#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 2.83 -3.44 3.04 0.00 -1.26 -4.25 120.51 117.42 1m9l n ALA 2 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1m9l n ALA 2 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.52 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 -2.83 1.32 -3.03 0.00 4.81 -1.26 -4.38 118.16 112.79 1m9l n LYS 3 Ca -0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.29 1m9l n LYS 3 Cb 0.01 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.03 1m9l n LYS 3 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1m9l n ALA 4 N -3.00 0.22 -2.20 3.14 0.00 -1.26 -4.95 120.51 112.45 1m9l n ALA 4 Ca 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 53.44 51.45 1m9l n ALA 4 Cb 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1m9l n ALA 4 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1m9l n THR 5 N 2.72 0.00 -3.12 0.00 -2.24 -1.26 -4.35 114.28 106.03 1m9l n THR 5 Ca 0.22 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.76 1m9l n THR 5 Cb 0.53 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.76 1m9l n THR 5 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1m9l s THR 6 N 2.25 4.71 0.08 4.28 -4.23 -1.26 -3.01 115.64 118.46 1m9l s THR 6 Ca 0.00 -0.36 -0.32 0.00 -1.18 0.00 0.00 61.69 59.84 1m9l s THR 6 Cb 0.00 -3.74 -0.17 0.00 1.34 0.00 0.00 72.50 69.93 1m9l s THR 6 CO 0.00 -0.54 1.63 -0.29 -0.54 0.00 0.00 174.62 174.89 1m9l h ILE 7 N 0.54 0.38 0.42 2.99 -0.00 -1.91 0.21 117.51 120.14 1m9l h ILE 7 Ca -0.48 0.00 -0.01 0.00 -0.00 0.00 0.00 64.86 64.37 1m9l h ILE 7 Cb 1.23 0.38 -0.02 0.00 -0.00 0.00 0.00 36.82 38.40 1m9l h ILE 7 CO 0.60 0.00 -0.37 0.11 -0.00 0.00 0.00 178.15 178.49 1m9l h LYS 8 N -0.79 -0.77 0.47 2.19 1.57 -1.97 0.68 116.57 117.95 1m9l h LYS 8 Ca -0.07 0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1m9l h LYS 8 Cb 0.63 0.18 -0.00 0.00 0.08 0.00 0.00 32.23 33.11 1m9l h LYS 8 CO 0.08 -0.52 -0.30 -0.44 -0.57 0.00 0.00 179.45 177.71 1m9l h ASP 9 N -0.80 -0.76 -0.58 0.86 5.19 -1.98 -1.65 116.42 116.69 1m9l h ASP 9 Ca -0.04 0.04 0.12 0.00 -0.62 0.00 0.00 57.03 56.53 1m9l h ASP 9 Cb 0.70 0.22 -0.11 0.00 0.18 0.00 0.00 39.33 40.32 1m9l h ASP 9 CO -0.04 -0.45 -0.18 0.00 -3.12 0.00 0.00 179.24 175.45 1m9l h ALA 10 N -1.45 0.32 -0.69 3.45 0.00 -0.57 0.18 119.26 120.50 1m9l h ALA 10 Ca -0.06 0.22 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1m9l h ALA 10 Cb 0.58 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1m9l h ALA 10 CO 0.06 -0.47 0.24 0.82 0.00 0.00 0.00 179.25 179.90 1m9l h ILE 11 N -0.03 1.25 -0.71 0.00 2.04 -0.84 0.16 117.51 119.39 1m9l h ILE 11 Ca 0.28 -0.82 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 1m9l h ILE 11 Cb 0.46 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1m9l h ILE 11 CO -0.62 0.32 0.34 -0.09 0.00 0.00 0.00 178.15 178.10 1m9l h ARG 12 N 0.99 1.02 0.00 2.37 2.43 -0.36 -1.30 114.38 119.53 1m9l h ARG 12 Ca 0.23 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 1m9l h ARG 12 Cb 0.26 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1m9l h ARG 12 CO -0.01 0.80 -0.12 0.82 -1.51 0.00 0.00 179.97 179.95 1m9l h ILE 13 N 0.99 0.85 0.02 1.20 2.04 0.13 0.14 117.51 122.88 1m9l h ILE 13 Ca 0.24 -0.44 -0.27 0.00 1.00 0.00 0.00 64.86 65.40 1m9l h ILE 13 Cb 0.12 1.25 0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1m9l h ILE 13 CO -0.03 0.11 -1.07 -0.26 0.00 0.00 0.00 178.15 176.90 1m9l h PHE 14 N 0.00 0.97 0.00 1.37 0.04 0.15 0.27 116.94 119.74 1m9l h PHE 14 Ca -0.00 -0.55 -0.02 0.00 2.80 0.00 0.00 57.97 60.20 1m9l h PHE 14 Cb 0.24 -0.10 -0.00 0.00 2.20 0.00 0.00 35.95 38.29 1m9l h PHE 14 CO 0.00 1.38 -0.10 0.93 -0.60 0.00 0.00 178.31 179.92 1m9l h GLU 15 N 0.35 0.00 0.00 1.51 5.08 -0.14 0.17 114.58 121.55 1m9l h GLU 15 Ca -0.13 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 1m9l h GLU 15 Cb 1.73 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.97 1m9l h GLU 15 CO 0.21 0.10 -1.12 0.39 -1.00 0.00 0.00 179.01 177.59 1m9l n GLU 16 N -3.44 0.50 0.17 2.33 -0.58 0.38 -2.88 120.64 117.12 1m9l n GLU 16 Ca -0.01 0.20 -0.08 0.00 -0.42 0.00 0.00 57.16 56.85 1m9l n GLU 16 Cb 0.26 -1.37 -0.04 0.00 -0.57 0.00 0.00 31.44 29.72 1m9l n GLU 16 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 1m9l h ARG 17 N -0.93 -0.48 -0.78 3.49 2.43 -0.61 -3.12 114.38 114.37 1m9l h ARG 17 Ca -0.08 0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.18 1m9l h ARG 17 Cb 1.01 0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 30.62 1m9l h ARG 17 CO -0.05 -0.32 0.51 -0.22 -1.51 0.00 0.00 179.97 178.39 1m9l h LYS 18 N -0.96 0.82 -2.08 0.20 3.11 -1.52 -3.47 116.57 112.68 1m9l h LYS 18 Ca -0.05 -0.05 -0.02 0.00 -2.81 0.00 0.00 60.65 57.72 1m9l h LYS 18 Cb 0.38 -0.19 0.01 0.00 -1.00 0.00 0.00 32.23 31.43 1m9l h LYS 18 CO 0.08 0.55 -0.04 0.45 -2.81 0.00 0.00 179.45 177.67 1m9l n SER 19 N -4.48 -2.04 0.00 4.20 2.88 0.54 -4.99 113.62 109.73 1m9l n SER 19 Ca 0.12 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 1m9l n SER 19 Cb 0.21 -0.77 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 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 -1.38 0.00 -3.81 2.46 0.24 -0.79 -4.90 118.33 110.14 1m9l n VAL 20 Ca -0.01 0.00 -0.28 0.00 -2.04 0.00 0.00 64.34 62.01 1m9l n VAL 20 Cb 0.51 0.00 -0.16 0.00 -1.47 0.00 0.00 33.84 32.71 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 1.12 0.83 -0.16 3.34 1.01 -1.26 -4.34 120.40 120.94 1m9l s VAL 21 Ca 0.00 -0.61 -0.16 0.00 0.00 0.00 0.00 61.98 61.21 1m9l s VAL 21 Cb 0.00 -1.17 -0.06 0.00 0.00 0.00 0.00 36.38 35.15 1m9l s VAL 21 CO 0.00 -0.05 -0.31 0.00 0.00 0.00 0.00 175.10 174.73 1m9l n ALA 22 N 4.95 1.14 -4.09 5.51 0.00 -1.26 -4.21 120.51 122.55 1m9l n ALA 22 Ca -0.10 -0.76 -0.32 0.00 0.00 0.00 0.00 53.44 52.26 1m9l n ALA 22 Cb 0.47 0.07 -0.04 0.00 0.00 0.00 0.00 19.45 19.95 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 -4.33 -2.47 -2.54 0.00 -1.04 -1.26 -1.34 114.28 101.31 1m9l n THR 23 Ca -0.17 -0.56 -0.06 0.00 -2.04 0.00 0.00 64.05 61.22 1m9l n THR 23 Cb 0.51 -2.11 -0.01 0.00 -1.82 0.00 0.00 70.33 66.90 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 -4.57 -2.37 -2.69 -2.82 2.13 -1.26 -4.85 120.64 104.22 1m9l n GLU 24 Ca -0.27 0.02 -0.29 0.00 0.66 0.00 0.00 57.16 57.28 1m9l n GLU 24 Cb 0.66 -3.88 -0.02 0.00 0.27 0.00 0.00 31.44 28.48 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 3.35 0.12 4.31 0.00 -0.45 -4.66 121.76 122.51 1m9l s ALA 25 Ca 0.12 -0.30 -0.15 0.00 0.00 0.00 0.00 51.96 51.63 1m9l s ALA 25 Cb -0.07 -2.69 -0.02 0.00 0.00 0.00 0.00 23.12 