#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i9l n HIS 4 N 0.00 0.00 -1.12 1.57 -0.00 -1.26 -5.16 115.22 109.25 1i9l n HIS 4 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.42 1i9l n HIS 4 Cb 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 29.99 30.12 1i9l n HIS 4 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.34 178.01 1i9l s TRP 5 N -1.30 2.25 0.00 1.57 1.48 -1.26 -4.92 118.94 116.76 1i9l s TRP 5 Ca 0.00 1.41 0.00 0.00 -1.06 0.00 0.00 56.10 56.45 1i9l s TRP 5 Cb 0.00 -3.14 0.00 0.00 -1.16 0.00 0.00 33.47 29.17 1i9l s TRP 5 CO 0.00 -2.35 0.00 0.41 -4.06 0.00 0.00 176.95 170.95 1i9l n GLY 6 N -0.87 1.99 0.09 3.67 0.00 -0.55 -5.03 105.19 104.48 1i9l n GLY 6 Ca 0.08 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.46 1i9l n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1i9l n TYR 7 N 0.00 0.02 -2.25 1.61 4.01 -1.26 -3.59 117.16 115.70 1i9l n TYR 7 Ca 0.00 -0.97 -0.26 0.00 -0.16 0.00 0.00 57.90 56.51 1i9l n TYR 7 Cb 0.00 -0.15 0.11 0.00 -0.31 0.00 0.00 39.34 38.99 1i9l n TYR 7 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1i9l s GLY 8 N -2.77 1.74 0.28 2.72 0.00 -1.26 -4.73 107.32 103.30 1i9l s GLY 8 Ca 0.31 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.80 1i9l s GLY 8 CO 0.03 -0.69 1.87 1.70 0.00 0.00 0.00 173.10 176.01 1i9l h LYS 9 N -0.82 1.02 -0.01 2.90 1.63 -1.98 0.19 116.57 119.51 1i9l h LYS 9 Ca -0.42 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 1i9l h LYS 9 Cb 1.28 -0.23 0.00 0.00 -0.60 0.00 0.00 32.23 32.68 1i9l h LYS 9 CO 0.49 0.68 -0.24 0.72 -3.45 0.00 0.00 179.45 177.64 1i9l n HIS 10 N -4.55 0.00 -1.97 1.91 8.25 -1.26 -4.41 115.22 113.19 1i9l n HIS 10 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.63 1i9l n HIS 10 Cb 0.27 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.33 1i9l n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1i9l n ASN 11 N -0.15 0.00 -2.97 0.41 6.94 -1.13 -4.97 115.26 113.38 1i9l n ASN 11 Ca 0.13 -1.41 -0.14 0.00 -0.02 0.00 0.00 54.58 53.14 1i9l n ASN 11 Cb 0.40 -0.08 0.11 0.00 -2.36 0.00 0.00 39.78 37.85 1i9l n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1i9l n GLY 12 N 0.00 -2.01 0.33 4.83 0.00 0.04 -1.48 105.19 106.89 1i9l n GLY 12 Ca 0.00 -1.57 0.23 0.00 0.00 0.00 0.00 46.02 44.68 1i9l n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1i9l h PRO 13 N 0.00 0.11 0.00 1.61 0.11 -1.86 0.10 132.00 132.06 1i9l h PRO 13 Ca -0.20 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1i9l h PRO 13 Cb 0.59 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.68 1i9l h PRO 13 CO 0.14 0.07 0.00 1.05 -0.21 0.00 0.00 178.00 179.05 1i9l h GLU 14 N 0.11 0.00 0.00 1.05 9.09 -1.95 -2.63 114.58 120.25 1i9l h GLU 14 Ca 0.71 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.12 1i9l h GLU 14 Cb 1.68 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.78 1i9l h GLU 14 CO -0.75 0.00 -1.27 0.72 0.05 0.00 0.00 179.01 177.76 1i9l n HIS 15 N -2.45 0.00 -0.11 2.06 8.25 0.01 -4.62 115.22 118.36 1i9l n HIS 15 Ca -0.00 0.00 0.23 0.00 -0.26 0.00 0.00 57.72 57.68 1i9l n HIS 15 Cb 0.13 -0.18 0.66 0.00 1.12 0.00 0.00 29.99 31.72 1i9l n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 1i9l h TRP 16 N 0.00 0.11 0.00 4.41 6.55 -1.42 -2.02 115.95 123.59 1i9l h TRP 16 Ca 0.00 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.83 