#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 0.00 -3.00 3.04 0.00 -1.26 -2.70 120.51 116.59 1m9l n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1m9l n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1m9l n ALA 2 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1m9l n LYS 3 N -0.90 0.53 -3.15 0.00 5.02 -1.26 -4.30 118.16 114.10 1m9l n LYS 3 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.33 1m9l n LYS 3 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.01 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 -2.64 0.00 7.82 0.00 -1.26 -4.77 121.76 118.91 1m9l s ALA 4 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 51.96 52.89 1m9l s ALA 4 Cb 0.00 -2.63 0.00 0.00 0.00 0.00 0.00 23.12 20.49 1m9l s ALA 4 CO 0.00 -1.96 0.00 0.25 0.00 0.00 0.00 175.76 174.05 1m9l n THR 5 N 5.13 0.00 -3.98 0.00 -2.24 -1.25 -4.42 114.28 107.52 1m9l n THR 5 Ca 0.07 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.61 1m9l n THR 5 Cb 0.55 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.76 1m9l n THR 5 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1m9l s THR 6 N 2.98 5.17 0.11 4.28 2.01 -1.26 -0.56 115.64 128.37 1m9l s THR 6 Ca 0.00 -0.91 -0.35 0.00 0.31 0.00 0.00 61.69 60.74 1m9l s THR 6 Cb 0.00 -3.74 -0.14 0.00 0.01 0.00 0.00 72.50 68.62 1m9l s THR 6 CO 0.00 -0.23 1.56 -0.29 -0.69 0.00 0.00 174.62 174.97 1m9l h ILE 7 N 1.42 0.00 0.29 1.82 2.10 -1.78 0.31 117.51 121.68 1m9l h ILE 7 Ca -0.50 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.43 1m9l h ILE 7 Cb 1.22 0.00 -0.02 0.00 -1.09 0.00 0.00 36.82 36.93 1m9l h ILE 7 CO 0.64 0.00 -0.33 0.11 -1.08 0.00 0.00 178.15 177.49 1m9l h LYS 8 N -0.75 -0.60 0.02 2.19 1.57 -1.95 0.00 116.57 117.06 1m9l h LYS 8 Ca -0.00 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1m9l h LYS 8 Cb 0.76 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1m9l h LYS 8 CO -0.30 -0.40 -0.07 -0.44 -0.57 0.00 0.00 179.45 177.67 1m9l h ASP 9 N -0.62 -0.22 -0.65 0.86 5.19 -1.98 -1.92 116.42 117.08 1m9l h ASP 9 Ca -0.04 0.02 0.13 0.00 -0.62 0.00 0.00 57.03 56.52 1m9l h ASP 9 Cb 0.55 0.08 -0.12 0.00 0.18 0.00 0.00 39.33 40.01 1m9l h ASP 9 CO -0.06 -0.08 -0.22 0.00 -3.12 0.00 0.00 179.24 175.76 1m9l h ALA 10 N -1.44 0.29 -0.17 3.45 0.00 -0.41 0.18 119.26 121.16 1m9l h ALA 10 Ca -0.00 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1m9l h ALA 10 Cb 0.11 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1m9l h ALA 10 CO -0.04 -0.50 0.09 0.82 0.00 0.00 0.00 179.25 179.62 1m9l h ILE 11 N -0.06 1.10 -0.50 0.00 2.04 -0.88 0.24 117.51 119.45 1m9l h ILE 11 Ca 0.30 -0.28 -0.07 0.00 1.00 0.00 0.00 64.86 65.81 1m9l h ILE 11 Cb 0.52 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1m9l h ILE 11 CO -0.69 0.10 0.03 -0.09 0.00 0.00 0.00 178.15 177.49 1m9l h ARG 12 N 0.17 0.81 0.00 2.37 2.43 -0.85 -1.45 114.38 117.87 1m9l h ARG 12 Ca 0.06 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 1m9l h ARG 12 Cb 0.07 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1m9l h ARG 12 CO -0.01 0.80 -0.06 0.82 -1.51 0.00 0.00 179.97 180.01 1m9l h ILE 13 N 0.76 0.92 0.06 1.20 2.04 0.01 0.67 117.51 123.17 1m9l h ILE 13 Ca 0.15 -0.20 -0.27 0.00 1.00 0.00 0.00 64.86 65.54 1m9l h ILE 13 Cb 0.42 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 1m9l h ILE 13 CO 0.02 0.06 -1.35 -0.26 0.00 0.00 0.00 178.15 176.61 1m9l h PHE 14 N 0.00 0.23 0.00 1.37 0.04 0.13 0.18 116.94 118.89 1m9l h PHE 14 Ca -0.00 -0.17 -0.02 0.00 2.80 0.00 0.00 57.97 60.58 1m9l h PHE 14 Cb 0.11 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.25 1m9l h PHE 14 CO 0.00 1.18 -0.08 1.49 -0.60 0.00 0.00 178.31 180.30 1m9l h GLU 15 N 0.03 0.00 0.00 1.51 4.81 -0.19 0.21 114.58 120.96 1m9l h GLU 15 Ca -0.16 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.78 1m9l h GLU 15 Cb 1.93 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 31.26 1m9l h GLU 15 CO 0.14 0.08 -1.76 0.39 -0.73 0.00 0.00 179.01 177.13 1m9l n GLU 16 N -3.37 0.56 0.00 1.92 1.02 0.11 -3.92 120.64 116.96 1m9l n GLU 16 Ca -0.01 0.38 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 1m9l n GLU 16 Cb 0.25 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1m9l n GLU 16 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1m9l n ARG 17 N -4.37 0.00 -0.26 3.49 0.63 0.63 -4.10 116.66 112.67 1m9l n ARG 17 Ca -0.38 0.31 0.02 0.00 -0.92 0.00 0.00 57.85 56.88 1m9l n ARG 17 Cb 0.72 -0.91 0.16 0.00 0.45 0.00 0.00 32.46 32.87 1m9l n ARG 17 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 1m9l h LYS 18 N 0.00 0.64 -1.88 -0.14 3.11 -1.34 -3.47 116.57 113.49 1m9l h LYS 18 Ca 0.00 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.80 1m9l h LYS 18 Cb 0.00 -0.14 0.00 0.00 -1.00 0.00 0.00 32.23 31.09 1m9l h LYS 18 CO 0.00 0.42 0.00 0.45 -2.81 0.00 0.00 179.45 177.51 1m9l n SER 19 N -4.83 -1.40 -2.96 4.20 2.88 0.65 -5.02 113.62 107.15 1m9l n SER 19 Ca 0.12 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.50 1m9l n SER 19 Cb 0.29 -0.35 -0.05 0.00 -0.75 0.00 0.00 64.21 63.35 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 -0.94 0.00 -3.86 2.46 0.24 -0.74 -4.97 118.33 110.53 1m9l n VAL 20 Ca 0.00 -1.76 -0.36 0.00 -2.04 0.00 0.00 64.34 60.18 1m9l n VAL 20 Cb 0.35 0.74 -0.13 0.00 -1.47 0.00 0.00 33.84 33.33 1m9l n VAL 20 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1m9l s VAL 21 N -2.81 3.35 -0.03 3.34 1.01 -1.26 -4.03 120.40 119.96 1m9l s VAL 21 Ca 0.21 -1.08 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 1m9l s VAL 21 Cb 0.01 -2.81 -0.01 0.00 0.00 0.00 0.00 36.38 33.57 1m9l s VAL 21 CO 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 175.10 175.20 1m9l n ALA 22 N 4.73 0.49 -3.71 5.51 0.00 -1.26 -4.05 120.51 122.22 1m9l n ALA 22 Ca -0.14 -0.31 -0.23 0.00 0.00 0.00 0.00 53.44 52.75 1m9l n ALA 22 Cb 0.46 0.01 0.03 0.00 0.00 0.00 0.00 19.45 19.94 1m9l n ALA 22 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1m9l n THR 23 N -2.84 -4.78 -1.87 0.00 -1.04 -1.26 -1.51 114.28 100.97 1m9l n THR 23 Ca -0.02 -0.64 0.00 0.00 -2.04 0.00 0.00 64.05 61.35 1m9l n THR 23 Cb 0.09 -3.86 0.00 0.00 -1.82 0.00 0.00 70.33 64.73 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 -4.21 -2.24 -1.98 -2.82 2.13 -1.26 -4.85 120.64 105.41 1m9l n GLU 24 Ca -0.25 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.25 1m9l n GLU 24 Cb 0.66 -3.80 0.01 0.00 0.27 0.00 0.00 31.44 28.58 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 -1.51 2.90 0.27 4.31 0.00 -0.57 -4.69 121.76 122.47 1m9l s ALA 25 Ca 0.00 0.15 -0.03 0.00 0.00 0.00 0.00 51.96 52.08 1m9l s ALA 25 Cb 0.00 -3.15 0.36 0.00 0.00 0.00 