#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 2.46 -3.00 3.04 0.00 -1.26 -4.28 120.51 117.46 1m9l n ALA 2 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1m9l n ALA 2 Cb 0.00 0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.58 1m9l n ALA 2 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1m9l n LYS 3 N -3.30 0.48 -3.19 0.00 5.02 -1.26 -4.48 118.16 111.43 1m9l n LYS 3 Ca -0.02 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.29 1m9l n LYS 3 Cb 0.08 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.08 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 -2.40 0.00 7.82 0.00 -1.26 -4.94 121.76 118.98 1m9l s ALA 4 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.38 1m9l s ALA 4 Cb 0.00 -2.70 0.00 0.00 0.00 0.00 0.00 23.12 20.42 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 4.64 0.00 -3.53 0.00 -2.24 -1.26 -4.38 114.28 107.51 1m9l n THR 5 Ca 0.10 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.66 1m9l n THR 5 Cb 0.56 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.78 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 1.77 4.84 0.06 4.28 2.01 -1.26 -3.56 115.64 123.78 1m9l s THR 6 Ca 0.00 -0.72 -0.35 0.00 0.31 0.00 0.00 61.69 60.93 1m9l s THR 6 Cb 0.00 -3.74 -0.19 0.00 0.01 0.00 0.00 72.50 68.59 1m9l s THR 6 CO 0.00 -0.39 1.53 -0.29 -0.69 0.00 0.00 174.62 174.78 1m9l h ILE 7 N 0.86 0.00 0.06 1.82 2.10 -1.91 0.71 117.51 121.14 1m9l h ILE 7 Ca -0.49 0.00 0.02 0.00 1.08 0.00 0.00 64.86 65.47 1m9l h ILE 7 Cb 1.23 0.00 -0.05 0.00 -1.09 0.00 0.00 36.82 36.91 1m9l h ILE 7 CO 0.59 0.00 -0.49 0.11 -1.08 0.00 0.00 178.15 177.28 1m9l h LYS 8 N -1.20 -0.65 0.34 2.19 1.57 -1.97 0.95 116.57 117.80 1m9l h LYS 8 Ca -0.11 0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1m9l h LYS 8 Cb 0.94 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.37 1m9l h LYS 8 CO 0.15 -0.43 -0.47 -0.44 -0.57 0.00 0.00 179.45 177.69 1m9l h ASP 9 N -0.68 -1.33 -0.47 0.86 3.32 -1.98 -1.65 116.42 114.50 1m9l h ASP 9 Ca 0.02 0.12 0.09 0.00 0.02 0.00 0.00 57.03 57.27 1m9l h ASP 9 Cb 0.72 0.46 -0.07 0.00 0.22 0.00 0.00 39.33 40.65 1m9l h ASP 9 CO -0.31 -0.57 0.02 0.00 -1.72 0.00 0.00 179.24 176.65 1m9l h ALA 10 N -0.87 0.45 -0.61 3.45 0.00 -0.70 0.11 119.26 121.08 1m9l h ALA 10 Ca -0.04 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1m9l h ALA 10 Cb 0.76 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1m9l h ALA 10 CO -0.13 -0.38 0.05 0.82 0.00 0.00 0.00 179.25 179.61 1m9l h ILE 11 N 0.13 1.26 -0.50 0.00 2.04 -0.68 0.43 117.51 120.19 1m9l h ILE 11 Ca 0.23 -1.08 -0.11 0.00 1.00 0.00 0.00 64.86 64.91 1m9l h ILE 11 Cb 0.34 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1m9l h ILE 11 CO -0.37 0.40 -0.11 -0.09 0.00 0.00 0.00 178.15 177.98 1m9l h ARG 12 N 0.96 0.93 0.00 2.37 2.43 -0.92 -1.23 114.38 118.93 1m9l h ARG 12 Ca 0.18 -0.33 -0.03 0.00 -0.81 0.00 0.00 59.98 59.00 1m9l h ARG 12 Cb 0.49 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1m9l h ARG 12 CO 0.02 0.98 -0.12 0.82 -1.51 0.00 0.00 179.97 180.17 1m9l h ILE 13 N 0.83 0.62 0.13 1.20 2.04 0.05 0.04 117.51 122.42 1m9l h ILE 13 Ca 0.13 -0.52 -0.28 0.00 1.00 0.00 0.00 64.86 65.20 1m9l h ILE 13 Cb 0.64 1.33 0.01 0.00 -0.74 0.00 0.00 36.82 38.06 1m9l h ILE 13 CO 0.04 0.12 -1.24 -0.26 0.00 0.00 0.00 178.15 176.81 1m9l h PHE 14 N 0.00 0.55 0.00 1.37 0.04 0.45 0.10 116.94 119.46 1m9l h PHE 14 Ca -0.00 -0.39 -0.05 0.00 2.80 0.00 0.00 57.97 60.33 1m9l h PHE 14 Cb 0.32 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 1m9l h PHE 14 CO 0.00 1.30 -0.23 1.49 -0.60 0.00 0.00 178.31 180.27 1m9l h GLU 15 N 0.09 0.00 0.00 1.51 4.81 -0.19 0.19 114.58 120.99 1m9l h GLU 15 Ca -0.14 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 58.87 1m9l h GLU 15 Cb 1.96 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.31 1m9l h GLU 15 CO 0.21 0.23 -1.41 0.39 -0.73 0.00 0.00 179.01 177.69 1m9l n GLU 16 N -3.83 0.54 -0.05 1.92 1.02 -0.10 -3.72 120.64 116.42 1m9l n GLU 16 Ca -0.02 0.43 -0.00 0.00 -0.02 0.00 0.00 57.16 57.55 1m9l n GLU 16 Cb 0.32 -1.62 -0.00 0.00 -0.02 0.00 0.00 31.44 30.12 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 -1.00 0.00 -0.60 3.49 2.43 -0.93 -3.35 114.38 114.43 1m9l h ARG 17 Ca -0.32 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.86 1m9l h ARG 17 Cb 1.18 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.70 1m9l h ARG 17 CO -0.20 0.00 0.39 -0.22 -1.51 0.00 0.00 179.97 178.44 1m9l h LYS 18 N -0.97 0.77 -1.54 0.20 3.11 -1.61 -3.48 116.57 113.05 1m9l h LYS 18 Ca 0.00 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.79 1m9l h LYS 18 Cb 0.02 -0.17 0.00 0.00 -1.00 0.00 0.00 32.23 31.07 1m9l h LYS 18 CO 0.00 0.51 0.00 0.45 -2.81 0.00 0.00 179.45 177.60 1m9l n SER 19 N -4.68 -1.39 -2.99 4.20 2.88 0.59 -5.02 113.62 107.21 1m9l n SER 19 Ca 0.04 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.41 1m9l n SER 19 Cb 0.03 -0.35 -0.07 0.00 -0.75 0.00 0.00 64.21 63.08 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 -0.77 0.00 -3.43 2.46 0.24 -0.77 -4.97 118.33 111.09 1m9l n VAL 20 Ca 0.00 -2.09 -0.44 0.00 -2.04 0.00 0.00 64.34 59.78 1m9l n VAL 20 Cb 0.35 1.01 -0.08 0.00 -1.47 0.00 0.00 33.84 33.64 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 -3.13 5.13 -0.04 3.34 1.01 -1.26 -4.15 120.40 121.30 1m9l s VAL 21 Ca 0.32 -1.01 -0.05 0.00 0.00 0.00 0.00 61.98 61.25 1m9l s VAL 21 Cb 0.02 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 1m9l s VAL 21 CO 0.23 -0.51 -0.09 0.00 0.00 0.00 0.00 175.10 174.73 1m9l n ALA 22 N 5.16 0.61 -3.97 5.51 0.00 -1.26 -4.09 120.51 122.47 1m9l n ALA 22 Ca -0.12 -0.36 -0.27 0.00 0.00 0.00 0.00 53.44 52.69 1m9l n ALA 22 Cb 0.44 0.02 -0.02 0.00 0.00 0.00 0.00 19.45 19.89 1m9l n ALA 22 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1m9l n THR 23 N -3.04 -3.09 -2.64 0.00 -1.04 -1.26 -1.46 114.28 101.76 1m9l n THR 23 Ca -0.04 -0.55 -0.12 0.00 -2.04 0.00 0.00 64.05 61.31 1m9l n THR 23 Cb 0.13 -2.62 -0.02 0.00 -1.82 0.00 0.00 70.33 66.00 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 -4.43 -1.82 -2.31 -2.82 2.13 -1.26 -4.84 120.64 105.29 1m9l n GLU 24 Ca -0.29 0.04 -0.29 0.00 0.66 0.00 0.00 57.16 57.28 1m9l n GLU 24 Cb 0.68 -3.35 0.00 0.00 0.27 0.00 0.00 31.44 29.04 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 -1.92 3.26 0.15 4.31 0.00 -0.53 -4.77 121.76 122.25 1m9l s ALA 25 Ca 0.24 -0.29 -0.14 0.00 0.00 0.00 0.00 51.96 51.77 1m9l s ALA 25 Cb -0.14 -2.82 0.02 0.00 0.00 0.00 0.00 23.12 20.18 1m9l s ALA 25 CO 0.29 -0.47 1.69 0.93 0.00 0.00 0.00 175.76 178.20 1m9l h GLU 26 N 0.07 0.72 -5.35 0.00 3.07 -1.88 -3.38 114.58 107.83 1m9l h GLU 26 