1i9l h TRP 16 Cb 0.60 -0.03 -0.00 0.00 -0.86 0.00 0.00 29.16 28.86 1i9l h TRP 16 CO 0.00 0.04 -0.05 1.12 -1.05 0.00 0.00 178.44 178.49 1i9l h HIS 17 N 0.09 0.00 -0.57 0.49 2.07 -1.78 -0.13 115.15 115.33 1i9l h HIS 17 Ca 0.35 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.83 1i9l h HIS 17 Cb 1.27 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.22 1i9l h HIS 17 CO -0.00 0.05 0.18 0.87 -3.07 0.00 0.00 177.93 175.96 1i9l h LYS 18 N 0.00 0.85 0.00 5.12 1.57 -1.71 -2.97 116.57 119.42 1i9l h LYS 18 Ca -0.00 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 1i9l h LYS 18 Cb 0.12 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 1i9l h LYS 18 CO 0.01 0.73 -1.87 -0.25 -0.57 0.00 0.00 179.45 177.50 1i9l n ASP 19 N -4.30 0.75 -3.72 0.86 8.00 -1.05 -4.76 116.55 112.34 1i9l n ASP 19 Ca 0.04 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.26 1i9l n ASP 19 Cb 0.20 1.79 -0.12 0.00 -0.02 0.00 0.00 41.12 42.97 1i9l n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1i9l s PHE 20 N -3.23 2.42 0.55 1.24 0.08 -0.09 -4.98 117.98 113.97 1i9l s PHE 20 Ca -0.07 -2.78 0.31 0.00 0.12 0.00 0.00 56.93 54.52 1i9l s PHE 20 Cb 0.11 -2.02 1.47 0.00 -0.57 0.00 0.00 43.02 42.01 1i9l s PHE 20 CO 0.77 -0.71 1.86 -1.35 -0.10 0.00 0.00 175.22 175.69 1i9l h PRO 21 N 6.01 0.00 0.00 0.24 0.11 -1.77 -1.24 132.00 135.35 1i9l h PRO 21 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1i9l h PRO 21 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1i9l h PRO 21 CO 0.55 0.00 0.00 1.51 -0.21 0.00 0.00 178.00 179.85 1i9l n ILE 22 N -4.08 1.09 0.05 4.15 3.06 -1.26 -2.73 119.36 119.65 1i9l n ILE 22 Ca 0.17 0.56 0.21 0.00 -2.50 0.00 0.00 62.75 61.19 1i9l n ILE 22 Cb 0.94 -1.53 0.73 0.00 0.54 0.00 0.00 39.64 40.31 1i9l n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1i9l h ALA 23 N 2.09 2.22 -0.51 1.51 0.00 -1.56 0.27 119.26 123.29 1i9l h ALA 23 Ca 0.00 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 1i9l h ALA 23 Cb 0.10 0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.84 1i9l h ALA 23 CO 0.00 -0.74 0.12 1.63 0.00 0.00 0.00 179.25 180.26 1i9l n LYS 24 N -3.75 2.99 -0.28 0.00 5.02 -1.10 -4.99 118.16 116.05 1i9l n LYS 24 Ca 0.09 -3.04 -0.08 0.00 -2.02 0.00 0.00 58.31 53.26 1i9l n LYS 24 Cb 0.69 -2.01 0.07 0.00 -0.02 0.00 0.00 35.03 33.76 1i9l n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1i9l n GLY 25 N -0.53 -2.61 0.08 0.72 0.00 0.96 -5.02 105.19 98.79 1i9l n GLY 25 Ca 0.34 -1.45 0.07 0.00 0.00 0.00 0.00 46.02 44.99 1i9l n GLY 25 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1i9l n GLU 26 N -2.47 0.63 -3.13 1.61 4.07 -1.26 -4.49 120.64 115.60 1i9l n GLU 26 Ca 0.04 0.04 -0.24 0.00 -0.06 0.00 0.00 57.16 56.94 1i9l n GLU 26 Cb 0.16 -1.71 -0.05 0.00 -0.06 0.00 0.00 31.44 29.78 1i9l n GLU 26 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 1i9l n ARG 27 N -2.60 2.18 -3.67 5.31 1.85 -1.26 -4.67 116.66 113.79 1i9l n ARG 27 Ca -0.06 -4.22 -0.32 0.00 -1.00 0.00 0.00 57.85 52.25 1i9l n ARG 27 Cb 0.66 -1.97 -0.05 0.00 -1.05 0.00 0.00 32.46 30.05 1i9l n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1i9l s GLN 28 N -2.71 3.62 0.28 2.89 -1.52 -1.26 -2.80 119.66 118.17 1i9l s GLN 28 Ca 0.43 -0.08 0.09 0.00 -1.95 0.00 0.00 55.36 53.85 1i9l s GLN 28 Cb 0.26 -2.85 -0.06 0.00 -0.22 0.00 0.00 33.01 30.14 1i9l s GLN 28 CO -0.09 0.47 -0.11 -1.12 -0.25 0.00 0.00 175.29 174.18 1i9l s SER 29 N -2.41 3.15 0.83 5.90 0.01 -1.26 -4.69 113.70 115.23 1i9l s SER 29 Ca 0.41 -1.13 -0.07 0.00 1.31 0.00 0.00 55.95 56.46 1i9l s SER 29 Cb -0.12 -0.24 0.16 0.00 0.21 0.00 0.00 66.02 66.03 1i9l s SER 29 CO 0.24 -0.20 1.14 -2.16 0.41 0.00 0.00 173.24 172.67 1i9l s PRO 30 N -3.64 1.20 0.18 12.44 0.04 -1.26 -4.62 135.00 139.35 1i9l s PRO 30 Ca 0.29 -0.85 0.00 0.00 0.04 0.00 0.00 61.00 60.48 1i9l s PRO 30 Cb 0.01 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1i9l s PRO 30 CO 0.13 -1.88 0.07 0.14 0.04 0.00 0.00 177.00 175.50 1i9l s VAL 31 N -3.46 0.29 -0.04 -0.36 -7.23 -1.26 0.80 120.40 109.12 1i9l s VAL 31 Ca 0.70 -1.97 -0.23 0.00 -1.81 0.00 0.00 61.98 58.67 1i9l s VAL 31 Cb -0.04 -2.29 -0.04 0.00 0.56 0.00 0.00 36.38 34.57 1i9l s VAL 31 CO 0.48 -0.26 0.70 -0.62 -0.31 0.00 0.00 175.10 175.09 1i9l s ASP 32 N -3.15 7.02 -0.46 4.85 2.15 -1.26 -3.23 116.67 122.59 1i9l s ASP 32 Ca 0.30 1.23 -0.19 0.00 0.43 0.00 0.00 52.55 54.33 1i9l s ASP 32 Cb 0.07 -2.42 0.04 0.00 -0.30 0.00 0.00 42.92 40.31 1i9l s ASP 32 CO 0.07 -0.08 0.55 -0.63 -0.17 0.00 0.00 175.17 174.91 1i9l s ILE 33 N 0.60 4.96 -0.59 4.11 1.01 0.67 -4.94 121.20 127.01 1i9l s ILE 33 Ca 0.37 -0.33 -0.23 0.00 0.00 0.00 0.00 60.65 60.47 1i9l s ILE 33 Cb -0.18 -4.17 0.06 0.00 0.01 0.00 0.00 42.46 38.17 1i9l s ILE 33 CO 0.19 -0.61 0.90 -0.62 0.00 0.00 0.00 174.94 174.80 1i9l s ASP 34 N 2.20 6.24 0.45 3.58 2.15 -1.26 0.14 116.67 130.17 1i9l s ASP 34 Ca 0.15 -0.75 0.20 0.00 0.43 0.00 0.00 52.55 52.58 1i9l s ASP 34 Cb -0.17 -2.40 1.17 0.00 -0.30 0.00 0.00 42.92 41.21 1i9l s ASP 34 CO 0.14 -1.27 1.90 0.71 -0.17 0.00 0.00 175.17 176.47 1i9l h THR 35 N 5.97 0.71 0.00 1.71 1.35 -1.95 -2.21 112.91 118.49 1i9l h THR 35 Ca -0.28 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1i9l h THR 35 Cb 1.08 0.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 1i9l h THR 35 CO 1.11 0.06 0.00 0.45 -0.25 0.00 0.00 175.52 176.89 1i9l h HIS 36 N 0.30 0.00 0.00 4.73 3.86 -2.03 -3.28 115.15 118.73 1i9l h HIS 36 Ca 0.40 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.61 1i9l h HIS 36 Cb 1.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.59 1i9l h HIS 36 CO -0.00 0.00 -1.18 2.41 0.86 0.00 0.00 177.93 180.02 1i9l n THR 37 N -2.49 0.00 -2.06 2.45 -1.04 -0.87 -4.98 114.28 105.29 1i9l n THR 37 Ca 0.05 -0.24 -0.39 0.00 -2.04 0.00 0.00 64.05 61.43 1i9l n THR 37 Cb 0.43 0.61 0.00 0.00 -1.82 0.00 0.00 70.33 69.56 1i9l n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1i9l s ALA 38 N -2.75 3.11 -0.24 2.41 0.00 -0.96 -4.84 121.76 118.48 1i9l s ALA 38 Ca 0.01 1.18 -0.12 0.00 0.00 0.00 0.00 51.96 53.02 1i9l s ALA 38 Cb 0.11 -3.47 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 1i9l s ALA 38 CO 0.65 -0.88 0.22 0.21 0.00 0.00 0.00 175.76 175.96 1i9l s LYS 39 N -2.47 4.06 -0.25 0.00 2.47 0.11 -4.83 119.74 118.84 1i9l s LYS 39 Ca 0.61 -0.18 -0.29 0.00 -1.56 0.00 0.00 55.97 54.55 1i9l s LYS 39 Cb -0.36 -3.57 -0.02 0.00 -1.46 0.00 0.00 37.83 32.42 1i9l s LYS 39 CO 0.45 -0.03 1.61 -0.47 0.16 0.00 0.00 175.35 177.07 1i9l s TYR 40 N 1.32 2.11 -0.51 4.03 5.04 -1.26 -0.41 117.35 127.68 1i9l s TYR 40 Ca 0.10 0.58 -0.04 0.00 -2.44 0.00 0.00 57.07 55.27 