0.00 23.12 20.33 1m9l s ALA 25 CO 0.00 -0.73 1.84 0.93 0.00 0.00 0.00 175.76 177.80 1m9l h GLU 26 N 0.10 0.95 -5.65 0.00 3.07 -1.88 -3.39 114.58 107.78 1m9l h GLU 26 Ca -0.45 -0.16 -0.63 0.00 -0.50 0.00 0.00 59.36 57.61 1m9l h GLU 26 Cb 1.20 -0.16 -0.14 0.00 -0.84 0.00 0.00 28.75 28.82 1m9l h GLU 26 CO 0.59 0.79 0.40 0.15 -1.40 0.00 0.00 179.01 179.55 1m9l s LYS 27 N -5.41 3.30 -0.27 2.33 1.02 -1.25 0.23 119.74 119.69 1m9l s LYS 27 Ca -0.11 -0.36 0.03 0.00 0.02 0.00 0.00 55.97 55.55 1m9l s LYS 27 Cb 0.16 -4.04 0.07 0.00 -0.52 0.00 0.00 37.83 33.50 1m9l s LYS 27 CO 0.81 -1.34 -0.06 0.08 -0.92 0.00 0.00 175.35 173.91 1m9l s VAL 28 N 3.51 2.08 -0.98 3.17 1.01 -0.67 -4.77 120.40 123.75 1m9l s VAL 28 Ca 0.27 -1.73 -0.18 0.00 0.00 0.00 0.00 61.98 60.34 1m9l s VAL 28 Cb -0.14 -2.29 0.13 0.00 0.00 0.00 0.00 36.38 34.08 1m9l s VAL 28 CO 0.18 -0.17 1.21 -1.61 0.00 0.00 0.00 175.10 174.71 1m9l s GLU 29 N 1.11 3.67 0.00 2.72 8.01 -1.26 -1.32 118.70 131.63 1m9l s GLU 29 Ca -0.04 -1.81 0.00 0.00 0.01 0.00 0.00 54.97 53.13 1m9l s GLU 29 Cb -0.20 -4.99 0.00 0.00 -4.31 0.00 0.00 34.13 24.63 1m9l s GLU 29 CO -0.06 -1.82 0.00 1.28 0.01 0.00 0.00 175.26 174.67 1m9l n LEU 30 N 6.69 0.00 0.00 1.80 4.77 -0.49 -4.48 117.00 125.29 1m9l n LEU 30 Ca 0.27 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 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 0.54 0.00 0.00 1.57 -1.33 0.00 0.00 177.39 178.17 1m9l n HIS 31 N 0.00 0.00 -3.83 -1.77 -0.00 -1.26 -4.64 115.22 103.72 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 0.00 -0.07 0.07 1.57 0.00 -1.26 -1.15 107.32 106.48 1m9l s GLY 32 Ca 0.00 -0.26 -0.26 0.00 0.00 0.00 0.00 44.72 44.20 1m9l s GLY 32 CO 0.00 -0.03 0.62 -0.29 0.00 0.00 0.00 173.10 173.41 1m9l s MET 33 N -3.58 1.18 -0.02 2.90 1.75 -0.47 0.01 119.30 121.07 1m9l s MET 33 Ca 0.12 -0.18 -0.17 0.00 -1.25 0.00 0.00 55.69 54.21 1m9l s MET 33 Cb -0.05 0.55 -0.05 0.00 2.84 0.00 0.00 34.83 38.12 1m9l s MET 33 CO 0.06 -0.46 0.46 0.96 -0.65 0.00 0.00 175.02 175.40 1m9l s ILE 34 N -2.70 5.02 0.27 10.11 -4.36 -1.26 -3.52 121.20 124.77 1m9l s ILE 34 Ca -0.04 0.95 -0.04 0.00 -0.26 0.00 0.00 60.65 61.26 1m9l s ILE 34 Cb -0.01 -3.78 0.35 0.00 1.25 0.00 0.00 42.46 40.27 1m9l s ILE 34 CO -0.04 0.49 1.60 -0.65 0.24 0.00 0.00 174.94 176.59 1m9l h PRO 35 N 5.32 0.06 0.00 0.37 0.11 -1.94 -1.81 132.00 134.10 1m9l h PRO 35 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1m9l h PRO 35 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1m9l h PRO 35 CO 0.66 0.04 0.00 -2.30 -0.21 0.00 0.00 178.00 176.19 1m9l n PRO 36 N -5.43 0.24 -1.61 1.05 -0.02 -1.26 -0.57 135.00 127.40 1m9l n PRO 36 Ca 0.17 0.00 -0.62 0.00 -2.02 0.00 0.00 63.50 61.03 1m9l n PRO 36 Cb 0.58 -1.05 -0.09 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 0.01 0.00 4.25 3.06 -0.68 -4.75 119.36 120.70 1m9l n ILE 37 Ca 0.01 -0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1m9l n ILE 37 Cb 0.00 -0.28 0.00 0.00 0.54 0.00 0.00 39.64 39.90 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 2.65 0.00 -4.32 9.51 2.13 -1.24 -1.65 120.64 127.72 1m9l n GLU 38 Ca 0.24 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.72 1m9l n GLU 38 Cb 0.03 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.64 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 0.40 3.43 -1.02 5.31 1.02 -1.26 -2.75 119.74 124.87 1m9l s LYS 39 Ca 0.00 -0.44 -0.02 0.00 0.02 0.00 0.00 55.97 55.53 1m9l s LYS 39 Cb 0.00 -2.92 0.31 0.00 -0.52 0.00 0.00 37.83 34.71 1m9l s LYS 39 CO 0.00 0.45 1.59 -0.12 -0.92 0.00 0.00 175.35 176.34 1m9l n MET 40 N 2.93 4.79 0.04 1.68 1.56 -1.26 -3.90 117.12 122.95 1m9l n MET 40 Ca -0.18 -4.63 0.21 0.00 -0.27 0.00 0.00 57.70 52.84 1m9l n MET 40 Cb 0.53 -2.47 0.73 0.00 2.15 0.00 0.00 33.22 34.16 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 4.74 0.00 0.29 6.12 1.82 -1.18 -0.70 116.42 127.52 1m9l h ASP 41 Ca 0.35 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.98 1m9l h ASP 41 Cb 0.48 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.48 1m9l h ASP 41 CO 1.23 0.00 -0.32 0.00 -1.61 0.00 0.00 179.24 178.54 1m9l h ALA 42 N 1.57 -0.99 -0.67 -0.78 0.00 -1.43 -1.52 119.26 115.44 1m9l h ALA 42 Ca 0.24 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1m9l h ALA 42 Cb 1.14 0.58 -0.04 0.00 0.00 0.00 0.00 17.79 19.47 1m9l h ALA 42 CO -0.00 -1.01 0.44 0.00 0.00 0.00 0.00 179.25 178.67 1m9l h THR 43 N -0.62 1.08 -0.66 0.00 1.03 -1.54 -0.18 112.91 112.02 1m9l h THR 43 Ca -0.04 -0.27 0.14 0.00 -0.01 0.00 0.00 66.41 66.23 1m9l h THR 43 Cb 0.55 0.23 -0.10 0.00 -1.07 0.00 0.00 68.15 67.76 1m9l h THR 43 CO -0.06 0.14 0.09 0.25 -0.01 0.00 0.00 175.52 175.94 1m9l h LEU 44 N 0.78 -0.11 0.00 0.00 5.85 -0.65 0.56 115.31 121.73 1m9l h LEU 44 Ca 0.27 0.14 -0.00 0.00 0.84 0.00 0.00 57.88 59.13 1m9l h LEU 44 Cb 0.10 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 1m9l h LEU 44 CO -0.08 -0.06 -0.14 -1.28 -0.34 0.00 0.00 178.44 176.54 1m9l h SER 45 N 0.20 0.00 0.00 1.25 0.87 -0.62 -3.34 113.55 111.91 1m9l h SER 45 Ca 0.36 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 1m9l h SER 45 Cb 0.59 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 1m9l h SER 45 CO -0.50 0.59 0.02 1.07 -0.53 0.00 0.00 176.83 177.48 1m9l n THR 46 N -4.73 0.54 -0.31 2.23 5.66 -0.14 -1.82 114.28 115.71 1m9l n THR 46 Ca -0.02 0.16 -0.01 0.00 -3.05 0.00 0.00 64.05 61.12 1m9l n THR 46 Cb 0.08 -1.16 0.05 0.00 -1.55 0.00 0.00 70.33 67.76 1m9l n THR 46 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 1m9l h LEU 47 N 0.00 -1.18 -0.96 1.09 6.46 0.00 0.48 115.31 121.21 1m9l h LEU 47 Ca 0.00 0.27 0.26 0.00 -0.12 0.00 0.00 57.88 58.29 1m9l h LEU 47 Cb 0.04 0.64 -0.18 0.00 -0.73 0.00 0.00 40.66 40.44 1m9l h LEU 47 CO 0.00 -0.29 -0.00 0.29 -0.62 0.00 0.00 178.44 177.82 1m9l n LYS 48 N -5.49 -0.08 0.04 1.25 5.02 -0.76 -0.60 118.16 117.55 1m9l n LYS 48 Ca 0.09 1.44 0.01 0.00 -2.02 0.00 0.00 58.31 57.83 1m9l n LYS 48 Cb 0.40 -2.27 -0.07 0.00 -0.02 0.00 0.00 35.03 33.06 1m9l n LYS 48 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1m9l n ALA 49 N -3.22 1.99 -1.54 7.82 0.00 -0.02 -5.02 120.51 120.53 1m9l n ALA 49 Ca 0.22 -0.51 -0.60 0.00 0.00 0.00 0.00 53.44 52.55 1m9l n ALA 49 Cb 0.72 -0.97 -0.09 0.00 0.00 0.00 0.00 19.45 19.11 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 2.75 0.00 -3.19 0.00 4.81 -1.21 -4.27 118.16 117.05 1m9l n LYS 51 Ca 0.25 0.00 -0.44 0.00 -0.87 0.00 0.00 58.31 57.25 1m9l n LYS 51 Cb -0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 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 -2.76 3.92 -2.61 5.64 -0.00 0.14 -0.31 