#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 -3.17 3.04 0.00 -1.26 -4.34 120.51 117.77 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 0.23 -0.00 0.00 0.00 0.00 0.00 19.45 19.68 1m9l n ALA 2 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1m9l n LYS 3 N -3.29 0.33 -3.24 0.00 4.81 -1.26 -4.53 118.16 110.98 1m9l n LYS 3 Ca 0.00 -0.03 -0.16 0.00 -0.87 0.00 0.00 58.31 57.25 1m9l n LYS 3 Cb 0.11 0.02 -0.06 0.00 0.02 0.00 0.00 35.03 35.13 1m9l n LYS 3 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1m9l s ALA 4 N -2.01 -0.44 0.00 3.14 0.00 -1.26 -4.94 121.76 116.25 1m9l s ALA 4 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 50.80 1m9l s ALA 4 Cb 0.00 -2.12 0.00 0.00 0.00 0.00 0.00 23.12 21.00 1m9l s ALA 4 CO 0.00 -2.13 0.00 0.25 0.00 0.00 0.00 175.76 173.88 1m9l n THR 5 N 3.64 0.00 -2.56 0.00 -2.24 -1.25 -4.37 114.28 107.50 1m9l n THR 5 Ca 0.17 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.65 1m9l n THR 5 Cb 0.49 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.70 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 2.76 4.74 0.05 4.28 2.01 -1.26 -2.37 115.64 125.85 1m9l s THR 6 Ca 0.00 0.72 -0.20 0.00 0.31 0.00 0.00 61.69 62.52 1m9l s THR 6 Cb 0.00 -3.77 -0.09 0.00 0.01 0.00 0.00 72.50 68.64 1m9l s THR 6 CO 0.00 -0.71 1.32 -0.29 -0.69 0.00 0.00 174.62 174.24 1m9l h ILE 7 N 0.68 0.00 -0.22 1.82 2.10 -1.91 0.17 117.51 120.15 1m9l h ILE 7 Ca -0.47 0.00 0.03 0.00 1.08 0.00 0.00 64.86 65.51 1m9l h ILE 7 Cb 1.19 0.00 -0.06 0.00 -1.09 0.00 0.00 36.82 36.86 1m9l h ILE 7 CO 0.63 0.00 -0.49 0.11 -1.08 0.00 0.00 178.15 177.31 1m9l h LYS 8 N -0.53 -0.44 0.46 2.19 1.57 -1.96 0.51 116.57 118.36 1m9l h LYS 8 Ca -0.03 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1m9l h LYS 8 Cb 0.48 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 1m9l h LYS 8 CO -0.08 -0.29 -0.47 -0.44 -0.57 0.00 0.00 179.45 177.60 1m9l h ASP 9 N -0.46 -1.29 -0.45 0.86 3.32 -1.97 -1.77 116.42 114.65 1m9l h ASP 9 Ca 0.04 0.10 0.09 0.00 0.02 0.00 0.00 57.03 57.29 1m9l h ASP 9 Cb 0.58 0.43 -0.10 0.00 0.22 0.00 0.00 39.33 40.46 1m9l h ASP 9 CO -0.45 -0.62 -0.25 0.00 -1.72 0.00 0.00 179.24 176.20 1m9l h ALA 10 N -0.97 0.03 -0.09 3.45 0.00 -0.42 0.12 119.26 121.39 1m9l h ALA 10 Ca -0.06 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1m9l h ALA 10 Cb 0.81 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 1m9l h ALA 10 CO -0.06 -0.61 0.05 0.82 0.00 0.00 0.00 179.25 179.45 1m9l h ILE 11 N -0.16 1.06 -0.99 0.00 2.04 -0.78 0.57 117.51 119.25 1m9l h ILE 11 Ca 0.21 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.94 1m9l h ILE 11 Cb 0.49 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 1m9l h ILE 11 CO -0.55 0.06 0.65 -0.09 0.00 0.00 0.00 178.15 178.22 1m9l h ARG 12 N 0.07 1.22 -0.33 2.37 2.43 -0.92 -1.38 114.38 117.84 1m9l h ARG 12 Ca 0.03 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.09 1m9l h ARG 12 Cb 0.05 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.30 1m9l h ARG 12 CO -0.01 0.80 0.05 0.82 -1.51 0.00 0.00 179.97 180.13 1m9l h ILE 13 N 1.25 1.17 -0.06 1.20 2.04 -0.08 0.90 117.51 123.94 1m9l h ILE 13 Ca 0.40 -0.62 -0.19 0.00 1.00 0.00 0.00 64.86 65.44 1m9l h ILE 13 Cb 0.00 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1m9l h ILE 13 CO -0.13 0.22 -0.78 -0.26 0.00 0.00 0.00 178.15 177.20 1m9l h PHE 14 N 0.48 0.56 0.00 1.37 0.04 0.00 0.27 116.94 119.66 1m9l h PHE 14 Ca 0.11 -0.26 -0.03 0.00 2.80 0.00 0.00 57.97 60.59 1m9l h PHE 14 Cb 0.23 -0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.29 1m9l h PHE 14 CO 0.01 1.03 -0.13 0.93 -0.60 0.00 0.00 178.31 179.55 1m9l h GLU 15 N 0.26 0.00 0.00 1.51 5.08 -0.23 0.21 114.58 121.41 1m9l h GLU 15 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1m9l h GLU 15 Cb 1.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1m9l h GLU 15 CO 0.13 0.13 -0.78 0.39 -1.00 0.00 0.00 179.01 177.89 1m9l n GLU 16 N -3.64 0.44 0.15 2.33 1.02 0.20 -2.56 120.64 118.58 1m9l n GLU 16 Ca -0.02 0.24 -0.10 0.00 -0.02 0.00 0.00 57.16 57.26 1m9l n GLU 16 Cb 0.26 -1.35 -0.06 0.00 -0.02 0.00 0.00 31.44 30.27 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 -0.86 -0.43 -0.82 3.49 2.43 -0.60 -3.06 114.38 114.53 1m9l h ARG 17 Ca 0.00 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1m9l h ARG 17 Cb 0.78 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.38 1m9l h ARG 17 CO 0.00 -0.13 0.53 -0.22 -1.51 0.00 0.00 179.97 178.64 1m9l h LYS 18 N -0.99 1.10 -1.33 0.20 3.11 -1.52 -3.47 116.57 113.66 1m9l h LYS 18 Ca -0.05 -0.08 0.00 0.00 -2.81 0.00 0.00 60.65 57.72 1m9l h LYS 18 Cb 0.49 -0.24 0.00 0.00 -1.00 0.00 0.00 32.23 31.48 1m9l h LYS 18 CO 0.07 0.74 0.00 0.45 -2.81 0.00 0.00 179.45 177.91 1m9l n SER 19 N -4.40 -1.55 0.00 4.20 2.88 0.66 -5.00 113.62 110.42 1m9l n SER 19 Ca 0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 1m9l n SER 19 Cb 0.04 -0.39 0.00 0.00 -0.75 0.00 0.00 64.21 63.11 1m9l n SER 19 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1m9l n VAL 20 N -1.10 0.00 -4.04 2.46 0.24 -0.81 -4.90 118.33 110.18 1m9l n VAL 20 Ca 0.00 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 61.97 1m9l n VAL 20 Cb 0.39 0.00 -0.15 0.00 -1.47 0.00 0.00 33.84 32.61 1m9l n VAL 20 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1m9l s VAL 21 N 0.36 2.33 -0.14 3.34 0.11 -1.26 -4.29 120.40 120.85 1m9l s VAL 21 Ca 0.00 -1.56 -0.16 0.00 -2.93 0.00 0.00 61.98 57.34 1m9l s VAL 21 Cb 0.00 -2.35 -0.05 0.00 -1.53 0.00 0.00 36.38 32.45 1m9l s VAL 21 CO 0.00 -0.02 -0.30 0.00 -3.33 0.00 0.00 175.10 171.45 1m9l n ALA 22 N 4.48 1.09 -4.03 1.54 0.00 -1.26 -4.01 120.51 118.32 1m9l n ALA 22 Ca -0.14 -0.72 -0.32 0.00 0.00 0.00 0.00 53.44 52.26 1m9l n ALA 22 Cb 0.43 0.05 -0.02 0.00 0.00 0.00 0.00 19.45 19.91 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 -4.30 -2.93 -1.76 0.00 -1.04 -1.26 -1.61 114.28 101.37 1m9l n THR 23 Ca -0.12 -0.60 0.00 0.00 -2.04 0.00 0.00 64.05 61.29 1m9l n THR 23 Cb 0.45 -2.43 0.00 0.00 -1.82 0.00 0.00 70.33 66.53 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 -4.54 -2.04 -2.10 -2.82 2.13 -1.26 -4.86 120.64 105.15 1m9l n GLU 24 Ca -0.24 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.29 1m9l n GLU 24 Cb 0.65 -4.06 0.03 0.00 0.27 0.00 0.00 31.44 28.33 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 -1.48 3.10 0.17 4.31 0.00 -0.64 -4.79 121.76 122.43 1m9l s ALA 25 Ca 0.00 -0.40 -0.11 0.00 0.00 0.00 0.00 51.96 51.45 1m9l s ALA 25 Cb 0.00 -2.88 0.05 0.00 0.00 0.00 0.00 23.12 20.29 1m9l s ALA 25 CO 0.00 -0.87 1.63 0.93 0.00 0.00 0.00 175.76 177.46 1m9l h GLU 26 N -0.36 0.98 -5.33 0.00 3.07 -1.88 -3.39 114.58 107.67 