1i9l s TYR 40 Cb -0.14 -4.02 0.13 0.00 0.35 0.00 0.00 41.96 38.28 1i9l s TYR 40 CO 0.07 -2.81 0.32 0.34 -1.34 0.00 0.00 175.55 172.13 1i9l s ASP 41 N 4.39 5.35 0.00 4.32 -1.08 -0.81 -4.93 116.67 123.91 1i9l s ASP 41 Ca 0.71 -2.33 0.07 0.00 -0.52 0.00 0.00 52.55 50.48 1i9l s ASP 41 Cb -0.23 -1.87 0.38 0.00 -1.46 0.00 0.00 42.92 39.73 1i9l s ASP 41 CO 0.30 -0.50 0.96 -0.81 0.52 0.00 0.00 175.17 175.63 1i9l n PRO 42 N 4.22 0.16 0.00 4.34 -0.04 -1.26 -1.76 135.00 140.66 1i9l n PRO 42 Ca 0.01 0.10 0.12 0.00 -0.04 0.00 0.00 63.50 63.68 1i9l n PRO 42 Cb 0.40 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.56 1i9l n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1i9l n SER 43 N -1.12 0.98 -4.74 3.54 3.41 -1.26 -4.88 113.62 109.56 1i9l n SER 43 Ca 0.04 -0.77 -0.41 0.00 -0.26 0.00 0.00 58.87 57.46 1i9l n SER 43 Cb 0.04 0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 1i9l n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1i9l s LEU 44 N -2.75 4.41 0.49 1.04 1.43 -0.72 -5.02 118.68 117.55 1i9l s LEU 44 Ca 0.16 2.47 -0.02 0.00 -1.03 0.00 0.00 54.13 55.71 1i9l s LEU 44 Cb 0.18 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.78 1i9l s LEU 44 CO 0.64 -0.58 0.75 -0.54 0.23 0.00 0.00 176.35 176.85 1i9l s LYS 45 N -0.13 3.11 0.57 1.70 3.01 -1.20 -5.00 119.74 121.81 1i9l s LYS 45 Ca 0.58 -0.24 -0.18 0.00 -1.01 0.00 0.00 55.97 55.11 1i9l s LYS 45 Cb -0.38 -2.46 -0.05 0.00 -1.01 0.00 0.00 37.83 33.94 1i9l s LYS 45 CO 0.39 -0.36 1.12 -1.25 0.51 0.00 0.00 175.35 175.76 1i9l s PRO 46 N -4.69 3.26 0.45 -1.68 0.04 -1.26 -2.90 135.00 128.23 1i9l s PRO 46 Ca 0.49 1.53 -0.23 0.00 0.04 0.00 0.00 61.00 62.83 1i9l s PRO 46 Cb -0.10 -2.00 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 1i9l s PRO 46 CO 0.41 -0.91 1.19 -0.51 0.04 0.00 0.00 177.00 177.22 1i9l s LEU 47 N -4.04 4.04 -0.28 -3.56 1.43 -1.26 -1.59 118.68 113.42 1i9l s LEU 47 Ca 0.71 2.36 0.03 0.00 -1.03 0.00 0.00 54.13 56.20 1i9l s LEU 47 Cb -0.22 -4.19 0.07 0.00 0.03 0.00 0.00 46.19 41.87 1i9l s LEU 47 CO 0.30 -0.93 -0.05 -0.55 0.23 0.00 0.00 176.35 175.35 1i9l s SER 48 N -1.26 4.45 -0.27 2.29 0.15 0.11 -4.87 113.70 114.29 1i9l s SER 48 Ca 0.63 -1.59 -0.07 0.00 0.70 0.00 0.00 55.95 55.61 1i9l s SER 48 Cb -0.30 -1.50 -0.01 0.00 -1.71 0.00 0.00 66.02 62.50 1i9l s SER 48 CO 0.37 -0.26 0.07 -0.69 1.20 0.00 0.00 173.24 173.93 1i9l s VAL 49 N 1.10 4.16 -0.52 4.45 1.01 -1.26 -1.60 120.40 127.74 1i9l s VAL 49 Ca -0.02 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.60 1i9l s VAL 49 Cb -0.19 -3.02 0.14 0.00 0.00 0.00 0.00 36.38 33.30 1i9l s VAL 49 CO -0.07 0.23 0.30 -0.44 0.00 0.00 0.00 175.10 175.13 1i9l s SER 50 N 1.57 3.98 -0.05 3.32 0.01 -0.67 -4.91 113.70 116.95 1i9l s SER 50 Ca 0.05 -3.02 0.14 0.00 1.31 0.00 0.00 55.95 54.43 1i9l s SER 50 Cb -0.16 -1.34 0.43 0.00 0.21 0.00 0.00 66.02 65.17 1i9l s SER 50 CO 0.03 -0.22 1.36 -1.22 0.41 0.00 0.00 173.24 173.60 1i9l n TYR 51 N 3.06 0.73 0.30 2.43 4.01 -1.26 -0.97 117.16 125.46 1i9l n TYR 51 Ca 0.10 -0.60 0.17 0.00 -0.16 0.00 0.00 57.90 57.42 1i9l n TYR 51 Cb 0.34 -0.11 0.73 0.00 -0.31 0.00 0.00 39.34 39.99 1i9l n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1i9l h ASP 52 N 2.39 0.00 -0.19 7.72 2.03 -1.91 -2.87 116.42 123.59 1i9l h ASP 52 Ca 0.00 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.24 