Ca -0.46 -0.14 -0.65 0.00 -0.50 0.00 0.00 59.36 57.62 1m9l h GLU 26 Cb 1.20 -0.11 -0.15 0.00 -0.84 0.00 0.00 28.75 28.84 1m9l h GLU 26 CO 0.62 0.66 0.68 0.15 -1.40 0.00 0.00 179.01 179.71 1m9l s LYS 27 N -5.50 3.28 -0.37 2.33 1.02 -1.25 0.31 119.74 119.55 1m9l s LYS 27 Ca -0.13 -1.12 -0.03 0.00 0.02 0.00 0.00 55.97 54.71 1m9l s LYS 27 Cb 0.11 -4.49 0.08 0.00 -0.52 0.00 0.00 37.83 33.02 1m9l s LYS 27 CO 0.77 -1.82 0.13 0.08 -0.92 0.00 0.00 175.35 173.58 1m9l s VAL 28 N 3.71 3.22 -0.92 3.17 1.01 -0.68 -4.82 120.40 125.09 1m9l s VAL 28 Ca 0.26 -1.75 -0.19 0.00 0.00 0.00 0.00 61.98 60.30 1m9l s VAL 28 Cb -0.13 -3.06 0.12 0.00 0.00 0.00 0.00 36.38 33.31 1m9l s VAL 28 CO 0.03 -0.45 1.15 -1.61 0.00 0.00 0.00 175.10 174.22 1m9l s GLU 29 N 1.20 3.57 0.00 2.72 8.01 -1.26 -1.50 118.70 131.43 1m9l s GLU 29 Ca 0.03 -1.65 0.00 0.00 0.01 0.00 0.00 54.97 53.36 1m9l s GLU 29 Cb -0.21 -4.92 0.00 0.00 -4.31 0.00 0.00 34.13 24.69 1m9l s GLU 29 CO -0.03 -1.81 0.00 1.28 0.01 0.00 0.00 175.26 174.71 1m9l n LEU 30 N 6.83 0.00 0.00 1.80 4.77 -0.57 -4.57 117.00 125.26 1m9l n LEU 30 Ca 0.23 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 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 0.53 0.00 0.00 1.57 -1.33 0.00 0.00 177.39 178.16 1m9l n HIS 31 N 0.00 0.00 -3.83 -1.77 -0.00 -1.26 -4.67 115.22 103.68 1m9l n HIS 31 Ca 0.00 0.00 -0.06 0.00 0.46 0.00 0.00 57.72 58.12 1m9l n HIS 31 Cb 0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 29.86 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 -0.52 -0.05 0.05 1.57 0.00 -1.26 -0.90 107.32 106.22 1m9l s GLY 32 Ca 0.00 -0.28 -0.27 0.00 0.00 0.00 0.00 44.72 44.17 1m9l s GLY 32 CO 0.00 -0.02 0.65 -0.29 0.00 0.00 0.00 173.10 173.45 1m9l s MET 33 N -3.51 1.15 -0.01 2.90 0.00 -0.57 0.41 119.30 119.67 1m9l s MET 33 Ca 0.12 -0.10 -0.19 0.00 0.00 0.00 0.00 55.69 55.52 1m9l s MET 33 Cb -0.05 0.54 -0.06 0.00 0.00 0.00 0.00 34.83 35.26 1m9l s MET 33 CO 0.07 -0.44 0.53 0.96 0.00 0.00 0.00 175.02 176.14 1m9l s ILE 34 N -2.45 4.95 0.28 10.11 -4.36 -1.26 -3.36 121.20 125.10 1m9l s ILE 34 Ca -0.05 1.10 -0.01 0.00 -0.26 0.00 0.00 60.65 61.43 1m9l s ILE 34 Cb -0.01 -3.86 0.34 0.00 1.25 0.00 0.00 42.46 40.19 1m9l s ILE 34 CO -0.02 0.47 1.62 -0.65 0.24 0.00 0.00 174.94 176.60 1m9l h PRO 35 N 5.39 0.10 0.00 0.37 0.11 -1.95 -1.81 132.00 134.21 1m9l h PRO 35 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1m9l h PRO 35 Cb 1.20 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1m9l h PRO 35 CO 0.68 0.06 0.00 -2.30 -0.21 0.00 0.00 178.00 176.23 1m9l n PRO 36 N -5.36 0.18 -1.55 1.05 -0.02 -1.26 -0.59 135.00 127.45 1m9l n PRO 36 Ca 0.19 0.00 -0.61 0.00 -2.02 0.00 0.00 63.50 61.07 1m9l n PRO 36 Cb 0.64 -1.16 -0.08 0.00 -0.02 0.00 0.00 33.50 32.88 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 -0.66 0.00 0.00 4.25 0.00 -0.68 -4.71 119.36 117.56 1m9l n ILE 37 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 62.75 62.76 1m9l n ILE 37 Cb 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 39.64 39.54 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 2.00 0.00 -3.68 9.51 2.13 -1.23 -1.74 120.64 127.63 1m9l n GLU 38 Ca 0.22 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.68 1m9l n GLU 38 Cb 0.05 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.70 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 0.54 3.92 -1.09 5.31 1.02 -1.26 -2.55 119.74 125.63 1m9l s LYS 39 Ca 0.00 0.02 -0.06 0.00 0.02 0.00 0.00 55.97 55.95 1m9l s LYS 39 Cb 0.00 -3.31 0.29 0.00 -0.52 0.00 0.00 37.83 34.29 1m9l s LYS 39 CO 0.00 0.50 1.28 -0.12 -0.92 0.00 0.00 175.35 176.09 1m9l n MET 40 N 2.75 3.95 -0.09 1.68 1.56 -1.26 -4.19 117.12 121.52 1m9l n MET 40 Ca -0.16 -4.51 0.03 0.00 -0.27 0.00 0.00 57.70 52.80 1m9l n MET 40 Cb 0.53 -2.53 0.36 0.00 2.15 0.00 0.00 33.22 33.74 1m9l n MET 40 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 1m9l h ASP 41 N 6.04 0.61 0.11 6.12 5.19 -1.88 -0.19 116.42 132.44 1m9l h ASP 41 Ca 0.19 -0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.60 1m9l h ASP 41 Cb 0.75 -0.15 -0.05 0.00 0.18 0.00 0.00 39.33 40.06 1m9l h ASP 41 CO 1.16 0.44 -0.52 0.00 -3.12 0.00 0.00 179.24 177.20 1m9l h ALA 42 N 1.66 -0.99 -0.26 3.45 0.00 -1.83 -1.52 119.26 119.77 1m9l h ALA 42 Ca 0.21 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.07 1m9l h ALA 42 Cb -0.04 0.89 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 1m9l h ALA 42 CO -0.05 -1.11 -0.32 1.15 0.00 0.00 0.00 179.25 178.92 1m9l h THR 43 N -0.73 0.27 -0.98 0.00 2.02 -1.79 0.38 112.91 112.07 1m9l h THR 43 Ca -0.01 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.36 1m9l h THR 43 Cb 0.74 0.27 -0.18 0.00 -1.74 0.00 0.00 68.15 67.23 1m9l h THR 43 CO -0.28 0.00 -0.29 -0.11 0.37 0.00 0.00 175.52 175.21 1m9l n LEU 44 N -5.41 -0.44 -0.09 2.58 7.94 -0.13 0.28 117.00 121.73 1m9l n LEU 44 Ca -0.01 1.70 -0.12 0.00 -1.11 0.00 0.00 56.01 56.47 1m9l n LEU 44 Cb 0.33 -0.48 -0.05 0.00 0.53 0.00 0.00 43.42 43.75 1m9l n LEU 44 CO 0.11 -1.60 -0.46 -0.24 -1.11 0.00 0.00 177.39 174.09 1m9l n SER 45 N -5.56 1.84 0.09 1.96 2.88 -0.65 -4.17 113.62 110.00 1m9l n SER 45 Ca 0.14 0.54 0.04 0.00 -1.33 0.00 0.00 58.87 58.25 1m9l n SER 45 Cb 0.46 -0.90 0.19 0.00 -0.75 0.00 0.00 64.21 63.21 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 -4.53 0.84 -0.32 2.46 5.66 0.10 -1.88 114.28 116.61 1m9l n THR 46 Ca -0.18 0.63 -0.04 0.00 -3.05 0.00 0.00 64.05 61.41 1m9l n THR 46 Cb 0.44 -1.63 -0.02 0.00 -1.55 0.00 0.00 70.33 67.57 1m9l n THR 46 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1m9l n LEU 47 N -1.70 -0.67 -0.32 1.09 0.00 0.14 -0.18 117.00 115.37 1m9l n LEU 47 Ca -0.00 1.40 0.17 0.00 0.00 0.00 0.00 56.01 57.57 1m9l n LEU 47 Cb 0.28 -0.26 0.34 0.00 0.00 0.00 0.00 43.42 43.78 1m9l n LEU 47 CO 0.03 -1.20 0.90 0.11 0.00 0.00 0.00 177.39 177.23 1m9l h LYS 48 N 0.00 0.09 0.00 1.96 1.57 -1.66 0.47 116.57 119.00 1m9l h LYS 48 Ca 0.21 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1m9l h LYS 48 Cb 0.41 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1m9l h LYS 48 CO -0.77 0.06 -1.46 0.00 -0.57 0.00 0.00 179.45 176.71 1m9l n ALA 49 N -2.82 2.68 -1.56 3.86 0.00 0.26 -5.02 120.51 117.91 1m9l n ALA 49 Ca 0.25 -0.37 -0.54 0.00 0.00 0.00 0.00 53.44 52.78 1m9l n ALA 49 Cb 0.81 -0.94 -0.07 0.00 0.00 0.00 0.00 19.45 19.25 1m9l n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m9l n LYS 51 N 2.23 0.00 -2.99 0.00 4.81 -1.22 -4.46 118.16 116.52 1m9l n LYS 51 Ca 0.19 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.20 1m9l n LYS 51 Cb 0.16 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.21 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 -2.80 2.92 -2.50 5.64 -0.00 0.15 -0.16 115.22 118.47 1m9l n HIS 52 Ca 0.00 -2.85 -0.41 0.00 -0.00 0.00 0.00 57.72 54.46 1m9l n HIS 52 Cb 0.00 -1.43 -0.03 0.00 -0.00 0.00 0.00 29.99 28.53 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 -2.15 3.28 -0.25 0.27 2.96 -0.13 -1.68 118.68 120.99 1m9l s LEU 53 Ca 0.32 -0.13 -0.05 0.00 -0.22 0.00 0.00 54.13 54.04 1m9l s LEU 53 Cb 0.03 -2.80 -0.01 0.00 0.50 0.00 0.00 46.19 43.91 1m9l s LEU 53 CO 0.06 -1.76 0.02 0.00 -1.32 0.00 0.00 176.35 173.35 1m9l s ALA 54 N 5.80 2.96 0.00 5.97 0.00 -0.56 -0.68 121.76 135.25 1m9l s ALA 54 Ca 0.42 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 51.11 1m9l s ALA 54 Cb -0.09 -1.93 0.00 0.00 0.00 0.00 0.00 23.12 21.11 1m9l s ALA 54 CO 0.20 -0.63 0.00 1.28 0.00 0.00 0.00 175.76 176.61 1m9l n LEU 55 N 4.84 0.00 0.00 0.00 7.99 -0.58 -1.51 117.00 127.74 1m9l n LEU 55 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.84 1m9l n LEU 55 Cb 0.50 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.81 1m9l n LEU 55 CO 0.30 -0.04 0.00 -0.24 -1.51 0.00 0.00 177.39 175.90 1m9l n SER 56 N -0.56 0.00 -3.45 -1.43 2.88 -1.13 -4.46 113.62 105.47 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 0.26 -0.12 0.00 -0.75 0.00 0.00 64.21 63.60 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 -1.54 0.06 0.22 2.46 -1.32 -0.08 -0.42 115.64 115.03 1m9l s THR 57 Ca 0.00 -1.57 0.02 0.00 -1.21 0.00 0.00 61.69 58.93 1m9l s THR 57 Cb 0.00 -1.05 -0.05 0.00 -1.51 0.00 0.00 72.50 69.89 1m9l s THR 57 CO 0.00 -0.93 0.03 0.54 -2.21 0.00 0.00 174.62 172.06 1m9l s ASN 58 N 1.17 1.34 0.01 8.08 4.22 -0.49 -1.51 114.94 127.76 1m9l s ASN 58 Ca 0.17 -1.26 -0.03 0.00 -2.14 0.00 0.00 52.86 49.61 1m9l s ASN 58 Cb -0.22 0.11 -0.01 0.00 1.28 0.00 0.00 41.25 42.41 1m9l s ASN 58 CO -0.01 -0.62 0.03 0.20 -2.04 0.00 0.00 177.10 174.67 1m9l s ASN 59 N -3.25 0.16 -0.20 3.54 0.01 -1.21 -1.44 114.94 112.55 1m9l s ASN 59 Ca 0.30 -0.40 -0.04 0.00 -0.71 0.00 0.00 52.86 52.01 1m9l s ASN 59 Cb 0.07 0.14 0.07 0.00 0.41 0.00 0.00 41.25 41.94 1m9l s ASN 59 CO 0.08 -0.33 0.08 -0.63 -1.51 0.00 0.00 177.10 174.79 1m9l s ILE 60 N -1.48 0.10 -0.23 0.60 1.01 0.05 -4.03 121.20 117.22 1m9l s ILE 60 Ca -0.15 -0.40 -0.13 0.00 0.00 0.00 0.00 60.65 59.97 1m9l s ILE 60 Cb -0.09 -0.79 -0.17 0.00 0.01 0.00 0.00 42.46 41.42 1m9l s ILE 60 CO -0.00 -0.34 -0.05 1.21 0.00 0.00 0.00 174.94 175.75 1m9l n GLU 61 N 5.20 0.62 -4.12 2.79 2.13 0.25 -3.77 120.64 123.73 1m9l n GLU 61 Ca -0.07 0.34 -0.16 0.00 0.66 0.00 0.00 57.16 57.93 1m9l n GLU 61 Cb 0.47 -1.61 -0.15 0.00 0.27 0.00 0.00 31.44 30.43 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 -2.47 0.40 -0.35 5.31 2.20 -0.71 -4.63 119.74 119.48 1m9l s LYS 62 Ca -0.33 -0.15 0.00 0.00 -0.36 0.00 0.00 55.97 55.14 1m9l s LYS 62 Cb 0.10 -0.40 0.14 0.00 -1.51 0.00 0.00 37.83 36.16 1m9l s LYS 62 CO 0.58 0.07 0.22 -1.50 -0.36 0.00 0.00 175.35 174.36 1m9l s ILE 63 N 0.03 0.15 0.20 5.43 -1.16 -1.22 -3.50 121.20 121.14 1m9l s ILE 63 Ca 0.00 -1.77 0.02 0.00 -0.51 0.00 0.00 60.65 58.40 1m9l s ILE 63 Cb -0.03 -1.13 -0.09 0.00 0.61 0.00 0.00 42.46 41.82 1m9l s ILE 63 CO -0.00 -1.01 1.47 -1.28 -2.81 0.00 0.00 174.94 171.32 1m9l h SER 64 N 6.93 0.31 0.00 4.50 0.87 -1.75 -3.38 113.55 121.03 1m9l h SER 64 Ca 0.07 -0.21 -0.64 0.00 -1.23 0.00 0.00 61.79 59.78 1m9l h SER 64 Cb 0.97 -0.09 0.01 0.00 -0.44 0.00 0.00 62.40 62.84 1m9l h SER 64 CO 0.27 0.93 3.44 -1.54 -0.53 0.00 0.00 176.83 179.39 1m9l n SER 65 N -3.80 6.67 -0.04 6.23 3.41 -1.26 -4.61 113.62 120.22 1m9l n SER 65 Ca -0.03 -2.62 -0.14 0.00 -0.26 0.00 0.00 58.87 55.82 1m9l n SER 65 Cb 0.70 -1.50 -0.08 0.00 -0.26 0.00 0.00 64.21 63.06 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 8.32 0.38 -2.39 1.04 8.10 -1.79 -0.49 115.31 128.49 1m9l h LEU 66 Ca 0.73 -0.56 -0.00 0.00 0.11 0.00 0.00 57.88 58.15 1m9l h LEU 66 Cb 0.38 -0.11 -0.00 0.00 -0.44 0.00 0.00 40.66 40.49 1m9l h LEU 66 CO 1.78 0.87 -0.02 0.77 -4.11 0.00 0.00 178.44 177.73 1m9l h SER 67 N -0.09 0.00 0.00 0.17 4.64 -1.95 -0.33 113.55 116.00 1m9l h SER 67 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 1m9l h SER 67 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1m9l h SER 67 CO 0.05 0.02 -0.07 1.23 -0.87 0.00 0.00 176.83 177.19 1m9l h GLY 68 N 0.67 0.05 1.74 -0.77 0.00 -1.80 -3.27 103.07 99.69 1m9l h GLY 68 Ca -0.00 -0.09 0.03 0.00 0.00 0.00 0.00 47.33 47.27 1m9l h GLY 68 CO 0.00 0.08 0.10 -0.33 0.00 0.00 0.00 176.54 176.39 1m9l h MET 69 N -0.76 0.00 0.00 4.80 2.07 -0.08 -3.31 114.93 117.65 1m9l h MET 69 Ca -0.01 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.62 1m9l h MET 69 Cb 0.90 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.63 1m9l h MET 69 CO 0.01 0.00 0.00 -1.91 1.07 0.00 0.00 176.91 176.08 1m9l n GLU 70 N -4.01 0.00 -0.00 1.72 4.07 -0.23 -1.60 120.64 120.60 1m9l n GLU 70 Ca -0.00 0.00 0.01 0.00 -0.06 0.00 0.00 57.16 57.11 1m9l n GLU 70 Cb 0.21 -1.45 -0.02 0.00 -0.06 0.00 0.00 31.44 30.12 1m9l n GLU 70 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1m9l n ASN 71 N -0.67 0.33 -4.65 4.31 5.15 -1.24 -4.64 115.26 113.85 1m9l n ASN 71 Ca 0.00 -0.54 -0.38 0.00 -0.60 0.00 0.00 54.58 53.06 1m9l n ASN 71 Cb 0.00 1.01 0.05 0.00 -0.53 0.00 0.00 39.78 40.31 1m9l n ASN 71 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1m9l n LEU 72 N -1.09 4.14 0.10 1.20 7.94 -0.63 -4.66 117.00 124.00 1m9l n LEU 72 Ca 0.00 0.85 0.00 0.00 -1.11 0.00 0.00 56.01 55.76 1m9l n LEU 72 Cb 0.04 -1.43 0.00 0.00 0.53 0.00 0.00 43.42 42.56 1m9l n LEU 72 CO 0.06 -1.54 -0.01 0.54 -1.11 0.00 0.00 177.39 175.32 1m9l n ARG 73 N -1.01 0.00 -3.25 1.96 1.74 -1.25 -3.29 116.66 111.57 1m9l n ARG 73 Ca 0.13 0.00 -0.46 0.00 -0.77 0.00 0.00 57.85 56.75 1m9l n ARG 73 Cb 0.46 -0.04 -0.04 0.00 -1.02 0.00 0.00 32.46 31.82 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 5.20 -0.49 0.55 1.01 0.77 -1.50 121.20 124.74 1m9l s ILE 74 Ca 0.00 -1.63 -0.19 0.00 0.00 0.00 0.00 60.65 58.83 1m9l s ILE 74 Cb 0.00 -4.43 0.05 0.00 0.01 0.00 0.00 42.46 38.09 1m9l s ILE 74 CO 0.00 -1.00 0.59 -0.22 0.00 0.00 0.00 174.94 174.31 1m9l s LEU 75 N 1.55 4.93 -0.93 2.97 0.20 -0.57 -0.95 118.68 125.88 1m9l s LEU 75 Ca 0.10 -0.84 -0.01 0.00 0.69 0.00 0.00 54.13 54.08 1m9l s LEU 75 Cb -0.22 -2.46 0.30 0.00 -0.43 0.00 0.00 46.19 43.38 1m9l s LEU 75 CO 0.00 -0.83 1.30 -1.20 -0.29 0.00 0.00 176.35 175.33 1m9l n SER 76 N 6.06 5.72 -2.36 3.68 7.64 0.14 -0.81 113.62 133.70 1m9l n SER 76 Ca -0.06 -3.47 0.00 0.00 1.01 0.00 0.00 58.87 56.35 1m9l n SER 76 Cb 0.46 -1.06 0.00 0.00 -1.01 0.00 0.00 64.21 62.60 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 