20.33 1m9l s ALA 25 CO 0.15 -0.19 1.61 0.93 0.00 0.00 0.00 175.76 178.26 1m9l h GLU 26 N 0.74 0.64 -5.67 0.00 3.07 -1.87 -3.39 114.58 108.10 1m9l h GLU 26 Ca -0.47 -0.16 -0.62 0.00 -0.50 0.00 0.00 59.36 57.60 1m9l h GLU 26 Cb 1.19 -0.08 -0.13 0.00 -0.84 0.00 0.00 28.75 28.89 1m9l h GLU 26 CO 0.63 0.68 0.47 0.15 -1.40 0.00 0.00 179.01 179.54 1m9l s LYS 27 N -5.24 3.28 -0.25 2.33 1.02 -1.26 0.29 119.74 119.91 1m9l s LYS 27 Ca -0.13 -0.42 0.03 0.00 0.02 0.00 0.00 55.97 55.47 1m9l s LYS 27 Cb 0.10 -4.07 0.06 0.00 -0.52 0.00 0.00 37.83 33.39 1m9l s LYS 27 CO 0.77 -1.46 -0.11 0.08 -0.92 0.00 0.00 175.35 173.71 1m9l s VAL 28 N 3.71 2.06 -0.87 3.17 1.01 -0.70 -4.84 120.40 123.95 1m9l s VAL 28 Ca 0.27 -1.54 -0.19 0.00 0.00 0.00 0.00 61.98 60.52 1m9l s VAL 28 Cb -0.14 -2.18 0.13 0.00 0.00 0.00 0.00 36.38 34.19 1m9l s VAL 28 CO 0.17 -0.01 1.06 -1.61 0.00 0.00 0.00 175.10 174.71 1m9l s GLU 29 N 1.16 3.51 0.00 2.72 8.01 -1.26 -1.55 118.70 131.28 1m9l s GLU 29 Ca -0.08 -1.67 0.00 0.00 0.01 0.00 0.00 54.97 53.23 1m9l s GLU 29 Cb -0.19 -4.76 0.00 0.00 -4.31 0.00 0.00 34.13 24.87 1m9l s GLU 29 CO -0.06 -1.73 0.00 1.28 0.01 0.00 0.00 175.26 174.76 1m9l n LEU 30 N 6.50 0.00 0.00 1.80 4.77 -0.42 -4.60 117.00 125.05 1m9l n LEU 30 Ca 0.18 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 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 0.51 0.00 0.00 1.57 -1.33 0.00 0.00 177.39 178.14 1m9l n HIS 31 N 0.00 0.00 -3.82 -1.77 -0.00 -1.26 -4.68 115.22 103.69 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 -1.00 -0.14 -0.02 1.57 0.00 -1.26 -0.76 107.32 105.70 1m9l s GLY 32 Ca 0.00 -0.20 -0.20 0.00 0.00 0.00 0.00 44.72 44.32 1m9l s GLY 32 CO 0.00 -0.06 0.43 -0.29 0.00 0.00 0.00 173.10 173.18 1m9l s MET 33 N -3.82 0.81 0.02 2.90 0.00 -0.56 0.15 119.30 118.80 1m9l s MET 33 Ca 0.11 -0.07 -0.26 0.00 0.00 0.00 0.00 55.69 55.47 1m9l s MET 33 Cb -0.05 0.37 -0.05 0.00 0.00 0.00 0.00 34.83 35.10 1m9l s MET 33 CO 0.05 -0.24 0.79 0.96 0.00 0.00 0.00 175.02 176.58 1m9l s ILE 34 N -1.38 4.80 0.27 10.11 -4.36 -1.26 -3.38 121.20 126.01 1m9l s ILE 34 Ca -0.12 1.67 -0.04 0.00 -0.26 0.00 0.00 60.65 61.89 1m9l s ILE 34 Cb -0.03 -4.14 0.37 0.00 1.25 0.00 0.00 42.46 39.91 1m9l s ILE 34 CO 0.05 0.31 1.59 -0.65 0.24 0.00 0.00 174.94 176.49 1m9l h PRO 35 N 6.04 0.04 0.00 0.37 0.11 -1.95 -1.87 132.00 134.74 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 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1m9l h PRO 35 CO 0.72 0.03 0.00 -2.30 -0.21 0.00 0.00 178.00 176.24 1m9l n PRO 36 N -5.47 0.44 -1.56 1.05 -0.02 -1.26 -1.20 135.00 126.98 1m9l n PRO 36 Ca 0.17 0.00 -0.61 0.00 -2.02 0.00 0.00 63.50 61.04 1m9l n PRO 36 Cb 0.58 -1.05 -0.08 0.00 -0.02 0.00 0.00 33.50 32.92 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 -0.55 0.00 0.00 4.25 3.06 -0.71 -4.76 119.36 120.66 1m9l n ILE 37 Ca 0.01 -0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.26 1m9l n ILE 37 Cb 0.00 -0.14 0.00 0.00 0.54 0.00 0.00 39.64 40.04 1m9l n ILE 37 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 1m9l n GLU 38 N 2.13 0.00 -4.01 9.51 2.13 -1.22 -1.64 120.64 127.53 1m9l n GLU 38 Ca 0.23 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.69 1m9l n GLU 38 Cb 0.05 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 31.68 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 0.00 3.56 -1.09 5.31 1.02 -1.26 -2.49 119.74 124.80 1m9l s LYS 39 Ca 0.00 -0.26 -0.07 0.00 0.02 0.00 0.00 55.97 55.66 1m9l s LYS 39 Cb 0.00 -3.13 0.28 0.00 -0.52 0.00 0.00 37.83 34.46 1m9l s LYS 39 CO 0.00 0.57 1.20 -0.12 -0.92 0.00 0.00 175.35 176.09 1m9l n MET 40 N 2.60 3.76 -0.08 1.68 1.56 -1.26 -4.23 117.12 121.15 1m9l n MET 40 Ca -0.18 -4.49 -0.01 0.00 -0.27 0.00 0.00 57.70 52.74 1m9l n MET 40 Cb 0.54 -2.52 0.26 0.00 2.15 0.00 0.00 33.22 33.64 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 6.20 0.65 -0.03 6.12 1.82 -1.87 -1.30 116.42 128.01 1m9l h ASP 41 Ca 0.19 -0.10 0.03 0.00 -0.39 0.00 0.00 57.03 56.76 1m9l h ASP 41 Cb 0.79 -0.17 -0.05 0.00 0.68 0.00 0.00 39.33 40.58 1m9l h ASP 41 CO 1.10 0.64 -0.24 0.00 -1.61 0.00 0.00 179.24 179.13 1m9l h ALA 42 N 1.45 -0.31 -0.33 -0.78 0.00 -1.78 -1.08 119.26 116.43 1m9l h ALA 42 Ca 0.16 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.15 1m9l h ALA 42 Cb 0.24 0.44 -0.08 0.00 0.00 0.00 0.00 17.79 18.39 1m9l h ALA 42 CO -0.00 -0.74 -0.24 1.15 0.00 0.00 0.00 179.25 179.42 1m9l h THR 43 N -0.37 0.37 -0.81 0.00 2.02 -1.87 0.23 112.91 112.49 1m9l h THR 43 Ca 0.07 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.40 1m9l h THR 43 Cb 0.46 0.37 -0.15 0.00 -1.74 0.00 0.00 68.15 67.09 1m9l h THR 43 CO -0.23 0.00 -0.27 0.25 0.37 0.00 0.00 175.52 175.64 1m9l h LEU 44 N -0.21 -0.97 0.00 2.58 5.85 -0.05 0.38 115.31 122.89 1m9l h LEU 44 Ca 0.17 0.25 -0.01 0.00 0.84 0.00 0.00 57.88 59.13 1m9l h LEU 44 Cb 0.46 0.57 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 1m9l h LEU 44 CO -0.45 -0.28 -0.33 0.28 -0.34 0.00 0.00 178.44 177.31 1m9l h SER 45 N -0.04 0.00 0.00 1.25 0.02 -0.93 -3.36 113.55 110.49 1m9l h SER 45 Ca 0.35 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 1m9l h SER 45 Cb 0.59 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.13 1m9l h SER 45 CO -0.84 0.70 0.25 1.07 -1.14 0.00 0.00 176.83 176.87 1m9l n THR 46 N -4.67 0.92 -0.33 -2.27 5.66 0.77 -1.80 114.28 112.57 1m9l n THR 46 Ca -0.06 0.60 -0.01 0.00 -3.05 0.00 0.00 64.05 61.54 1m9l n THR 46 Cb 0.19 -1.60 0.04 0.00 -1.55 0.00 0.00 70.33 67.41 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 -1.60 -0.55 -0.33 1.09 0.00 0.13 -0.41 117.00 115.33 1m9l n LEU 47 Ca -0.00 1.52 0.21 0.00 0.00 0.00 0.00 56.01 57.73 1m9l n LEU 47 Cb 0.26 -0.35 0.41 0.00 0.00 0.00 0.00 43.42 43.73 1m9l n LEU 47 CO 0.02 -1.37 0.93 0.11 0.00 0.00 0.00 177.39 177.09 1m9l h LYS 48 N 0.00 0.06 0.00 1.96 1.57 -1.64 0.61 116.57 119.13 1m9l h LYS 48 Ca 0.31 -0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.91 1m9l h LYS 48 Cb 0.53 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.79 1m9l h LYS 48 CO -0.87 0.04 -1.60 0.00 -0.57 0.00 0.00 179.45 176.45 1m9l n ALA 49 N -2.71 1.99 -1.29 3.86 0.00 0.46 -5.03 120.51 117.77 1m9l n ALA 49 Ca 0.29 -0.64 -0.50 0.00 0.00 0.00 0.00 53.44 52.58 1m9l n ALA 49 Cb 0.95 -0.83 -0.07 0.00 0.00 0.00 0.00 19.45 19.49 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 2.66 0.00 -3.19 0.00 4.81 -1.22 -4.21 118.16 117.01 1m9l n LYS 51 Ca 0.22 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.23 1m9l n LYS 51 Cb -0.02 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.03 