cb 0.43 -1.85 0.74 0.00 -0.91 0.00 0.00 33.84 32.24 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 0.49 0.00 2.52 3.04 -1.27 -0.71 116.25 120.33 1m9l h VAL 170 Ca 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1m9l h VAL 170 Cb 0.00 0.68 -0.00 0.00 -2.01 0.00 0.00 31.29 29.96 1m9l h VAL 170 CO 0.00 0.00 -0.21 0.50 -1.01 0.00 0.00 177.57 176.85 1m9l h LYS 171 N 0.00 0.00 0.00 4.17 3.64 -0.96 -3.46 116.57 119.96 1m9l h LYS 171 Ca 0.22 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.29 1m9l h LYS 171 Cb 1.07 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.83 1m9l h LYS 171 CO -0.00 0.03 -2.19 0.54 -2.27 0.00 0.00 179.45 175.56 1m9l n ARG 172 N -4.71 0.90 -3.96 1.90 1.74 0.37 -4.93 116.66 107.97 1m9l n ARG 172 Ca -0.03 0.06 -0.33 0.00 -0.77 0.00 0.00 57.85 56.77 1m9l n ARG 172 Cb 0.12 -1.43 -0.05 0.00 -1.02 0.00 0.00 32.46 30.08 1m9l n ARG 172 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1m9l s LEU 173 N -5.75 4.24 -0.02 0.55 1.43 -0.29 -5.00 118.68 113.84 1m9l s LEU 173 Ca -0.19 0.29 0.17 0.00 -1.03 0.00 0.00 54.13 53.37 1m9l s LEU 173 Cb 0.06 -2.51 -0.20 0.00 0.03 0.00 0.00 46.19 43.58 1m9l s LEU 173 CO 0.59 0.27 0.61 -0.81 0.23 0.00 0.00 176.35 177.24 1m9l n PRO 174 N 1.02 0.64 0.00 1.29 -0.04 -1.26 -4.63 135.00 132.02 1m9l n PRO 174 Ca -0.12 0.16 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1m9l n PRO 174 Cb 0.53 -1.72 0.00 0.00 -0.04 0.00 0.00 33.50 32.26 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 -2.84 0.00 0.00 3.54 4.13 -1.26 -4.89 115.26 113.93 1m9l n ASN 175 Ca -0.15 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.11 1m9l n ASN 175 Cb 0.93 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 39.17 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 -0.09 3.41 4.32 -0.65 -4.94 117.00 119.06 1m9l n LEU 176 Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 56.01 55.81 1m9l n LEU 176 Cb 0.00 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 41.74 1m9l n LEU 176 CO 0.00 0.00 -1.09 1.17 -1.22 0.00 0.00 177.39 176.25 1m9l n LYS 177 N 0.00 0.38 -3.64 3.23 4.81 -1.12 -4.85 118.16 116.96 1m9l n LYS 177 Ca 0.00 0.15 -0.34 0.00 -0.87 0.00 0.00 58.31 57.26 1m9l n LYS 177 Cb 0.00 -1.15 -0.07 0.00 0.02 0.00 0.00 35.03 33.83 1m9l n LYS 177 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1m9l n LYS 178 N -3.67 2.56 -2.48 1.64 4.76 -0.59 -4.96 118.16 115.41 1m9l n LYS 178 Ca -0.34 -4.51 -0.39 0.00 -2.87 0.00 0.00 58.31 50.20 1m9l n LYS 178 Cb 0.75 -2.37 -0.03 0.00 -1.84 0.00 0.00 35.03 31.54 1m9l n LYS 178 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1m9l s LEU 179 N -1.61 3.46 0.00 -0.35 1.98 -1.26 -1.53 118.68 119.36 1m9l s LEU 179 Ca 0.29 -1.36 0.00 0.00 -2.89 0.00 0.00 54.13 50.17 1m9l s LEU 179 Cb -0.03 -2.57 0.00 0.00 0.66 0.00 0.00 46.19 44.25 1m9l s LEU 179 CO -0.11 -1.70 0.00 -0.67 -1.89 0.00 0.00 176.35 171.98 1m9l n ASP 180 N 9.67 0.00 0.00 3.68 2.03 0.32 -4.70 116.55 127.55 1m9l n ASP 180 Ca 0.35 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.66 1m9l n ASP 180 Cb 0.50 -2.10 0.00 0.00 -0.72 0.00 0.00 41.12 38.80 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 -0.09 0.00 0.27 0.00 -1.26 -4.44 105.19 97.67 1m9l n GLY 181 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.30 1m9l n GLY 181 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1m9l n MET 182 N 0.00 0.00 0.20 1.61 0.00 -1.26 -1.60 117.12 116.06 1m9l n MET 182 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 57.70 57.84 1m9l n MET 182 Cb 0.00 0.00 0.50 0.00 0.00 0.00 0.00 33.22 33.72 1m9l n MET 182 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 175.97 174.97 1m9l h PRO 183 N 0.00 0.00 0.00 2.12 0.13 -1.84 -3.27 132.00 129.14 1m9l h PRO 183 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1m9l h PRO 183 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1m9l h PRO 183 CO 0.00 