1m9l h GLU 26 Ca -0.45 -0.30 -0.64 0.00 -0.50 0.00 0.00 59.36 57.47 1m9l h GLU 26 Cb 1.23 -0.10 -0.15 0.00 -0.84 0.00 0.00 28.75 28.90 1m9l h GLU 26 CO 0.62 0.97 0.41 0.15 -1.40 0.00 0.00 179.01 179.76 1m9l s LYS 27 N -5.07 3.14 -0.36 2.33 1.02 -1.26 0.23 119.74 119.78 1m9l s LYS 27 Ca -0.12 -0.81 0.02 0.00 0.02 0.00 0.00 55.97 55.08 1m9l s LYS 27 Cb 0.13 -4.18 0.10 0.00 -0.52 0.00 0.00 37.83 33.36 1m9l s LYS 27 CO 0.84 -1.62 0.09 0.08 -0.92 0.00 0.00 175.35 173.81 1m9l s VAL 28 N 3.61 2.53 -0.78 3.17 1.01 -0.70 -4.83 120.40 124.42 1m9l s VAL 28 Ca 0.21 -2.27 -0.23 0.00 0.00 0.00 0.00 61.98 59.69 1m9l s VAL 28 Cb -0.18 -2.83 0.06 0.00 0.00 0.00 0.00 36.38 33.44 1m9l s VAL 28 CO 0.12 -0.62 1.16 -1.61 0.00 0.00 0.00 175.10 174.15 1m9l s GLU 29 N 0.96 3.28 0.00 2.72 8.01 -1.26 -1.33 118.70 131.09 1m9l s GLU 29 Ca 0.10 -0.85 0.00 0.00 0.01 0.00 0.00 54.97 54.23 1m9l s GLU 29 Cb -0.20 -4.50 0.00 0.00 -4.31 0.00 0.00 34.13 25.12 1m9l s GLU 29 CO -0.07 -1.97 0.00 1.28 0.01 0.00 0.00 175.26 174.51 1m9l n LEU 30 N 8.20 0.00 0.00 1.80 4.77 -0.37 -4.49 117.00 126.91 1m9l n LEU 30 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1m9l n LEU 30 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1m9l n LEU 30 CO 0.64 0.00 0.00 1.57 -1.33 0.00 0.00 177.39 178.27 1m9l n HIS 31 N 0.00 0.00 -3.75 -1.77 -0.00 -1.26 -4.68 115.22 103.76 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 -0.02 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 0.00 -0.22 -0.02 1.57 0.00 -1.26 -0.89 107.32 106.50 1m9l s GLY 32 Ca 0.00 -0.03 -0.28 0.00 0.00 0.00 0.00 44.72 44.41 1m9l s GLY 32 CO 0.00 -0.01 0.62 -0.29 0.00 0.00 0.00 173.10 173.42 1m9l s MET 33 N -3.72 1.03 0.05 2.90 0.00 -0.58 0.27 119.30 119.27 1m9l s MET 33 Ca 0.09 0.12 -0.28 0.00 0.00 0.00 0.00 55.69 55.63 1m9l s MET 33 Cb -0.04 0.48 -0.05 0.00 0.00 0.00 0.00 34.83 35.23 1m9l s MET 33 CO 0.02 -0.34 0.89 0.96 0.00 0.00 0.00 175.02 176.56 1m9l s ILE 34 N -1.49 4.69 0.29 10.11 -4.36 -1.26 -3.42 121.20 125.76 1m9l s ILE 34 Ca -0.10 1.90 -0.05 0.00 -0.26 0.00 0.00 60.65 62.14 1m9l s ILE 34 Cb -0.01 -4.24 0.44 0.00 1.25 0.00 0.00 42.46 39.89 1m9l s ILE 34 CO 0.07 0.29 1.57 -0.65 0.24 0.00 0.00 174.94 176.45 1m9l h PRO 35 N 5.98 0.00 0.00 0.37 0.11 -1.95 -1.88 132.00 134.63 1m9l h PRO 35 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1m9l h PRO 35 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1m9l h PRO 35 CO 0.73 0.00 0.00 -2.30 -0.21 0.00 0.00 178.00 176.22 1m9l n PRO 36 N -5.57 0.28 -0.96 1.05 -0.02 -1.26 -0.66 135.00 127.85 1m9l n PRO 36 Ca 0.18 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.25 1m9l n PRO 36 Cb 0.59 -1.19 -0.07 0.00 -0.02 0.00 0.00 33.50 32.81 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 -0.69 0.00 0.00 4.25 0.00 -0.71 -4.67 119.36 117.54 1m9l n ILE 37 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 62.75 62.78 1m9l n ILE 37 Cb 0.01 -0.33 0.00 0.00 0.00 0.00 0.00 39.64 39.32 1m9l n ILE 37 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1m9l n GLU 38 N 3.94 0.00 -3.32 9.51 4.07 -1.25 -1.75 120.64 131.85 1m9l n GLU 38 Ca 0.29 0.00 -0.38 0.00 -0.06 0.00 0.00 57.16 57.01 1m9l n GLU 38 Cb -0.03 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.29 1m9l n GLU 38 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 1m9l s LYS 39 N 1.53 4.29 -1.08 5.31 1.02 -1.26 -1.68 119.74 127.87 1m9l s LYS 39 Ca 0.00 0.49 -0.05 0.00 0.02 0.00 0.00 55.97 56.43 1m9l s LYS 39 Cb 0.00 -3.40 0.31 0.00 -0.52 0.00 0.00 37.83 34.22 1m9l s LYS 39 CO 0.00 0.25 1.44 -0.12 -0.92 0.00 0.00 175.35 175.99 1m9l n MET 40 N 3.34 4.37 -0.10 1.68 1.56 -1.26 -3.91 117.12 122.79 1m9l n MET 40 Ca -0.08 -4.55 0.20 0.00 -0.27 0.00 0.00 57.70 53.01 1m9l n MET 40 Cb 0.52 -2.51 0.63 0.00 2.15 0.00 0.00 33.22 34.00 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 5.58 0.15 0.43 6.12 3.58 -1.78 -0.12 116.42 130.38 1m9l h ASP 41 Ca 0.20 0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.65 1m9l h ASP 41 Cb 0.65 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.66 1m9l h ASP 41 CO 1.30 0.07 -0.33 0.00 -2.88 0.00 0.00 179.24 177.40 1m9l h ALA 42 N 1.67 -0.77 -0.27 -0.78 0.00 -1.78 -1.56 119.26 115.77 1m9l h ALA 42 Ca 0.33 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1m9l h ALA 42 Cb 1.09 0.44 -0.06 0.00 0.00 0.00 0.00 17.79 19.26 1m9l h ALA 42 CO -0.05 -0.96 -0.11 0.00 0.00 0.00 0.00 179.25 178.14 1m9l h THR 43 N -0.75 0.64 -0.84 0.00 1.03 -1.46 0.20 112.91 111.73 1m9l h THR 43 Ca -0.04 0.00 0.14 0.00 -0.01 0.00 0.00 66.41 66.49 1m9l h THR 43 Cb 0.65 0.64 -0.14 0.00 -1.07 0.00 0.00 68.15 68.23 1m9l h THR 43 CO 0.00 0.00 -0.37 0.25 -0.01 0.00 0.00 175.52 175.40 1m9l h LEU 44 N -0.06 -1.32 0.00 0.00 5.85 -0.75 0.45 115.31 119.49 1m9l h LEU 44 Ca 0.14 0.28 -0.13 0.00 0.84 0.00 0.00 57.88 59.00 1m9l h LEU 44 Cb 0.27 0.69 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 1m9l h LEU 44 CO -0.31 -0.29 -0.96 -0.24 -0.34 0.00 0.00 178.44 176.29 1m9l n SER 45 N -5.46 1.84 0.00 1.25 2.88 -0.62 -4.12 113.62 109.38 1m9l n SER 45 Ca 0.08 0.51 0.00 0.00 -1.33 0.00 0.00 58.87 58.13 1m9l n SER 45 Cb 0.38 -0.92 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 1m9l n SER 45 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1m9l n THR 46 N -4.51 1.18 -0.30 2.46 5.66 0.68 -1.87 114.28 117.59 1m9l n THR 46 Ca -0.22 0.36 0.14 0.00 -3.05 0.00 0.00 64.05 61.28 1m9l n THR 46 Cb 0.50 -1.36 0.32 0.00 -1.55 0.00 0.00 70.33 68.24 1m9l n THR 46 CO 0.00 0.00 0.00 0.17 -3.05 0.00 0.00 175.07 172.19 1m9l h LEU 47 N 0.00 0.13 -0.85 1.09 -0.00 -0.22 0.13 115.31 115.59 1m9l h LEU 47 Ca 0.00 0.19 0.19 0.00 -0.00 0.00 0.00 57.88 58.26 1m9l h LEU 47 Cb 0.12 0.23 -0.16 0.00 -0.00 0.00 0.00 40.66 40.85 1m9l h LEU 47 CO 0.00 -0.12 -0.09 0.11 -0.00 0.00 0.00 178.44 178.34 1m9l h LYS 48 N 0.26 0.04 0.00 0.17 1.57 -1.65 0.50 116.57 117.45 1m9l h LYS 48 Ca 0.58 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.32 1m9l h LYS 48 Cb 1.17 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 1m9l h LYS 48 CO -0.62 0.02 -0.96 0.00 -0.57 0.00 0.00 179.45 177.32 1m9l h ALA 49 N 1.83 0.58 -1.67 3.86 0.00 -1.13 -3.49 119.26 119.25 1m9l h ALA 49 Ca 0.45 -0.17 -0.67 0.00 0.00 0.00 0.00 54.91 54.51 1m9l h ALA 49 Cb 0.78 0.05 0.06 0.00 0.00 0.00 0.00 17.79 18.68 1m9l h ALA 49 CO -0.81 0.19 0.36 0.00 0.00 0.00 0.00 179.25 178.99 1m9l n LYS 51 N 2.20 0.00 -3.17 0.00 4.81 -1.20 -4.53 118.16 116.27 1m9l n LYS 51 Ca 0.17 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.18 1m9l n LYS 51 Cb 0.20 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.26 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 -2.54 3.55 -2.52 5.64 -0.00 0.14 -0.26 115.22 119.23 1m9l n HIS 52 Ca 0.00 -3.19 -0.43 0.00 -0.00 0.00 0.00 57.72 54.10 1m9l n HIS 52 Cb 0.00 -1.42 -0.02 0.00 -0.00 0.00 0.00 29.99 28.55 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 -2.16 3.64 -0.32 0.27 2.96 -0.20 -1.72 118.68 121.17 1m9l s LEU 53 Ca 0.31 0.64 -0.06 0.00 -0.22 0.00 0.00 54.13 54.80 1m9l s LEU 53 Cb -0.01 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.16 1m9l s LEU 53 CO 0.02 -1.29 0.08 0.00 -1.32 0.00 0.00 176.35 173.84 1m9l s ALA 54 N 4.72 3.01 0.00 5.97 0.00 -0.44 -0.48 121.76 134.54 1m9l s ALA 54 Ca 0.52 -1.63 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1m9l s ALA 54 Cb -0.10 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.86 1m9l s ALA 54 CO 0.31 -1.16 0.00 1.28 0.00 0.00 0.00 175.76 176.18 1m9l n LEU 55 N 4.80 0.00 0.00 0.00 7.99 -0.31 -1.24 117.00 128.24 1m9l n LEU 55 Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.87 1m9l n LEU 55 Cb 0.46 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.77 1m9l n LEU 55 CO 0.31 -0.05 0.00 -0.24 -1.51 0.00 0.00 177.39 175.90 1m9l n SER 56 N -1.17 0.00 -4.53 -1.43 2.88 -1.21 -4.16 113.62 103.99 1m9l n SER 56 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 1m9l n SER 56 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 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 0.56 3.99 0.28 2.46 -1.32 -0.07 -1.00 115.64 120.54 1m9l s THR 57 Ca 0.00 0.36 -0.08 0.00 -1.21 0.00 0.00 61.69 60.76 1m9l s THR 57 Cb 0.00 -4.78 -0.00 0.00 -1.51 0.00 0.00 72.50 66.21 1m9l s THR 57 CO 0.00 -1.56 0.44 0.54 -2.21 0.00 0.00 174.62 171.83 1m9l s ASN 58 N 3.43 0.26 0.04 8.08 4.22 -0.46 -1.52 114.94 128.99 1m9l s ASN 58 Ca 0.34 -1.17 0.02 0.00 -2.14 0.00 0.00 52.86 49.90 1m9l s ASN 58 Cb -0.10 0.59 -0.03 0.00 1.28 0.00 0.00 41.25 43.00 1m9l s ASN 58 CO 0.17 -1.17 -0.07 0.20 -2.04 0.00 0.00 177.10 174.19 1m9l s ASN 59 N -3.11 0.76 -0.21 3.54 -0.87 -1.22 -1.47 114.94 112.36 1m9l s ASN 59 Ca 0.27 -0.60 -0.02 0.00 -1.57 0.00 0.00 52.86 50.94 1m9l s ASN 59 Cb 0.00 0.06 0.06 0.00 -0.02 0.00 0.00 41.25 41.35 1m9l s ASN 59 CO 0.13 -0.26 0.02 -0.63 -2.57 0.00 0.00 177.10 173.79 1m9l s ILE 60 N -1.71 0.72 -0.21 0.60 1.01 0.31 -3.92 121.20 118.00 1m9l s ILE 60 Ca -0.08 -0.72 -0.19 0.00 0.00 0.00 0.00 60.65 59.66 1m9l s ILE 60 Cb -0.08 -1.20 -0.15 0.00 0.01 0.00 0.00 42.46 41.04 1m9l s ILE 60 CO -0.01 -0.22 0.06 1.21 0.00 0.00 0.00 174.94 175.98 1m9l n GLU 61 N 4.97 0.55 -2.98 2.79 2.13 0.16 -3.93 120.64 124.34 1m9l n GLU 61 Ca -0.09 0.51 -0.08 0.00 0.66 0.00 0.00 57.16 58.16 1m9l n GLU 61 Cb 0.46 -1.69 -0.02 0.00 0.27 0.00 0.00 31.44 30.46 1m9l n GLU 61 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1m9l s LYS 62 N -2.38 0.98 -1.23 5.31 2.20 -0.72 -4.69 119.74 119.21 1m9l s LYS 62 Ca -0.29 -1.13 -0.20 0.00 -0.36 0.00 0.00 55.97 54.00 1m9l s LYS 62 Cb 0.07 -0.32 0.04 0.00 -1.51 0.00 0.00 37.83 36.11 1m9l s LYS 62 CO 0.52 -1.31 1.74 -1.50 -0.36 0.00 0.00 175.35 174.43 1m9l s ILE 63 N 0.90 3.99 0.44 5.43 -1.16 -1.23 -3.81 121.20 125.76 1m9l s ILE 63 Ca 0.28 -1.57 0.34 0.00 -0.51 0.00 0.00 60.65 59.18 1m9l s ILE 63 Cb -0.01 -5.06 0.37 0.00 0.61 0.00 0.00 42.46 38.37 1m9l s ILE 63 CO -0.08 -1.83 2.16 -1.28 -2.81 0.00 0.00 174.94 171.10 1m9l h SER 64 N 8.29 0.00 0.00 4.50 0.87 -1.61 -3.35 113.55 122.24 1m9l h SER 64 Ca 0.37 0.00 -0.62 0.00 -1.23 0.00 0.00 61.79 60.31 1m9l h SER 64 Cb 0.90 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.88 1m9l h SER 64 CO 1.41 0.05 3.48 -1.54 -0.53 0.00 0.00 176.83 179.70 1m9l n SER 65 N -3.37 7.13 -0.07 6.23 3.41 -1.26 -4.57 113.62 121.12 1m9l n SER 65 Ca -0.02 -2.57 -0.12 0.00 -0.26 0.00 0.00 58.87 55.90 1m9l n SER 65 Cb 0.19 -1.48 -0.05 0.00 -0.26 0.00 0.00 64.21 62.61 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 7.94 0.43 -2.62 1.04 8.10 -1.91 -1.32 115.31 126.98 1m9l h LEU 66 Ca 0.75 -0.40 -0.00 0.00 0.11 0.00 0.00 57.88 58.34 1m9l h LEU 66 Cb 0.33 -0.12 -0.00 0.00 -0.44 0.00 0.00 40.66 40.43 1m9l h LEU 66 CO 1.75 0.73 -0.01 0.77 -4.11 0.00 0.00 178.44 177.57 1m9l h SER 67 N 0.13 0.00 0.01 0.17 4.64 -1.96 0.08 113.55 116.63 1m9l h SER 67 Ca 0.05 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1m9l h SER 67 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1m9l h SER 67 CO 0.03 0.01 -0.00 1.23 -0.87 0.00 0.00 176.83 177.22 1m9l h GLY 68 N 0.39 -0.01 1.52 -0.77 0.00 -1.76 -3.29 103.07 99.14 1m9l h GLY 68 Ca -0.00 0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.37 1m9l h GLY 68 CO 0.00 -0.01 0.20 -0.33 0.00 0.00 0.00 176.54 176.41 1m9l h MET 69 N -0.98 0.00 0.00 4.80 2.07 -0.40 -3.20 114.93 117.22 1m9l h MET 69 Ca -0.00 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.63 1m9l h MET 69 Cb 0.71 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.44 1m9l h MET 69 CO 0.00 0.00 0.00 -1.91 1.07 0.00 0.00 176.91 176.07 1m9l n GLU 70 N -3.53 0.00 0.00 1.72 2.13 -0.06 -1.47 120.64 119.42 1m9l n GLU 70 Ca 0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.83 1m9l n GLU 70 Cb 0.31 -1.43 0.00 0.00 0.27 0.00 0.00 31.44 30.59 1m9l n GLU 70 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1m9l n ASN 71 N -0.77 0.25 -4.77 4.31 4.13 -1.21 -4.65 115.26 112.55 1m9l n ASN 71 Ca 0.00 -0.59 -0.34 0.00 1.68 0.00 0.00 54.58 55.32 1m9l n ASN 71 Cb 0.00 0.57 0.02 0.00 -1.54 0.00 0.00 39.78 38.83 1m9l n ASN 71 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1m9l s LEU 72 N -1.13 3.60 0.08 3.41 2.96 -0.54 -4.76 118.68 122.30 1m9l s LEU 72 Ca 0.00 2.12 0.00 0.00 -0.22 0.00 0.00 54.13 56.03 1m9l s LEU 72 Cb 0.00 -4.57 0.00 0.00 0.50 0.00 0.00 46.19 42.12 1m9l s LEU 72 CO 0.00 -1.41 0.00 0.54 -1.32 0.00 0.00 176.35 174.16 1m9l n ARG 73 N -1.76 0.00 -3.34 1.98 1.74 -1.25 -3.26 116.66 110.77 1m9l n ARG 73 Ca 0.11 0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.74 1m9l n ARG 73 Cb 0.51 -0.33 -0.06 0.00 -1.02 0.00 0.00 32.46 31.57 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 -2.00 5.18 -0.36 0.55 1.01 0.64 -1.49 121.20 124.72 1m9l s ILE 74 Ca 0.00 -1.41 -0.16 0.00 0.00 0.00 0.00 60.65 59.08 1m9l s ILE 74 Cb 0.00 -4.27 -0.00 0.00 0.01 0.00 0.00 42.46 38.20 1m9l s ILE 74 CO 0.00 -0.80 0.39 -0.22 0.00 0.00 0.00 174.94 174.31 1m9l s LEU 75 N 1.60 4.55 -0.72 2.97 0.20 -0.43 -1.03 118.68 125.82 1m9l s LEU 75 Ca 0.03 -0.34 0.04 0.00 0.69 0.00 0.00 54.13 54.55 1m9l s LEU 75 Cb -0.29 -2.36 0.25 0.00 -0.43 0.00 0.00 46.19 43.36 1m9l s LEU 75 CO 0.04 -0.41 0.85 -1.20 -0.29 0.00 0.00 176.35 175.33 1m9l n SER 76 N 5.45 4.16 -2.97 3.68 7.64 0.37 -0.60 113.62 131.35 1m9l n SER 76 Ca -0.08 -3.42 0.00 0.00 1.01 0.00 0.00 58.87 