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 -2.58 3.75 -2.49 5.64 -0.00 0.15 0.06 115.22 119.75 1m9l n HIS 52 Ca 0.00 -3.28 -0.41 0.00 0.46 0.00 0.00 57.72 54.48 1m9l n HIS 52 Cb 0.00 -1.44 -0.03 0.00 -0.12 0.00 0.00 29.99 28.40 1m9l n HIS 52 CO 0.00 0.00 0.00 -1.17 0.46 0.00 0.00 176.34 175.63 1m9l s LEU 53 N -2.05 3.25 -0.33 0.27 2.96 -0.22 -1.72 118.68 120.83 1m9l s LEU 53 Ca 0.31 -0.20 -0.09 0.00 -0.22 0.00 0.00 54.13 53.93 1m9l s LEU 53 Cb -0.02 -2.71 0.01 0.00 0.50 0.00 0.00 46.19 43.97 1m9l s LEU 53 CO 0.01 -1.82 0.15 0.00 -1.32 0.00 0.00 176.35 173.37 1m9l s ALA 54 N 5.96 3.21 0.00 5.97 0.00 -0.60 -0.74 121.76 135.56 1m9l s ALA 54 Ca 0.41 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.84 1m9l s ALA 54 Cb -0.09 -2.38 0.00 0.00 0.00 0.00 0.00 23.12 20.66 1m9l s ALA 54 CO 0.18 -1.09 0.00 1.28 0.00 0.00 0.00 175.76 176.14 1m9l n LEU 55 N 4.94 0.00 0.00 0.00 7.99 -0.53 -1.30 117.00 128.11 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 0.48 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.79 1m9l n LEU 55 CO 0.34 -0.10 0.00 -0.24 -1.51 0.00 0.00 177.39 175.88 1m9l n SER 56 N -1.13 0.00 -3.47 -1.43 2.88 -0.98 -4.47 113.62 105.03 1m9l n SER 56 Ca 0.00 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.36 1m9l n SER 56 Cb 0.00 0.11 -0.12 0.00 -0.75 0.00 0.00 64.21 63.45 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 -1.23 -0.33 0.20 2.46 -1.32 0.06 -0.45 115.64 115.02 1m9l s THR 57 Ca 0.00 -0.21 -0.11 0.00 -1.21 0.00 0.00 61.69 60.15 1m9l s THR 57 Cb 0.00 -0.75 -0.00 0.00 -1.51 0.00 0.00 72.50 70.24 1m9l s THR 57 CO 0.00 -0.28 0.39 0.54 -2.21 0.00 0.00 174.62 173.06 1m9l s ASN 58 N 2.33 -0.05 0.08 8.08 4.22 -0.22 -1.49 114.94 127.88 1m9l s ASN 58 Ca 0.08 -0.84 0.04 0.00 -2.14 0.00 0.00 52.86 50.00 1m9l s ASN 58 Cb -0.15 0.51 -0.03 0.00 1.28 0.00 0.00 41.25 42.85 1m9l s ASN 58 CO -0.17 -1.00 -0.12 0.20 -2.04 0.00 0.00 177.10 173.97 1m9l s ASN 59 N -2.98 1.54 -0.27 3.54 0.01 -1.22 -1.54 114.94 114.01 1m9l s ASN 59 Ca 0.18 -0.71 -0.04 0.00 -0.71 0.00 0.00 52.86 51.59 1m9l s ASN 59 Cb 0.01 -0.02 0.09 0.00 0.41 0.00 0.00 41.25 41.75 1m9l s ASN 59 CO 0.03 -0.17 0.12 -0.63 -1.51 0.00 0.00 177.10 174.94 1m9l s ILE 60 N -1.84 0.01 -0.17 0.60 1.01 0.07 -3.78 121.20 117.10 1m9l s ILE 60 Ca 0.01 -0.73 -0.23 0.00 0.00 0.00 0.00 60.65 59.70 1m9l s ILE 60 Cb -0.07 -0.98 -0.20 0.00 0.01 0.00 0.00 42.46 41.22 1m9l s ILE 60 CO 0.01 -0.66 0.43 -0.08 0.00 0.00 0.00 174.94 174.64 1m9l h GLU 61 N 8.38 0.00 -4.17 2.79 4.22 -1.35 -3.36 114.58 121.10 1m9l h GLU 61 Ca -0.19 0.00 -0.34 0.00 0.08 0.00 0.00 59.36 58.92 1m9l h GLU 61 Cb 1.03 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 29.98 1m9l h GLU 61 CO 0.42 0.87 -0.75 0.21 -2.18 0.00 0.00 179.01 177.58 1m9l s LYS 62 N -2.24 0.45 -0.45 1.92 2.20 -0.66 -4.65 119.74 116.32 1m9l s LYS 62 Ca -0.22 -0.13 0.05 0.00 -0.36 0.00 0.00 55.97 55.31 1m9l s LYS 62 Cb 0.01 -0.46 0.20 0.00 -1.51 0.00 0.00 37.83 36.07 1m9l s LYS 62 CO 0.57 0.05 0.44 1.51 -0.36 0.00 0.00 175.35 177.56 1m9l n ILE 63 N 3.27 -0.54 0.23 5.43 0.00 -1.22 -3.42 119.36 123.12 1m9l n ILE 63 Ca -0.17 -3.87 0.08 0.00 0.00 0.00 0.00 62.75 58.80 1m9l n ILE 63 Cb 0.56 -1.83 0.57 0.00 0.00 0.00 0.00 39.64 38.94 1m9l n ILE 63 CO 0.00 0.00 0.00 -1.28 0.00 0.00 0.00 176.55 175.27 1m9l h SER 64 N 5.01 0.00 -0.19 9.51 0.87 -1.86 -3.35 113.55 123.55 1m9l h SER 64 Ca 0.19 0.00 -0.56 0.00 -1.23 0.00 0.00 61.79 60.19 1m9l h SER 64 Cb 0.87 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.81 1m9l h SER 64 CO 0.46 0.20 2.57 -1.54 -0.53 0.00 0.00 176.83 178.00 1m9l n SER 65 N -3.86 7.79 -0.04 6.23 3.41 -1.26 -4.62 113.62 121.27 1m9l n SER 65 Ca -0.02 -2.65 -0.12 0.00 -0.26 0.00 0.00 58.87 55.83 1m9l n SER 65 Cb 0.30 -1.49 -0.06 0.00 -0.26 0.00 0.00 64.21 62.70 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 6.24 0.21 -2.63 1.04 8.10 -1.85 -1.42 115.31 124.99 1m9l h LEU 66 Ca 0.68 -0.27 -0.00 0.00 0.11 0.00 0.00 57.88 58.40 1m9l h LEU 66 Cb 0.58 -0.06 -0.00 0.00 -0.44 0.00 0.00 40.66 40.75 1m9l h LEU 66 CO 1.36 0.42 -0.00 0.77 -4.11 0.00 0.00 178.44 176.88 1m9l h SER 67 N -0.01 0.00 0.14 0.17 4.64 -1.95 -1.10 113.55 115.44 1m9l h SER 67 Ca 0.04 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.35 1m9l h SER 67 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1m9l h SER 67 CO 0.00 0.00 -0.07 1.23 -0.87 0.00 0.00 176.83 177.13 1m9l h GLY 68 N 0.04 -0.19 1.27 -0.77 0.00 -1.71 -3.26 103.07 98.45 1m9l h GLY 68 Ca -0.00 0.07 0.09 0.00 0.00 0.00 0.00 47.33 47.49 1m9l h GLY 68 CO 0.00 -0.07 0.27 -0.33 0.00 0.00 0.00 176.54 176.41 1m9l h MET 69 N -0.83 0.00 0.00 4.80 2.86 -0.18 -3.32 114.93 118.27 1m9l h MET 69 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1m9l h MET 69 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 1m9l h MET 69 CO 0.03 0.00 0.00 -1.91 1.06 0.00 0.00 176.91 176.09 1m9l n GLU 70 N -4.10 0.00 0.00 1.72 4.07 -0.60 -1.63 120.64 120.10 1m9l n GLU 70 Ca 0.05 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.15 1m9l n GLU 70 Cb 0.44 -1.33 0.00 0.00 -0.06 0.00 0.00 31.44 30.49 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 -0.42 2.97 -4.70 4.31 5.15 -1.25 -4.61 115.26 116.71 1m9l n ASN 71 Ca 0.00 -0.16 -0.34 0.00 -0.60 0.00 0.00 54.58 53.47 1m9l n ASN 71 Cb 0.00 0.92 0.11 0.00 -0.53 0.00 0.00 39.78 40.28 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 -1.21 4.79 0.07 1.20 7.94 -0.64 -4.70 117.00 124.44 1m9l n LEU 72 Ca 0.00 0.65 0.00 0.00 -1.11 0.00 0.00 56.01 55.55 1m9l n LEU 72 Cb 0.00 -1.52 0.00 0.00 0.53 0.00 0.00 43.42 42.43 1m9l n LEU 72 CO 0.00 -1.54 -0.07 0.54 -1.11 0.00 0.00 177.39 175.21 1m9l n ARG 73 N -2.86 0.00 -3.19 1.96 1.74 -1.24 -3.17 116.66 109.89 1m9l n ARG 73 Ca 0.14 0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.77 1m9l n ARG 73 Cb 0.50 -0.19 -0.04 0.00 -1.02 0.00 0.00 32.46 31.70 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 5.07 -0.45 0.55 1.01 0.11 -1.50 121.20 124.00 1m9l s ILE 74 Ca 0.00 -1.46 -0.19 0.00 0.00 0.00 0.00 60.65 58.99 1m9l s ILE 74 Cb 0.00 -4.47 0.03 0.00 0.01 0.00 0.00 42.46 38.03 1m9l s ILE 74 CO 0.00 -1.06 0.58 -0.22 0.00 0.00 0.00 174.94 174.24 1m9l s LEU 75 N 1.90 4.68 -0.81 2.97 0.20 -0.38 -1.06 118.68 126.19 1m9l s LEU 75 Ca 0.12 -0.54 0.02 0.00 0.69 0.00 0.00 54.13 54.42 1m9l s LEU 75 Cb -0.22 -2.58 0.28 0.00 -0.43 0.00 0.00 46.19 43.24 1m9l s LEU 75 CO 0.01 -0.74 1.05 -1.20 -0.29 0.00 0.00 176.35 175.18 1m9l n SER 76 N 6.06 4.84 -2.67 3.68 7.64 0.08 -0.80 113.62 132.44 1m9l n SER 76 Ca -0.04 -3.45 