0.95 0.00 0.14 -3.43 0.00 0.08 -1.52 117.00 113.22 1m9l n LEU 77 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.31 1m9l n LEU 77 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.77 1m9l n LEU 77 CO 0.60 -0.31 0.00 0.61 0.00 0.00 0.00 177.39 178.29 1m9l n GLY 78 N 5.00 -1.82 2.84 -3.96 0.00 -1.26 -4.61 105.19 101.38 1m9l n GLY 78 Ca 0.00 0.41 -0.24 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.60 1.01 0.29 1.61 3.00 0.44 -0.23 118.95 123.47 1m9l s ARG 79 Ca 0.00 -0.06 -0.20 0.00 -1.00 0.00 0.00 55.73 54.47 1m9l s ARG 79 Cb 0.00 -1.21 0.02 0.00 0.00 0.00 0.00 34.95 33.76 1m9l s ARG 79 CO 0.00 -0.26 0.72 0.54 0.00 0.00 0.00 175.30 176.29 1m9l s ASN 80 N 1.76 -0.21 -0.07 -2.12 6.03 -0.39 -1.40 114.94 118.54 1m9l s ASN 80 Ca 0.03 -0.70 0.03 0.00 -1.03 0.00 0.00 52.86 51.19 1m9l s ASN 80 Cb -0.13 0.74 0.00 0.00 -3.03 0.00 0.00 41.25 38.84 1m9l s ASN 80 CO -0.06 -1.39 -0.18 -0.76 -2.03 0.00 0.00 177.10 172.69 1m9l s LEU 81 N -2.95 1.86 -0.02 3.54 1.02 -0.52 -1.62 118.68 119.99 1m9l s LEU 81 Ca 0.12 -0.40 0.04 0.00 0.02 0.00 0.00 54.13 53.91 1m9l s LEU 81 Cb -0.06 -1.07 -0.01 0.00 0.02 0.00 0.00 46.19 45.08 1m9l s LEU 81 CO 0.08 0.11 -0.14 -0.63 0.02 0.00 0.00 176.35 175.78 1m9l s ILE 82 N 0.41 1.18 0.14 -0.59 1.01 -0.25 -0.77 121.20 122.32 1m9l s ILE 82 Ca -0.14 -0.61 0.00 0.00 0.00 0.00 0.00 60.65 59.91 1m9l s ILE 82 Cb -0.16 -1.00 0.00 0.00 0.01 0.00 0.00 42.46 41.31 1m9l s ILE 82 CO 0.05 0.34 0.00 1.17 0.00 0.00 0.00 174.94 176.50 1m9l n LYS 83 N 2.95 0.00 -5.03 2.79 4.81 -1.25 -4.04 118.16 118.40 1m9l n LYS 83 Ca -0.16 0.00 -0.32 0.00 -0.87 0.00 0.00 58.31 56.96 1m9l n LYS 83 Cb 0.54 -0.21 -0.14 0.00 0.02 0.00 0.00 35.03 35.24 1m9l n LYS 83 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1m9l s LYS 84 N -2.00 2.42 -0.69 1.64 2.20 -1.26 -4.55 119.74 117.50 1m9l s LYS 84 Ca 0.00 -0.78 -0.27 0.00 -0.36 0.00 0.00 55.97 54.56 1m9l s LYS 84 Cb 0.00 -2.28 0.02 0.00 -1.51 0.00 0.00 37.83 34.06 1m9l s LYS 84 CO 0.00 0.58 1.38 -1.50 -0.36 0.00 0.00 175.35 175.45 1m9l s ILE 85 N -0.63 3.69 0.00 5.43 -1.16 -1.26 -4.67 121.20 122.60 1m9l s ILE 85 Ca 0.09 0.43 0.00 0.00 -0.51 0.00 0.00 60.65 60.67 1m9l s ILE 85 Cb -0.11 -4.71 0.00 0.00 0.61 0.00 0.00 42.46 38.25 1m9l s ILE 85 CO 0.00 -1.61 0.25 -0.62 -2.81 0.00 0.00 174.94 170.15 1m9l n GLU 86 N 9.23 0.06 0.00 3.50 1.02 -1.26 -4.90 120.64 128.28 1m9l n GLU 86 Ca 0.07 -0.27 0.00 0.00 -0.02 0.00 0.00 57.16 56.94 1m9l n GLU 86 Cb 0.50 -0.55 0.00 0.00 -0.02 0.00 0.00 31.44 31.36 1m9l n GLU 86 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1m9l n ASN 87 N -0.02 0.00 -0.25 1.62 6.94 -1.26 -4.50 115.26 117.79 1m9l n ASN 87 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 54.58 54.54 1m9l n ASN 87 Cb 0.32 0.00 0.16 0.00 -2.36 0.00 0.00 39.78 37.90 1m9l n ASN 87 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1m9l h LEU 88 N 0.00 0.97 -0.57 -4.53 3.38 -1.90 -1.54 115.31 111.11 1m9l h LEU 88 Ca 0.00 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1m9l h LEU 88 Cb 0.00 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 1m9l h LEU 88 CO 0.00 0.79 0.33 0.44 0.09 0.00 0.00 178.44 180.09 1m9l h ASP 89 N 1.08 0.69 0.34 -0.43 5.19 -1.90 0.18 116.42 121.57 1m9l h ASP 89 Ca 0.27 -0.07 -0.02 0.00 -0.62 0.00 0.00 57.03 56.59 1m9l h ASP 89 Cb 0.05 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.39 1m9l h ASP 89 CO -0.04 0.56 -0.16 0.00 -3.12 0.00 0.00 179.24 176.48 1m9l h ALA 90 N 1.16 -0.46 -0.76 3.45 0.00 -1.76 -0.79 119.26 120.10 1m9l h ALA 90 Ca 0.20 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 55.01 1m9l h ALA 90 Cb 0.01 0.18 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 1m9l h ALA 90 CO -0.04 -0.53 0.42 -0.39 0.00 0.00 0.00 179.25 178.71 1m9l h VAL 91 N -0.91 0.91 -0.71 0.00 -1.51 -1.32 -1.45 116.25 111.26 1m9l h VAL 91 Ca -0.05 -0.25 -0.03 0.00 -1.23 0.00 0.00 66.70 65.15 1m9l h VAL 91 Cb 0.53 0.13 -0.03 0.00 -2.13 0.00 0.00 31.29 29.78 1m9l h VAL 91 CO 0.08 0.13 0.32 0.00 -1.23 0.00 0.00 177.57 176.87 1m9l h ALA 92 N 1.42 1.23 -0.28 5.19 0.00 -0.61 0.50 119.26 126.72 1m9l h ALA 92 Ca 0.36 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1m9l h ALA 92 Cb 0.32 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1m9l h ALA 92 CO -0.24 0.58 0.05 0.22 0.00 0.00 0.00 179.25 179.86 1m9l h ASP 93 N 1.01 0.44 0.43 0.00 3.58 -0.13 -3.27 116.42 118.49 1m9l h ASP 93 Ca 0.24 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1m9l h ASP 93 Cb 0.14 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.07 1m9l h ASP 93 CO -0.03 0.58 -0.80 1.07 -2.88 0.00 0.00 179.24 177.19 1m9l n THR 94 N -4.66 0.10 -1.13 2.25 5.66 -0.75 -4.98 114.28 110.78 1m9l n THR 94 Ca -0.03 -0.12 -0.29 0.00 -3.05 0.00 0.00 64.05 60.56 1m9l n THR 94 Cb 0.21 0.31 0.21 0.00 -1.55 0.00 0.00 70.33 69.50 1m9l n THR 94 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1m9l s LEU 95 N -3.48 1.18 0.02 1.09 1.43 0.17 -4.46 118.68 114.64 1m9l s LEU 95 Ca 0.07 0.95 0.00 0.00 -1.03 0.00 0.00 54.13 54.12 1m9l s LEU 95 Cb 0.16 -2.93 0.00 0.00 0.03 0.00 0.00 46.19 43.45 1m9l s LEU 95 CO 0.77 -3.58 0.00 1.21 0.23 0.00 0.00 176.35 174.97 1m9l n GLU 96 N -4.44 0.00 -3.58 1.70 2.13 -1.21 -4.82 120.64 110.42 1m9l n GLU 96 Ca 0.08 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.52 1m9l n GLU 96 Cb 0.58 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 32.24 1m9l n GLU 96 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1m9l s GLU 97 N -2.00 3.33 -1.20 5.31 2.02 -0.57 -1.65 118.70 123.95 1m9l s GLU 97 Ca 0.00 -3.07 -0.17 0.00 0.02 0.00 0.00 54.97 51.74 1m9l s GLU 97 Cb 0.00 -4.05 0.11 0.00 0.10 0.00 0.00 34.13 30.28 1m9l s GLU 97 CO 0.00 -1.25 1.54 -0.51 0.02 0.00 0.00 175.26 175.07 1m9l s LEU 98 N -0.99 4.31 -0.70 1.80 1.43 -0.59 -1.51 118.68 122.44 1m9l s LEU 98 Ca 0.25 -2.46 -0.20 0.00 -1.03 0.00 0.00 54.13 50.70 1m9l s LEU 98 Cb -0.10 -2.50 0.11 0.00 0.03 0.00 0.00 46.19 43.72 1m9l s LEU 98 CO -0.10 -1.07 0.87 0.26 0.23 0.00 0.00 176.35 176.55 1m9l s TRP 99 N 3.31 2.98 -0.37 0.29 0.51 0.01 -0.90 118.94 124.77 1m9l s TRP 99 Ca 0.47 -1.00 0.12 0.00 -2.12 0.00 0.00 56.10 53.58 1m9l s TRP 99 Cb 0.00 -4.14 0.37 0.00 -0.81 0.00 0.00 33.47 28.89 1m9l s TRP 99 CO 0.01 -1.42 0.81 0.44 -0.51 0.00 0.00 176.95 176.28 1m9l n ILE 100 N 5.54 0.04 -0.06 2.03 -5.35 -0.63 -0.74 119.36 120.19 1m9l n ILE 100 Ca 0.00 -4.02 0.00 0.00 -0.27 0.00 0.00 62.75 58.47 1m9l n ILE 100 Cb 0.45 0.06 0.01 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 0.21 -0.08 -3.99 7.28 3.41 -1.23 -3.81 113.62 115.42 1m9l n SER 101 Ca 0.20 0.26 -0.31 0.00 -0.26 0.00 0.00 58.87 58.77 1m9l n