115.22 119.23 1m9l n HIS 52 Ca 0.00 -3.32 -0.43 0.00 0.46 0.00 0.00 57.72 54.43 1m9l n HIS 52 Cb 0.00 -1.50 -0.02 0.00 -0.12 0.00 0.00 29.99 28.35 1m9l n HIS 52 CO 0.00 0.00 0.00 -1.17 0.46 0.00 0.00 176.34 175.63 1m9l s LEU 53 N -1.98 3.72 -0.28 0.27 2.96 -0.28 -1.66 118.68 121.44 1m9l s LEU 53 Ca 0.31 0.62 -0.04 0.00 -0.22 0.00 0.00 54.13 54.80 1m9l s LEU 53 Cb -0.03 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.14 1m9l s LEU 53 CO 0.00 -1.15 0.01 0.00 -1.32 0.00 0.00 176.35 173.89 1m9l s ALA 54 N 4.23 2.87 0.00 5.97 0.00 -0.44 -0.78 121.76 133.61 1m9l s ALA 54 Ca 0.47 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.92 1m9l s ALA 54 Cb -0.08 -1.93 0.00 0.00 0.00 0.00 0.00 23.12 21.11 1m9l s ALA 54 CO 0.27 -0.94 0.00 1.28 0.00 0.00 0.00 175.76 176.37 1m9l n LEU 55 N 4.75 0.00 0.00 0.00 7.99 -0.56 -1.40 117.00 127.78 1m9l n LEU 55 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.85 1m9l n LEU 55 Cb 0.47 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.78 1m9l n LEU 55 CO 0.29 0.00 0.00 -0.24 -1.51 0.00 0.00 177.39 175.93 1m9l n SER 56 N -0.48 0.00 -4.45 -1.43 2.88 -1.16 -4.44 113.62 104.53 1m9l n SER 56 Ca 0.00 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 1m9l n SER 56 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1m9l n SER 56 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1m9l s THR 57 N 0.00 4.44 0.10 2.46 -1.32 -0.30 -0.79 115.64 120.24 1m9l s THR 57 Ca 0.00 -0.73 -0.01 0.00 -1.21 0.00 0.00 61.69 59.74 1m9l s THR 57 Cb 0.00 -4.71 -0.04 0.00 -1.51 0.00 0.00 72.50 66.24 1m9l s THR 57 CO 0.00 -1.47 0.03 0.54 -2.21 0.00 0.00 174.62 171.51 1m9l s ASN 58 N 3.71 0.37 0.03 8.08 4.22 -0.57 -1.37 114.94 129.41 1m9l s ASN 58 Ca 0.25 -1.12 0.00 0.00 -2.14 0.00 0.00 52.86 49.86 1m9l s ASN 58 Cb -0.14 0.27 -0.02 0.00 1.28 0.00 0.00 41.25 42.64 1m9l s ASN 58 CO 0.04 -0.69 -0.04 0.20 -2.04 0.00 0.00 177.10 174.57 1m9l s ASN 59 N -3.00 0.44 -0.16 3.54 -0.87 -1.23 -1.56 114.94 112.10 1m9l s ASN 59 Ca 0.17 -0.59 -0.03 0.00 -1.57 0.00 0.00 52.86 50.84 1m9l s ASN 59 Cb 0.08 0.10 0.05 0.00 -0.02 0.00 0.00 41.25 41.46 1m9l s ASN 59 CO -0.03 -0.32 0.05 -0.63 -2.57 0.00 0.00 177.10 173.61 1m9l s ILE 60 N -1.79 0.22 -0.22 0.60 1.01 0.01 -3.91 121.20 117.12 1m9l s ILE 60 Ca -0.11 -0.26 -0.18 0.00 0.00 0.00 0.00 60.65 60.10 1m9l s ILE 60 Cb -0.07 -0.74 -0.18 0.00 0.01 0.00 0.00 42.46 41.48 1m9l s ILE 60 CO -0.02 -0.16 0.06 1.21 0.00 0.00 0.00 174.94 176.03 1m9l n GLU 61 N 5.17 0.59 -4.05 2.79 2.13 0.26 -3.93 120.64 123.60 1m9l n GLU 61 Ca -0.08 0.45 -0.13 0.00 0.66 0.00 0.00 57.16 58.06 1m9l n GLU 61 Cb 0.48 -1.67 -0.13 0.00 0.27 0.00 0.00 31.44 30.39 1m9l n GLU 61 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1m9l s LYS 62 N -2.42 0.35 -0.41 5.31 1.02 -0.66 -4.62 119.74 118.31 1m9l s LYS 62 Ca -0.31 -0.34 0.02 0.00 0.02 0.00 0.00 55.97 55.36 1m9l s LYS 62 Cb 0.08 -0.23 0.15 0.00 -0.52 0.00 0.00 37.83 37.31 1m9l s LYS 62 CO 0.58 0.05 0.28 -1.50 -0.92 0.00 0.00 175.35 173.84 1m9l s ILE 63 N -0.58 0.57 0.23 2.17 1.10 -1.23 -3.73 121.20 119.75 1m9l s ILE 63 Ca -0.04 -2.34 0.06 0.00 -0.51 0.00 0.00 60.65 57.82 1m9l s ILE 63 Cb -0.05 -1.41 -0.06 0.00 0.15 0.00 0.00 42.46 41.10 1m9l s ILE 63 CO -0.00 -1.07 1.54 -1.28 -2.11 0.00 0.00 174.94 172.02 1m9l h SER 64 N 6.36 0.16 -0.08 4.50 0.87 -1.89 -3.34 113.55 120.13 1m9l h SER 64 Ca 0.13 -0.10 -0.30 0.00 -1.23 0.00 0.00 61.79 60.29 1m9l h SER 64 Cb 0.93 -0.05 -0.06 0.00 -0.44 0.00 0.00 62.40 62.78 1m9l h SER 64 CO 0.36 0.78 0.46 -1.54 -0.53 0.00 0.00 176.83 176.36 1m9l n SER 65 N -3.80 5.99 -0.01 6.23 3.41 -1.26 -4.55 113.62 119.63 1m9l n SER 65 Ca -0.02 -2.55 -0.10 0.00 -0.26 0.00 0.00 58.87 55.94 1m9l n SER 65 Cb 0.66 -1.43 -0.04 0.00 -0.26 0.00 0.00 64.21 63.13 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 5.30 0.11 -2.52 1.04 8.10 -1.91 -0.71 115.31 124.72 1m9l h LEU 66 Ca 0.33 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.33 1m9l h LEU 66 Cb 1.23 -0.02 0.00 0.00 -0.44 0.00 0.00 40.66 41.43 1m9l h LEU 66 CO 0.56 0.08 0.00 0.77 -4.11 0.00 0.00 178.44 175.75 1m9l h SER 67 N 0.15 0.00 0.00 0.17 4.64 -1.95 -0.48 113.55 116.08 1m9l h SER 67 Ca 0.05 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1m9l h SER 67 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1m9l h SER 67 CO -0.03 0.00 -0.05 1.23 -0.87 0.00 0.00 176.83 177.11 1m9l h GLY 68 N 0.01 0.00 2.00 -0.77 0.00 -1.48 -3.31 103.07 99.52 1m9l h GLY 68 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1m9l h GLY 68 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.54 176.21 1m9l h MET 69 N -1.00 0.00 0.00 4.80 2.86 -0.78 -3.29 114.93 117.51 1m9l h MET 69 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1m9l h MET 69 Cb 0.36 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.02 1m9l h MET 69 CO -0.00 0.00 0.00 -1.91 1.06 0.00 0.00 176.91 176.06 1m9l n GLU 70 N -2.77 0.00 0.00 1.72 2.13 -0.23 -1.55 120.64 119.94 1m9l n GLU 70 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 1m9l n GLU 70 Cb 0.10 -1.09 0.00 0.00 0.27 0.00 0.00 31.44 30.72 1m9l n GLU 70 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1m9l n ASN 71 N -0.43 0.95 -4.75 4.31 5.15 -1.24 -4.64 115.26 114.61 1m9l n ASN 71 Ca 0.00 -0.38 -0.35 0.00 -0.60 0.00 0.00 54.58 53.25 1m9l n ASN 71 Cb 0.00 0.96 0.05 0.00 -0.53 0.00 0.00 39.78 40.25 1m9l n ASN 71 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1m9l s LEU 72 N -2.10 3.54 0.08 1.20 2.96 -0.59 -4.69 118.68 119.07 1m9l s LEU 72 Ca 0.00 2.27 0.00 0.00 -0.22 0.00 0.00 54.13 56.18 1m9l s LEU 72 Cb 0.00 -4.58 0.00 0.00 0.50 0.00 0.00 46.19 42.11 1m9l s LEU 72 CO 0.00 -1.70 0.00 0.54 -1.32 0.00 0.00 176.35 173.87 1m9l n ARG 73 N -1.98 0.00 -3.20 1.98 1.74 -1.24 -3.13 116.66 110.84 1m9l n ARG 73 Ca 0.13 0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.75 1m9l n ARG 73 Cb 0.50 -0.18 -0.04 0.00 -1.02 0.00 0.00 32.46 31.73 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 5.08 -0.40 0.55 1.01 0.57 -1.53 121.20 124.48 1m9l s ILE 74 Ca 0.00 -1.47 -0.17 0.00 0.00 0.00 0.00 60.65 59.01 1m9l s ILE 74 Cb 0.00 -4.46 0.01 0.00 0.01 0.00 0.00 42.46 38.02 1m9l s ILE 74 CO 0.00 -1.06 0.43 -0.22 0.00 0.00 0.00 174.94 174.09 1m9l s LEU 75 N 1.89 4.76 -0.79 2.97 0.20 -0.61 -1.12 118.68 125.99 1m9l s LEU 75 Ca 0.12 -0.56 0.03 0.00 0.69 0.00 0.00 54.13 54.40 1m9l s LEU 75 Cb -0.22 -2.40 0.26 0.00 -0.43 0.00 0.00 46.19 43.40 1m9l s LEU 75 CO 0.01 -0.54 0.92 -1.20 -0.29 0.00 0.00 176.35 175.26 1m9l n SER 76 N 5.59 4.45 -2.40 3.68 7.64 0.04 -0.79 113.62 131.81 1m9l n SER 76 Ca -0.07 -3.39 0.00 0.00 1.01 0.00 