56.38 1m9l n SER 76 Cb 0.49 -0.78 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 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 1.05 0.00 0.10 -3.43 0.00 0.39 -1.16 117.00 113.94 1m9l n LEU 77 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.29 1m9l n LEU 77 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.81 1m9l n LEU 77 CO 0.45 -0.08 0.00 0.61 0.00 0.00 0.00 177.39 178.37 1m9l n GLY 78 N 4.69 -1.17 2.81 -3.96 0.00 -1.23 -4.56 105.19 101.77 1m9l n GLY 78 Ca 0.00 0.21 -0.17 0.00 0.00 0.00 0.00 46.02 46.05 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 0.13 0.34 1.61 3.00 -0.17 -0.49 118.95 121.36 1m9l s ARG 79 Ca 0.00 0.39 -0.14 0.00 -1.00 0.00 0.00 55.73 54.98 1m9l s ARG 79 Cb 0.00 -0.77 0.03 0.00 0.00 0.00 0.00 34.95 34.21 1m9l s ARG 79 CO 0.00 -0.49 0.67 0.54 0.00 0.00 0.00 175.30 176.02 1m9l s ASN 80 N 2.32 0.10 -0.05 -2.12 6.03 -0.29 -1.35 114.94 119.59 1m9l s ASN 80 Ca 0.05 -1.06 0.06 0.00 -1.03 0.00 0.00 52.86 50.87 1m9l s ASN 80 Cb -0.14 0.76 -0.01 0.00 -3.03 0.00 0.00 41.25 38.82 1m9l s ASN 80 CO -0.09 -1.47 -0.23 -0.76 -2.03 0.00 0.00 177.10 172.52 1m9l s LEU 81 N -3.06 2.02 -0.02 3.54 1.02 -0.54 -1.41 118.68 120.23 1m9l s LEU 81 Ca 0.18 -0.45 0.03 0.00 0.02 0.00 0.00 54.13 53.90 1m9l s LEU 81 Cb -0.04 -1.24 0.00 0.00 0.02 0.00 0.00 46.19 44.93 1m9l s LEU 81 CO 0.12 0.23 -0.09 -0.63 0.02 0.00 0.00 176.35 175.99 1m9l s ILE 82 N -0.18 0.80 0.00 -0.59 1.01 -0.17 -0.53 121.20 121.54 1m9l s ILE 82 Ca -0.01 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.25 1m9l s ILE 82 Cb -0.12 -0.70 0.00 0.00 0.01 0.00 0.00 42.46 41.65 1m9l s ILE 82 CO 0.02 0.24 0.00 0.29 0.00 0.00 0.00 174.94 175.50 1m9l n LYS 83 N 3.17 0.00 0.00 2.79 4.01 -1.25 -4.11 118.16 122.76 1m9l n LYS 83 Ca -0.17 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.63 1m9l n LYS 83 Cb 0.55 -0.40 0.00 0.00 -0.51 0.00 0.00 35.03 34.67 1m9l n LYS 83 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1m9l n LYS 84 N -2.57 3.46 -3.28 1.97 5.02 -1.26 -4.52 118.16 116.97 1m9l n LYS 84 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.24 1m9l n LYS 84 Cb 0.27 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.22 1m9l n LYS 84 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1m9l s ILE 85 N 2.31 -0.74 0.30 -0.18 -1.16 -1.26 -4.73 121.20 115.75 1m9l s ILE 85 Ca 0.00 -0.06 0.00 0.00 -0.51 0.00 0.00 60.65 60.08 1m9l s ILE 85 Cb 0.00 -0.88 0.00 0.00 0.61 0.00 0.00 42.46 42.19 1m9l s ILE 85 CO 0.00 -0.09 0.00 1.21 -2.81 0.00 0.00 174.94 173.25 1m9l n GLU 86 N 5.39 0.00 0.15 3.50 2.13 -1.26 -4.90 120.64 125.65 1m9l n GLU 86 Ca -0.03 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.83 1m9l n GLU 86 Cb 0.50 0.00 0.08 0.00 0.27 0.00 0.00 31.44 32.30 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 -0.77 4.31 -1.07 -1.94 -3.26 115.58 112.85 1m9l h ASN 87 Ca 0.00 0.00 0.02 0.00 0.07 0.00 0.00 56.30 56.39 1m9l h ASN 87 Cb 0.00 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.21 1m9l h ASN 87 CO 0.00 0.44 0.51 -0.07 0.07 0.00 0.00 177.43 178.37 1m9l h LEU 88 N 0.00 0.86 -0.08 6.14 3.38 -1.92 -1.11 115.31 122.58 1m9l h LEU 88 Ca -0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1m9l h LEU 88 Cb 1.29 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1m9l h LEU 88 CO 0.06 0.61 0.04 0.44 0.09 0.00 0.00 178.44 179.68 1m9l h ASP 89 N 1.00 0.10 -0.03 -0.43 3.32 -1.92 0.98 116.42 119.44 1m9l h ASP 89 Ca 0.29 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 1m9l h ASP 89 Cb -0.06 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.46 1m9l h ASP 89 CO -0.07 0.17 -0.07 0.00 -1.72 0.00 0.00 179.24 177.55 1m9l h ALA 90 N 0.94 0.05 -0.90 3.45 0.00 -1.65 -0.08 119.26 121.07 1m9l h ALA 90 Ca 0.03 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1m9l h ALA 90 Cb 0.09 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1m9l h ALA 90 CO -0.00 -0.11 0.55 -0.39 0.00 0.00 0.00 179.25 179.30 1m9l h VAL 91 N -0.44 1.24 -0.11 0.00 -1.51 -1.27 -1.36 116.25 112.80 1m9l h VAL 91 Ca 0.00 -0.52 -0.10 0.00 -1.23 0.00 0.00 66.70 64.86 1m9l h VAL 91 Cb 0.65 -0.04 -0.01 0.00 -2.13 0.00 0.00 31.29 29.76 1m9l h VAL 91 CO 0.01 0.25 -0.36 0.00 -1.23 0.00 0.00 177.57 176.25 1m9l h ALA 92 N 1.37 1.18 -0.17 5.19 0.00 -0.74 0.18 119.26 126.27 1m9l h ALA 92 Ca 0.32 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1m9l h ALA 92 Cb -0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1m9l h ALA 92 CO -0.06 0.55 -0.03 -0.44 0.00 0.00 0.00 179.25 179.27 1m9l h ASP 93 N 0.20 0.32 0.06 0.00 3.32 0.05 -3.38 116.42 116.99 1m9l h ASP 93 Ca 0.02 -0.35 -0.36 0.00 0.02 0.00 0.00 57.03 56.36 1m9l h ASP 93 Cb 0.74 -0.09 -0.07 0.00 0.22 0.00 0.00 39.33 40.13 1m9l h ASP 93 CO 0.06 0.59 -2.31 1.07 -1.72 0.00 0.00 179.24 176.93 1m9l n THR 94 N -4.69 1.43 -1.19 0.35 5.66 -0.68 -5.01 114.28 110.15 1m9l n THR 94 Ca -0.05 -0.83 -0.34 0.00 -3.05 0.00 0.00 64.05 59.78 1m9l n THR 94 Cb 0.25 -0.63 0.11 0.00 -1.55 0.00 0.00 70.33 68.51 1m9l n THR 94 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1m9l n LEU 95 N -2.84 3.66 0.00 1.09 4.77 0.64 -4.66 117.00 119.65 1m9l n LEU 95 Ca -0.32 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1m9l n LEU 95 Cb 1.13 -1.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 1m9l n LEU 95 CO 0.42 -2.00 -0.23 1.21 -1.33 0.00 0.00 177.39 175.46 1m9l n GLU 96 N -2.54 0.00 -3.58 3.23 2.13 -1.02 -4.68 120.64 114.19 1m9l n GLU 96 Ca 0.13 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.56 1m9l n GLU 96 Cb 0.50 -0.47 -0.05 0.00 0.27 0.00 0.00 31.44 31.69 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 -1.75 3.39 -1.40 5.31 2.02 -0.56 -1.59 118.70 124.13 1m9l s GLU 97 Ca 0.00 -3.15 -0.15 0.00 0.02 0.00 0.00 54.97 51.69 1m9l s GLU 97 Cb 0.00 -4.07 0.06 0.00 0.10 0.00 0.00 34.13 30.22 1m9l s GLU 97 CO 0.00 -1.25 2.07 1.28 0.02 0.00 0.00 175.26 177.38 1m9l n LEU 98 N 2.60 6.32 -4.41 1.80 4.77 -0.46 -1.32 117.00 126.30 1m9l n LEU 98 Ca 0.20 -4.11 -0.45 0.00 -0.03 0.00 0.00 56.01 51.62 1m9l n LEU 98 Cb 0.38 -1.67 -0.03 0.00 -2.33 0.00 0.00 43.42 39.77 1m9l n LEU 98 CO 0.38 0.86 0.73 0.26 -1.33 0.00 0.00 177.39 178.29 1m9l s TRP 99 N 3.30 3.25 -0.36 -1.77 0.51 0.23 -0.69 118.94 123.41 1m9l s TRP 99 Ca 0.48 -1.44 0.14 0.00 -2.12 0.00 0.00 56.10 53.16 1m9l s TRP 99 Cb 0.11 -4.11 0.40 0.00 -0.81 0.00 0.00 33.47 29.05 1m9l s TRP 99 CO -0.04 -1.33 0.84 0.44 -0.51 0.00 0.00 176.95 176.35 1m9l n ILE 100 N 5.11 0.47 0.00 2.03 -5.35 -0.51 -0.46 119.36 120.64 1m9l n ILE 100 Ca 0.14 -4.01 0.00 0.00 -0.27 0.00 0.00 62.75 58.62 1m9l n ILE 100 Cb 0.47 0.06 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 1m9l n ILE 