SER 101 Cb 0.69 -0.07 -0.15 0.00 -0.26 0.00 0.00 64.21 64.42 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 -5.17 2.65 -0.11 7.33 6.14 0.68 -0.18 117.35 128.69 1m9l s TYR 102 Ca -0.02 -1.90 -0.04 0.00 0.64 0.00 0.00 57.07 55.75 1m9l s TYR 102 Cb 0.04 -1.69 0.06 0.00 0.42 0.00 0.00 41.96 40.78 1m9l s TYR 102 CO 0.11 -0.80 0.19 0.54 0.64 0.00 0.00 175.55 176.23 1m9l s ASN 103 N 1.31 0.83 -0.13 4.32 2.20 -0.41 -1.26 114.94 121.80 1m9l s ASN 103 Ca -0.06 0.27 -0.27 0.00 -0.94 0.00 0.00 52.86 51.86 1m9l s ASN 103 Cb -0.19 0.36 -0.02 0.00 -2.00 0.00 0.00 41.25 39.40 1m9l s ASN 103 CO -0.06 -0.26 0.88 -1.10 -2.94 0.00 0.00 177.10 173.61 1m9l s GLN 104 N 2.32 4.37 0.22 3.55 -0.21 -0.64 -1.51 119.66 127.76 1m9l s GLN 104 Ca 0.03 1.13 -0.02 0.00 0.02 0.00 0.00 55.36 56.53 1m9l s GLN 104 Cb -0.13 -3.54 -0.03 0.00 1.00 0.00 0.00 33.01 30.31 1m9l s GLN 104 CO -0.07 -0.26 0.19 0.42 -2.12 0.00 0.00 175.29 173.45 1m9l s ILE 105 N 1.86 0.00 0.00 1.08 1.01 -0.55 -1.09 121.20 123.51 1m9l s ILE 105 Ca 0.42 -1.92 0.00 0.00 0.00 0.00 0.00 60.65 59.15 1m9l s ILE 105 Cb -0.17 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.83 1m9l s ILE 105 CO 0.16 0.00 0.00 0.00 0.00 0.00 0.00 174.94 175.10 1m9l n ALA 106 N -0.31 0.00 -2.54 9.38 0.00 -1.26 -4.35 120.51 121.43 1m9l n ALA 106 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.04 1m9l n ALA 106 Cb 0.65 0.00 -0.03 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 0.00 7.38 0.11 0.00 0.01 -1.26 -4.98 113.70 114.96 1m9l s SER 107 Ca 0.00 1.74 -0.17 0.00 1.31 0.00 0.00 55.95 58.83 1m9l s SER 107 Cb 0.00 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 1m9l s SER 107 CO 0.00 -0.22 1.62 -0.07 0.41 0.00 0.00 173.24 174.98 1m9l h LEU 108 N 6.39 0.48 0.05 2.44 -0.00 -1.99 -0.77 115.31 121.91 1m9l h LEU 108 Ca -0.42 -0.22 -0.00 0.00 -0.00 0.00 0.00 57.88 57.24 1m9l h LEU 108 Cb 1.22 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 41.75 1m9l h LEU 108 CO 0.75 0.57 -0.02 -1.28 -0.00 0.00 0.00 178.44 178.45 1m9l h SER 109 N 0.36 -0.05 0.36 -0.43 0.87 -1.99 -1.08 113.55 111.60 1m9l h SER 109 Ca 0.10 -0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1m9l h SER 109 Cb 0.27 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.21 1m9l h SER 109 CO -0.00 0.20 -0.49 1.23 -0.53 0.00 0.00 176.83 177.23 1m9l h GLY 110 N -0.31 -1.16 0.73 5.77 0.00 -1.94 -1.73 103.07 104.42 1m9l h GLY 110 Ca -0.01 0.58 0.06 0.00 0.00 0.00 0.00 47.33 47.97 1m9l h GLY 110 CO 0.01 -0.33 0.52 0.16 0.00 0.00 0.00 176.54 176.90 1m9l h ILE 111 N -0.90 1.04 -0.17 2.60 -0.00 -1.20 -0.88 117.51 118.00 1m9l h ILE 111 Ca -0.04 -0.33 0.05 0.00 -0.00 0.00 0.00 64.86 64.55 1m9l h ILE 111 Cb 0.82 0.00 -0.06 0.00 -0.00 0.00 0.00 36.82 37.58 1m9l h ILE 111 CO -0.14 0.17 -0.23 -0.08 -0.00 0.00 0.00 178.15 177.88 1m9l h GLU 112 N 0.95 -0.26 0.28 0.16 4.81 -0.64 0.52 114.58 120.41 1m9l h GLU 112 Ca 0.37 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.60 1m9l h GLU 112 Cb 0.16 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1m9l h GLU 112 CO -0.17 -0.17 -0.14 0.87 -0.73 0.00 0.00 179.01 178.67 1m9l h LYS 113 N -0.27 -0.37 -0.15 1.92 1.57 -0.91 -0.96 116.57 117.41 1m9l h LYS 113 Ca 0.11 0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.96 1m9l h LYS 113 Cb 0.44 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1m9l h LYS 113 CO -0.32 -0.15 0.15 1.37 -0.57 0.00 0.00 179.45 179.93 1m9l h LEU 114 N -1.06 0.00 0.08 2.94 8.10 -1.20 -1.29 115.31 122.88 1m9l h LEU 114 Ca -0.04 0.00 -0.27 0.00 0.11 0.00 0.00 57.88 57.68 1m9l h LEU 114 Cb 0.39 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.60 1m9l h LEU 114 CO 0.06 0.00 -1.45 0.58 -4.11 0.00 0.00 178.44 173.53 1m9l h VAL 115 N 0.00 0.93 -0.64 0.15 2.07 -0.99 -3.33 116.25 114.44 1m9l h VAL 115 Ca 0.07 -2.32 0.19 0.00 0.82 0.00 0.00 66.70 65.46 1m9l h VAL 115 Cb 0.38 2.55 -0.03 0.00 -1.52 0.00 0.00 31.29 32.67 1m9l h VAL 115 CO -0.00 0.63 0.65 -1.13 0.02 0.00 0.00 177.57 177.73 1m9l h ASN 116 N -0.45 0.00 -0.75 0.57 -1.24 -0.31 -3.43 115.58 109.97 1m9l h ASN 116 Ca -0.33 0.00 -0.17 0.00 0.71 0.00 0.00 56.30 56.51 1m9l h ASN 116 Cb 1.66 0.00 0.09 0.00 0.73 0.00 0.00 38.32 40.80 1m9l h ASN 116 CO -0.02 0.00 -0.96 -0.11 -1.29 0.00 0.00 177.43 175.06 1m9l n LEU 117 N -3.71 -1.84 0.00 0.34 7.94 -0.57 -4.66 117.00 114.49 1m9l n LEU 117 Ca 0.13 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 55.03 1m9l n LEU 117 Cb 0.88 -0.37 -0.00 0.00 0.53 0.00 0.00 43.42 44.45 1m9l n LEU 117 CO 0.29 -1.67 0.05 0.03 -1.11 0.00 0.00 177.39 174.98 1m9l h ARG 118 N -1.15 -0.03 -4.47 1.96 2.47 -1.84 -3.39 114.38 107.93 1m9l h ARG 118 Ca -0.14 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.06 1m9l h ARG 118 Cb 0.49 0.01 -0.35 0.00 -1.65 0.00 0.00 29.97 28.47 1m9l h ARG 118 CO 0.07 -0.02 -0.81 0.54 0.56 0.00 0.00 179.97 180.31 1m9l s VAL 119 N -1.36 1.15 -0.02 2.04 0.11 -0.66 -1.63 120.40 120.04 1m9l s VAL 119 Ca -0.00 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 58.60 1m9l s VAL 119 Cb 0.00 -1.09 0.02 0.00 -1.53 0.00 0.00 36.38 33.78 1m9l s VAL 119 CO 0.01 0.37 0.02 -1.48 -3.33 0.00 0.00 175.10 170.70 1m9l s LEU 120 N 1.04 1.28 -0.25 2.54 2.34 -0.65 -1.55 118.68 123.44 1m9l s LEU 120 Ca -0.07 0.03 -0.03 0.00 0.06 0.00 0.00 54.13 54.12 1m9l s LEU 120 Cb -0.15 -0.06 0.02 0.00 -0.56 0.00 0.00 46.19 45.44 1m9l s LEU 120 CO -0.01 -0.10 -0.04 -0.31 -1.06 0.00 0.00 176.35 174.83 1m9l s TYR 121 N 0.83 3.05 -0.42 3.48 2.02 -0.08 -1.33 117.35 124.90 1m9l s TYR 121 Ca -0.07 -1.37 0.02 0.00 -0.37 0.00 0.00 57.07 55.28 1m9l s TYR 121 Cb -0.10 -2.09 0.15 0.00 -0.40 0.00 0.00 41.96 39.52 1m9l s TYR 121 CO -0.02 -0.68 0.28 -1.64 -1.57 0.00 0.00 175.55 171.92 1m9l s MET 122 N 1.37 0.97 0.35 -0.62 -1.94 0.66 -1.61 119.30 118.48 1m9l s MET 122 Ca 0.02 -1.90 0.26 0.00 -1.71 0.00 0.00 55.69 52.36 1m9l s MET 122 Cb -0.16 -1.71 0.77 0.00 2.01 0.00 0.00 34.83 35.74 1m9l s MET 122 CO -0.04 -1.27 1.75 0.66 -0.01 0.00 0.00 175.02 176.11 1m9l h SER 123 N 6.34 0.00 -3.10 3.03 4.64 -1.65 0.36 113.55 123.17 1m9l h SER 123 Ca 0.13 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.23 1m9l h SER 123 Cb 0.92 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 62.70 1m9l h SER 123 CO 0.38 0.00 -0.52 0.20 -0.87 0.00 0.00 176.83 176.02 1m9l s ASN 124 N -5.21 0.10 0.21 4.97 0.01 0.74 -0.05 114.94 115.72 1m9l s ASN 124 Ca 0.07 0.54 -0.22 0.00 -0.71 0.00 0.00 52.86 52.54 1m9l s ASN 124 Cb 0.09 0.54 0.05 0.00 0.41 0.00 0.00 41.25 42.33 1m9l s ASN 124 CO 0.58 -0.21 0.65 0.54 -1.51 0.00 0.00 177.10 177.16 1m9l s ASN 125 N 1.89 -0.43 -0.23 -1.22 2.20 0.16 -1.29 114.94 116.02 1m9l