0.00 0.00 1.01 0.00 0.00 58.87 56.39 1m9l n SER 76 Cb 0.47 -0.90 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 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 0.98 0.00 0.14 -3.43 0.00 -0.00 -1.45 117.00 113.24 1m9l n LEU 77 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.30 1m9l n LEU 77 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.80 1m9l n LEU 77 CO 0.53 -0.20 0.00 0.61 0.00 0.00 0.00 177.39 178.33 1m9l n GLY 78 N 4.83 -1.82 2.85 -3.96 0.00 -1.26 -4.62 105.19 101.21 1m9l n GLY 78 Ca 0.00 0.41 -0.26 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.59 1.14 0.07 1.61 3.00 0.41 -0.08 118.95 123.51 1m9l s ARG 79 Ca 0.00 -0.17 -0.19 0.00 -1.00 0.00 0.00 55.73 54.37 1m9l s ARG 79 Cb 0.00 -1.46 0.04 0.00 0.00 0.00 0.00 34.95 33.53 1m9l s ARG 79 CO 0.00 -0.32 0.45 0.54 0.00 0.00 0.00 175.30 175.97 1m9l s ASN 80 N 1.80 -0.33 -0.19 -2.12 6.03 -0.38 -1.06 114.94 118.69 1m9l s ASN 80 Ca 0.04 -0.02 -0.04 0.00 -1.03 0.00 0.00 52.86 51.81 1m9l s ASN 80 Cb -0.13 0.46 -0.02 0.00 -3.03 0.00 0.00 41.25 38.53 1m9l s ASN 80 CO -0.07 -0.74 -0.03 -0.76 -2.03 0.00 0.00 177.10 173.47 1m9l s LEU 81 N -2.21 3.14 -0.02 3.54 2.01 -0.59 -1.09 118.68 123.46 1m9l s LEU 81 Ca -0.03 -0.23 0.04 0.00 0.01 0.00 0.00 54.13 53.92 1m9l s LEU 81 Cb -0.00 -1.78 -0.01 0.00 0.01 0.00 0.00 46.19 44.41 1m9l s LEU 81 CO -0.05 0.08 -0.14 -0.63 1.01 0.00 0.00 176.35 176.63 1m9l s ILE 82 N 0.87 1.10 0.17 -0.59 1.01 -0.22 -0.75 121.20 122.80 1m9l s ILE 82 Ca -0.00 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 60.07 1m9l s ILE 82 Cb -0.14 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.39 1m9l s ILE 82 CO 0.02 0.32 0.00 0.29 0.00 0.00 0.00 174.94 175.56 1m9l n LYS 83 N 2.92 0.00 -4.38 2.79 5.02 -1.26 -4.19 118.16 119.06 1m9l n LYS 83 Ca -0.16 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.79 1m9l n LYS 83 Cb 0.55 -0.26 -0.11 0.00 -0.02 0.00 0.00 35.03 35.19 1m9l n LYS 83 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1m9l s LYS 84 N -2.00 3.30 -0.13 1.97 2.47 -1.26 -4.57 119.74 119.52 1m9l s LYS 84 Ca 0.00 -0.46 -0.29 0.00 -1.56 0.00 0.00 55.97 53.66 1m9l s LYS 84 Cb 0.00 -2.85 -0.01 0.00 -1.46 0.00 0.00 37.83 33.50 1m9l s LYS 84 CO 0.00 0.49 1.08 -1.50 0.16 0.00 0.00 175.35 175.58 1m9l s ILE 85 N -0.30 4.61 0.00 5.43 -1.16 -1.26 -4.77 121.20 123.74 1m9l s ILE 85 Ca 0.06 1.90 0.00 0.00 -0.51 0.00 0.00 60.65 62.10 1m9l s ILE 85 Cb -0.12 -4.23 0.00 0.00 0.61 0.00 0.00 42.46 38.72 1m9l s ILE 85 CO 0.02 -0.06 0.00 -0.62 -2.81 0.00 0.00 174.94 171.47 1m9l n GLU 86 N 5.54 0.00 -0.00 3.50 1.02 -1.26 -4.93 120.64 124.51 1m9l n GLU 86 Ca 0.11 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.31 1m9l n GLU 86 Cb 0.47 -0.16 -0.09 0.00 -0.02 0.00 0.00 31.44 31.64 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 -1.96 1.29 -0.36 1.62 6.94 -1.25 -4.62 115.26 116.92 1m9l n ASN 87 Ca 0.00 -0.40 0.03 0.00 -0.02 0.00 0.00 54.58 54.19 1m9l n ASN 87 Cb 0.00 1.30 0.19 0.00 -2.36 0.00 0.00 39.78 38.91 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 1.01 -0.61 -4.53 3.38 -1.92 -0.91 115.31 111.74 1m9l h LEU 88 Ca 0.00 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1m9l h LEU 88 Cb 0.45 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1m9l h LEU 88 CO 0.00 0.64 0.13 0.44 0.09 0.00 0.00 178.44 179.74 1m9l h ASP 89 N 1.14 0.93 0.10 -0.43 3.32 -1.89 0.11 116.42 119.71 1m9l h ASP 89 Ca 0.43 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 1m9l h ASP 89 Cb 0.20 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1m9l h ASP 89 CO -0.18 0.93 -0.05 0.00 -1.72 0.00 0.00 179.24 178.23 1m9l h ALA 90 N 1.03 -0.13 -0.99 3.45 0.00 -1.67 -0.19 119.26 120.77 1m9l h ALA 90 Ca 0.19 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1m9l h ALA 90 Cb 0.38 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 1m9l h ALA 90 CO 0.00 -0.31 0.64 -0.39 0.00 0.00 0.00 179.25 179.20 1m9l h VAL 91 N -0.65 1.09 -0.19 0.00 -1.51 -1.24 -0.98 116.25 112.77 1m9l h VAL 91 Ca -0.01 -0.40 -0.10 0.00 -1.23 0.00 0.00 66.70 64.95 1m9l h VAL 91 Cb 0.52 -0.18 -0.01 0.00 -2.13 0.00 0.00 31.29 29.49 1m9l h VAL 91 CO 0.02 0.21 -0.33 0.00 -1.23 0.00 0.00 177.57 176.24 1m9l h ALA 92 N 1.46 1.08 -0.51 5.19 0.00 -0.90 0.37 119.26 125.96 1m9l h ALA 92 Ca 0.42 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1m9l h ALA 92 Cb 0.16 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1m9l h ALA 92 CO -0.17 0.57 0.06 -0.44 0.00 0.00 0.00 179.25 179.28 1m9l h ASP 93 N 0.33 0.83 0.20 0.00 3.32 0.26 -3.34 116.42 118.03 1m9l h ASP 93 Ca 0.04 -0.28 -0.17 0.00 0.02 0.00 0.00 57.03 56.65 1m9l h ASP 93 Cb 0.75 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 1m9l h ASP 93 CO 0.06 0.90 -1.96 1.07 -1.72 0.00 0.00 179.24 177.59 1m9l n THR 94 N -4.37 0.79 -1.05 0.35 5.66 -0.69 -5.02 114.28 109.94 1m9l n THR 94 Ca 0.01 -0.67 -0.29 0.00 -3.05 0.00 0.00 64.05 60.05 1m9l n THR 94 Cb 0.28 -0.35 0.20 0.00 -1.55 0.00 0.00 70.33 68.91 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 -5.19 1.22 0.00 1.09 1.43 0.13 -4.60 118.68 112.76 1m9l s LEU 95 Ca -0.07 1.10 0.00 0.00 -1.03 0.00 0.00 54.13 54.13 1m9l s LEU 95 Cb 0.10 -3.14 0.00 0.00 0.03 0.00 0.00 46.19 43.18 1m9l s LEU 95 CO 0.85 -3.54 0.00 1.21 0.23 0.00 0.00 176.35 175.10 1m9l n GLU 96 N -4.43 0.00 -3.52 1.70 2.13 -1.19 -4.78 120.64 110.54 1m9l n GLU 96 Ca 0.06 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.49 1m9l n GLU 96 Cb 0.57 -0.06 -0.04 0.00 0.27 0.00 0.00 31.44 32.18 1m9l n GLU 96 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1m9l n GLU 97 N -2.24 2.98 -2.37 5.31 1.02 -0.56 -1.68 120.64 123.10 1m9l n GLU 97 Ca 0.00 -4.48 -0.43 0.00 -0.02 0.00 0.00 57.16 52.23 1m9l n GLU 97 Cb 0.00 -2.46 0.00 0.00 -0.02 0.00 0.00 31.44 28.97 1m9l n GLU 97 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1m9l n LEU 98 N 2.35 5.79 -4.40 -4.62 4.77 -0.53 -1.25 117.00 119.12 1m9l n LEU 98 Ca 0.23 -4.19 -0.44 0.00 -0.03 0.00 0.00 56.01 51.57 1m9l n LEU 98 Cb 0.37 -1.66 -0.04 0.00 -2.33 0.00 0.00 43.42 39.76 1m9l n LEU 98 CO 0.41 0.71 0.55 0.26 -1.33 0.00 0.00 177.39 177.99 1m9l s TRP 99 N 2.87 2.96 -0.35 -1.77 0.51 0.02 -1.04 118.94 122.14 1m9l s TRP 99 Ca 0.48 -0.95 0.15 0.00 -2.12 0.00 0.00 56.10 53.66 1m9l s TRP 99 Cb 0.06 -4.10 0.42 0.00 -0.81 0.00 0.00 33.47 29.04 1m9l s TRP 99 CO 0.01 -1.39 0.92 0.44 -0.51 0.00 0.00 176.95 176.42 1m9l n ILE 100 N 5.56 0.53 0.00 2.03 -5.35 -0.58 -0.82 119.36 120.72 1m9l n ILE 100 Ca -0.04 -3.35 0.00 0.00 -0.27 0.00 0.00 62.75 59.09 1m9l n ILE 100 Cb 0.44 0.44 0.00 0.00 -1.74 0.00 0.00 39.64 38.78 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 0.02 0.00 -4.18 7.28 3.41 -1.13 -3.94 113.62 115.08 1m9l n SER 101 Ca 0.13 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.39 1m9l n SER 101 Cb 0.77 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.58 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 -4.95 3.20 0.03 7.33 6.14 0.89 -0.86 117.35 129.14 1m9l s TYR 102 Ca 0.00 -1.77 -0.15 0.00 0.64 0.00 0.00 57.07 55.79 1m9l s TYR 102 Cb 0.00 -2.09 0.02 0.00 0.42 0.00 0.00 41.96 40.31 1m9l s TYR 102 CO 0.00 -0.78 0.33 0.54 0.64 0.00 0.00 175.55 176.29 1m9l s ASN 103 N 1.28 -0.18 -0.15 4.32 2.20 -0.48 -1.25 114.94 120.68 1m9l s ASN 103 Ca -0.04 -0.10 0.01 0.00 -0.94 0.00 0.00 52.86 51.80 1m9l s ASN 103 Cb -0.19 0.37 0.02 0.00 -2.00 0.00 0.00 41.25 39.45 1m9l s ASN 103 CO -0.02 -0.60 -0.17 -1.10 -2.94 0.00 0.00 177.10 172.27 1m9l s GLN 104 N -2.34 2.60 0.25 3.55 -0.21 -0.25 -0.96 119.66 122.30 1m9l s GLN 104 Ca -0.06 -0.68 0.02 0.00 0.02 0.00 0.00 55.36 54.65 1m9l s GLN 104 Cb -0.01 -2.27 -0.05 0.00 1.00 0.00 0.00 33.01 31.67 1m9l s GLN 104 CO -0.02 -0.18 0.08 0.42 -2.12 0.00 0.00 175.29 173.47 1m9l s ILE 105 N 1.27 0.63 0.00 1.08 1.01 -0.66 -1.05 121.20 123.48 1m9l s ILE 105 Ca 0.02 -2.00 0.00 0.00 0.00 0.00 0.00 60.65 58.67 1m9l s ILE 105 Cb -0.13 -2.57 0.00 0.00 0.01 0.00 0.00 42.46 39.76 1m9l s ILE 105 CO -0.09 -0.07 0.00 0.00 0.00 0.00 0.00 174.94 174.78 1m9l n ALA 106 N -0.45 0.01 -2.26 9.38 0.00 -1.26 -4.35 120.51 121.57 1m9l n ALA 106 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.02 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 -1.54 0.00 0.00 0.00 177.50 175.96 1m9l s SER 107 N -0.14 7.44 0.10 0.00 1.04 -1.26 -5.00 113.70 115.87 1m9l s SER 107 Ca 0.00 1.85 -0.14 0.00 0.48 0.00 0.00 55.95 58.13 1m9l s SER 107 Cb 0.00 -2.59 -0.08 0.00 0.10 0.00 0.00 66.02 63.45 1m9l s SER 107 CO 0.00 -0.12 1.43 -0.07 0.98 0.00 0.00 173.24 175.47 1m9l h LEU 108 N 5.61 0.77 0.15 2.42 -0.00 -1.99 -1.32 115.31 120.94 1m9l h LEU 108 Ca -0.43 -0.46 -0.01 0.00 -0.00 0.00 0.00 57.88 56.98 1m9l h LEU 108 Cb 1.21 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 41.66 1m9l h LEU 108 CO 0.72 1.07 -0.07 -1.28 -0.00 0.00 0.00 178.44 178.88 1m9l h SER 109 N 0.48 -0.17 0.91 -0.43 0.87 -1.99 -0.91 113.55 112.31 1m9l h SER 109 Ca 0.05 -0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 1m9l h SER 109 Cb 0.84 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.85 1m9l h SER 109 CO 0.07 -0.07 -0.49 1.23 -0.53 0.00 0.00 176.83 177.05 1m9l h GLY 110 N -0.27 -1.38 0.39 5.77 0.00 -1.94 -1.92 103.07 103.73 1m9l h GLY 110 Ca -0.02 0.53 0.13 0.00 0.00 0.00 0.00 47.33 47.98 1m9l h GLY 110 CO 0.03 -0.48 0.59 0.16 0.00 0.00 0.00 176.54 176.84 1m9l h ILE 111 N -1.28 0.86 0.14 2.60 -0.00 -1.29 -0.42 117.51 118.12 1m9l h ILE 111 Ca -0.12 -0.31 0.01 0.00 -0.00 0.00 0.00 64.86 64.44 1m9l h ILE 111 Cb 1.00 -0.11 -0.02 0.00 -0.00 0.00 0.00 36.82 37.69 1m9l h ILE 111 CO 0.17 0.16 -0.21 -0.08 -0.00 0.00 0.00 178.15 178.19 1m9l h GLU 112 N 0.89 -0.39 0.18 0.16 4.81 -0.85 -0.48 114.58 118.90 1m9l h GLU 112 Ca 0.50 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.74 1m9l h GLU 112 Cb 0.56 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1m9l h GLU 112 CO -0.29 -0.26 -0.09 0.87 -0.73 0.00 0.00 179.01 178.51 1m9l h LYS 113 N -0.41 -0.23 -0.76 1.92 1.57 -0.72 -1.03 116.57 116.90 1m9l h LYS 113 Ca 0.02 0.02 0.15 0.00 -1.87 0.00 0.00 60.65 58.97 1m9l h LYS 113 Cb 0.42 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.73 1m9l h LYS 113 CO -0.10 0.16 0.51 1.37 -0.57 0.00 0.00 179.45 180.81 1m9l h LEU 114 N -0.91 0.37 0.01 2.94 8.10 -1.16 -1.04 115.31 123.61 1m9l h LEU 114 Ca -0.02 0.02 -0.01 0.00 0.11 0.00 0.00 57.88 57.98 1m9l h LEU 114 Cb 0.50 -0.05 0.00 0.00 -0.44 0.00 0.00 40.66 40.67 1m9l h LEU 114 CO 0.04 0.19 -0.04 0.58 -4.11 0.00 0.00 178.44 175.09 1m9l h VAL 115 N 0.39 1.76 -0.90 0.15 2.07 -1.16 -3.29 116.25 115.26 1m9l h VAL 115 Ca 0.37 -2.28 0.26 0.00 0.82 0.00 0.00 66.70 65.88 1m9l h VAL 115 Cb 0.89 3.30 -0.04 0.00 -1.52 0.00 0.00 31.29 33.93 1m9l h VAL 115 CO -0.12 0.59 0.90 -1.13 0.02 0.00 0.00 177.57 177.84 1m9l h ASN 116 N -0.93 0.00 -1.19 0.57 -1.24 -0.04 -3.43 115.58 109.33 1m9l h ASN 116 Ca -0.01 0.00 -0.04 0.00 0.71 0.00 0.00 56.30 56.96 1m9l h ASN 116 Cb 1.00 0.00 0.02 0.00 0.73 0.00 0.00 38.32 40.07 1m9l h ASN 116 CO 0.01 0.00 -0.02 -0.11 -1.29 0.00 0.00 177.43 176.02 1m9l n LEU 117 N -3.60 0.00 -0.02 0.34 7.94 -0.51 -4.69 117.00 116.47 1m9l n LEU 117 Ca 0.19 -0.09 -0.01 0.00 -1.11 0.00 0.00 56.01 54.99 1m9l n LEU 117 Cb 1.20 -0.54 -0.00 0.00 0.53 0.00 0.00 43.42 44.60 1m9l n LEU 117 CO 0.29 -2.07 0.03 0.03 -1.11 0.00 0.00 177.39 174.55 1m9l h ARG 118 N 0.00 -0.05 -4.43 1.96 2.47 -1.83 -3.40 114.38 109.10 1m9l h ARG 118 Ca -0.04 0.00 -0.49 0.00 -1.26 0.00 0.00 59.98 58.20 1m9l h ARG 118 Cb 0.14 0.01 -0.33 0.00 -1.65 0.00 0.00 29.97 28.14 1m9l h ARG 118 CO 0.02 -0.03 -0.80 0.54 0.56 0.00 0.00 179.97 180.26 1m9l s VAL 119 N -1.62 0.98 -0.08 2.04 0.11 -0.67 -1.70 120.40 119.46 1m9l s VAL 119 Ca -0.01 -0.39 -0.03 0.00 -2.93 0.00 0.00 61.98 58.62 1m9l s VAL 119 Cb 0.00 -0.91 0.04 0.00 -1.53 0.00 0.00 36.38 33.98 1m9l s VAL 119 CO 0.02 0.32 0.17 -1.48 -3.33 0.00 0.00 175.10 170.80 1m9l s LEU 120 N 0.70 0.63 -0.23 2.54 2.34 -0.67 -1.45 118.68 122.54 1m9l s LEU 120 Ca -0.14 0.36 -0.04 0.00 0.06 0.00 0.00 54.13 54.37 1m9l s LEU 120 Cb -0.15 0.45 -0.00 0.00 -0.56 0.00 0.00 46.19 45.93 1m9l s LEU 120 CO 0.03 -0.15 -0.04 -0.31 -1.06 0.00 0.00 176.35 174.81 1m9l s TYR 121 N 1.22 2.98 -0.38 3.48 2.02 -0.21 -1.38 117.35 125.07 1m9l s TYR 121 Ca -0.09 -1.04 0.02 0.00 -0.37 0.00 0.00 57.07 55.59 1m9l s TYR 121 Cb -0.11 -2.10 0.16 0.00 -0.40 0.00 0.00 41.96 39.50 1m9l s TYR 121 CO -0.07 -0.58 0.31 -1.64 -1.57 0.00 0.00 175.55 172.00 1m9l s MET 122 N 1.46 0.70 0.15 -0.62 -1.94 0.82 -1.53 119.30 118.33 1m9l s MET 122 Ca 0.05 -1.49 0.03 0.00 -1.71 0.00 0.00 55.69 52.57 1m9l s MET 122 Cb -0.15 -1.17 -0.07 0.00 2.01 0.00 0.00 34.83 35.45 1m9l s MET 122 CO -0.03 -1.27 1.34 0.66 -0.01 0.00 0.00 175.02 175.70 1m9l h SER 123 N 6.47 0.19 -3.34 3.03 4.64 -1.68 0.46 113.55 123.32 1m9l h SER 123 Ca 0.13 -0.17 -0.62 0.00 -0.47 0.00 0.00 61.79 60.66 1m9l h SER 123 Cb 0.97 -0.06 -0.36 0.00 -0.31 0.00 0.00 62.40 62.64 1m9l h SER 123 CO 0.27 1.02 -0.82 0.20 -0.87 0.00 0.00 176.83 176.64 1m9l s ASN 124 N -6.90 3.27 0.33 4.97 0.01 -0.04 -0.15 114.94 116.43 1m9l s ASN 124 Ca -0.02 -0.80 -0.18 0.00 -0.71 0.00 0.00 52.86 51.15 