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.10 1m9l n VAL 184 N -2.98 0.00 -2.21 1.56 0.24 -0.63 -4.54 118.33 109.77 1m9l n VAL 184 Ca 0.05 1.49 -0.05 0.00 -2.04 0.00 0.00 64.34 63.79 1m9l n VAL 184 Cb 0.81 -1.99 -0.01 0.00 -1.47 0.00 0.00 33.84 31.18 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 -2.95 -0.81 0.00 -1.34 8.00 -1.24 -0.78 116.55 117.44 1m9l n ASP 185 Ca 0.00 0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.66 1m9l n ASP 185 Cb 0.00 -0.79 0.00 0.00 -0.02 0.00 0.00 41.12 40.31 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 -1.99 0.00 0.01 2.53 3.14 -1.26 -4.87 118.33 115.89 1m9l n VAL 186 Ca 0.01 0.00 -0.10 0.00 -2.96 0.00 0.00 64.34 61.30 1m9l n VAL 186 Cb 0.35 0.00 -0.13 0.00 -1.06 0.00 0.00 33.84 33.00 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 0.07 0.31 6.55 3.58 -1.25 -3.29 116.42 122.39 1m9l h ASP 187 Ca 0.00 -0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.34 1m9l h ASP 187 Cb 0.00 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.03 1m9l h ASP 187 CO 0.00 1.10 0.00 -0.33 -2.88 0.00 0.00 179.24 177.13 1m9l h GLU 188 N 0.01 0.00 -0.01 0.28 4.39 -1.67 0.25 114.58 117.82 1m9l h GLU 188 Ca -0.21 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.49 1m9l h GLU 188 Cb 1.95 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.60 1m9l h GLU 188 CO 0.10 0.00 -0.18 -2.13 -1.16 0.00 0.00 179.01 175.65 1m9l n ARG 189 N -2.49 1.39 0.03 2.33 3.00 -1.24 -3.39 116.66 116.29 1m9l n ARG 189 Ca -0.01 -0.95 -0.00 0.00 -0.00 0.00 0.00 57.85 56.89 1m9l n ARG 189 Cb 0.12 -1.48 -0.00 0.00 0.00 0.00 0.00 32.46 31.10 1m9l n ARG 189 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1m9l n GLU 190 N 0.02 0.03 0.05 -0.14 -0.58 0.42 -4.38 120.64 116.06 1m9l n GLU 190 Ca 0.14 0.01 -0.13 0.00 -0.42 0.00 0.00 57.16 56.77 1m9l n GLU 190 Cb 0.41 -0.44 -0.09 0.00 -0.57 0.00 0.00 31.44 30.75 1m9l n GLU 190 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 1m9l h GLN 191 N -0.05 -0.15 0.00 3.49 4.15 -0.91 -0.16 115.11 121.47 1m9l h GLN 191 Ca 0.00 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 1m9l h GLN 191 Cb 0.05 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.78 1m9l h GLN 191 CO 0.00 0.27 -0.04 0.00 -1.93 0.00 0.00 178.83 177.12 1m9l h ALA 192 N 0.16 1.28 0.19 3.38 0.00 -1.62 0.49 119.26 123.14 1m9l h ALA 192 Ca -0.02 -0.04 -0.34 0.00 0.00 0.00 0.00 54.91 54.51 1m9l h ALA 192 Cb 0.49 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1m9l h ALA 192 CO 0.03 0.06 -1.66 -0.97 0.00 0.00 0.00 179.25 176.70 1m9l h ASN 193 N 0.00 0.63 0.26 0.00 -1.24 -1.55 0.06 115.58 113.73 1m9l h ASN 193 Ca -0.00 -0.86 -0.14 0.00 0.71 0.00 0.00 56.30 56.01 1m9l h ASN 193 Cb 0.16 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.00 1m9l h ASN 193 CO 0.01 1.71 -0.53 0.58 -1.29 0.00 0.00 177.43 177.91 1m9l h VAL 194 N 0.11 1.35 0.19 2.57 2.07 -0.55 -1.34 116.25 120.65 1m9l h VAL 194 Ca -0.31 -1.81 -0.31 0.00 0.82 0.00 0.00 66.70 65.09 1m9l h VAL 194 Cb 2.10 1.86 0.03 0.00 -1.52 0.00 0.00 31.29 33.76 1m9l h VAL 194 CO 0.20 0.54 -1.36 0.00 0.02 0.00 0.00 177.57 176.97 1m9l h ALA 195 N 1.20 -0.06 0.12 1.67 0.00 -1.01 -2.96 119.26 118.22 1m9l h ALA 195 Ca 0.00 -0.84 0.01 0.00 0.00 0.00 0.00 54.91 54.09 1m9l h ALA 195 Cb 1.02 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1m9l h ALA 195 CO 0.09 0.76 -0.19 -0.09 0.00 0.00 0.00 179.25 179.82 1m9l h ARG 196 N 0.16 -0.35 0.00 0.00 9.65 -0.90 -3.45 114.38 119.49 1m9l h ARG 196 Ca -0.21 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.69 1m9l h ARG 196 Cb 2.05 0.08 0.00 0.00 -1.39 0.00 0.00 29.97 30.72 1m9l h ARG 196 CO 0.25 -0.24 0.00 0.41 2.80 0.00 0.00 179.97 183.19 1m9l n GLY 197 N -1.31 -1.75 0.57 2.80 0.00 -0.59 -5.05 105.19 99.86 1m9l n GLY 197 Ca -0.07 0.69 0.07 0.00 0.00 0.00 0.00 46.02 46.71 1m9l n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93