1i9l h ASP 52 Cb 1.00 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.46 1i9l h ASP 52 CO 0.08 0.00 -0.10 1.67 -1.03 0.00 0.00 179.24 179.85 1i9l n GLN 53 N -2.98 1.98 -2.01 4.15 -0.06 -1.19 -5.04 117.38 112.22 1i9l n GLN 53 Ca 0.00 -2.98 -0.42 0.00 -2.00 0.00 0.00 57.00 51.61 1i9l n GLN 53 Cb 0.26 -1.72 -0.03 0.00 -4.06 0.00 0.00 30.24 24.69 1i9l n GLN 53 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1i9l s ALA 54 N -3.05 3.71 -0.33 1.69 0.00 -1.09 -4.60 121.76 118.10 1i9l s ALA 54 Ca 0.40 1.29 0.04 0.00 0.00 0.00 0.00 51.96 53.68 1i9l s ALA 54 Cb 0.35 -3.59 0.10 0.00 0.00 0.00 0.00 23.12 19.98 1i9l s ALA 54 CO 0.02 -0.72 0.04 0.99 0.00 0.00 0.00 175.76 176.08 1i9l s THR 55 N 1.07 2.31 0.48 0.00 2.01 -1.26 -4.86 115.64 115.39 1i9l s THR 55 Ca 0.68 -2.25 -0.19 0.00 0.31 0.00 0.00 61.69 60.24 1i9l s THR 55 Cb -0.41 -2.66 -0.09 0.00 0.01 0.00 0.00 72.50 69.34 1i9l s THR 55 CO 0.31 -0.53 0.98 -0.94 -0.69 0.00 0.00 174.62 173.76 1i9l s SER 56 N 0.96 6.65 0.00 3.53 1.04 -1.26 -1.12 113.70 123.49 1i9l s SER 56 Ca 0.08 1.70 0.00 0.00 0.48 0.00 0.00 55.95 58.22 1i9l s SER 56 Cb -0.19 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.39 1i9l s SER 56 CO -0.07 -0.57 0.00 0.18 0.98 0.00 0.00 173.24 173.76 1i9l n LEU 57 N -1.10 0.83 -3.90 2.42 4.77 0.15 -4.05 117.00 116.13 1i9l n LEU 57 Ca 0.07 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.97 1i9l n LEU 57 Cb 0.54 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.55 1i9l n LEU 57 CO 0.41 0.03 -0.09 -0.60 -1.33 0.00 0.00 177.39 175.81 1i9l s ARG 58 N -1.82 0.91 -0.02 3.23 3.52 -1.23 -1.03 118.95 122.51 1i9l s ARG 58 Ca 0.00 -1.03 0.02 0.00 -0.13 0.00 0.00 55.73 54.59 1i9l s ARG 58 Cb 0.00 0.34 0.00 0.00 -1.56 0.00 0.00 34.95 33.74 1i9l s ARG 58 CO 0.00 -0.30 -0.08 -1.50 -0.81 0.00 0.00 175.30 172.61 1i9l s ILE 59 N -3.89 0.71 -0.01 4.11 2.07 -0.60 -0.65 121.20 122.94 1i9l s ILE 59 Ca 0.08 -0.32 -0.08 0.00 -1.41 0.00 0.00 60.65 58.92 1i9l s ILE 59 Cb 0.05 -0.64 0.01 0.00 0.13 0.00 0.00 42.46 42.01 1i9l s ILE 59 CO -0.08 0.23 0.17 -1.48 -1.91 0.00 0.00 174.94 171.86 1i9l s LEU 60 N 0.20 1.42 -0.39 8.50 2.34 -0.39 -0.95 118.68 129.42 1i9l s LEU 60 Ca -0.03 -0.12 -0.18 0.00 0.06 0.00 0.00 54.13 53.86 1i9l s LEU 60 Cb -0.08 0.77 0.01 0.00 -0.56 0.00 0.00 46.19 46.32 1i9l s LEU 60 CO 0.00 -0.36 0.49 0.21 -1.06 0.00 0.00 176.35 175.63 1i9l s ASN 61 N -1.27 6.26 -0.10 1.48 3.84 -0.18 -1.12 114.94 123.85 1i9l s ASN 61 Ca -0.13 -0.32 0.18 0.00 0.21 0.00 0.00 52.86 52.79 1i9l s ASN 61 Cb -0.07 -2.25 0.70 0.00 -0.55 0.00 0.00 41.25 39.08 1i9l s ASN 61 CO 0.02 -0.55 1.60 -0.46 -2.79 0.00 0.00 177.10 174.92 1i9l n ASN 62 N 5.74 4.58 0.00 -4.21 0.23 -0.84 -1.10 115.26 119.67 1i9l n ASN 62 Ca -0.06 -2.41 0.00 0.00 -0.53 0.00 0.00 54.58 51.59 1i9l n ASN 62 Cb 0.48 -0.57 0.00 0.00 -2.08 0.00 0.00 39.78 37.61 1i9l n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1i9l n GLY 63 N 1.15 1.86 0.00 4.83 0.00 -1.26 -4.74 105.19 107.03 1i9l n GLY 63 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1i9l n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1i9l n HIS 64 N -2.00 0.00 -3.83 1.61 8.25 -1.26 -4.75 115.22 113.24 1i9l n HIS 64 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1i9l n HIS 64 