0.00 58.87 56.42 1m9l n SER 76 Cb 0.48 -0.87 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 1m9l n SER 76 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1m9l n LEU 77 N 1.20 0.00 0.15 -3.43 0.00 -0.12 -1.49 117.00 113.31 1m9l n LEU 77 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.28 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 0.48 -0.19 0.00 0.61 0.00 0.00 0.00 177.39 178.28 1m9l n GLY 78 N 5.00 -1.41 2.64 -3.96 0.00 -1.25 -4.58 105.19 101.63 1m9l n GLY 78 Ca 0.00 0.27 -0.24 0.00 0.00 0.00 0.00 46.02 46.05 1m9l n GLY 78 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1m9l s ARG 79 N -2.00 0.07 0.32 1.61 3.00 0.03 -0.50 118.95 121.47 1m9l s ARG 79 Ca 0.00 0.02 -0.13 0.00 -1.00 0.00 0.00 55.73 54.63 1m9l s ARG 79 Cb 0.00 -1.57 0.02 0.00 0.00 0.00 0.00 34.95 33.40 1m9l s ARG 79 CO 0.00 -0.63 0.61 0.54 0.00 0.00 0.00 175.30 175.83 1m9l s ASN 80 N 2.17 0.15 -0.05 -2.12 6.03 -0.36 -1.50 114.94 119.25 1m9l s ASN 80 Ca 0.03 -1.07 0.04 0.00 -1.03 0.00 0.00 52.86 50.83 1m9l s ASN 80 Cb -0.15 0.71 -0.00 0.00 -3.03 0.00 0.00 41.25 38.77 1m9l s ASN 80 CO -0.09 -1.38 -0.17 -0.76 -2.03 0.00 0.00 177.10 172.67 1m9l s LEU 81 N -3.07 1.89 -0.03 3.54 1.02 -0.60 -1.60 118.68 119.84 1m9l s LEU 81 Ca 0.20 -0.36 0.04 0.00 0.02 0.00 0.00 54.13 54.02 1m9l s LEU 81 Cb -0.03 -0.99 -0.00 0.00 0.02 0.00 0.00 46.19 45.19 1m9l s LEU 81 CO 0.12 0.14 -0.13 -0.63 0.02 0.00 0.00 176.35 175.87 1m9l s ILE 82 N 0.16 1.10 0.15 -0.59 1.01 -0.31 -0.81 121.20 121.91 1m9l s ILE 82 Ca -0.07 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.04 1m9l s ILE 82 Cb -0.13 -0.95 0.00 0.00 0.01 0.00 0.00 42.46 41.39 1m9l s ILE 82 CO 0.03 0.32 0.00 0.29 0.00 0.00 0.00 174.94 175.58 1m9l n LYS 83 N 3.12 0.00 -4.45 2.79 5.02 -1.25 -4.06 118.16 119.32 1m9l n LYS 83 Ca -0.17 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.78 1m9l n LYS 83 Cb 0.54 -0.28 -0.12 0.00 -0.02 0.00 0.00 35.03 35.15 1m9l n LYS 83 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1m9l s LYS 84 N -2.00 3.47 0.05 1.97 -0.14 -1.26 -4.49 119.74 117.34 1m9l s LYS 84 Ca 0.00 -0.52 -0.30 0.00 -1.36 0.00 0.00 55.97 53.79 1m9l s LYS 84 Cb 0.00 -2.84 -0.05 0.00 -1.68 0.00 0.00 37.83 33.26 1m9l s LYS 84 CO 0.00 0.34 1.05 -1.50 -0.76 0.00 0.00 175.35 174.49 1m9l s ILE 85 N 0.08 4.47 0.00 2.17 -1.16 -1.26 -4.76 121.20 120.74 1m9l s ILE 85 Ca -0.01 1.84 0.00 0.00 -0.51 0.00 0.00 60.65 61.97 1m9l s ILE 85 Cb -0.14 -4.18 0.00 0.00 0.61 0.00 0.00 42.46 38.76 1m9l s ILE 85 CO 0.03 0.18 0.00 1.21 -2.81 0.00 0.00 174.94 173.55 1m9l n GLU 86 N 3.59 0.00 -0.05 3.50 2.13 -1.26 -4.94 120.64 123.61 1m9l n GLU 86 Ca 0.06 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.89 1m9l n GLU 86 Cb 0.49 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 32.05 1m9l n GLU 86 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1m9l n ASN 87 N -2.00 0.60 -0.30 4.31 6.94 -1.26 -4.57 115.26 118.98 1m9l n ASN 87 Ca 0.00 0.00 0.26 0.00 -0.02 0.00 0.00 54.58 54.82 1m9l n ASN 87 Cb 0.00 1.42 0.58 0.00 -2.36 0.00 0.00 39.78 39.42 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 0.30 0.22 -4.53 3.38 -1.92 -0.63 115.31 112.14 1m9l h LEU 88 Ca -0.24 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1m9l h LEU 88 Cb 1.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1m9l h LEU 88 CO 0.01 0.07 -0.11 0.44 0.09 0.00 0.00 178.44 178.94 1m9l h ASP 89 N 0.27 -0.26 0.19 -0.43 3.32 -1.91 0.16 116.42 117.77 1m9l h ASP 89 Ca 0.56 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.40 1m9l h ASP 89 Cb 1.66 0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.28 1m9l h ASP 89 CO -0.20 0.08 -0.09 0.00 -1.72 0.00 0.00 179.24 177.32 1m9l h ALA 90 N 0.06 -0.26 -0.61 3.45 0.00 -1.49 -0.82 119.26 119.60 1m9l h ALA 90 Ca -0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1m9l h ALA 90 Cb 0.45 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1m9l h ALA 90 CO 0.05 -0.57 0.27 -0.39 0.00 0.00 0.00 179.25 178.61 1m9l h VAL 91 N -0.40 1.21 -0.39 0.00 -1.51 -1.28 -1.62 116.25 112.26 1m9l h VAL 91 Ca -0.03 -0.61 -0.06 0.00 -1.23 0.00 0.00 66.70 64.78 1m9l h VAL 91 Cb 0.31 0.45 -0.02 0.00 -2.13 0.00 0.00 31.29 29.90 1m9l h VAL 91 CO 0.04 0.25 -0.00 0.00 -1.23 0.00 0.00 177.57 176.63 1m9l h ALA 92 N 1.44 1.27 -0.27 5.19 0.00 -0.37 0.41 119.26 126.92 1m9l h ALA 92 Ca 0.21 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1m9l h ALA 92 Cb 0.12 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1m9l h ALA 92 CO -0.02 0.49 -0.16 -0.44 0.00 0.00 0.00 179.25 179.11 1m9l h ASP 93 N 0.59 0.62 0.87 0.00 3.32 -0.33 -3.31 116.42 118.18 1m9l h ASP 93 Ca 0.12 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1m9l h ASP 93 Cb 0.37 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1m9l h ASP 93 CO 0.01 0.91 -0.96 1.07 -1.72 0.00 0.00 179.24 178.55 1m9l n THR 94 N -4.41 0.50 -1.07 0.35 5.66 -0.69 -4.96 114.28 109.66 1m9l n THR 94 Ca -0.04 -0.45 -0.29 0.00 -3.05 0.00 0.00 64.05 60.22 1m9l n THR 94 Cb 0.38 -0.22 0.21 0.00 -1.55 0.00 0.00 70.33 69.15 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 -4.93 1.15 0.08 1.09 1.43 0.14 -4.43 118.68 113.22 1m9l s LEU 95 Ca 0.01 1.03 0.00 0.00 -1.03 0.00 0.00 54.13 54.14 1m9l s LEU 95 Cb 0.11 -3.03 0.00 0.00 0.03 0.00 0.00 46.19 43.30 1m9l s LEU 95 CO 0.78 -3.60 0.00 1.21 0.23 0.00 0.00 176.35 174.97 1m9l n GLU 96 N -4.47 0.00 -3.72 1.70 2.13 -1.20 -4.84 120.64 110.25 1m9l n GLU 96 Ca 0.07 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.53 1m9l n GLU 96 Cb 0.58 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 32.20 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 2.66 -1.16 5.31 2.02 -0.58 -1.73 118.70 123.21 1m9l s GLU 97 Ca 0.00 -2.67 -0.17 0.00 0.02 0.00 0.00 54.97 52.15 1m9l s GLU 97 Cb 0.00 -3.75 0.12 0.00 0.10 0.00 0.00 34.13 30.60 1m9l s GLU 97 CO 0.00 -1.19 1.46 -0.51 0.02 0.00 0.00 175.26 175.04 1m9l s LEU 98 N -0.30 4.55 -0.80 1.80 1.43 -0.60 -1.57 118.68 123.19 1m9l s LEU 98 Ca 0.19 -2.50 -0.17 0.00 -1.03 0.00 0.00 54.13 50.61 1m9l s LEU 98 Cb -0.18 -2.47 0.15 0.00 0.03 0.00 0.00 46.19 43.72 1m9l s LEU 98 CO -0.05 -1.00 0.88 0.26 0.23 0.00 0.00 176.35 176.67 1m9l s TRP 99 N 2.88 3.30 -0.36 0.29 0.51 0.03 -0.61 118.94 124.98 1m9l s TRP 99 Ca 0.44 -1.47 0.14 0.00 -2.12 0.00 0.00 56.10 53.09 1m9l s TRP 99 Cb -0.01 -4.05 0.38 0.00 -0.81 0.00 0.00 33.47 28.98 1m9l s TRP 99 CO -0.01 -1.27 0.79 0.44 -0.51 0.00 0.00 176.95 176.40 1m9l n ILE 100 N 4.99 0.14 -0.01 2.03 -5.35 -0.71 -0.95 119.36 119.51 1m9l n ILE 100 Ca 0.11 -4.19 -0.00 0.00 -0.27 0.00 0.00 62.75 58.40 1m9l n ILE 100 Cb 0.46 -0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.34 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 0.19 -0.01 -4.05 7.28 3.41 -1.25 -3.83 113.62 115.36 1m9l n SER 101 Ca 0.21 0.03 -0.31 0.00 -0.26 0.00 0.00 58.87 58.54 1m9l n SER 101 Cb 0.70 -0.01 -0.16 0.00 -0.26 0.00 0.00 64.21 64.48 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 -5.02 2.65 -0.15 7.33 6.14 0.34 -0.20 117.35 128.44 1m9l s TYR 102 Ca -0.00 -1.69 -0.05 0.00 0.64 0.00 0.00 57.07 55.96 1m9l s TYR 102 Cb 0.00 -1.77 0.07 0.00 0.42 0.00 0.00 41.96 40.69 1m9l s TYR 102 CO 0.01 -0.78 0.31 0.54 0.64 0.00 0.00 175.55 176.27 1m9l s ASN 103 N 1.32 0.20 -0.08 4.32 2.20 -0.40 -1.23 114.94 121.27 1m9l s ASN 103 Ca 0.00 0.69 -0.28 0.00 -0.94 0.00 0.00 52.86 52.33 1m9l s ASN 103 Cb -0.15 0.89 -0.02 0.00 -2.00 0.00 0.00 41.25 39.96 1m9l s ASN 103 CO -0.09 -0.24 0.91 -1.10 -2.94 0.00 0.00 177.10 173.64 1m9l s GLN 104 N 2.48 4.44 0.22 3.55 -0.21 -0.63 -1.51 119.66 128.00 1m9l s GLN 104 Ca 0.01 1.24 0.01 0.00 0.02 0.00 0.00 55.36 56.63 1m9l s GLN 104 Cb -0.12 -3.51 -0.05 0.00 1.00 0.00 0.00 33.01 30.33 1m9l s GLN 104 CO -0.10 -0.18 0.09 0.42 -2.12 0.00 0.00 175.29 173.40 1m9l s ILE 105 N 1.55 0.40 0.00 1.08 1.01 -0.38 -1.16 121.20 123.70 1m9l s ILE 105 Ca 0.46 -1.99 0.00 0.00 0.00 0.00 0.00 60.65 59.12 1m9l s ILE 105 Cb -0.19 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 39.81 1m9l s ILE 105 CO 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 174.94 175.02 1m9l n ALA 106 N -0.35 0.00 -2.38 9.38 0.00 -1.26 -4.31 120.51 121.59 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 -1.12 0.00 0.00 0.00 177.50 176.38 1m9l s SER 107 N -0.07 7.45 0.07 0.00 0.01 -1.26 -4.99 113.70 114.91 1m9l s SER 107 Ca 0.00 1.77 -0.19 0.00 1.31 0.00 0.00 55.95 58.85 1m9l s SER 107 Cb 0.00 -2.58 -0.10 0.00 0.21 0.00 0.00 66.02 63.55 1m9l s SER 107 CO 0.00 -0.13 1.48 -0.07 0.41 0.00 0.00 173.24 174.92 1m9l h LEU 108 N 5.91 0.42 -0.31 2.44 -0.00 -1.99 -1.49 115.31 120.29 1m9l h LEU 108 Ca -0.42 -0.35 -0.02 0.00 -0.00 0.00 0.00 57.88 57.08 1m9l h LEU 108 Cb 1.21 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 41.75 1m9l h LEU 108 CO 0.73 0.67 0.10 -1.28 -0.00 0.00 0.00 178.44 178.65 1m9l h SER 109 N 0.16 0.45 0.20 -0.43 0.87 -1.99 -1.40 113.55 111.41 1m9l h SER 109 Ca 0.06 -0.21 -0.00 0.00 -1.23 0.00 0.00 61.79 60.41 1m9l h SER 109 Cb 0.48 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 1m9l h SER 109 CO 0.02 0.54 -0.25 1.23 -0.53 0.00 0.00 176.83 177.84 1m9l h GLY 110 N 0.34 -1.02 0.30 5.77 0.00 -1.94 -1.66 103.07 104.85 1m9l h GLY 110 Ca 0.10 0.47 0.12 0.00 0.00 0.00 0.00 47.33 48.02 1m9l h GLY 110 CO -0.00 -0.33 0.30 0.16 0.00 0.00 0.00 176.54 176.66 1m9l h ILE 111 N -0.46 0.74 -0.23 2.60 -0.00 -1.33 -0.82 117.51 118.00 1m9l h ILE 111 Ca -0.02 -0.16 0.06 0.00 -0.00 0.00 0.00 64.86 64.73 1m9l h ILE 111 Cb 0.41 0.22 -0.06 0.00 -0.00 0.00 0.00 36.82 37.38 1m9l h ILE 111 CO -0.05 0.09 -0.18 -0.08 -0.00 0.00 0.00 178.15 177.92 1m9l h GLU 112 N 0.48 -0.18 0.14 0.16 4.81 -0.95 0.81 114.58 119.86 1m9l h GLU 112 Ca 0.37 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.60 1m9l h GLU 112 Cb 0.49 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1m9l h GLU 112 CO -0.34 -0.12 -0.07 0.87 -0.73 0.00 0.00 179.01 178.62 1m9l h LYS 113 N -0.18 -0.18 -0.20 1.92 1.57 -0.76 -0.70 116.57 118.03 1m9l h LYS 113 Ca 0.13 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.98 1m9l h LYS 113 Cb 0.38 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1m9l h LYS 113 CO -0.34 0.19 0.17 1.37 -0.57 0.00 0.00 179.45 180.27 1m9l h LEU 114 N -0.96 0.00 0.16 2.94 8.10 -1.20 -0.48 115.31 123.87 1m9l h LEU 114 Ca -0.02 0.00 -0.32 0.00 0.11 0.00 0.00 57.88 57.65 1m9l h LEU 114 Cb 0.46 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.68 1m9l h LEU 114 CO 0.03 0.00 -1.59 0.58 -4.11 0.00 0.00 178.44 173.35 1m9l h VAL 115 N 0.00 1.00 -0.02 0.15 2.07 -0.92 -3.30 116.25 115.23 1m9l h VAL 115 Ca 0.10 -2.47 0.00 0.00 0.82 0.00 0.00 66.70 65.15 1m9l h VAL 115 Cb 0.44 2.77 -0.00 0.00 -1.52 0.00 0.00 31.29 32.98 1m9l h VAL 115 CO -0.00 0.80 0.30 -1.13 0.02 0.00 0.00 177.57 177.56 1m9l h ASN 116 N -0.06 0.00 -1.28 0.57 -1.24 0.39 -3.43 115.58 110.53 1m9l h ASN 116 Ca -0.32 0.00 -0.30 0.00 0.71 0.00 0.00 56.30 56.39 1m9l h ASN 116 Cb 1.96 0.00 0.16 0.00 0.73 0.00 0.00 38.32 41.17 1m9l h ASN 116 CO 0.14 0.00 -1.39 -0.11 -1.29 0.00 0.00 177.43 174.77 1m9l n LEU 117 N -2.94 -2.40 -0.01 0.34 7.94 -0.42 -4.96 117.00 114.55 1m9l n LEU 117 Ca -0.02 -0.07 -0.01 0.00 -1.11 0.00 0.00 56.01 54.81 1m9l n LEU 117 Cb 0.36 -0.59 -0.00 0.00 0.53 0.00 0.00 43.42 43.72 1m9l n LEU 117 CO 0.15 -2.52 0.03 0.03 -1.11 0.00 0.00 177.39 173.96 1m9l h ARG 118 N -1.66 -0.04 -4.13 1.96 3.08 -1.84 -3.44 114.38 108.32 1m9l h ARG 118 Ca -0.27 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.22 1m9l h ARG 118 Cb 0.89 0.01 -0.38 0.00 0.08 0.00 0.00 29.97 30.57 1m9l h ARG 118 CO 0.16 -0.03 -0.79 0.54 -1.07 0.00 0.00 179.97 178.78 1m9l s VAL 119 N -1.50 1.11 -0.07 2.04 0.11 -0.71 -1.83 120.40 119.56 1m9l s VAL 119 Ca -0.01 -0.70 0.02 0.00 -2.93 0.00 0.00 61.98 58.36 1m9l s VAL 119 Cb 0.00 -1.33 0.01 0.00 -1.53 0.00 0.00 36.38 33.54 1m9l s VAL 119 CO 0.02 0.07 -0.12 -1.48 -3.33 0.00 0.00 175.10 170.26 1m9l s LEU 120 N 1.62 1.61 -0.25 2.54 2.34 -0.67 -1.55 118.68 124.32 1m9l s LEU 120 Ca -0.00 -0.29 -0.02 0.00 0.06 0.00 0.00 54.13 53.87 1m9l s LEU 120 Cb -0.16 -0.81 0.02 0.00 -0.56 0.00 0.00 46.19 44.68 1m9l s LEU 120 CO -0.07 0.02 -0.05 -0.31 -1.06 0.00 0.00 176.35 174.87 1m9l s TYR 121 N 0.73 3.05 -0.35 3.48 2.02 0.22 -0.93 117.35 125.57 1m9l s TYR 121 Ca -0.13 -1.46 -0.00 0.00 -0.37 0.00 0.00 57.07 55.11 1m9l s TYR 121 Cb -0.16 -2.07 0.13 0.00 -0.40 0.00 0.00 41.96 39.47 1m9l s TYR 121 CO 0.03 -0.70 0.20 -1.64 -1.57 0.00 0.00 175.55 171.87 1m9l s MET 122 N 1.35 0.55 0.42 -0.62 -1.94 0.12 -1.73 119.30 117.45 1m9l s MET 122 Ca 0.01 -1.26 0.23 0.00 -1.71 0.00 0.00 55.69 52.96 1m9l s MET 122 Cb -0.16 -1.35 0.52 0.00 2.01 0.00 0.00 34.83 35.84 1m9l s MET 122 CO -0.04 -1.18 1.66 0.66 -0.01 0.00 0.00 175.02 176.11 1m9l h SER 123 N 7.19 0.00 -3.37 3.03 4.64 -1.68 -0.09 113.55 123.28 1m9l h SER 123 Ca 0.02 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.09 1m9l h SER 123 Cb 0.97 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.74 1m9l h SER 123 CO 0.30 0.15 -0.60 0.20 -0.87 0.00 0.00 176.83 176.01 1m9l s ASN 124 N -6.19 0.02 0.26 4.97 0.01 0.73 -0.92 114.94 113.82 1m9l s ASN 124 Ca 0.04 0.32 -0.21 0.00 -0.71 0.00 0.00 52.86 52.30 1m9l s ASN 124 Cb 0.07 0.21 0.03 0.00 0.41 