100 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1m9l n SER 101 N 0.11 0.00 -4.08 7.28 3.41 -1.21 -3.87 113.62 115.26 1m9l n SER 101 Ca 0.19 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.48 1m9l n SER 101 Cb 0.72 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.51 1m9l n SER 101 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1m9l s TYR 102 N -4.99 2.81 -0.20 7.33 6.14 0.35 -0.36 117.35 128.43 1m9l s TYR 102 Ca 0.00 -1.79 -0.09 0.00 0.64 0.00 0.00 57.07 55.83 1m9l s TYR 102 Cb 0.00 -1.86 0.08 0.00 0.42 0.00 0.00 41.96 40.60 1m9l s TYR 102 CO 0.00 -0.81 0.46 0.54 0.64 0.00 0.00 175.55 176.39 1m9l s ASN 103 N 1.27 -0.52 -0.13 4.32 2.20 -0.23 -1.14 114.94 120.70 1m9l s ASN 103 Ca 0.00 1.05 -0.24 0.00 -0.94 0.00 0.00 52.86 52.74 1m9l s ASN 103 Cb -0.15 1.15 -0.02 0.00 -2.00 0.00 0.00 41.25 40.22 1m9l s ASN 103 CO -0.10 -0.21 0.75 -1.10 -2.94 0.00 0.00 177.10 173.49 1m9l s GLN 104 N 1.96 4.33 0.23 3.55 -0.21 -0.50 -1.28 119.66 127.74 1m9l s GLN 104 Ca -0.07 0.89 0.00 0.00 0.02 0.00 0.00 55.36 56.21 1m9l s GLN 104 Cb -0.09 -3.53 -0.05 0.00 1.00 0.00 0.00 33.01 30.34 1m9l s GLN 104 CO -0.14 -0.16 0.10 0.42 -2.12 0.00 0.00 175.29 173.39 1m9l s ILE 105 N 1.59 0.33 0.00 1.08 1.01 -0.45 -1.00 121.20 123.76 1m9l s ILE 105 Ca 0.36 -2.00 0.00 0.00 0.00 0.00 0.00 60.65 59.02 1m9l s ILE 105 Cb -0.17 -2.54 0.00 0.00 0.01 0.00 0.00 42.46 39.76 1m9l s ILE 105 CO 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 174.94 175.04 1m9l n ALA 106 N -0.36 0.00 -2.32 9.38 0.00 -1.26 -4.40 120.51 121.55 1m9l n ALA 106 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 1m9l n ALA 106 Cb 0.66 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.07 1m9l n ALA 106 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1m9l s SER 107 N -0.36 7.42 -0.01 0.00 0.01 -1.26 -4.99 113.70 114.51 1m9l s SER 107 Ca 0.00 1.82 -0.25 0.00 1.31 0.00 0.00 55.95 58.84 1m9l s SER 107 Cb 0.00 -2.59 -0.19 0.00 0.21 0.00 0.00 66.02 63.45 1m9l s SER 107 CO 0.00 -0.14 1.27 -0.07 0.41 0.00 0.00 173.24 174.71 1m9l h LEU 108 N 5.77 0.07 -0.43 2.44 -0.00 -1.98 -0.84 115.31 120.35 1m9l h LEU 108 Ca -0.43 -0.50 -0.01 0.00 -0.00 0.00 0.00 57.88 56.95 1m9l h LEU 108 Cb 1.21 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 41.83 1m9l h LEU 108 CO 0.73 0.56 0.25 -1.28 -0.00 0.00 0.00 178.44 178.69 1m9l h SER 109 N -0.41 0.53 0.24 -0.43 0.87 -1.99 -0.82 113.55 111.54 1m9l h SER 109 Ca 0.00 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 1m9l h SER 109 Cb 0.54 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 1m9l h SER 109 CO 0.01 0.45 -0.22 1.23 -0.53 0.00 0.00 176.83 177.78 1m9l h GLY 110 N 0.57 -0.91 0.37 5.77 0.00 -1.91 -1.78 103.07 105.18 1m9l h GLY 110 Ca 0.15 0.40 0.17 0.00 0.00 0.00 0.00 47.33 48.06 1m9l h GLY 110 CO -0.03 -0.30 0.59 0.16 0.00 0.00 0.00 176.54 176.97 1m9l h ILE 111 N -0.45 0.77 0.27 2.60 -0.00 -1.17 0.13 117.51 119.67 1m9l h ILE 111 Ca -0.03 -0.22 -0.00 0.00 -0.00 0.00 0.00 64.86 64.61 1m9l h ILE 111 Cb 0.38 0.06 -0.01 0.00 -0.00 0.00 0.00 36.82 37.25 1m9l h ILE 111 CO -0.01 0.12 -0.23 -0.08 -0.00 0.00 0.00 178.15 177.94 1m9l h GLU 112 N 0.65 -0.51 0.50 0.16 4.22 -0.78 0.06 114.58 118.89 1m9l h GLU 112 Ca 0.49 0.03 -0.02 0.00 0.08 0.00 0.00 59.36 59.94 1m9l h GLU 112 Cb 0.88 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1m9l h GLU 112 CO -0.24 -0.34 -0.24 0.87 -2.18 0.00 0.00 179.01 176.88 1m9l h LYS 113 N -0.52 -0.65 -0.28 1.92 1.57 -0.45 -0.64 116.57 117.51 1m9l h LYS 113 Ca -0.01 0.04 0.08 0.00 -1.87 0.00 0.00 60.65 58.89 1m9l h LYS 113 Cb 0.47 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1m9l h LYS 113 CO -0.03 -0.43 0.25 1.37 -0.57 0.00 0.00 179.45 180.04 1m9l h LEU 114 N -1.05 0.00 0.10 2.94 8.10 -1.08 -0.91 115.31 123.41 1m9l h LEU 114 Ca -0.07 0.00 -0.26 0.00 0.11 0.00 0.00 57.88 57.66 1m9l h LEU 114 Cb 0.52 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.73 1m9l h LEU 114 CO 0.11 0.00 -1.34 0.58 -4.11 0.00 0.00 178.44 173.69 1m9l h VAL 115 N 0.00 1.04 -0.44 0.15 2.07 -1.06 -3.32 116.25 114.69 1m9l h VAL 115 Ca 0.13 -2.37 0.13 0.00 0.82 0.00 0.00 66.70 65.42 1m9l h VAL 115 Cb 0.64 2.69 -0.02 0.00 -1.52 0.00 0.00 31.29 33.08 1m9l h VAL 115 CO -0.00 0.66 0.61 -1.13 0.02 0.00 0.00 177.57 177.73 1m9l h ASN 116 N -0.41 0.00 -0.97 0.57 -1.24 0.12 -3.43 115.58 110.21 1m9l h ASN 116 Ca -0.30 0.00 -0.20 0.00 0.71 0.00 0.00 56.30 56.51 1m9l h ASN 116 Cb 1.67 0.00 0.11 0.00 0.73 0.00 0.00 38.32 40.83 1m9l h ASN 116 CO 0.02 0.00 -1.15 -0.11 -1.29 0.00 0.00 177.43 174.91 1m9l n LEU 117 N -3.41 -2.36 -0.00 0.34 7.94 -0.47 -4.79 117.00 114.26 1m9l n LEU 117 Ca 0.09 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 54.98 1m9l n LEU 117 Cb 0.78 -0.49 -0.00 0.00 0.53 0.00 0.00 43.42 44.24 1m9l n LEU 117 CO 0.23 -2.15 0.03 0.03 -1.11 0.00 0.00 177.39 174.41 1m9l h ARG 118 N -1.52 -0.00 -4.32 1.96 -0.00 -1.83 -3.41 114.38 105.25 1m9l h ARG 118 Ca -0.16 0.00 -0.59 0.00 -0.50 0.00 0.00 59.98 58.73 1m9l h ARG 118 Cb 0.58 0.00 -0.38 0.00 0.00 0.00 0.00 29.97 30.18 1m9l h ARG 118 CO 0.09 -0.00 -0.80 0.54 0.00 0.00 0.00 179.97 179.80 1m9l s VAL 119 N -1.12 1.36 -0.07 2.04 0.11 -0.62 -1.57 120.40 120.53 1m9l s VAL 119 Ca -0.00 -0.90 0.04 0.00 -2.93 0.00 0.00 61.98 58.19 1m9l s VAL 119 Cb 0.00 -1.54 0.00 0.00 -1.53 0.00 0.00 36.38 33.31 1m9l s VAL 119 CO 0.00 0.07 -0.19 -1.48 -3.33 0.00 0.00 175.10 170.17 1m9l s LEU 120 N 1.51 1.90 -0.29 2.54 2.34 -0.70 -1.36 118.68 124.62 1m9l s LEU 120 Ca -0.02 -0.42 -0.03 0.00 0.06 0.00 0.00 54.13 53.72 1m9l s LEU 120 Cb -0.17 -1.11 0.04 0.00 -0.56 0.00 0.00 46.19 44.39 1m9l s LEU 120 CO -0.07 0.12 0.01 -0.31 -1.06 0.00 0.00 176.35 175.03 1m9l s TYR 121 N 0.34 3.19 -0.38 3.48 2.02 0.13 -1.09 117.35 125.04 1m9l s TYR 121 Ca -0.13 -1.62 0.02 0.00 -0.37 0.00 0.00 57.07 54.97 1m9l s TYR 121 Cb -0.16 -2.13 0.15 0.00 -0.40 0.00 0.00 41.96 39.43 1m9l s TYR 121 CO 0.05 -0.75 0.27 -1.64 -1.57 0.00 0.00 175.55 171.92 1m9l s MET 122 N 1.32 0.74 0.22 -0.62 -1.94 0.82 -1.42 119.30 118.43 1m9l s MET 122 Ca -0.02 -1.72 0.25 0.00 -1.71 0.00 0.00 55.69 52.49 1m9l s MET 122 Cb -0.19 -1.39 0.87 0.00 2.01 0.00 0.00 34.83 36.13 1m9l s MET 122 CO -0.01 -1.29 1.76 -1.13 -0.01 0.00 0.00 175.02 174.34 1m9l n SER 123 N 3.46 0.77 -3.70 3.03 3.41 -0.81 -0.67 113.62 119.12 1m9l n SER 123 Ca 0.20 0.60 -0.13 0.00 -0.26 0.00 0.00 58.87 59.29 1m9l n SER 123 Cb 0.42 -0.80 -0.13 0.00 -0.26 0.00 0.00 64.21 63.44 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 -4.44 -0.02 0.28 4.04 0.01 0.51 -0.50 114.94 114.82 1m9l s ASN 124 Ca 0.09 0.57 -0.21 0.00 -0.71 0.00 0.00 52.86 52.60 1m9l s ASN 124 Cb 