1m9l s ASN 124 Cb 0.10 -1.27 0.04 0.00 0.41 0.00 0.00 41.25 40.53 1m9l s ASN 124 CO 0.83 -0.11 0.74 0.54 -1.51 0.00 0.00 177.10 177.59 1m9l s ASN 125 N 1.39 -0.10 -0.17 -1.22 2.20 0.17 -1.38 114.94 115.83 1m9l s ASN 125 Ca 0.00 -0.91 -0.00 0.00 -0.94 0.00 0.00 52.86 51.01 1m9l s ASN 125 Cb -0.15 0.79 0.04 0.00 -2.00 0.00 0.00 41.25 39.93 1m9l s ASN 125 CO -0.09 -1.52 -0.05 -0.54 -2.94 0.00 0.00 177.10 171.96 1m9l s LYS 126 N -3.09 1.47 -0.26 3.55 -0.14 -0.13 -3.20 119.74 117.94 1m9l s LYS 126 Ca 0.14 -0.57 -0.24 0.00 -1.36 0.00 0.00 55.97 53.94 1m9l s LYS 126 Cb -0.05 -2.08 0.07 0.00 -1.68 0.00 0.00 37.83 34.08 1m9l s LYS 126 CO 0.10 -0.45 0.69 0.42 -0.76 0.00 0.00 175.35 175.35 1m9l s ILE 127 N 1.61 -0.00 0.00 2.17 1.01 -1.26 -1.66 121.20 123.06 1m9l s ILE 127 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.65 1m9l s ILE 127 Cb -0.16 -0.96 0.00 0.00 0.01 0.00 0.00 42.46 41.35 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 2.78 0.00 -1.63 2.92 -2.24 -1.26 -1.56 114.28 113.29 1m9l n THR 128 Ca -0.14 -0.03 -0.40 0.00 -2.27 0.00 0.00 64.05 61.21 1m9l n THR 128 Cb 0.55 0.96 -0.02 0.00 -2.10 0.00 0.00 70.33 69.73 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 -0.06 7.16 -0.29 3.42 5.15 -1.26 -4.66 115.26 124.72 1m9l n ASN 129 Ca 0.00 -2.79 0.10 0.00 -0.60 0.00 0.00 54.58 51.30 1m9l n ASN 129 Cb 0.00 -1.54 0.26 0.00 -0.53 0.00 0.00 39.78 37.97 1m9l n ASN 129 CO 0.00 0.00 0.00 -0.25 1.40 0.00 0.00 177.26 178.41 1m9l h TRP 130 N 5.23 0.61 -0.96 1.20 7.01 -1.94 0.37 115.95 127.47 1m9l h TRP 130 Ca 0.73 0.04 0.16 0.00 2.11 0.00 0.00 58.89 61.93 1m9l h TRP 130 Cb 0.40 -0.14 -0.16 0.00 -2.10 0.00 0.00 29.16 27.16 1m9l h TRP 130 CO 1.68 0.00 -0.35 0.41 -2.79 0.00 0.00 178.44 177.39 1m9l n GLY 131 N -1.34 -1.91 0.00 2.65 0.00 -1.26 -1.41 105.19 101.92 1m9l n GLY 131 Ca 0.19 1.07 0.00 0.00 0.00 0.00 0.00 46.02 47.28 1m9l n GLY 131 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1m9l n GLU 132 N -5.44 0.00 -0.25 1.61 1.02 -0.80 -4.74 120.64 112.04 1m9l n GLU 132 Ca 0.11 0.05 0.07 0.00 -0.02 0.00 0.00 57.16 57.37 1m9l n GLU 132 Cb 0.40 -0.46 0.14 0.00 -0.02 0.00 0.00 31.44 31.50 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 -2.20 -0.29 -0.32 -3.67 5.41 0.12 -1.33 119.36 117.08 1m9l n ILE 133 Ca 0.00 1.58 -0.00 0.00 1.00 0.00 0.00 62.75 65.33 1m9l n ILE 133 Cb 0.00 -2.23 0.06 0.00 -0.71 0.00 0.00 39.64 36.76 1m9l n ILE 133 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1m9l h ASP 134 N 0.00 -1.18 0.00 4.38 3.58 -1.38 -1.44 116.42 120.39 1m9l h ASP 134 Ca 0.37 0.28 -0.43 0.00 0.42 0.00 0.00 57.03 57.67 1m9l h ASP 134 Cb 0.65 0.65 -0.07 0.00 1.72 0.00 0.00 39.33 42.28 1m9l h ASP 134 CO -0.70 -0.30 -2.43 0.29 -2.88 0.00 0.00 179.24 173.23 1m9l n LYS 135 N -5.50 0.61 -0.09 0.28 4.76 -1.02 -4.50 118.16 112.69 1m9l n LYS 135 Ca 0.10 0.25 0.25 0.00 -2.87 0.00 0.00 58.31 56.05 1m9l n LYS 135 Cb 0.41 -1.52 0.56 0.00 -1.84 0.00 0.00 35.03 32.63 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 -0.70 0.00 -0.55 -0.35 5.85 -1.12 0.26 115.31 118.70 1m9l h LEU 136 Ca -0.64 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.08 1m9l h LEU 136 Cb 1.68 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.71 1m9l h LEU 136 CO -0.31 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 177.79 1m9l n ALA 137 N -2.27 1.86 -3.54 1.25 0.00 -0.55 -4.72 120.51 112.53 1m9l n ALA 137 Ca 0.17 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.41 1m9l n ALA 137 Cb 1.18 -1.00 0.07 0.00 0.00 0.00 0.00 19.45 19.70 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 -0.09 -1.79 0.37 0.00 0.00 0.00 -3.57 120.51 115.44 1m9l n ALA 138 Ca 0.00 0.06 -0.18 0.00 0.00 0.00 0.00 53.44 53.33 1m9l n ALA 138 Cb 0.07 -3.30 -0.09 0.00 0.00 0.00 0.00 19.45 16.13 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 -2.12 -1.15 -1.56 0.00 7.12 -1.60 -1.42 115.31 114.58 1m9l h LEU 139 Ca -0.59 0.07 0.21 0.00 0.13 0.00 0.00 57.88 57.71 1m9l h LEU 139 Cb 1.35 0.35 -0.06 0.00 -0.53 0.00 0.00 40.66 41.76 1m9l h LEU 139 CO 0.54 -0.67 0.61 -0.78 -0.13 0.00 0.00 178.44 178.01 1m9l h ASP 140 N -1.06 0.36 0.00 1.25 3.58 -1.92 -3.27 116.42 115.36 1m9l h ASP 140 Ca -0.09 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.40 1m9l h ASP 140 Cb 0.86 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.88 1m9l h ASP 140 CO 0.07 0.14 0.00 1.17 -2.88 0.00 0.00 179.24 177.73 1m9l n LYS 141 N -4.49 0.00 -0.16 0.28 0.00 -1.12 -3.61 118.16 109.07 1m9l n LYS 141 Ca 0.20 0.27 -0.05 0.00 0.00 0.00 0.00 58.31 58.72 1m9l n LYS 141 Cb 0.74 -0.76 -0.00 0.00 0.00 0.00 0.00 35.03 35.01 1m9l n LYS 141 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1m9l n LEU 142 N -1.32 -0.29 -0.02 3.14 0.00 -0.55 -1.50 117.00 116.45 1m9l n LEU 142 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 56.01 56.10 1m9l n LEU 142 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 43.42 43.31 1m9l n LEU 142 CO 0.00 -0.46 -0.13 -0.62 0.00 0.00 0.00 177.39 176.18 1m9l n GLU 143 N 0.15 0.14 -3.83 1.96 4.71 -1.26 -3.37 120.64 119.14 1m9l n GLU 143 Ca 0.02 0.23 -0.34 0.00 -0.01 0.00 0.00 57.16 57.05 1m9l n GLU 143 Cb 0.04 -0.92 -0.12 0.00 -1.01 0.00 0.00 31.44 29.43 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 -4.29 4.94 -0.38 1.62 1.11 -0.69 -1.49 116.67 117.49 1m9l s ASP 144 Ca -0.06 -2.65 -0.02 0.00 0.18 0.00 0.00 52.55 50.00 1m9l s ASP 144 Cb 0.01 -1.77 0.10 0.00 1.07 0.00 0.00 42.92 42.33 1m9l s ASP 144 CO 0.08 -0.37 0.16 -1.48 1.18 0.00 0.00 175.17 174.74 1m9l s LEU 145 N 0.23 5.02 -0.37 1.23 2.34 -0.73 -1.66 118.68 124.73 1m9l s LEU 145 Ca 0.15 -1.96 -0.11 0.00 0.06 0.00 0.00 54.13 52.27 1m9l s LEU 145 Cb -0.22 -1.79 0.02 0.00 -0.56 0.00 0.00 46.19 43.65 1m9l s LEU 145 CO -0.03 -0.48 0.20 -0.22 -1.06 0.00 0.00 176.35 174.75 1m9l s LEU 146 N 1.12 4.64 -0.37 1.48 2.96 -0.48 -0.29 118.68 127.74 1m9l s LEU 146 Ca 0.07 -0.95 0.12 0.00 -0.22 0.00 0.00 54.13 53.15 1m9l s LEU 146 Cb -0.22 -2.02 0.37 0.00 0.50 0.00 0.00 46.19 44.83 1m9l s LEU 146 CO -0.04 -0.36 0.85 0.00 -1.32 0.00 0.00 176.35 175.47 1m9l n LEU 147 N 4.99 0.47 -0.04 -0.68 -0.00 -1.21 -0.13 117.00 120.40 1m9l n LEU 147 Ca -0.12 -4.50 -0.13 0.00 -0.00 0.00 0.00 56.01 51.26 1m9l n LEU 147 Cb 0.46 0.65 -0.07 0.00 -0.00 0.00 0.00 43.42 44.46 1m9l n LEU 147 CO 0.36 2.09 0.65 0.00 -0.00 0.00 0.00 177.39 180.49 1m9l h ALA 148 N 2.96 0.17 -2.13 1.47 0.00 -1.07 -3.43 119.26 117.23 1m9l h ALA 148 Ca 0.02 -0.27 -0.64 0.00 0.00 0.00 0.00 54.91 54.02 1m9l h ALA 148 Cb 1.05 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.66 