0.00 0.00 41.25 41.97 1m9l s ASN 124 CO 0.66 -0.17 0.74 0.54 -1.51 0.00 0.00 177.10 177.36 1m9l s ASN 125 N 1.37 -0.27 -0.21 -1.22 2.20 0.16 -1.28 114.94 115.69 1m9l s ASN 125 Ca -0.07 -0.56 0.02 0.00 -0.94 0.00 0.00 52.86 51.31 1m9l s ASN 125 Cb -0.12 0.70 0.04 0.00 -2.00 0.00 0.00 41.25 39.87 1m9l s ASN 125 CO -0.06 -1.29 -0.16 -0.54 -2.94 0.00 0.00 177.10 172.12 1m9l s LYS 126 N -3.85 2.60 -0.23 3.55 -0.14 -0.57 -3.69 119.74 117.40 1m9l s LYS 126 Ca 0.11 -1.01 -0.19 0.00 -1.36 0.00 0.00 55.97 53.52 1m9l s LYS 126 Cb -0.05 -2.66 0.06 0.00 -1.68 0.00 0.00 37.83 33.50 1m9l s LYS 126 CO 0.05 -0.36 0.59 0.42 -0.76 0.00 0.00 175.35 175.29 1m9l s ILE 127 N 1.24 -0.00 0.00 2.17 1.01 -1.26 -1.24 121.20 123.11 1m9l s ILE 127 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.65 1m9l s ILE 127 Cb -0.16 -0.83 0.00 0.00 0.01 0.00 0.00 42.46 41.48 1m9l s ILE 127 CO -0.10 0.00 0.00 0.35 0.00 0.00 0.00 174.94 175.20 1m9l n THR 128 N 3.18 0.00 -1.32 2.92 -2.24 -1.26 -1.18 114.28 114.39 1m9l n THR 128 Ca -0.16 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.24 1m9l n THR 128 Cb 0.56 0.83 -0.03 0.00 -2.10 0.00 0.00 70.33 69.59 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 8.62 -0.32 3.42 2.85 -1.26 -4.70 115.26 123.86 1m9l n ASN 129 Ca 0.00 -2.59 0.15 0.00 -0.11 0.00 0.00 54.58 52.03 1m9l n ASN 129 Cb 0.00 -1.55 0.34 0.00 1.24 0.00 0.00 39.78 39.81 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 4.90 0.83 -0.97 1.20 7.01 -1.94 0.24 115.95 127.23 1m9l h TRP 130 Ca 0.85 0.04 0.29 0.00 2.11 0.00 0.00 58.89 62.17 1m9l h TRP 130 Cb 0.33 -0.22 -0.17 0.00 -2.10 0.00 0.00 29.16 27.00 1m9l h TRP 130 CO 1.88 0.02 0.14 0.78 -2.79 0.00 0.00 178.44 178.47 1m9l h GLY 131 N 0.50 1.42 0.00 2.65 0.00 -2.01 -1.17 103.07 104.47 1m9l h GLY 131 Ca 0.59 0.08 0.00 0.00 0.00 0.00 0.00 47.33 48.00 1m9l h GLY 131 CO -0.49 -0.53 -0.14 1.18 0.00 0.00 0.00 176.54 176.56 1m9l n GLU 132 N -5.41 0.07 -0.29 4.80 1.02 -0.81 -4.79 120.64 115.24 1m9l n GLU 132 Ca 0.25 0.03 0.15 0.00 -0.02 0.00 0.00 57.16 57.57 1m9l n GLU 132 Cb 0.83 -0.50 0.30 0.00 -0.02 0.00 0.00 31.44 32.05 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 -2.83 -0.36 -0.32 -3.67 5.41 0.80 -1.47 119.36 116.92 1m9l n ILE 133 Ca -0.02 1.83 -0.04 0.00 1.00 0.00 0.00 62.75 65.52 1m9l n ILE 133 Cb 0.07 -2.73 -0.01 0.00 -0.71 0.00 0.00 39.64 36.25 1m9l n ILE 133 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1m9l n ASP 134 N -5.16 -0.66 -0.13 4.38 2.03 -0.44 -1.51 116.55 115.06 1m9l n ASP 134 Ca 0.22 1.41 -0.22 0.00 0.52 0.00 0.00 54.79 56.73 1m9l n ASP 134 Cb 0.74 -0.26 -0.11 0.00 -0.72 0.00 0.00 41.12 40.77 1m9l n ASP 134 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1m9l n LYS 135 N -5.10 0.61 -0.28 -0.67 2.85 -1.11 -4.60 118.16 109.87 1m9l n LYS 135 Ca 0.05 0.18 0.33 0.00 -1.05 0.00 0.00 58.31 57.83 1m9l n LYS 135 Cb 0.27 -1.49 0.64 0.00 -0.65 0.00 0.00 35.03 33.80 1m9l n LYS 135 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 1m9l h LEU 136 N -0.34 0.00 -1.67 -5.58 5.85 -1.00 -0.22 115.31 112.35 1m9l h LEU 136 Ca -0.61 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.11 1m9l h LEU 136 Cb 1.78 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.81 1m9l h LEU 136 CO -0.20 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 177.90 1m9l n ALA 137 N -2.51 2.37 -3.33 1.25 0.00 -0.57 -4.75 120.51 112.98 1m9l n ALA 137 Ca 0.25 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.45 1m9l n ALA 137 Cb 1.40 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 19.89 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 0.39 -1.10 0.01 0.00 0.00 -0.17 -4.26 120.51 115.38 1m9l n ALA 138 Ca 0.00 0.25 -0.01 0.00 0.00 0.00 0.00 53.44 53.69 1m9l n ALA 138 Cb 0.37 -4.04 -0.00 0.00 0.00 0.00 0.00 19.45 15.78 1m9l n ALA 138 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1m9l h LEU 139 N -1.64 -0.05 -4.99 0.00 7.12 -1.60 -1.86 115.31 112.30 1m9l h LEU 139 Ca -0.52 0.00 -0.63 0.00 0.13 0.00 0.00 57.88 56.86 1m9l h LEU 139 Cb 1.35 0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 41.49 1m9l h LEU 139 CO 0.58 -0.02 3.17 0.47 -0.13 0.00 0.00 178.44 182.51 1m9l n ASP 140 N -2.38 8.29 0.04 1.25 8.00 -1.26 -3.71 116.55 126.77 1m9l n ASP 140 Ca -0.00 -2.66 0.00 0.00 0.71 0.00 0.00 54.79 52.84 1m9l n ASP 140 Cb 0.02 -1.51 0.00 0.00 -0.02 0.00 0.00 41.12 39.61 1m9l n ASP 140 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1m9l n LYS 141 N 3.15 0.00 -0.27 -1.24 0.00 -1.19 -4.94 118.16 113.67 1m9l n LYS 141 Ca 0.72 0.00 -0.10 0.00 0.00 0.00 0.00 58.31 58.94 1m9l n LYS 141 Cb 0.31 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.35 1m9l n LYS 141 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1m9l n LEU 142 N -2.65 -1.54 0.00 3.14 4.77 -0.71 -1.56 117.00 118.45 1m9l n LEU 142 Ca 0.00 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 1m9l n LEU 142 Cb 0.00 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1m9l n LEU 142 CO 0.00 -1.57 0.00 -0.62 -1.33 0.00 0.00 177.39 173.87 1m9l n GLU 143 N 0.64 0.00 -3.89 3.23 4.71 -1.26 -3.34 120.64 120.72 1m9l n GLU 143 Ca -0.00 0.04 -0.34 0.00 -0.01 0.00 0.00 57.16 56.85 1m9l n GLU 143 Cb 0.15 -0.50 -0.13 0.00 -1.01 0.00 0.00 31.44 29.94 1m9l n GLU 143 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1m9l s ASP 144 N -3.67 5.01 -0.27 1.62 1.11 -0.76 -1.45 116.67 118.27 1m9l s ASP 144 Ca 0.00 -2.03 0.01 0.00 0.18 0.00 0.00 52.55 50.71 1m9l s ASP 144 Cb 0.00 -1.73 0.07 0.00 1.07 0.00 0.00 42.92 42.33 1m9l s ASP 144 CO 0.00 -0.45 -0.01 -1.48 1.18 0.00 0.00 175.17 174.41 1m9l s LEU 145 N 1.04 2.95 -0.38 1.23 2.34 -0.67 -1.68 118.68 123.52 1m9l s LEU 145 Ca 0.08 -1.45 -0.06 0.00 0.06 0.00 0.00 54.13 52.77 1m9l s LEU 145 Cb -0.21 -1.22 0.08 0.00 -0.56 0.00 0.00 46.19 44.28 1m9l s LEU 145 CO -0.06 -0.29 0.18 -0.22 -1.06 0.00 0.00 176.35 174.90 1m9l s LEU 146 N 1.33 4.85 -0.42 1.48 2.96 -0.10 -0.40 118.68 128.38 1m9l s LEU 146 Ca 0.00 -1.57 0.10 0.00 -0.22 0.00 0.00 54.13 52.44 1m9l s LEU 146 Cb -0.19 -1.88 0.34 0.00 0.50 0.00 0.00 46.19 44.97 1m9l s LEU 146 CO -0.10 -0.46 0.78 0.18 -1.32 0.00 0.00 176.35 175.43 1m9l n LEU 147 N 4.76 1.74 -0.09 -0.68 4.32 -1.22 0.16 117.00 125.99 1m9l n LEU 147 Ca -0.09 -5.17 -0.10 0.00 -0.02 0.00 0.00 56.01 50.63 1m9l n LEU 147 Cb 0.43 0.39 0.03 0.00 -1.62 0.00 0.00 43.42 42.66 1m9l n LEU 147 CO 0.34 2.30 0.60 0.00 -1.22 0.00 0.00 177.39 179.41 1m9l h ALA 148 N 3.03 0.71 -3.12 -1.18 0.00 -1.19 -3.43 119.26 114.08 1m9l h ALA 148 Ca 0.11 -0.43 -0.67 0.00 0.00 0.00 0.00 54.91 53.92 1m9l h ALA 148 Cb 0.85 -0.13 -0.29 0.00 0.00 0.00 0.00 