0.11 0.55 0.03 0.00 0.41 0.00 0.00 41.25 42.36 1m9l s ASN 124 CO 0.53 -0.20 0.77 0.54 -1.51 0.00 0.00 177.10 177.24 1m9l s ASN 125 N 1.75 -0.20 -0.23 -1.22 2.20 0.18 -1.07 114.94 116.35 1m9l s ASN 125 Ca -0.05 -0.67 0.01 0.00 -0.94 0.00 0.00 52.86 51.21 1m9l s ASN 125 Cb -0.11 0.71 0.05 0.00 -2.00 0.00 0.00 41.25 39.91 1m9l s ASN 125 CO -0.09 -1.34 -0.09 -0.54 -2.94 0.00 0.00 177.10 172.10 1m9l s LYS 126 N -3.53 1.99 -0.20 3.55 -0.14 -0.40 -3.68 119.74 117.32 1m9l s LYS 126 Ca 0.12 -1.03 -0.18 0.00 -1.36 0.00 0.00 55.97 53.52 1m9l s LYS 126 Cb -0.05 -2.61 0.05 0.00 -1.68 0.00 0.00 37.83 33.54 1m9l s LYS 126 CO 0.07 -0.51 0.53 0.42 -0.76 0.00 0.00 175.35 175.10 1m9l s ILE 127 N 1.31 -0.00 0.00 2.17 1.01 -1.26 -1.34 121.20 123.09 1m9l s ILE 127 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.61 1m9l s ILE 127 Cb -0.18 -0.74 0.00 0.00 0.01 0.00 0.00 42.46 41.55 1m9l s ILE 127 CO -0.07 0.00 0.00 0.35 0.00 0.00 0.00 174.94 175.22 1m9l n THR 128 N 2.89 0.00 -1.34 2.92 -2.24 -1.26 -1.49 114.28 113.75 1m9l n THR 128 Ca -0.14 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.29 1m9l n THR 128 Cb 0.56 1.05 -0.05 0.00 -2.10 0.00 0.00 70.33 69.80 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 0.00 8.09 -0.28 3.42 3.02 -1.26 -4.67 115.26 123.58 1m9l n ASN 129 Ca 0.00 -2.64 0.08 0.00 -0.03 0.00 0.00 54.58 51.99 1m9l n ASN 129 Cb 0.07 -1.51 0.23 0.00 -0.61 0.00 0.00 39.78 37.96 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 4.59 0.51 -1.46 3.10 7.01 -1.94 0.36 115.95 128.12 1m9l h TRP 130 Ca 0.74 0.04 0.47 0.00 2.11 0.00 0.00 58.89 62.25 1m9l h TRP 130 Cb 0.49 -0.10 -0.12 0.00 -2.10 0.00 0.00 29.16 27.33 1m9l h TRP 130 CO 1.83 -0.01 0.97 0.78 -2.79 0.00 0.00 178.44 179.22 1m9l h GLY 131 N 0.39 1.04 0.00 2.65 0.00 -2.01 -1.54 103.07 103.60 1m9l h GLY 131 Ca 0.47 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.72 1m9l h GLY 131 CO -0.48 -0.34 -0.00 1.18 0.00 0.00 0.00 176.54 176.90 1m9l n GLU 132 N -4.55 0.00 -0.24 4.80 1.02 -0.58 -4.85 120.64 116.23 1m9l n GLU 132 Ca 0.39 0.00 0.19 0.00 -0.02 0.00 0.00 57.16 57.72 1m9l n GLU 132 Cb 1.58 -0.03 0.35 0.00 -0.02 0.00 0.00 31.44 33.32 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 -2.54 -0.31 -0.32 -3.67 5.41 0.12 -1.21 119.36 116.83 1m9l n ILE 133 Ca -0.00 1.54 0.14 0.00 1.00 0.00 0.00 62.75 65.43 1m9l n ILE 133 Cb 0.00 -2.40 0.32 0.00 -0.71 0.00 0.00 39.64 36.85 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 0.52 0.00 4.38 3.58 -1.42 -1.47 116.42 122.01 1m9l h ASP 134 Ca 0.56 0.13 -0.23 0.00 0.42 0.00 0.00 57.03 57.91 1m9l h ASP 134 Cb 1.37 0.06 -0.03 0.00 1.72 0.00 0.00 39.33 42.45 1m9l h ASP 134 CO -0.61 0.10 -1.74 0.29 -2.88 0.00 0.00 179.24 174.39 1m9l n LYS 135 N -4.94 0.52 -0.51 0.28 4.76 -0.58 -4.65 118.16 113.05 1m9l n LYS 135 Ca 0.23 0.22 0.44 0.00 -2.87 0.00 0.00 58.31 56.32 1m9l n LYS 135 Cb 0.64 -1.39 0.71 0.00 -1.84 0.00 0.00 35.03 33.15 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 -0.92 0.00 -1.05 -0.35 5.85 -1.13 -1.63 115.31 116.08 1m9l h LEU 136 Ca -0.35 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1m9l h LEU 136 Cb 1.27 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.30 1m9l h LEU 136 CO -0.21 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 177.89 1m9l n ALA 137 N -2.71 1.69 -3.27 1.25 0.00 -0.56 -4.70 120.51 112.21 1m9l n ALA 137 Ca 0.35 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.57 1m9l n ALA 137 Cb 1.75 -1.00 0.06 0.00 0.00 0.00 0.00 19.45 20.26 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 0.30 -1.11 0.00 0.00 0.00 -0.70 -3.81 120.51 115.19 1m9l n ALA 138 Ca 0.00 0.34 -0.06 0.00 0.00 0.00 0.00 53.44 53.72 1m9l n ALA 138 Cb 0.12 -4.62 -0.04 0.00 0.00 0.00 0.00 19.45 14.91 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 -1.98 -0.68 -1.15 0.00 7.12 -1.61 -1.14 115.31 115.87 1m9l h LEU 139 Ca -0.54 0.08 0.20 0.00 0.13 0.00 0.00 57.88 57.74 1m9l h LEU 139 Cb 1.37 0.26 -0.10 0.00 -0.53 0.00 0.00 40.66 41.66 1m9l h LEU 139 CO 0.56 -0.20 0.61 -0.78 -0.13 0.00 0.00 178.44 178.51 1m9l h ASP 140 N -0.24 0.69 0.00 1.25 1.82 -1.92 -3.30 116.42 114.72 1m9l h ASP 140 Ca 0.01 0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.73 1m9l h ASP 140 Cb 0.28 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.24 1m9l h ASP 140 CO -0.17 0.25 -0.02 0.50 -1.61 0.00 0.00 179.24 178.19 1m9l h LYS 141 N 0.67 0.00 -0.51 0.28 3.64 -1.89 -3.30 116.57 115.46 1m9l h LYS 141 Ca 0.55 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.88 1m9l h LYS 141 Cb 0.99 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.82 1m9l h LYS 141 CO -0.33 0.00 -0.06 -0.11 -2.27 0.00 0.00 179.45 176.68 1m9l n LEU 142 N -2.45 -0.17 -0.00 5.20 0.00 -0.46 -1.17 117.00 117.96 1m9l n LEU 142 Ca -0.00 0.08 -0.00 0.00 0.00 0.00 0.00 56.01 56.09 1m9l n LEU 142 Cb 0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 43.42 43.35 1m9l n LEU 142 CO 0.00 -0.30 -0.01 -0.62 0.00 0.00 0.00 177.39 176.47 1m9l n GLU 143 N 0.10 0.01 -3.70 1.96 4.71 -1.26 -3.48 120.64 118.97 1m9l n GLU 143 Ca 0.01 0.15 -0.38 0.00 -0.01 0.00 0.00 57.16 56.94 1m9l n GLU 143 Cb 0.03 -0.66 -0.10 0.00 -1.01 0.00 0.00 31.44 29.70 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 -3.73 5.39 -0.32 1.62 1.11 -0.61 -1.15 116.67 118.98 1m9l s ASP 144 Ca -0.00 -2.27 0.01 0.00 0.18 0.00 0.00 52.55 50.47 1m9l s ASP 144 Cb 0.00 -1.89 0.08 0.00 1.07 0.00 0.00 42.92 42.19 1m9l s ASP 144 CO 0.00 -0.52 0.03 -1.48 1.18 0.00 0.00 175.17 174.38 1m9l s LEU 145 N 0.80 4.36 -0.38 1.23 2.34 -0.64 -1.72 118.68 124.67 1m9l s LEU 145 Ca 0.11 -1.77 -0.07 0.00 0.06 0.00 0.00 54.13 52.46 1m9l s LEU 145 Cb -0.22 -1.66 0.07 0.00 -0.56 0.00 0.00 46.19 43.81 1m9l s LEU 145 CO -0.03 -0.34 0.17 -0.22 -1.06 0.00 0.00 176.35 174.87 1m9l s LEU 146 N 1.06 4.77 -0.41 1.48 2.96 -0.25 -0.36 118.68 127.93 1m9l s LEU 146 Ca 0.02 -1.43 0.11 0.00 -0.22 0.00 0.00 54.13 52.61 1m9l s LEU 146 Cb -0.20 -1.90 0.36 0.00 0.50 0.00 0.00 46.19 44.95 1m9l s LEU 146 CO -0.05 -0.44 0.80 0.18 -1.32 0.00 0.00 176.35 175.52 1m9l n LEU 147 N 4.81 1.72 -0.00 -0.68 4.32 -1.20 -0.13 117.00 125.84 1m9l n LEU 147 Ca -0.10 -5.07 -0.04 0.00 -0.02 0.00 0.00 56.01 50.78 1m9l n LEU 147 Cb 0.43 0.41 0.18 0.00 -1.62 0.00 0.00 43.42 42.82 1m9l n LEU 147 CO 0.34 2.25 0.73 0.00 -1.22 0.00 0.00 177.39 179.50 1m9l h ALA 148 N 2.99 1.07 -3.05 -1.18 0.00 -1.05 -3.43 119.26 114.61 1m9l h ALA 148 Ca 0.10 -0.35 -0.67 0.00 0.00 0.00 0.00 54.91 53.99 1m9l h ALA 148 Cb 0.88 -0.13 -0.34 0.00 0.00 0.00 0.00 17.79 18.21 1m9l h ALA 148 CO 0.57 0.57 -0.83 0.20 0.00 0.00 0.00 179.25 179.76 1m9l s GLY 149 N -3.98 1.43 0.00 0.00 0.00 