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1i9l n HIS 64 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1i9l n ALA 65 N -0.93 -1.04 -2.70 -1.41 0.00 -1.26 -4.87 120.51 108.30 1i9l n ALA 65 Ca 0.00 -0.26 -0.30 0.00 0.00 0.00 0.00 53.44 52.88 1i9l n ALA 65 Cb 0.06 0.07 -0.16 0.00 0.00 0.00 0.00 19.45 19.42 1i9l n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1i9l s PHE 66 N -3.18 2.27 -0.08 0.00 -0.71 -1.26 -1.98 117.98 113.03 1i9l s PHE 66 Ca 0.09 -0.63 0.01 0.00 -1.04 0.00 0.00 56.93 55.36 1i9l s PHE 66 Cb -0.00 -1.49 -0.02 0.00 -1.21 0.00 0.00 43.02 40.30 1i9l s PHE 66 CO 0.00 -0.18 -0.12 -0.80 -1.34 0.00 0.00 175.22 172.79 1i9l s ASN 67 N -0.20 4.22 -0.28 1.98 0.02 -0.27 -4.41 114.94 116.00 1i9l s ASN 67 Ca -0.01 -0.18 -0.10 0.00 -1.02 0.00 0.00 52.86 51.54 1i9l s ASN 67 Cb -0.13 -1.18 -0.03 0.00 0.02 0.00 0.00 41.25 39.93 1i9l s ASN 67 CO 0.03 0.29 0.15 -0.69 0.02 0.00 0.00 177.10 176.90 1i9l s VAL 68 N -0.40 4.88 0.16 1.60 1.01 -0.73 -1.26 120.40 125.67 1i9l s VAL 68 Ca 0.05 -0.08 -0.05 0.00 0.00 0.00 0.00 61.98 61.90 1i9l s VAL 68 Cb -0.12 -3.36 -0.06 0.00 0.00 0.00 0.00 36.38 32.84 1i9l s VAL 68 CO 0.02 0.22 0.41 -1.61 0.00 0.00 0.00 175.10 174.14 1i9l s GLU 69 N 1.69 3.65 0.15 2.72 2.02 0.18 -2.15 118.70 126.95 1i9l s GLU 69 Ca 0.06 -0.04 0.09 0.00 0.02 0.00 0.00 54.97 55.10 1i9l s GLU 69 Cb -0.16 -2.81 -0.04 0.00 0.10 0.00 0.00 34.13 31.22 1i9l s GLU 69 CO 0.08 0.44 -0.19 -0.06 0.02 0.00 0.00 175.26 175.54 1i9l s PHE 70 N -1.69 1.84 -0.49 1.61 0.40 -0.07 -0.67 117.98 118.91 1i9l s PHE 70 Ca 0.42 -0.45 -0.28 0.00 -0.60 0.00 0.00 56.93 56.02 1i9l s PHE 70 Cb -0.12 -0.94 0.01 0.00 0.51 0.00 0.00 43.02 42.48 1i9l s PHE 70 CO 0.24 0.31 1.39 0.34 0.70 0.00 0.00 175.22 178.20 1i9l s ASP 71 N -2.47 6.26 -0.35 1.36 -1.08 -0.28 -4.84 116.67 115.28 1i9l s ASP 71 Ca 0.14 0.53 0.07 0.00 -0.52 0.00 0.00 52.55 52.77 1i9l s ASP 71 Cb -0.07 -2.54 0.53 0.00 -1.46 0.00 0.00 42.92 39.37 1i9l s ASP 71 CO 0.06 -1.55 1.57 -0.90 0.52 0.00 0.00 175.17 174.87 1i9l n ASP 72 N 9.11 3.30 0.20 -0.34 5.75 -1.26 -4.56 116.55 128.73 1i9l n ASP 72 Ca 0.14 -3.77 0.13 0.00 -0.01 0.00 0.00 54.79 51.28 1i9l n ASP 72 Cb 0.49 -0.67 0.29 0.00 -1.03 0.00 0.00 41.12 40.19 1i9l n ASP 72 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1i9l h SER 73 N 1.18 0.00 -5.35 -1.12 4.64 -1.96 -3.46 113.55 107.49 1i9l h SER 73 Ca 0.34 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.51 1i9l h SER 73 Cb 1.79 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.73 1i9l h SER 73 CO 0.64 0.00 -0.55 -1.10 -0.87 0.00 0.00 176.83 174.95 1i9l s GLN 74 N -3.24 0.93 -0.96 4.77 -0.21 -1.26 -5.05 119.66 114.64 1i9l s GLN 74 Ca 0.07 -1.32 -0.08 0.00 0.02 0.00 0.00 55.36 54.06 1i9l s GLN 74 Cb 0.07 0.28 -0.06 0.00 1.00 0.00 0.00 33.01 34.30 1i9l s GLN 74 CO 0.63 -0.28 2.15 -0.25 -2.12 0.00 0.00 175.29 175.42 1i9l n ASP 75 N -0.09 4.97 0.10 5.90 8.00 -1.26 -4.50 116.55 129.66 1i9l n ASP 75 Ca -0.08 -2.38 -0.22 0.00 0.71 0.00 0.00 54.79 52.82 1i9l n ASP 75 Cb 0.63 -1.14 -0.15 0.00 -0.02 0.00 0.00 41.12 40.45 1i9l n ASP 75 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1i9l h LYS 76 N 6.36 0.47 -3.45 -1.24 1.57 -1.87 -3.43 116.57 114.97 1i9l h LYS 76 Ca 0.52 -0.74 -0.52 0.00 -1.87 0.00 0.00 60.65 58.03 1i9l h LYS 76 Cb 0.22 0.27 -0.40 0.00 0.08 0.00 