17.79 18.22 1m9l h ALA 148 CO 0.58 0.66 -0.69 0.20 0.00 0.00 0.00 179.25 180.00 1m9l s GLY 149 N -3.89 1.69 0.00 0.00 0.00 -0.10 -4.77 107.32 100.24 1m9l s GLY 149 Ca -0.10 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.22 1m9l s GLY 149 CO 0.86 0.55 0.00 1.16 0.00 0.00 0.00 173.10 175.67 1m9l n ASN 150 N 4.77 0.00 -0.35 1.64 0.23 -1.24 0.40 115.26 120.71 1m9l n ASN 150 Ca -0.16 0.00 0.23 0.00 -0.53 0.00 0.00 54.58 54.12 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 0.37 0.24 -0.53 0.11 -1.77 -1.09 132.00 129.32 1m9l h PRO 151 Ca 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1m9l h PRO 151 Cb 0.00 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 1m9l h PRO 151 CO 0.00 0.24 -0.24 -0.07 -0.21 0.00 0.00 178.00 177.73 1m9l h LEU 152 N 0.38 -0.65 -0.70 2.35 3.38 -1.43 0.32 115.31 118.96 1m9l h LEU 152 Ca 0.70 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.76 1m9l h LEU 152 Cb 1.63 0.21 -0.05 0.00 0.09 0.00 0.00 40.66 42.54 1m9l h LEU 152 CO -0.49 -0.31 0.42 0.22 0.09 0.00 0.00 178.44 178.37 1m9l h TYR 153 N -0.47 0.79 0.00 1.13 3.20 -1.72 -0.21 116.97 119.68 1m9l h TYR 153 Ca -0.03 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.83 1m9l h TYR 153 Cb 0.41 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.42 1m9l h TYR 153 CO -0.15 0.43 -0.17 -0.91 -1.64 0.00 0.00 178.16 175.72 1m9l h ASN 154 N 0.81 0.00 0.44 -2.11 -0.26 -1.18 -1.74 115.58 111.54 1m9l h ASN 154 Ca 0.29 0.00 -0.28 0.00 -0.56 0.00 0.00 56.30 55.75 1m9l h ASN 154 Cb 0.08 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 37.36 1m9l h ASN 154 CO -0.13 0.17 -1.25 0.44 -1.06 0.00 0.00 177.43 175.59 1m9l h ASP 155 N 0.00 0.60 0.69 5.81 3.32 0.14 -3.25 116.42 123.73 1m9l h ASP 155 Ca -0.00 -0.60 -0.03 0.00 0.02 0.00 0.00 57.03 56.42 1m9l h ASP 155 Cb 0.44 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1m9l h ASP 155 CO 0.02 1.45 -0.41 0.22 -1.72 0.00 0.00 179.24 178.80 1m9l h TYR 156 N 0.14 -1.08 0.00 4.55 3.20 -0.80 -3.48 116.97 119.49 1m9l h TYR 156 Ca -0.16 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.70 1m9l h TYR 156 Cb 1.95 0.38 0.00 0.00 1.54 0.00 0.00 36.73 40.60 1m9l h TYR 156 CO 0.08 -0.62 0.00 1.17 -1.64 0.00 0.00 178.16 177.15 1m9l n LYS 157 N -5.55 0.00 0.22 1.82 3.00 -0.69 -4.71 118.16 112.24 1m9l n LYS 157 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.17 1m9l n LYS 157 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.47 1m9l n LYS 157 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1m9l n GLU 158 N 0.00 0.02 -1.46 1.64 -0.00 -1.21 -1.43 120.64 118.20 1m9l n GLU 158 Ca 0.00 0.62 0.03 0.00 -0.00 0.00 0.00 57.16 57.81 1m9l n GLU 158 Cb 0.00 -2.02 0.01 0.00 -0.00 0.00 0.00 31.44 29.43 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 -1.87 0.85 0.00 -1.84 5.15 -1.26 -4.66 115.26 111.63 1m9l n ASN 159 Ca 0.00 -2.00 0.00 0.00 -0.60 0.00 0.00 54.58 51.98 1m9l n ASN 159 Cb 0.74 -0.26 0.00 0.00 -0.53 0.00 0.00 39.78 39.73 1m9l n ASN 159 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1m9l n ASN 160 N 0.46 0.00 -0.10 1.20 2.85 -0.59 -4.81 115.26 114.27 1m9l n ASN 160 Ca 0.04 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.41 1m9l n ASN 160 Cb 1.12 0.00 -0.15 0.00 1.24 0.00 0.00 39.78 41.99 1m9l n ASN 160 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1m9l n ALA 161 N -1.13 1.53 -0.05 5.20 0.00 -0.51 -3.76 120.51 121.79 1m9l n ALA 161 Ca 0.00 -1.22 -0.13 0.00 0.00 0.00 0.00 53.44 52.09 1m9l n ALA 161 Cb 0.00 -0.14 -0.07 0.00 0.00 0.00 0.00 19.45 19.24 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 1.34 -0.33 0.00 2.02 -1.76 0.17 112.91 114.35 1m9l h THR 162 Ca -0.51 -1.21 -0.04 0.00 0.77 0.00 0.00 66.41 65.41 1m9l h THR 162 Cb 2.13 1.86 -0.02 0.00 -1.74 0.00 0.00 68.15 70.38 1m9l h THR 162 CO 0.02 0.35 0.03 -1.28 0.37 0.00 0.00 175.52 175.00 1m9l h SER 163 N -0.08 0.45 -0.16 4.18 0.87 -1.78 -0.74 113.55 116.29 1m9l h SER 163 Ca 0.02 -0.07 -0.10 0.00 -1.23 0.00 0.00 61.79 60.42 1m9l h SER 163 Cb 0.60 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 1m9l h SER 163 CO 0.03 0.50 -0.20 -0.08 -0.53 0.00 0.00 176.83 176.55 1m9l h GLU 164 N 0.48 0.59 0.32 2.24 4.22 -1.60 -1.56 114.58 119.27 1m9l h GLU 164 Ca 0.11 -0.21 -0.02 0.00 0.08 0.00 0.00 59.36 59.32 1m9l h GLU 164 Cb 0.27 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1m9l h GLU 164 CO 0.00 0.76 -0.15 1.88 -2.18 0.00 0.00 179.01 179.32 1m9l h TYR 165 N 0.53 -0.40 -0.49 0.92 0.05 0.76 0.14 116.97 118.48 1m9l h TYR 165 Ca 0.08 -0.01 0.08 0.00 0.05 0.00 0.00 58.73 58.93 1m9l h TYR 165 Cb 0.64 0.13 -0.06 0.00 1.01 0.00 0.00 36.73 38.45 1m9l h TYR 165 CO 0.03 -0.20 0.13 -0.09 -1.05 0.00 0.00 178.16 176.97 1m9l h ARG 166 N -0.50 0.27 -0.87 4.88 1.12 -1.16 0.81 114.38 118.93 1m9l h ARG 166 Ca -0.04 -0.02 0.07 0.00 -1.11 0.00 0.00 59.98 58.88 1m9l h ARG 166 Cb 0.38 -0.06 -0.06 0.00 -0.01 0.00 0.00 29.97 30.21 1m9l h ARG 166 CO 0.07 0.18 0.53 0.82 -3.11 0.00 0.00 179.97 178.47 1m9l h ILE 167 N 0.28 1.02 0.00 1.20 2.04 -1.12 0.02 117.51 120.95 1m9l h ILE 167 Ca 0.24 -0.33 -0.07 0.00 1.00 0.00 0.00 64.86 65.70 1m9l h ILE 167 Cb 0.30 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.35 1m9l h ILE 167 CO -0.29 0.17 -0.34 -0.08 0.00 0.00 0.00 178.15 177.62 1m9l h GLU 168 N 0.96 0.00 0.00 2.37 4.81 0.67 -0.19 114.58 123.20 1m9l h GLU 168 Ca 0.38 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.61 1m9l h GLU 168 Cb 0.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1m9l h GLU 168 CO -0.19 0.34 0.00 0.28 -0.73 0.00 0.00 179.01 178.71 1m9l n VAL 169 N -3.97 0.00 -0.23 0.32 0.31 0.14 -0.38 118.33 114.52 1m9l n VAL 169 Ca -0.02 0.91 0.30 0.00 -0.01 0.00 0.00 64.34 65.52 1m9l n VAL 169 Cb 0.39 -1.78 0.72 0.00 -0.91 0.00 0.00 33.84 32.26 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 0.51 0.00 2.52 3.04 -1.26 -0.82 116.25 120.23 1m9l h VAL 170 Ca 0.00 -0.01 -0.02 0.00 -1.01 0.00 0.00 66.70 65.67 1m9l h VAL 170 Cb 0.00 0.48 -0.00 0.00 -2.01 0.00 0.00 31.29 29.76 1m9l h VAL 170 CO 0.00 0.00 -0.43 0.50 -1.01 0.00 0.00 177.57 176.63 1m9l h LYS 171 N 0.02 0.00 0.00 4.17 3.64 -1.12 -3.46 116.57 119.82 1m9l h LYS 171 Ca 0.48 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.67 1m9l h LYS 171 Cb 1.87 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.65 1m9l h LYS 171 CO -0.02 0.08 -2.00 0.54 -2.27 0.00 0.00 179.45 175.79 1m9l n ARG 172 N -4.64 1.08 -3.77 1.90 1.74 0.49 -5.04 116.66 108.41 1m9l n ARG 172 Ca -0.07 -0.06 -0.35 0.00 -0.77 0.00 0.00 57.85 56.59 1m9l n ARG 172 Cb 0.24 -1.41 -0.08 0.00 -1.02 0.00 0.00 32.46 30.18 1m9l n ARG 172 