0.34 -4.82 107.32 100.30 1m9l s GLY 149 Ca -0.07 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.44 1m9l s GLY 149 CO 0.80 0.30 0.00 1.16 0.00 0.00 0.00 173.10 175.36 1m9l n ASN 150 N 4.65 0.00 -0.33 1.64 0.23 -1.24 0.47 115.26 120.68 1m9l n ASN 150 Ca -0.20 0.00 0.21 0.00 -0.53 0.00 0.00 54.58 54.05 1m9l n ASN 150 Cb 0.50 0.00 0.42 0.00 -2.08 0.00 0.00 39.78 38.62 1m9l n ASN 150 CO 0.00 0.00 0.00 -0.65 -0.93 0.00 0.00 177.26 175.68 1m9l h PRO 151 N 0.00 0.31 0.04 -0.53 0.11 -1.78 -1.09 132.00 129.05 1m9l h PRO 151 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1m9l h PRO 151 Cb 0.00 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.03 1m9l h PRO 151 CO 0.00 0.20 -0.09 -0.07 -0.21 0.00 0.00 178.00 177.84 1m9l h LEU 152 N 0.32 -0.25 -0.57 2.35 3.38 -1.57 0.17 115.31 119.14 1m9l h LEU 152 Ca 0.68 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.72 1m9l h LEU 152 Cb 1.50 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 42.29 1m9l h LEU 152 CO -0.61 -0.10 0.31 0.22 0.09 0.00 0.00 178.44 178.36 1m9l h TYR 153 N -0.13 0.58 0.00 1.13 5.03 -1.79 -0.85 116.97 120.93 1m9l h TYR 153 Ca -0.00 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.30 1m9l h TYR 153 Cb 0.13 -0.18 -0.00 0.00 1.55 0.00 0.00 36.73 38.23 1m9l h TYR 153 CO -0.26 0.29 -0.11 -0.91 -1.32 0.00 0.00 178.16 175.85 1m9l h ASN 154 N 0.60 0.00 0.02 -2.11 4.21 -1.17 -1.62 115.58 115.51 1m9l h ASN 154 Ca 0.24 0.00 -0.26 0.00 1.21 0.00 0.00 56.30 57.49 1m9l h ASN 154 Cb 0.11 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 37.34 1m9l h ASN 154 CO -0.15 0.11 -1.03 0.44 -1.29 0.00 0.00 177.43 175.52 1m9l h ASP 155 N 0.00 0.88 0.29 5.81 3.32 0.72 -3.22 116.42 124.22 1m9l h ASP 155 Ca -0.00 -0.75 0.00 0.00 0.02 0.00 0.00 57.03 56.30 1m9l h ASP 155 Cb 0.21 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1m9l h ASP 155 CO 0.01 1.52 -0.32 0.22 -1.72 0.00 0.00 179.24 178.96 1m9l h TYR 156 N 0.33 -0.86 0.00 4.55 3.20 -0.77 -3.47 116.97 119.95 1m9l h TYR 156 Ca -0.13 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.74 1m9l h TYR 156 Cb 1.69 0.34 0.00 0.00 1.54 0.00 0.00 36.73 40.30 1m9l h TYR 156 CO 0.11 -0.45 0.00 1.17 -1.64 0.00 0.00 178.16 177.35 1m9l n LYS 157 N -5.43 0.00 0.06 1.82 4.81 -0.66 -4.75 118.16 114.01 1m9l n LYS 157 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.35 1m9l n LYS 157 Cb 0.34 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.39 1m9l n LYS 157 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1m9l n GLU 158 N 0.00 0.01 -0.96 1.64 -0.00 -1.21 -1.48 120.64 118.63 1m9l n GLU 158 Ca 0.00 0.16 -0.01 0.00 -0.00 0.00 0.00 57.16 57.31 1m9l n GLU 158 Cb 0.00 -0.65 -0.02 0.00 -0.00 0.00 0.00 31.44 30.78 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 -0.76 -0.03 0.00 -1.84 2.85 -1.26 -4.78 115.26 109.45 1m9l n ASN 159 Ca 0.00 -1.80 0.00 0.00 -0.11 0.00 0.00 54.58 52.67 1m9l n ASN 159 Cb 0.22 -0.03 0.00 0.00 1.24 0.00 0.00 39.78 41.21 1m9l n ASN 159 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1m9l n ASN 160 N 0.15 0.00 -0.03 1.20 4.05 -0.55 -4.82 115.26 115.26 1m9l n ASN 160 Ca -0.07 0.00 0.05 0.00 0.45 0.00 0.00 54.58 55.01 1m9l n ASN 160 Cb 0.80 0.00 -0.16 0.00 1.23 0.00 0.00 39.78 41.64 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 -1.20 2.44 0.08 5.20 0.00 -0.78 -4.00 120.51 122.25 1m9l n ALA 161 Ca 0.00 -0.71 -0.13 0.00 0.00 0.00 0.00 53.44 52.60 1m9l n ALA 161 Cb 0.00 -0.57 -0.08 0.00 0.00 0.00 0.00 19.45 18.79 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 1.00 -0.78 0.00 2.02 -1.85 0.63 112.91 113.93 1m9l h THR 162 Ca -0.14 -0.63 -0.00 0.00 0.77 0.00 0.00 66.41 66.41 1m9l h THR 162 Cb 1.29 1.39 -0.04 0.00 -1.74 0.00 0.00 68.15 69.05 1m9l h THR 162 CO 0.01 0.15 0.49 -1.28 0.37 0.00 0.00 175.52 175.25 1m9l h SER 163 N -0.49 0.92 -0.86 4.18 0.87 -1.78 -0.91 113.55 115.49 1m9l h SER 163 Ca -0.02 -0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.47 1m9l h SER 163 Cb 0.39 -0.23 -0.04 0.00 -0.44 0.00 0.00 62.40 62.07 1m9l h SER 163 CO 0.03 0.70 0.41 -0.08 -0.53 0.00 0.00 176.83 177.36 1m9l h GLU 164 N 1.07 1.23 0.01 2.24 4.22 -1.65 -1.52 114.58 120.18 1m9l h GLU 164 Ca 0.28 -0.18 -0.00 0.00 0.08 0.00 0.00 59.36 59.54 1m9l h GLU 164 Cb -0.07 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 28.96 1m9l h GLU 164 CO -0.06 0.94 -0.00 1.88 -2.18 0.00 0.00 179.01 179.59 1m9l h TYR 165 N 1.22 -0.01 -0.21 0.92 0.05 0.45 -0.03 116.97 119.36 1m9l h TYR 165 Ca 0.29 -0.00 0.01 0.00 0.05 0.00 0.00 58.73 59.09 1m9l h TYR 165 Cb 0.12 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.84 1m9l h TYR 165 CO 0.02 0.07 0.10 -0.09 -1.05 0.00 0.00 178.16 177.21 1m9l h ARG 166 N -0.09 0.21 -0.78 4.88 1.12 -1.10 -0.54 114.38 118.08 1m9l h ARG 166 Ca -0.00 -0.01 0.08 0.00 -1.11 0.00 0.00 59.98 58.94 1m9l h ARG 166 Cb 0.09 -0.05 -0.07 0.00 -0.01 0.00 0.00 29.97 29.93 1m9l h ARG 166 CO 0.00 0.14 0.44 0.82 -3.11 0.00 0.00 179.97 178.27 1m9l h ILE 167 N 0.22 0.93 -0.39 1.20 2.04 -1.21 -0.88 117.51 119.42 1m9l h ILE 167 Ca 0.09 -0.26 -0.08 0.00 1.00 0.00 0.00 64.86 65.60 1m9l h ILE 167 Cb 0.02 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.18 1m9l h ILE 167 CO -0.06 0.14 -0.10 -0.08 0.00 0.00 0.00 178.15 178.05 1m9l h GLU 168 N 0.77 0.67 0.00 2.37 4.57 -0.47 -0.85 114.58 121.65 1m9l h GLU 168 Ca 0.37 -0.20 0.00 0.00 -1.18 0.00 0.00 59.36 58.34 1m9l h GLU 168 Cb 0.30 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 1m9l h GLU 168 CO -0.23 0.76 0.00 0.28 -1.18 0.00 0.00 179.01 178.64 1m9l n VAL 169 N -4.19 0.00 -0.33 0.32 0.31 -0.26 -1.08 118.33 113.11 1m9l n VAL 169 Ca 0.01 1.22 0.20 0.00 -0.01 0.00 0.00 64.34 65.76 1m9l n VAL 169 Cb 0.34 -2.19 0.45 0.00 -0.91 0.00 0.00 33.84 31.53 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 0.57 0.21 2.52 3.04 -1.25 0.63 116.25 121.97 1m9l h VAL 170 Ca 0.00 -0.17 -0.01 0.00 -1.01 0.00 0.00 66.70 65.51 1m9l h VAL 170 Cb 0.00 0.02 0.00 0.00 -2.01 0.00 0.00 31.29 29.30 1m9l h VAL 170 CO 0.00 0.09 -0.10 0.50 -1.01 0.00 0.00 177.57 177.05 1m9l h LYS 171 N 0.50 -0.28 0.00 4.17 3.64 -1.20 -3.43 116.57 119.98 1m9l h LYS 171 Ca 0.60 0.02 -0.34 0.00 -1.27 0.00 0.00 60.65 59.66 1m9l h LYS 171 Cb 1.32 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 33.14 1m9l h LYS 171 CO -0.35 0.10 -2.27 -2.13 -2.27 0.00 0.00 179.45 172.54 1m9l n ARG 172 N -5.02 0.54 -3.22 1.90 0.63 -0.24 -5.05 116.66 106.21 1m9l n ARG 172 Ca -0.09 0.14 -0.39 0.00 -0.92 0.00 0.00 57.85 56.60 1m9l n ARG 172 Cb 0.26 -1.43 -0.06 0.00 0.45 0.00 0.00 32.46 31.68 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 -6.43 4.45 -0.04 6.15 1.43 0.17 -5.02 118.68 119.40 1m9l s LEU 