1m9l h ALA 148 CO 0.43 -0.03 0.24 0.20 0.00 0.00 0.00 179.25 180.09 1m9l s GLY 149 N -3.26 1.66 0.00 0.00 0.00 0.78 -4.45 107.32 102.05 1m9l s GLY 149 Ca -0.14 -1.08 0.00 0.00 0.00 0.00 0.00 44.72 43.50 1m9l s GLY 149 CO 0.73 1.65 0.00 1.16 0.00 0.00 0.00 173.10 176.64 1m9l n ASN 150 N 6.46 0.00 -0.34 1.64 0.23 -1.19 0.42 115.26 122.48 1m9l n ASN 150 Ca 0.00 0.00 0.24 0.00 -0.53 0.00 0.00 54.58 54.30 1m9l n ASN 150 Cb 0.48 0.00 0.48 0.00 -2.08 0.00 0.00 39.78 38.66 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 0.30 0.00 -0.53 0.11 -1.79 -1.32 132.00 128.77 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 0.00 0.00 0.11 0.00 0.00 31.00 31.04 1m9l h PRO 151 CO 0.00 0.20 0.00 1.28 -0.21 0.00 0.00 178.00 179.27 1m9l n LEU 152 N -5.04 0.00 -0.29 2.35 4.77 -0.60 0.09 117.00 118.28 1m9l n LEU 152 Ca 0.32 0.82 -0.05 0.00 -0.03 0.00 0.00 56.01 57.07 1m9l n LEU 152 Cb 1.00 -0.32 0.06 0.00 -2.33 0.00 0.00 43.42 41.84 1m9l n LEU 152 CO 0.10 -0.32 1.10 0.22 -1.33 0.00 0.00 177.39 177.17 1m9l h TYR 153 N 0.00 1.10 0.00 -1.77 5.03 -1.76 -0.78 116.97 118.79 1m9l h TYR 153 Ca 0.00 -0.04 -0.03 0.00 2.58 0.00 0.00 58.73 61.24 1m9l h TYR 153 Cb 0.00 -0.35 -0.00 0.00 1.55 0.00 0.00 36.73 37.93 1m9l h TYR 153 CO -0.25 0.79 -0.14 -0.91 -1.32 0.00 0.00 178.16 176.33 1m9l h ASN 154 N 1.09 0.00 0.17 -2.11 -0.26 -1.25 -1.70 115.58 111.53 1m9l h ASN 154 Ca 0.27 0.00 -0.25 0.00 -0.56 0.00 0.00 56.30 55.76 1m9l h ASN 154 Cb 0.08 0.00 0.03 0.00 -1.06 0.00 0.00 38.32 37.37 1m9l h ASN 154 CO -0.04 0.14 -1.10 0.44 -1.06 0.00 0.00 177.43 175.81 1m9l h ASP 155 N 0.00 0.67 -0.51 5.81 5.19 0.11 -3.17 116.42 124.51 1m9l h ASP 155 Ca -0.00 -0.91 0.06 0.00 -0.62 0.00 0.00 57.03 55.56 1m9l h ASP 155 Cb 0.34 -0.22 -0.05 0.00 0.18 0.00 0.00 39.33 39.58 1m9l h ASP 155 CO 0.02 1.53 0.21 0.22 -3.12 0.00 0.00 179.24 178.09 1m9l h TYR 156 N -0.08 0.37 0.00 4.55 3.20 -1.05 -3.47 116.97 120.49 1m9l h TYR 156 Ca -0.19 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.71 1m9l h TYR 156 Cb 1.85 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 40.03 1m9l h TYR 156 CO 0.16 0.14 0.00 1.17 -1.64 0.00 0.00 178.16 177.99 1m9l n LYS 157 N -4.97 0.00 0.00 1.82 4.81 -0.66 -4.48 118.16 114.69 1m9l n LYS 157 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.49 1m9l n LYS 157 Cb 0.19 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.24 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 0.00 1.64 0.00 -1.19 -1.30 120.64 119.79 1m9l n GLU 158 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.17 1m9l n GLU 158 Cb 0.00 -1.84 0.00 0.00 0.00 0.00 0.00 31.44 29.60 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 -0.86 0.00 0.02 -1.84 2.85 -1.26 -4.70 115.26 109.46 1m9l n ASN 159 Ca 0.00 -1.00 0.00 0.00 -0.11 0.00 0.00 54.58 53.47 1m9l n ASN 159 Cb 0.34 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.36 1m9l n ASN 159 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1m9l n ASN 160 N 0.00 0.14 -0.01 1.20 3.02 -0.42 -4.82 115.26 114.37 1m9l n ASN 160 Ca 0.00 0.05 0.10 0.00 -0.03 0.00 0.00 54.58 54.70 1m9l n ASN 160 Cb 0.41 -0.02 -0.15 0.00 -0.61 0.00 0.00 39.78 39.42 1m9l n ASN 160 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1m9l n ALA 161 N -2.97 2.75 -0.03 5.41 0.00 -0.90 -4.35 120.51 120.42 1m9l n ALA 161 Ca 0.00 -0.46 -0.12 0.00 0.00 0.00 0.00 53.44 52.86 1m9l n ALA 161 Cb 0.27 -0.66 -0.08 0.00 0.00 0.00 0.00 19.45 18.98 1m9l n ALA 161 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1m9l h THR 162 N 0.00 1.28 -0.90 0.00 2.02 -1.82 -0.74 112.91 112.75 1m9l h THR 162 Ca 0.00 -0.89 0.09 0.00 0.77 0.00 0.00 66.41 66.37 1m9l h THR 162 Cb 0.87 1.71 -0.07 0.00 -1.74 0.00 0.00 68.15 68.92 1m9l h THR 162 CO 0.00 0.25 0.55 -1.28 0.37 0.00 0.00 175.52 175.41 1m9l h SER 163 N -0.16 0.83 -0.48 4.18 0.87 -1.80 -1.13 113.55 115.86 1m9l h SER 163 Ca 0.02 0.03 0.01 0.00 -1.23 0.00 0.00 61.79 60.63 1m9l h SER 163 Cb 0.40 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.20 1m9l h SER 163 CO 0.01 0.49 0.30 -0.08 -0.53 0.00 0.00 176.83 177.02 1m9l h GLU 164 N 0.94 0.60 -0.00 2.24 4.22 -1.69 -1.41 114.58 119.48 1m9l h GLU 164 Ca 0.42 -0.04 0.01 0.00 0.08 0.00 0.00 59.36 59.83 1m9l h GLU 164 Cb 0.30 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1m9l h GLU 164 CO -0.22 0.40 -0.08 1.88 -2.18 0.00 0.00 179.01 178.81 1m9l h TYR 165 N 0.62 -0.21 -0.43 0.92 0.05 0.06 -0.94 116.97 117.05 1m9l h TYR 165 Ca 0.18 0.01 0.06 0.00 0.05 0.00 0.00 58.73 59.03 1m9l h TYR 165 Cb -0.04 0.09 -0.05 0.00 1.01 0.00 0.00 36.73 37.74 1m9l h TYR 165 CO -0.05 -0.13 0.13 -0.09 -1.05 0.00 0.00 178.16 176.97 1m9l h ARG 166 N -0.14 0.28 -0.74 4.88 1.12 -0.98 -0.64 114.38 118.16 1m9l h ARG 166 Ca 0.03 -0.02 0.08 0.00 -1.11 0.00 0.00 59.98 58.97 1m9l h ARG 166 Cb 0.18 -0.06 -0.07 0.00 -0.01 0.00 0.00 29.97 30.01 1m9l h ARG 166 CO -0.09 0.19 0.40 0.82 -3.11 0.00 0.00 179.97 178.18 1m9l h ILE 167 N 0.29 0.91 -0.16 1.20 2.04 -1.01 0.10 117.51 120.89 1m9l h ILE 167 Ca 0.20 -0.24 -0.06 0.00 1.00 0.00 0.00 64.86 65.76 1m9l h ILE 167 Cb 0.21 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1m9l h ILE 167 CO -0.22 0.13 -0.19 -0.08 0.00 0.00 0.00 178.15 177.79 1m9l h GLU 168 N 0.70 0.27 0.00 2.37 4.57 -0.37 -0.48 114.58 121.63 1m9l h GLU 168 Ca 0.35 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.45 1m9l h GLU 168 Cb 0.30 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 1m9l h GLU 168 CO -0.23 0.45 0.00 0.28 -1.18 0.00 0.00 179.01 178.33 1m9l n VAL 169 N -4.21 0.00 -0.11 0.32 0.31 0.23 -0.54 118.33 114.33 1m9l n VAL 169 Ca -0.01 1.04 0.26 0.00 -0.01 0.00 0.00 64.34 65.62 1m9l n VAL 169 Cb 0.32 -1.94 0.72 0.00 -0.91 0.00 0.00 33.84 32.03 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 0.52 0.00 2.52 3.04 -1.24 -0.34 116.25 120.75 1m9l h VAL 170 Ca 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 66.70 65.62 1m9l h VAL 170 Cb 0.00 0.58 -0.01 0.00 -2.01 0.00 0.00 31.29 29.84 1m9l h VAL 170 CO 0.00 0.00 -0.47 0.50 -1.01 0.00 0.00 177.57 176.59 1m9l h LYS 171 N 0.00 0.00 0.00 4.17 3.64 -1.16 -3.45 116.57 119.77 1m9l h LYS 171 Ca 0.36 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.43 1m9l h LYS 171 Cb 1.54 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 33.31 1m9l h LYS 171 CO -0.00 0.60 -2.18 -2.13 -2.27 0.00 0.00 179.45 173.47 1m9l n ARG 172 N -4.59 0.85 -3.29 1.90 0.63 0.30 -5.04 116.66 107.41 1m9l n ARG 172 Ca -0.14 0.07 -0.39 0.00 -0.92 0.00 0.00 57.85 56.47 1m9l n ARG 172 Cb 0.40 -1.43 -0.06 0.00 0.45 0.00 0.00 32.46 31.83 