s ASN 125 Ca -0.03 -0.27 0.02 0.00 -0.94 0.00 0.00 52.86 51.64 1m9l s ASN 125 Cb -0.11 0.66 0.05 0.00 -2.00 0.00 0.00 41.25 39.84 1m9l s ASN 125 CO -0.08 -1.14 -0.13 -0.54 -2.94 0.00 0.00 177.10 172.27 1m9l s LYS 126 N -3.82 2.41 -0.25 3.55 -0.14 -0.57 -3.78 119.74 117.14 1m9l s LYS 126 Ca 0.05 -1.12 -0.23 0.00 -1.36 0.00 0.00 55.97 53.32 1m9l s LYS 126 Cb -0.03 -2.72 0.07 0.00 -1.68 0.00 0.00 37.83 33.46 1m9l s LYS 126 CO -0.04 -0.45 0.67 0.42 -0.76 0.00 0.00 175.35 175.19 1m9l s ILE 127 N 1.21 -0.00 0.00 2.17 1.01 -1.26 -1.48 121.20 122.84 1m9l s ILE 127 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.61 1m9l s ILE 127 Cb -0.17 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.36 1m9l s ILE 127 CO -0.08 0.00 0.00 0.35 0.00 0.00 0.00 174.94 175.21 1m9l n THR 128 N 2.88 0.00 -1.28 2.92 -2.24 -1.26 -1.32 114.28 113.98 1m9l n THR 128 Ca -0.15 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.31 1m9l n THR 128 Cb 0.56 1.07 -0.06 0.00 -2.10 0.00 0.00 70.33 69.79 1m9l n THR 128 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1m9l n ASN 129 N 0.00 7.82 -0.31 3.42 2.85 -1.26 -4.68 115.26 123.10 1m9l n ASN 129 Ca 0.00 -2.60 0.13 0.00 -0.11 0.00 0.00 54.58 52.00 1m9l n ASN 129 Cb 0.05 -1.51 0.31 0.00 1.24 0.00 0.00 39.78 39.88 1m9l n ASN 129 CO 0.00 0.00 0.00 -0.25 -2.11 0.00 0.00 177.26 174.90 1m9l h TRP 130 N 4.44 0.68 -0.99 1.20 7.01 -1.94 0.21 115.95 126.55 1m9l h TRP 130 Ca 0.69 0.04 0.33 0.00 2.11 0.00 0.00 58.89 62.06 1m9l h TRP 130 Cb 0.60 -0.16 -0.16 0.00 -2.10 0.00 0.00 29.16 27.34 1m9l h TRP 130 CO 1.84 -0.03 0.50 0.78 -2.79 0.00 0.00 178.44 178.74 1m9l h GLY 131 N 0.42 2.01 0.00 2.65 0.00 -2.01 -1.47 103.07 104.66 1m9l h GLY 131 Ca 0.56 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1m9l h GLY 131 CO -0.52 -0.55 -0.08 1.18 0.00 0.00 0.00 176.54 176.57 1m9l n GLU 132 N -5.13 0.04 -0.28 4.80 1.02 -0.68 -4.80 120.64 115.61 1m9l n GLU 132 Ca 0.32 0.02 0.19 0.00 -0.02 0.00 0.00 57.16 57.66 1m9l n GLU 132 Cb 1.01 -0.39 0.36 0.00 -0.02 0.00 0.00 31.44 32.40 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 -2.72 -0.35 -0.32 -3.67 5.41 0.65 -1.32 119.36 117.04 1m9l n ILE 133 Ca -0.01 1.76 0.14 0.00 1.00 0.00 0.00 62.75 65.63 1m9l n ILE 133 Cb 0.04 -2.69 0.32 0.00 -0.71 0.00 0.00 39.64 36.60 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 0.44 0.00 4.38 3.58 -1.42 -1.54 116.42 121.86 1m9l h ASP 134 Ca 0.59 0.14 -0.17 0.00 0.42 0.00 0.00 57.03 58.02 1m9l h ASP 134 Cb 1.42 0.10 -0.03 0.00 1.72 0.00 0.00 39.33 42.54 1m9l h ASP 134 CO -0.71 0.05 -1.54 0.29 -2.88 0.00 0.00 179.24 174.44 1m9l n LYS 135 N -4.99 0.53 -0.67 0.28 5.02 -0.85 -4.61 118.16 112.88 1m9l n LYS 135 Ca 0.23 0.22 0.52 0.00 -2.02 0.00 0.00 58.31 57.26 1m9l n LYS 135 Cb 0.66 -1.42 0.82 0.00 -0.02 0.00 0.00 35.03 35.07 1m9l n LYS 135 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1m9l h LEU 136 N -0.97 0.00 -0.32 -0.35 5.85 -1.16 -0.34 115.31 118.03 1m9l h LEU 136 Ca -0.26 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1m9l h LEU 136 Cb 1.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1m9l h LEU 136 CO -0.15 -0.00 0.00 0.00 -0.34 0.00 0.00 178.44 177.94 1m9l n ALA 137 N -2.91 1.86 -3.45 1.25 0.00 -0.58 -4.70 120.51 111.98 1m9l n ALA 137 Ca 0.43 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.67 1m9l n ALA 137 Cb 1.94 -1.00 0.08 0.00 0.00 0.00 0.00 19.45 20.47 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 -0.25 -1.54 0.30 0.00 0.00 -0.22 -3.39 120.51 115.41 1m9l n ALA 138 Ca 0.00 0.18 -0.15 0.00 0.00 0.00 0.00 53.44 53.47 1m9l n ALA 138 Cb 0.04 -3.90 -0.08 0.00 0.00 0.00 0.00 19.45 15.51 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 -2.21 -1.06 -1.28 0.00 7.12 -1.60 -1.09 115.31 115.20 1m9l h LEU 139 Ca -0.55 0.07 0.34 0.00 0.13 0.00 0.00 57.88 57.87 1m9l h LEU 139 Cb 1.34 0.33 -0.12 0.00 -0.53 0.00 0.00 40.66 41.67 1m9l h LEU 139 CO 0.50 -0.57 0.70 -0.78 -0.13 0.00 0.00 178.44 178.16 1m9l h ASP 140 N -0.90 0.40 0.00 1.25 3.58 -1.90 -3.10 116.42 115.76 1m9l h ASP 140 Ca -0.07 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.51 1m9l h ASP 140 Cb 0.74 0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.87 1m9l h ASP 140 CO 0.02 -0.06 0.00 1.17 -2.88 0.00 0.00 179.24 177.50 1m9l n LYS 141 N -4.76 0.00 -0.04 0.28 4.81 -1.06 -3.61 118.16 113.79 1m9l n LYS 141 Ca 0.31 0.49 -0.01 0.00 -0.87 0.00 0.00 58.31 58.22 1m9l n LYS 141 Cb 1.08 -0.99 -0.00 0.00 0.02 0.00 0.00 35.03 35.14 1m9l n LYS 141 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1m9l n LEU 142 N -1.96 -0.05 0.00 3.14 0.00 -0.44 -1.44 117.00 116.26 1m9l n LEU 142 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 56.01 56.04 1m9l n LEU 142 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 43.42 43.40 1m9l n LEU 142 CO 0.00 -0.09 0.00 -0.62 0.00 0.00 0.00 177.39 176.68 1m9l n GLU 143 N 0.03 0.00 -3.73 1.96 4.71 -1.26 -3.48 120.64 118.87 1m9l n GLU 143 Ca 0.00 0.08 -0.37 0.00 -0.01 0.00 0.00 57.16 56.86 1m9l n GLU 143 Cb 0.01 -0.42 -0.11 0.00 -1.01 0.00 0.00 31.44 29.91 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 -2.51 5.35 -0.21 1.62 1.11 -0.65 -1.40 116.67 119.98 1m9l s ASP 144 Ca 0.00 -1.90 0.01 0.00 0.18 0.00 0.00 52.55 50.84 1m9l s ASP 144 Cb 0.00 -1.87 0.05 0.00 1.07 0.00 0.00 42.92 42.17 1m9l s ASP 144 CO 0.00 -0.55 -0.10 -1.48 1.18 0.00 0.00 175.17 174.22 1m9l s LEU 145 N 1.22 2.49 -0.28 1.23 2.34 -0.67 -1.64 118.68 123.37 1m9l s LEU 145 Ca 0.06 -0.99 -0.03 0.00 0.06 0.00 0.00 54.13 53.23 1m9l s LEU 145 Cb -0.23 -1.29 0.03 0.00 -0.56 0.00 0.00 46.19 44.14 1m9l s LEU 145 CO -0.03 -0.16 0.00 -0.22 -1.06 0.00 0.00 176.35 174.89 1m9l s LEU 146 N 1.35 3.63 -0.42 1.48 2.96 -0.45 -0.18 118.68 127.05 1m9l s LEU 146 Ca -0.03 -0.96 0.10 0.00 -0.22 0.00 0.00 54.13 53.02 1m9l s LEU 146 Cb -0.17 -1.74 0.33 0.00 0.50 0.00 0.00 46.19 45.10 1m9l s LEU 146 CO -0.08 -0.20 0.73 0.18 -1.32 0.00 0.00 176.35 175.66 1m9l n LEU 147 N 4.71 1.42 -0.04 -0.68 4.32 -1.22 -0.24 117.00 125.27 1m9l n LEU 147 Ca -0.15 -5.08 -0.10 0.00 -0.02 0.00 0.00 56.01 50.67 1m9l n LEU 147 Cb 0.46 0.44 0.05 0.00 -1.62 0.00 0.00 43.42 42.75 1m9l n LEU 147 CO 0.28 2.25 0.55 0.00 -1.22 0.00 0.00 177.39 179.25 1m9l h ALA 148 N 3.24 0.72 -3.31 -1.18 0.00 -1.07 -3.42 119.26 114.22 1m9l h ALA 148 Ca 0.10 -0.46 -0.67 0.00 0.00 0.00 0.00 54.91 53.88 1m9l h ALA 148 Cb 0.87 -0.11 -0.33 0.00 0.00 0.00 0.00 17.79 18.22 1m9l h ALA 148 CO 0.56 0.67 -0.77 0.20 0.00 0.00 0.00 179.25 179.91 1m9l s GLY 149 N -4.00 1.60 0.00 0.00 0.00 0.93 -4.84 107.32 101.02 1m9l s GLY 149 Ca -0.09 -1.47 0.00 0.00 0.00 0.00 0.00 44.72 43.17 1m9l s GLY 149 CO 0.85 