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1m9l s LEU 173 N -4.84 4.21 -0.13 0.55 1.43 -0.33 -4.98 118.68 114.58 1m9l s LEU 173 Ca -0.07 0.26 -0.25 0.00 -1.03 0.00 0.00 54.13 53.03 1m9l s LEU 173 Cb 0.07 -2.08 -0.26 0.00 0.03 0.00 0.00 46.19 43.95 1m9l s LEU 173 CO 0.68 0.22 0.69 1.55 0.23 0.00 0.00 176.35 179.72 1m9l h PRO 174 N 6.40 0.07 0.00 1.29 0.13 -1.93 -3.43 132.00 134.53 1m9l h PRO 174 Ca -0.43 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 1m9l h PRO 174 Cb 1.16 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1m9l h PRO 174 CO 0.73 1.06 0.00 0.09 -0.23 0.00 0.00 178.00 179.65 1m9l n ASN 175 N -4.44 0.00 0.00 1.44 4.13 -1.26 -4.89 115.26 110.24 1m9l n ASN 175 Ca -0.15 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.11 1m9l n ASN 175 Cb 0.61 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.85 1m9l n ASN 175 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1m9l n LEU 176 N 0.00 0.00 -0.04 3.41 7.94 -0.60 -4.96 117.00 122.76 1m9l n LEU 176 Ca 0.00 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.81 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 -0.72 1.17 -1.11 0.00 0.00 177.39 176.73 1m9l n LYS 177 N 0.00 0.19 -3.15 1.96 4.81 -1.24 -4.89 118.16 115.84 1m9l n LYS 177 Ca 0.00 0.08 -0.39 0.00 -0.87 0.00 0.00 58.31 57.13 1m9l n LYS 177 Cb 0.00 -0.81 -0.01 0.00 0.02 0.00 0.00 35.03 34.22 1m9l n LYS 177 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1m9l n LYS 178 N -3.46 3.92 -2.52 1.64 4.76 -0.53 -4.96 118.16 117.01 1m9l n LYS 178 Ca -0.16 -4.57 -0.41 0.00 -2.87 0.00 0.00 58.31 50.30 1m9l n LYS 178 Cb 0.56 -2.46 -0.01 0.00 -1.84 0.00 0.00 35.03 31.28 1m9l n LYS 178 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1m9l s LEU 179 N -2.56 3.73 0.00 -0.35 2.96 -1.26 -1.66 118.68 119.54 1m9l s LEU 179 Ca 0.33 -2.29 0.00 0.00 -0.22 0.00 0.00 54.13 51.94 1m9l s LEU 179 Cb 0.05 -2.58 0.00 0.00 0.50 0.00 0.00 46.19 44.16 1m9l s LEU 179 CO 0.06 -1.41 0.00 -0.67 -1.32 0.00 0.00 176.35 173.01 1m9l n ASP 180 N 9.11 0.00 0.00 3.68 2.03 0.46 -4.69 116.55 127.14 1m9l n ASP 180 Ca 0.48 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.79 1m9l n ASP 180 Cb 0.46 -1.15 0.00 0.00 -0.72 0.00 0.00 41.12 39.71 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 0.25 0.00 0.27 0.00 -1.26 -4.36 105.19 98.09 1m9l n GLY 181 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.65 1m9l n GLY 181 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1m9l n MET 182 N 0.00 0.00 -0.30 1.61 0.00 -1.26 -1.69 117.12 115.48 1m9l n MET 182 Ca 0.00 0.00 0.26 0.00 0.00 0.00 0.00 57.70 57.96 1m9l n MET 182 Cb 0.00 0.00 0.44 0.00 0.00 0.00 0.00 33.22 33.66 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 -3.95 -0.03 -0.04 2.12 -0.01 -1.26 -3.22 135.00 128.62 1m9l n PRO 183 Ca 0.00 0.84 -0.01 0.00 -0.01 0.00 0.00 63.50 64.32 1m9l n PRO 183 Cb 0.00 -1.63 -0.01 0.00 -0.01 0.00 0.00 33.50 31.85 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 -4.05 -0.06 -1.19 -1.45 0.24 -0.68 -4.37 118.33 106.77 1m9l n VAL 184 Ca 0.27 0.87 -0.02 0.00 -2.04 0.00 0.00 64.34 63.41 1m9l n VAL 184 Cb 1.02 -1.14 -0.01 0.00 -1.47 0.00 0.00 33.84 32.24 1m9l n VAL 184 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1m9l n ASP 185 N -2.87 -0.66 0.00 -1.34 8.00 -1.20 -1.36 116.55 117.13 1m9l n ASP 185 Ca 0.00 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.59 1m9l n ASP 185 Cb 0.02 -1.00 0.00 0.00 -0.02 0.00 0.00 41.12 40.12 1m9l n ASP 185 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1m9l n VAL 186 N -1.28 0.00 0.21 2.53 3.14 -1.26 -4.90 118.33 116.77 1m9l n VAL 186 Ca -0.02 0.00 0.10 0.00 -2.96 0.00 0.00 64.34 61.46 1m9l n VAL 186 Cb 0.11 0.00 0.29 0.00 -1.06 0.00 0.00 33.84 33.18 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 0.06 6.55 3.58 -1.53 -2.62 116.42 122.45 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 0.19 0.00 -0.62 -2.88 0.00 0.00 179.24 175.93 1m9l n GLU 188 N -3.20 0.55 0.00 0.28 -0.58 -1.21 -0.35 120.64 116.13 1m9l n GLU 188 Ca 0.02 0.02 0.11 0.00 -0.42 0.00 0.00 57.16 56.88 1m9l n GLU 188 Cb 0.52 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.83 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 -1.05 0.55 0.03 3.49 5.12 -0.99 -4.20 116.66 119.62 1m9l n ARG 189 Ca 0.14 -0.46 0.00 0.00 -1.93 0.00 0.00 57.85 55.60 1m9l n ARG 189 Cb 0.08 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 29.89 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 -0.82 0.00 -0.11 5.56 2.13 -0.06 -4.49 120.64 122.85 1m9l n GLU 190 Ca 0.06 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 57.76 1m9l n GLU 190 Cb 0.39 -0.23 -0.03 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 0.73 0.00 5.31 -0.00 -0.99 0.15 115.11 120.30 1m9l h GLN 191 Ca 0.00 -0.34 -0.04 0.00 -0.00 0.00 0.00 58.65 58.27 1m9l h GLN 191 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 27.47 1m9l h GLN 191 CO 0.00 0.95 -0.20 0.00 0.00 0.00 0.00 178.83 179.58 1m9l h ALA 192 N 0.76 1.27 0.09 3.38 0.00 -1.74 -0.09 119.26 122.93 1m9l h ALA 192 Ca 0.07 -0.18 -0.30 0.00 0.00 0.00 0.00 54.91 54.49 1m9l h ALA 192 Cb 0.77 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1m9l h ALA 192 CO 0.06 0.25 -1.55 -0.91 0.00 0.00 0.00 179.25 177.10 1m9l h ASN 193 N 0.00 0.31 -0.34 0.00 -0.26 -1.65 -0.64 115.58 113.00 1m9l h ASN 193 Ca -0.00 -0.46 -0.13 0.00 -0.56 0.00 0.00 56.30 55.14 1m9l h ASN 193 Cb 0.49 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 37.64 1m9l h ASN 193 CO 0.03 1.39 -0.28 0.58 -1.06 0.00 0.00 177.43 178.09 1m9l h VAL 194 N 0.05 1.27 -0.09 2.81 2.07 -0.48 0.22 116.25 122.11 1m9l h VAL 194 Ca -0.25 -1.43 -0.10 0.00 0.82 0.00 0.00 66.70 65.75 1m9l h VAL 194 Cb 2.00 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1m9l h VAL 194 CO 0.14 0.48 -0.33 0.00 0.02 0.00 0.00 177.57 177.88 1m9l h ALA 195 N 0.95 0.16 -0.36 1.67 0.00 -1.09 -2.62 119.26 117.98 1m9l h ALA 195 Ca 0.09 -0.44 0.06 0.00 0.00 0.00 0.00 54.91 54.62 1m9l h ALA 195 Cb 0.83 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.54 1m9l h ALA 195 CO 0.07 0.22 -0.00 0.00 0.00 0.00 0.00 179.25 179.54 1m9l h ARG 196 N -0.07 0.09 0.00 0.00 2.47 -1.03 -3.44 114.38 112.41 1m9l h ARG 196 Ca -0.01 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1m9l h ARG 196 Cb 0.96 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 1m9l h ARG 196 CO 0.07 0.06 0.00 0.41 0.56 0.00 0.00 179.97 181.07 1m9l n GLY 197 N -1.26 0.00 0.61 0.04 0.00 -0.58 -5.07 105.19 98.94 1m9l n GLY 197 Ca 0.02 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.11 1m9l n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93