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 -5.81 4.48 -0.12 6.15 1.43 -0.16 -5.01 118.68 119.64 1m9l s LEU 173 Ca -0.20 1.17 -0.13 0.00 -1.03 0.00 0.00 54.13 53.94 1m9l s LEU 173 Cb 0.06 -2.85 -0.26 0.00 0.03 0.00 0.00 46.19 43.17 1m9l s LEU 173 CO 0.57 0.22 0.46 1.55 0.23 0.00 0.00 176.35 179.38 1m9l h PRO 174 N 4.97 0.23 0.00 1.29 0.13 -1.92 -3.44 132.00 133.26 1m9l h PRO 174 Ca -0.48 -0.40 0.00 0.00 -0.87 0.00 0.00 66.00 64.25 1m9l h PRO 174 Cb 1.21 0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.49 1m9l h PRO 174 CO 0.65 1.19 0.00 0.09 -0.23 0.00 0.00 178.00 179.70 1m9l n ASN 175 N -3.82 0.00 0.00 1.44 3.02 -1.26 -4.90 115.26 109.74 1m9l n ASN 175 Ca -0.28 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 1m9l n ASN 175 Cb 0.93 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.10 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 -0.56 -4.94 117.00 122.81 1m9l n LEU 176 Ca 0.00 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 54.83 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 0.19 -3.84 1.96 5.02 -1.20 -4.86 118.16 115.43 1m9l n LYS 177 Ca 0.00 0.06 -0.36 0.00 -2.02 0.00 0.00 58.31 55.99 1m9l n LYS 177 Cb 0.00 -1.02 -0.13 0.00 -0.02 0.00 0.00 35.03 33.86 1m9l n LYS 177 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1m9l s LYS 178 N -2.16 2.66 -0.59 1.97 -0.14 -0.56 -4.84 119.74 116.09 1m9l s LYS 178 Ca -0.11 -1.13 0.00 0.00 -1.36 0.00 0.00 55.97 53.38 1m9l s LYS 178 Cb 0.03 -3.28 0.15 0.00 -1.68 0.00 0.00 37.83 33.06 1m9l s LYS 178 CO 0.17 -0.57 0.37 -1.17 -0.76 0.00 0.00 175.35 173.38 1m9l s LEU 179 N 1.35 4.80 0.00 3.17 2.96 -1.26 -1.77 118.68 127.93 1m9l s LEU 179 Ca -0.02 -2.97 0.00 0.00 -0.22 0.00 0.00 54.13 50.92 1m9l s LEU 179 Cb -0.19 -1.75 0.00 0.00 0.50 0.00 0.00 46.19 44.75 1m9l s LEU 179 CO 0.00 -0.29 0.00 -0.67 -1.32 0.00 0.00 176.35 174.07 1m9l n ASP 180 N 3.25 0.00 0.00 3.68 2.03 0.60 -4.69 116.55 121.42 1m9l n ASP 180 Ca 0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.38 1m9l n ASP 180 Cb 0.35 -1.19 0.00 0.00 -0.72 0.00 0.00 41.12 39.56 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 0.03 0.27 0.00 -1.26 -4.35 105.19 97.88 1m9l n GLY 181 Ca 0.00 0.39 -0.00 0.00 0.00 0.00 0.00 46.02 46.41 1m9l n GLY 181 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1m9l n MET 182 N 0.00 -0.02 -0.57 1.61 0.00 -1.26 -1.62 117.12 115.26 1m9l n MET 182 Ca 0.00 0.11 0.45 0.00 0.00 0.00 0.00 57.70 58.26 1m9l n MET 182 Cb 0.00 -0.17 0.69 0.00 0.00 0.00 0.00 33.22 33.74 1m9l n MET 182 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1m9l n PRO 183 N -4.11 0.00 -0.12 2.12 -0.01 -1.26 -3.37 135.00 128.25 1m9l n PRO 183 Ca 0.01 0.98 -0.03 0.00 -0.01 0.00 0.00 63.50 64.45 1m9l n PRO 183 Cb 0.03 -2.30 -0.03 0.00 -0.01 0.00 0.00 33.50 31.20 1m9l n PRO 183 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 175.50 176.82 1m9l n VAL 184 N -3.63 -0.20 -0.32 -1.45 0.24 -0.64 -4.35 118.33 107.98 1m9l n VAL 184 Ca 0.37 1.29 0.00 0.00 -2.04 0.00 0.00 64.34 63.97 1m9l n VAL 184 Cb 1.77 -1.65 0.00 0.00 -1.47 0.00 0.00 33.84 32.49 1m9l n VAL 184 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1m9l n ASP 185 N -3.62 -1.64 0.00 -1.34 8.00 -1.22 -1.12 116.55 115.61 1m9l n ASP 185 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.51 1m9l n ASP 185 Cb 0.08 -1.43 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 -0.57 0.00 0.16 2.53 3.14 -1.26 -4.96 118.33 117.37 1m9l n VAL 186 Ca 0.00 0.00 0.04 0.00 -2.96 0.00 0.00 64.34 61.42 1m9l n VAL 186 Cb 0.14 0.00 0.16 0.00 -1.06 0.00 0.00 33.84 33.08 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 0.42 6.55 3.58 -1.43 -2.89 116.42 122.65 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 0.45 0.00 -0.62 -2.88 0.00 0.00 179.24 176.19 1m9l n GLU 188 N -3.34 0.02 -0.02 0.28 -0.58 -1.22 -0.35 120.64 115.42 1m9l n GLU 188 Ca 0.01 0.27 0.12 0.00 -0.42 0.00 0.00 57.16 57.14 1m9l n GLU 188 Cb 0.64 -1.50 0.20 0.00 -0.57 0.00 0.00 31.44 30.21 1m9l n GLU 188 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1m9l n ARG 189 N -1.48 2.20 0.03 3.49 5.12 -1.09 -3.37 116.66 121.56 1m9l n ARG 189 Ca 0.03 -1.75 0.00 0.00 -1.93 0.00 0.00 57.85 54.20 1m9l n ARG 189 Cb 0.14 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 29.98 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 1.11 0.00 -0.03 5.56 0.00 0.13 -4.58 120.64 122.82 1m9l n GLU 190 Ca 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 57.16 57.16 1m9l n GLU 190 Cb 0.55 -0.12 -0.08 0.00 0.00 0.00 0.00 31.44 31.78 1m9l n GLU 190 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.13 177.50 1m9l h GLN 191 N 0.00 0.59 0.00 5.31 -0.00 -0.97 -0.61 115.11 119.43 1m9l h GLN 191 Ca 0.00 -0.46 -0.01 0.00 -0.00 0.00 0.00 58.65 58.18 1m9l h GLN 191 Cb 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 27.48 27.57 1m9l h GLN 191 CO 0.00 1.08 -0.05 0.00 0.00 0.00 0.00 178.83 179.87 1m9l h ALA 192 N 0.51 1.00 0.17 3.38 0.00 -1.68 -0.75 119.26 121.89 1m9l h ALA 192 Ca -0.03 -0.04 -0.26 0.00 0.00 0.00 0.00 54.91 54.58 1m9l h ALA 192 Cb 1.16 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.96 1m9l h ALA 192 CO 0.11 0.06 -1.22 -0.97 0.00 0.00 0.00 179.25 177.23 1m9l h ASN 193 N 0.00 0.55 -0.61 0.00 -1.24 -1.55 -0.54 115.58 112.19 1m9l h ASN 193 Ca -0.00 -0.92 -0.09 0.00 0.71 0.00 0.00 56.30 56.00 1m9l h ASN 193 Cb 0.66 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 39.51 1m9l h ASN 193 CO 0.01 1.57 0.03 0.58 -1.29 0.00 0.00 177.43 178.33 1m9l h VAL 194 N -0.19 1.26 -0.30 2.57 2.07 -1.00 0.31 116.25 120.98 1m9l h VAL 194 Ca -0.23 -1.11 -0.11 0.00 0.82 0.00 0.00 66.70 66.07 1m9l h VAL 194 Cb 1.84 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 1m9l h VAL 194 CO 0.16 0.41 -0.23 0.00 0.02 0.00 0.00 177.57 177.93 1m9l h ALA 195 N 1.00 0.43 -0.26 1.67 0.00 -1.21 -3.12 119.26 117.78 1m9l h ALA 195 Ca 0.18 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.74 1m9l h ALA 195 Cb 0.52 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1m9l h ALA 195 CO 0.02 0.40 0.12 0.00 0.00 0.00 0.00 179.25 179.79 1m9l h ARG 196 N 0.44 0.25 0.00 0.00 2.47 -0.92 -3.46 114.38 113.15 1m9l h ARG 196 Ca 0.06 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 1m9l h ARG 196 Cb 0.78 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 29.04 1m9l h ARG 196 CO 0.06 0.16 0.00 0.41 0.56 0.00 0.00 179.97 181.16 1m9l n GLY 197 N -1.18 -0.05 0.00 0.04 0.00 -0.60 -5.08 105.19 98.32 1m9l n GLY 197 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1m9l n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93