0.00 32.23 32.40 1i9l h LYS 76 CO 1.52 1.34 -0.76 0.00 -0.57 0.00 0.00 179.45 180.98 1i9l s ALA 77 N -2.66 1.02 0.33 3.86 0.00 -1.26 -3.16 121.76 119.89 1i9l s ALA 77 Ca -0.11 -0.86 0.09 0.00 0.00 0.00 0.00 51.96 51.09 1i9l s ALA 77 Cb 0.03 -1.26 -0.06 0.00 0.00 0.00 0.00 23.12 21.83 1i9l s ALA 77 CO 0.90 -1.29 -0.09 0.14 0.00 0.00 0.00 175.76 175.41 1i9l s VAL 78 N 1.86 2.17 -0.08 0.00 -7.23 -0.14 -1.74 120.40 115.23 1i9l s VAL 78 Ca 0.02 -2.20 0.01 0.00 -1.81 0.00 0.00 61.98 58.00 1i9l s VAL 78 Cb -0.17 -2.61 0.02 0.00 0.56 0.00 0.00 36.38 34.17 1i9l s VAL 78 CO -0.13 -0.22 -0.11 -0.22 -0.31 0.00 0.00 175.10 174.12 1i9l s LEU 79 N -3.59 1.48 0.31 1.32 2.96 -0.22 -1.67 118.68 119.27 1i9l s LEU 79 Ca 0.32 -0.30 0.05 0.00 -0.22 0.00 0.00 54.13 53.98 1i9l s LEU 79 Cb 0.02 -0.83 -0.03 0.00 0.50 0.00 0.00 46.19 45.85 1i9l s LEU 79 CO 0.16 -0.02 0.27 -0.54 -1.32 0.00 0.00 176.35 174.90 1i9l s LYS 80 N 1.05 1.66 2.37 1.98 1.02 -0.63 -2.50 119.74 124.70 1i9l s LYS 80 Ca -0.07 -1.91 0.00 0.00 0.02 0.00 0.00 55.97 54.00 1i9l s LYS 80 Cb -0.15 0.33 0.00 0.00 -0.52 0.00 0.00 37.83 37.49 1i9l s LYS 80 CO -0.01 -0.61 0.00 0.41 -0.92 0.00 0.00 175.35 174.22 1i9l n GLY 81 N -0.55 -0.68 7.00 -3.33 0.00 -1.26 -0.71 105.19 105.66 1i9l n GLY 81 Ca 0.06 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.93 1i9l n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i9l n GLY 82 N 0.00 3.43 0.57 -0.02 0.00 -0.62 -1.75 105.19 106.80 1i9l n GLY 82 Ca 0.00 -0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.02 1i9l n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1i9l n PRO 83 N 13.90 1.79 -2.86 1.61 -0.04 -1.26 -3.21 135.00 144.92 1i9l n PRO 83 Ca 0.00 -1.15 -0.32 0.00 -0.04 0.00 0.00 63.50 61.99 1i9l n PRO 83 Cb 0.00 -1.48 -0.05 0.00 -0.04 0.00 0.00 33.50 31.93 1i9l n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1i9l s LEU 84 N -2.01 3.90 -0.30 1.53 1.43 -0.72 -5.07 118.68 117.44 1i9l s LEU 84 Ca 0.36 1.38 0.02 0.00 -1.03 0.00 0.00 54.13 54.86 1i9l s LEU 84 Cb 0.21 -4.24 0.09 0.00 0.03 0.00 0.00 46.19 42.27 1i9l s LEU 84 CO 0.33 -0.36 0.02 -0.62 0.23 0.00 0.00 176.35 175.95 1i9l s ASP 85 N -2.62 4.32 0.00 2.29 -1.08 -1.26 -4.42 116.67 113.89 1i9l s ASP 85 Ca 0.56 -1.71 0.00 0.00 -0.52 0.00 0.00 52.55 50.88 1i9l s ASP 85 Cb -0.10 -1.32 0.00 0.00 -1.46 0.00 0.00 42.92 40.05 1i9l s ASP 85 CO 0.23 -0.33 0.00 0.61 0.52 0.00 0.00 175.17 176.19 1i9l n GLY 86 N 4.52 -1.04 3.60 2.66 0.00 -1.26 -5.00 105.19 108.67 1i9l n GLY 86 Ca -0.03 -2.13 -0.34 0.00 0.00 0.00 0.00 46.02 43.51 1i9l n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i9l s THR 87 N 0.00 4.04 -0.12 2.61 2.01 -1.26 -4.68 115.64 118.24 1i9l s THR 87 Ca 0.00 -0.34 0.03 0.00 0.31 0.00 0.00 61.69 61.69 1i9l s THR 87 Cb 0.00 -2.71 0.01 0.00 0.01 0.00 0.00 72.50 69.81 1i9l s THR 87 CO 0.00 0.57 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.99 1i9l s TYR 88 N -0.48 2.37 -0.07 4.92 1.51 -1.04 -1.12 117.35 123.44 1i9l s TYR 88 Ca 0.08 -1.10 -0.16 0.00 -1.01 0.00 0.00 57.07 54.87 1i9l s TYR 88 Cb -0.12 -1.63 -0.05 0.00 -0.11 0.00 0.00 41.96 40.05 1i9l s TYR 88 CO 0.02 -0.50 0.42 1.03 -1.11 0.00 0.00 175.55 175.40 1i9l s ARG 89 N 0.73 4.14 0.06 -0.62 0.52 -0.52 -1.06 118.95 122.21 1i9l s ARG 89 Ca -0.10 0.38 -0.31 0.00 -0.52 0.00 0.00 55.73 55.18 