0.50 0.00 1.16 0.00 0.00 0.00 173.10 175.61 1m9l n ASN 150 N 4.64 0.00 -0.32 1.64 0.23 -1.25 0.39 115.26 120.58 1m9l n ASN 150 Ca -0.17 0.00 0.16 0.00 -0.53 0.00 0.00 54.58 54.04 1m9l n ASN 150 Cb 0.47 0.00 0.32 0.00 -2.08 0.00 0.00 39.78 38.49 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 0.07 0.20 -0.53 0.11 -1.76 0.07 132.00 130.16 1m9l h PRO 151 Ca 0.00 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 1m9l h PRO 151 Cb 0.00 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.08 1m9l h PRO 151 CO 0.00 0.05 -0.29 -0.07 -0.21 0.00 0.00 178.00 177.47 1m9l h LEU 152 N 0.07 -0.84 -0.79 2.35 3.38 -1.49 0.18 115.31 118.17 1m9l h LEU 152 Ca 0.60 0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.71 1m9l h LEU 152 Cb 1.29 0.29 -0.06 0.00 0.09 0.00 0.00 40.66 42.27 1m9l h LEU 152 CO -0.81 -0.35 0.48 0.22 0.09 0.00 0.00 178.44 178.06 1m9l h TYR 153 N -0.52 0.89 -0.14 1.13 3.20 -1.68 -0.66 116.97 119.19 1m9l h TYR 153 Ca -0.02 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1m9l h TYR 153 Cb 0.47 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1m9l h TYR 153 CO -0.26 0.46 -0.03 -0.91 -1.64 0.00 0.00 178.16 175.78 1m9l h ASN 154 N 0.89 0.18 -0.05 -2.11 4.21 -0.89 -1.63 115.58 116.18 1m9l h ASN 154 Ca 0.34 -0.02 -0.12 0.00 1.21 0.00 0.00 56.30 57.71 1m9l h ASN 154 Cb 0.14 -0.05 0.01 0.00 -1.12 0.00 0.00 38.32 37.30 1m9l h ASN 154 CO -0.16 0.24 -0.44 0.44 -1.29 0.00 0.00 177.43 176.22 1m9l h ASP 155 N 0.20 0.47 -0.02 5.81 3.32 0.85 -3.21 116.42 123.83 1m9l h ASP 155 Ca 0.05 -0.70 0.03 0.00 0.02 0.00 0.00 57.03 56.43 1m9l h ASP 155 Cb 0.19 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.55 1m9l h ASP 155 CO 0.01 1.09 -0.28 0.22 -1.72 0.00 0.00 179.24 178.56 1m9l h TYR 156 N -0.13 -0.77 0.00 4.55 3.20 -1.01 -3.47 116.97 119.34 1m9l h TYR 156 Ca -0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1m9l h TYR 156 Cb 1.12 0.34 0.00 0.00 1.54 0.00 0.00 36.73 39.74 1m9l h TYR 156 CO 0.14 -0.37 0.00 1.17 -1.64 0.00 0.00 178.16 177.45 1m9l n LYS 157 N -5.39 0.00 0.00 1.82 4.81 -0.64 -4.74 118.16 114.01 1m9l n LYS 157 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 1m9l n LYS 157 Cb 0.31 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.36 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 0.00 -0.39 1.64 0.28 -1.07 -1.50 120.64 119.61 1m9l n GLU 158 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1m9l n GLU 158 Cb 0.00 -1.47 0.00 0.00 1.43 0.00 0.00 31.44 31.40 1m9l n GLU 158 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1m9l n ASN 159 N -0.55 0.00 0.00 -1.84 4.05 -1.26 -4.82 115.26 110.84 1m9l n ASN 159 Ca 0.00 -1.46 0.00 0.00 0.45 0.00 0.00 54.58 53.57 1m9l n ASN 159 Cb 0.00 -0.09 0.00 0.00 1.23 0.00 0.00 39.78 40.92 1m9l n ASN 159 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 1m9l n ASN 160 N 0.00 0.00 -1.04 1.20 5.15 -0.56 -4.86 115.26 115.15 1m9l n ASN 160 Ca 0.00 0.00 0.11 0.00 -0.60 0.00 0.00 54.58 54.09 1m9l n ASN 160 Cb 0.59 0.00 0.18 0.00 -0.53 0.00 0.00 39.78 40.02 1m9l n ASN 160 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1m9l n ALA 161 N -1.42 2.42 0.22 5.20 0.00 -0.81 -4.44 120.51 121.68 1m9l n ALA 161 Ca 0.00 -0.92 -0.10 0.00 0.00 0.00 0.00 53.44 52.43 1m9l n ALA 161 Cb 0.00 -0.80 -0.05 0.00 0.00 0.00 0.00 19.45 18.61 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 4.23 0.03 -0.57 0.00 2.02 -1.88 -0.28 112.91 116.45 1m9l h THR 162 Ca 0.00 -0.56 0.06 0.00 0.77 0.00 0.00 66.41 66.69 1m9l h THR 162 Cb 0.94 0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 1m9l h THR 162 CO 0.00 0.01 0.38 -1.28 0.37 0.00 0.00 175.52 175.00 1m9l h SER 163 N -1.16 0.46 -0.25 4.18 0.87 -1.80 -0.49 113.55 115.36 1m9l h SER 163 Ca -0.06 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.47 1m9l h SER 163 Cb 0.48 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1m9l h SER 163 CO 0.10 0.30 0.04 -0.08 -0.53 0.00 0.00 176.83 176.66 1m9l h GLU 164 N 0.52 0.41 0.02 2.24 4.22 -1.77 -1.25 114.58 118.98 1m9l h GLU 164 Ca 0.25 -0.11 0.03 0.00 0.08 0.00 0.00 59.36 59.61 1m9l h GLU 164 Cb 0.31 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 1m9l h GLU 164 CO -0.07 0.54 -0.33 1.88 -2.18 0.00 0.00 179.01 178.85 1m9l h TYR 165 N 0.22 -0.92 -0.27 0.92 0.05 0.57 -0.84 116.97 116.70 1m9l h TYR 165 Ca 0.08 0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.85 1m9l h TYR 165 Cb 0.33 0.40 -0.01 0.00 1.01 0.00 0.00 36.73 38.46 1m9l h TYR 165 CO 0.02 -0.43 0.03 -0.09 -1.05 0.00 0.00 178.16 176.65 1m9l h ARG 166 N -0.50 0.46 -0.87 4.88 1.12 -1.28 -0.11 114.38 118.09 1m9l h ARG 166 Ca 0.06 -0.13 0.17 0.00 -1.11 0.00 0.00 59.98 58.96 1m9l h ARG 166 Cb 0.57 -0.05 -0.10 0.00 -0.01 0.00 0.00 29.97 30.38 1m9l h ARG 166 CO -0.26 0.59 0.43 0.82 -3.11 0.00 0.00 179.97 178.44 1m9l h ILE 167 N 0.27 0.66 -0.16 1.20 2.04 -1.11 0.18 117.51 120.59 1m9l h ILE 167 Ca 0.08 -0.20 -0.13 0.00 1.00 0.00 0.00 64.86 65.61 1m9l h ILE 167 Cb 0.36 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 1m9l h ILE 167 CO 0.01 0.10 -0.47 -0.08 0.00 0.00 0.00 178.15 177.71 1m9l h GLU 168 N 0.57 0.41 0.17 2.37 4.57 -0.87 -1.40 114.58 120.40 1m9l h GLU 168 Ca 0.49 -0.23 -0.01 0.00 -1.18 0.00 0.00 59.36 58.44 1m9l h GLU 168 Cb 0.77 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.38 1m9l h GLU 168 CO -0.41 0.80 -0.08 0.28 -1.18 0.00 0.00 179.01 178.42 1m9l h VAL 169 N 0.33 0.00 -0.54 0.32 2.07 0.12 0.13 116.25 118.69 1m9l h VAL 169 Ca 0.02 -0.04 0.11 0.00 0.82 0.00 0.00 66.70 67.61 1m9l h VAL 169 Cb 0.95 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.63 1m9l h VAL 169 CO 0.08 0.00 -0.08 1.62 0.02 0.00 0.00 177.57 179.21 1m9l h VAL 170 N -0.27 0.50 -0.03 2.57 3.04 -1.21 0.14 116.25 120.99 1m9l h VAL 170 Ca -0.02 -0.02 -0.00 0.00 -1.01 0.00 0.00 66.70 65.65 1m9l h VAL 170 Cb 0.17 0.46 -0.00 0.00 -2.01 0.00 0.00 31.29 29.91 1m9l h VAL 170 CO 0.04 0.01 0.00 0.50 -1.01 0.00 0.00 177.57 177.11 1m9l h LYS 171 N 0.05 0.05 0.00 4.17 3.64 -1.33 -3.41 116.57 119.74 1m9l h LYS 171 Ca 0.27 -0.02 -0.40 0.00 -1.27 0.00 0.00 60.65 59.23 1m9l h LYS 171 Cb 0.41 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.17 1m9l h LYS 171 CO -0.51 0.33 -2.38 -2.13 -2.27 0.00 0.00 179.45 172.48 1m9l n ARG 172 N -4.91 0.56 -3.00 1.90 0.63 0.45 -5.05 116.66 107.23 1m9l n ARG 172 Ca -0.07 0.20 -0.35 0.00 -0.92 0.00 0.00 57.85 56.70 1m9l n ARG 172 Cb 0.17 -1.43 -0.06 0.00 0.45 0.00 0.00 32.46 31.59 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 -6.97 4.26 0.00 6.15 1.02 0.47 -5.02 118.68 118.59 1m9l s LEU 173 Ca -0.34 1.53 0.00 0.00 0.02 0.00 0.00 54.13 55.34 1m9l s LEU 173 Cb 0.11 -3.86 0.00 0.00 