173 Ca -0.30 1.20 -0.02 0.00 -1.03 0.00 0.00 54.13 53.98 1m9l s LEU 173 Cb 0.08 -2.92 -0.27 0.00 0.03 0.00 0.00 46.19 43.12 1m9l s LEU 173 CO 0.50 0.16 0.67 1.55 0.23 0.00 0.00 176.35 179.45 1m9l h PRO 174 N 5.28 0.21 0.00 1.29 0.13 -1.93 -3.42 132.00 133.56 1m9l h PRO 174 Ca -0.47 -0.37 0.00 0.00 -0.87 0.00 0.00 66.00 64.30 1m9l h PRO 174 Cb 1.20 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1m9l h PRO 174 CO 0.68 1.04 0.00 0.09 -0.23 0.00 0.00 178.00 179.57 1m9l n ASN 175 N -3.39 0.00 0.00 1.44 3.02 -1.26 -4.90 115.26 110.17 1m9l n ASN 175 Ca -0.21 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.34 1m9l n ASN 175 Cb 1.05 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.22 1m9l n ASN 175 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1m9l n LEU 176 N 0.00 0.00 -0.04 3.41 7.94 -0.32 -4.95 117.00 123.05 1m9l n LEU 176 Ca 0.00 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.82 1m9l n LEU 176 Cb 0.00 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 43.92 1m9l n LEU 176 CO 0.00 0.00 -0.77 0.29 -1.11 0.00 0.00 177.39 175.80 1m9l n LYS 177 N 0.00 0.17 -3.28 1.96 5.02 -1.23 -4.79 118.16 116.01 1m9l n LYS 177 Ca 0.00 0.07 -0.41 0.00 -2.02 0.00 0.00 58.31 55.95 1m9l n LYS 177 Cb 0.00 -0.87 -0.02 0.00 -0.02 0.00 0.00 35.03 34.13 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 -3.21 3.62 -2.56 1.97 4.76 -0.30 -4.89 118.16 117.55 1m9l n LYS 178 Ca -0.15 -4.52 -0.41 0.00 -2.87 0.00 0.00 58.31 50.35 1m9l n LYS 178 Cb 0.62 -2.48 -0.02 0.00 -1.84 0.00 0.00 35.03 31.31 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 -2.01 3.59 0.00 -0.35 2.96 -1.26 -1.63 118.68 119.98 1m9l s LEU 179 Ca 0.31 -1.73 0.00 0.00 -0.22 0.00 0.00 54.13 52.49 1m9l s LEU 179 Cb -0.01 -2.57 0.00 0.00 0.50 0.00 0.00 46.19 44.11 1m9l s LEU 179 CO -0.01 -1.42 0.00 -0.67 -1.32 0.00 0.00 176.35 172.92 1m9l n ASP 180 N 8.79 0.00 0.00 3.68 2.03 0.52 -4.62 116.55 126.94 1m9l n ASP 180 Ca 0.38 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.69 1m9l n ASP 180 Cb 0.50 -1.16 0.00 0.00 -0.72 0.00 0.00 41.12 39.74 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 -0.01 0.17 0.27 0.00 -1.26 -4.32 105.19 98.03 1m9l n GLY 181 Ca 0.00 0.39 0.04 0.00 0.00 0.00 0.00 46.02 46.45 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 -0.04 -0.34 1.61 2.81 -1.26 -1.63 117.12 118.26 1m9l n MET 182 Ca 0.00 0.75 0.34 0.00 -1.81 0.00 0.00 57.70 56.98 1m9l n MET 182 Cb 0.00 -1.13 0.52 0.00 -0.71 0.00 0.00 33.22 31.90 1m9l n MET 182 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1m9l n PRO 183 N -4.75 0.01 -0.36 0.03 -0.04 -1.26 -3.24 135.00 125.39 1m9l n PRO 183 Ca 0.08 1.01 -0.09 0.00 -0.04 0.00 0.00 63.50 64.47 1m9l n PRO 183 Cb 0.26 -2.47 -0.08 0.00 -0.04 0.00 0.00 33.50 31.18 1m9l n PRO 183 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1m9l n VAL 184 N -3.37 -0.58 -0.43 0.52 0.24 -0.65 -4.14 118.33 109.92 1m9l n VAL 184 Ca 0.28 2.07 0.00 0.00 -2.04 0.00 0.00 64.34 64.66 1m9l n VAL 184 Cb 1.63 -2.57 0.00 0.00 -1.47 0.00 0.00 33.84 31.43 1m9l n VAL 184 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1m9l n ASP 185 N -5.08 -2.01 0.00 -1.34 2.03 -1.20 -1.48 116.55 107.47 1m9l n ASP 185 Ca 0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.33 1m9l n ASP 185 Cb 0.23 -1.80 0.00 0.00 -0.72 0.00 0.00 41.12 38.83 1m9l n ASP 185 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1m9l n VAL 186 N -0.88 0.00 0.02 5.18 3.14 -1.26 -4.94 118.33 119.59 1m9l n VAL 186 Ca 0.00 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.30 1m9l n VAL 186 Cb 0.17 0.00 -0.13 0.00 -1.06 0.00 0.00 33.84 32.82 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 -0.01 6.55 3.58 -1.59 -3.31 116.42 121.65 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 0.99 0.02 -0.33 -2.88 0.00 0.00 179.24 177.04 1m9l h GLU 188 N 0.00 0.00 -0.02 0.28 4.39 -1.89 0.43 114.58 117.76 1m9l h GLU 188 Ca -0.16 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.54 1m9l h GLU 188 Cb 1.90 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.55 1m9l h GLU 188 CO 0.10 0.00 0.00 0.54 -1.16 0.00 0.00 179.01 178.49 1m9l n ARG 189 N -3.42 1.35 0.03 2.33 5.12 -1.24 -2.02 116.66 118.80 1m9l n ARG 189 Ca -0.03 -0.51 0.00 0.00 -1.93 0.00 0.00 57.85 55.39 1m9l n ARG 189 Cb 0.09 -1.46 0.00 0.00 -1.16 0.00 0.00 32.46 29.93 1m9l n ARG 189 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1m9l n GLU 190 N -0.37 0.00 0.07 5.56 1.02 0.69 -4.54 120.64 123.08 1m9l n GLU 190 Ca 0.20 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.22 1m9l n GLU 190 Cb 0.23 -0.14 -0.09 0.00 -0.02 0.00 0.00 31.44 31.42 1m9l n GLU 190 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1m9l h GLN 191 N 0.00 -0.20 0.00 3.49 4.15 -0.54 0.46 115.11 122.48 1m9l h GLN 191 Ca 0.00 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.42 1m9l h GLN 191 Cb 0.00 0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.73 1m9l h GLN 191 CO 0.00 0.18 -0.08 0.00 -1.93 0.00 0.00 178.83 177.00 1m9l h ALA 192 N 0.14 1.26 0.20 3.38 0.00 -1.56 0.09 119.26 122.78 1m9l h ALA 192 Ca -0.02 -0.07 -0.35 0.00 0.00 0.00 0.00 54.91 54.47 1m9l h ALA 192 Cb 0.46 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.26 1m9l h ALA 192 CO 0.03 0.10 -1.67 -0.97 0.00 0.00 0.00 179.25 176.74 1m9l h ASN 193 N 0.00 0.67 -0.13 0.00 -1.24 -1.31 -0.46 115.58 113.12 1m9l h ASN 193 Ca -0.00 -0.90 -0.19 0.00 0.71 0.00 0.00 56.30 55.91 1m9l h ASN 193 Cb 0.26 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 39.09 1m9l h ASN 193 CO 0.01 1.75 -0.64 0.58 -1.29 0.00 0.00 177.43 177.84 1m9l h VAL 194 N 0.12 1.29 -0.40 2.57 2.07 -0.66 0.37 116.25 121.62 1m9l h VAL 194 Ca -0.31 -1.86 -0.15 0.00 0.82 0.00 0.00 66.70 65.20 1m9l h VAL 194 Cb 2.12 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 33.70 1m9l h VAL 194 CO 0.21 0.59 -0.32 0.00 0.02 0.00 0.00 177.57 178.06 1m9l h ALA 195 N 0.73 0.57 0.02 1.67 0.00 -1.07 -2.72 119.26 118.45 1m9l h ALA 195 Ca -0.01 -0.43 0.02 0.00 0.00 0.00 0.00 54.91 54.49 1m9l h ALA 195 Cb 1.24 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1m9l h ALA 195 CO 0.13 0.64 -0.16 0.00 0.00 0.00 0.00 179.25 179.86 1m9l h ARG 196 N 0.74 -0.26 0.00 0.00 3.08 -0.95 -3.45 114.38 113.54 1m9l h ARG 196 Ca 0.07 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1m9l h ARG 196 Cb 0.91 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.02 1m9l h ARG 196 CO 0.08 -0.18 0.00 0.41 -1.07 0.00 0.00 179.97 179.22 1m9l n GLY 197 N -1.29 0.00 0.00 0.04 0.00 -0.62 -5.07 105.19 98.25 1m9l n GLY 197 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1m9l n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93