0.02 0.00 0.00 46.19 42.47 1m9l s LEU 173 CO 0.48 -0.06 0.17 -0.81 0.02 0.00 0.00 176.35 176.15 1m9l n PRO 174 N 0.40 0.00 0.00 1.29 -0.04 -1.26 -4.67 135.00 130.71 1m9l n PRO 174 Ca 0.00 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1m9l n PRO 174 Cb 0.51 -0.79 0.00 0.00 -0.04 0.00 0.00 33.50 33.18 1m9l n PRO 174 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1m9l n ASN 175 N -1.01 0.00 0.00 3.54 3.02 -1.26 -4.91 115.26 114.64 1m9l n ASN 175 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1m9l n ASN 175 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 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 -0.07 3.41 7.94 -0.52 -4.95 117.00 122.81 1m9l n LEU 176 Ca 0.00 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.76 1m9l n LEU 176 Cb 0.00 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 43.90 1m9l n LEU 176 CO 0.00 0.00 -0.98 0.29 -1.11 0.00 0.00 177.39 175.59 1m9l n LYS 177 N 0.00 0.31 -3.72 1.96 5.02 -1.22 -4.80 118.16 115.71 1m9l n LYS 177 Ca 0.00 0.12 -0.31 0.00 -2.02 0.00 0.00 58.31 56.10 1m9l n LYS 177 Cb 0.00 -1.06 -0.09 0.00 -0.02 0.00 0.00 35.03 33.85 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 -3.49 2.31 -1.65 1.97 4.76 -0.49 -4.95 118.16 116.62 1m9l n LYS 178 Ca -0.27 -4.52 -0.42 0.00 -2.87 0.00 0.00 58.31 50.23 1m9l n LYS 178 Cb 0.71 -2.34 -0.01 0.00 -1.84 0.00 0.00 35.03 31.56 1m9l n LYS 178 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1m9l n LEU 179 N 1.92 6.77 0.00 -0.35 7.94 -1.26 -1.66 117.00 130.36 1m9l n LEU 179 Ca 0.22 -4.05 0.00 0.00 -1.11 0.00 0.00 56.01 51.07 1m9l n LEU 179 Cb 0.36 -1.61 0.00 0.00 0.53 0.00 0.00 43.42 42.70 1m9l n LEU 179 CO 0.34 1.06 0.00 -0.67 -1.11 0.00 0.00 177.39 177.00 1m9l n ASP 180 N 6.03 0.00 0.00 1.96 2.03 0.75 -4.66 116.55 122.66 1m9l n ASP 180 Ca 0.54 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.85 1m9l n ASP 180 Cb 0.38 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.78 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 0.28 0.27 0.27 0.00 -1.26 -4.51 105.19 98.24 1m9l n GLY 181 Ca 0.00 -0.00 0.26 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.37 1.61 2.81 -1.26 -1.89 117.12 117.98 1m9l n MET 182 Ca 0.00 1.02 0.37 0.00 -1.81 0.00 0.00 57.70 57.28 1m9l n MET 182 Cb 0.00 -1.87 0.63 0.00 -0.71 0.00 0.00 33.22 31.27 1m9l n MET 182 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1m9l h PRO 183 N 0.00 0.00 -0.02 0.03 0.11 -1.79 -2.95 132.00 127.38 1m9l h PRO 183 Ca 0.65 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.76 1m9l h PRO 183 Cb 1.80 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.90 1m9l h PRO 183 CO -0.53 0.00 -0.01 -0.39 -0.21 0.00 0.00 178.00 176.86 1m9l h VAL 184 N 0.00 0.00 0.00 3.15 -1.51 -1.73 -3.36 116.25 112.81 1m9l h VAL 184 Ca 0.63 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 66.10 1m9l h VAL 184 Cb 3.00 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 32.16 1m9l h VAL 184 CO -0.01 0.00 0.00 0.47 -1.23 0.00 0.00 177.57 176.80 1m9l n ASP 185 N -3.02 -1.16 0.00 4.19 8.00 -1.11 -0.93 116.55 122.52 1m9l n ASP 185 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1m9l n ASP 185 Cb 0.01 -1.35 0.00 0.00 -0.02 0.00 0.00 41.12 39.75 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 -0.50 0.00 -0.02 2.53 3.14 -1.26 -4.93 118.33 117.29 1m9l n VAL 186 Ca 0.00 0.00 -0.07 0.00 -2.96 0.00 0.00 64.34 61.31 1m9l n VAL 186 Cb 0.10 0.00 -0.13 0.00 -1.06 0.00 0.00 33.84 32.75 1m9l n VAL 186 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1m9l n ASP 187 N 0.00 0.79 0.33 6.55 2.03 -0.10 -4.00 116.55 122.14 1m9l n ASP 187 Ca 0.00 0.37 0.21 0.00 0.52 0.00 0.00 54.79 55.89 1m9l n ASP 187 Cb 0.00 0.09 1.12 0.00 -0.72 0.00 0.00 41.12 41.62 1m9l n ASP 187 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1m9l h GLU 188 N 0.00 0.00 -0.12 -0.67 4.39 -1.65 0.24 114.58 116.76 1m9l h GLU 188 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 1m9l h GLU 188 Cb 1.94 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.59 1m9l h GLU 188 CO 0.07 0.00 0.00 0.54 -1.16 0.00 0.00 179.01 178.46 1m9l n ARG 189 N -2.99 2.13 0.04 2.33 5.12 -1.26 -3.69 116.66 118.35 1m9l n ARG 189 Ca -0.03 -1.66 0.00 0.00 -1.93 0.00 0.00 57.85 54.23 1m9l n ARG 189 Cb 0.11 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 29.94 1m9l n ARG 189 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 1m9l n GLU 190 N 0.96 0.00 0.11 5.56 2.13 0.21 -4.55 120.64 125.05 1m9l n GLU 190 Ca 0.17 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.86 1m9l n GLU 190 Cb 0.51 -0.28 -0.08 0.00 0.27 0.00 0.00 31.44 31.85 1m9l n GLU 190 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 1m9l h GLN 191 N 0.00 -0.28 -0.20 5.31 4.15 -0.91 -0.87 115.11 122.31 1m9l h GLN 191 Ca 0.00 0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.47 1m9l h GLN 191 Cb 0.00 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 1m9l h GLN 191 CO 0.00 0.07 0.14 0.00 -1.93 0.00 0.00 178.83 177.10 1m9l h ALA 192 N -0.01 2.04 -0.04 3.38 0.00 -1.65 0.18 119.26 123.16 1m9l h ALA 192 Ca -0.03 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 1m9l h ALA 192 Cb 0.47 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.25 1m9l h ALA 192 CO 0.05 -0.08 -0.74 -0.91 0.00 0.00 0.00 179.25 177.57 1m9l h ASN 193 N 0.12 0.72 0.35 0.00 4.21 -1.60 -0.78 115.58 118.59 1m9l h ASN 193 Ca 0.09 -0.72 -0.12 0.00 1.21 0.00 0.00 56.30 56.76 1m9l h ASN 193 Cb 0.20 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.17 1m9l h ASN 193 CO -0.01 1.33 -0.50 0.58 -1.29 0.00 0.00 177.43 177.54 1m9l h VAL 194 N 0.17 1.35 -0.07 2.81 2.07 -0.56 0.80 116.25 122.82 1m9l h VAL 194 Ca -0.08 -1.73 -0.23 0.00 0.82 0.00 0.00 66.70 65.48 1m9l h VAL 194 Cb 1.42 1.86 0.01 0.00 -1.52 0.00 0.00 31.29 33.05 1m9l h VAL 194 CO 0.15 0.51 -0.87 0.00 0.02 0.00 0.00 177.57 177.38 1m9l h ALA 195 N 1.35 0.33 -0.10 1.67 0.00 -0.63 -3.17 119.26 118.71 1m9l h ALA 195 Ca 0.00 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 1m9l h ALA 195 Cb 0.93 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1m9l h ALA 195 CO 0.07 0.73 0.03 0.00 0.00 0.00 0.00 179.25 180.08 1m9l h ARG 196 N 0.39 0.16 0.00 0.00 3.08 -0.98 -3.46 114.38 113.57 1m9l h ARG 196 Ca -0.07 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1m9l h ARG 196 Cb 1.50 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.53 1m9l h ARG 196 CO 0.17 0.33 0.00 0.41 -1.07 0.00 0.00 179.97 179.81 1m9l n GLY 197 N -0.51 0.00 0.00 0.04 0.00 -0.64 -5.10 105.19 98.97 1m9l n GLY 197 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1m9l n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93