1i9l s ARG 89 Cb -0.16 -3.34 -0.06 0.00 0.52 0.00 0.00 34.95 31.92 1i9l s ARG 89 CO 0.01 0.41 1.22 -1.17 0.02 0.00 0.00 175.30 175.80 1i9l s LEU 90 N -0.18 4.37 -0.06 2.53 2.96 -0.71 -1.50 118.68 126.09 1i9l s LEU 90 Ca 0.23 2.04 0.02 0.00 -0.22 0.00 0.00 54.13 56.21 1i9l s LEU 90 Cb -0.15 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 42.90 1i9l s LEU 90 CO 0.11 -0.49 -0.03 0.00 -1.32 0.00 0.00 176.35 174.61 1i9l n ILE 91 N 3.95 0.38 -3.53 6.68 3.06 -0.07 -4.58 119.36 125.25 1i9l n ILE 91 Ca 0.09 -0.18 -0.07 0.00 -2.50 0.00 0.00 62.75 60.09 1i9l n ILE 91 Cb 0.46 -0.79 -0.02 0.00 0.54 0.00 0.00 39.64 39.83 1i9l n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1i9l s GLN 92 N -2.13 0.72 0.05 9.51 1.03 -1.22 -0.89 119.66 126.74 1i9l s GLN 92 Ca -0.06 -0.27 0.03 0.00 0.04 0.00 0.00 55.36 55.09 1i9l s GLN 92 Cb 0.02 0.33 -0.03 0.00 0.03 0.00 0.00 33.01 33.36 1i9l s GLN 92 CO 0.18 -0.32 -0.09 -0.59 -2.54 0.00 0.00 175.29 171.93 1i9l s PHE 93 N -2.98 0.80 0.24 9.60 -0.12 -0.91 -0.73 117.98 123.88 1i9l s PHE 93 Ca 0.06 -0.54 -0.13 0.00 -0.05 0.00 0.00 56.93 56.28 1i9l s PHE 93 Cb -0.01 -0.47 -0.00 0.00 -0.63 0.00 0.00 43.02 41.91 1i9l s PHE 93 CO -0.08 -0.06 0.48 -3.38 -0.05 0.00 0.00 175.22 172.13 1i9l s HIS 94 N -1.61 0.33 0.29 3.49 -3.43 -0.84 -1.76 115.29 111.76 1i9l s HIS 94 Ca -0.06 -0.70 0.09 0.00 -0.80 0.00 0.00 55.06 53.59 1i9l s HIS 94 Cb -0.08 0.20 -0.06 0.00 -1.43 0.00 0.00 32.58 31.21 1i9l s HIS 94 CO 0.00 -0.99 -0.10 -0.06 -2.00 0.00 0.00 174.74 171.59 1i9l s PHE 95 N -4.01 2.13 -0.02 0.38 0.40 -1.26 -0.57 117.98 115.03 1i9l s PHE 95 Ca 0.22 -0.56 0.02 0.00 -0.60 0.00 0.00 56.93 56.01 1i9l s PHE 95 Cb -0.01 -1.15 0.00 0.00 0.51 0.00 0.00 43.02 42.38 1i9l s PHE 95 CO 0.08 0.46 -0.09 -1.01 0.70 0.00 0.00 175.22 175.37 1i9l s HIS 96 N -2.79 0.91 0.28 0.36 3.76 -0.67 -4.79 115.29 112.35 1i9l s HIS 96 Ca 0.30 -0.22 -0.11 0.00 -0.15 0.00 0.00 55.06 54.88 1i9l s HIS 96 Cb 0.01 -0.64 0.00 0.00 1.11 0.00 0.00 32.58 33.06 1i9l s HIS 96 CO 0.13 -0.09 0.51 1.67 -0.85 0.00 0.00 174.74 176.11 1i9l s TRP 97 N 0.14 0.46 0.50 1.40 -2.14 -1.20 -1.20 118.94 116.89 1i9l s TRP 97 Ca -0.02 -0.82 0.04 0.00 2.66 0.00 0.00 56.10 57.95 1i9l s TRP 97 Cb -0.08 0.20 -0.00 0.00 -3.10 0.00 0.00 33.47 30.49 1i9l s TRP 97 CO 0.00 -1.07 0.18 0.20 -2.66 0.00 0.00 176.95 173.60 1i9l s GLY 98 N -3.06 2.66 0.00 3.67 0.00 -1.21 -0.83 107.32 108.55 1i9l s GLY 98 Ca 0.23 -1.07 0.28 0.00 0.00 0.00 0.00 44.72 44.17 1i9l s GLY 98 CO 0.11 -2.05 1.82 -1.14 0.00 0.00 0.00 173.10 171.84 1i9l n SER 99 N -1.43 0.45 -3.81 1.64 3.41 -1.26 -4.44 113.62 108.18 1i9l n SER 99 Ca -0.09 -0.47 -0.11 0.00 -0.26 0.00 0.00 58.87 57.94 1i9l n SER 99 Cb 0.66 -0.08 -0.08 0.00 -0.26 0.00 0.00 64.21 64.45 1i9l n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1i9l s LEU 100 N -2.56 1.20 0.55 1.04 1.43 -1.26 -5.07 118.68 114.00 1i9l s LEU 100 Ca 0.26 -0.29 0.31 0.00 -1.03 0.00 0.00 54.13 53.37 1i9l s LEU 100 Cb 0.20 1.09 1.61 0.00 0.03 0.00 0.00 46.19 49.12 1i9l s LEU 100 CO 0.50 -0.57 2.12 0.44 0.23 0.00 0.00 176.35 179.07 1i9l h ASP 101 N 3.41 0.00 -0.11 2.29 3.32 -1.91 -2.81 116.42 120.61 1i9l h ASP 101 Ca -0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.73 1i9l h ASP 101 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1i9l h ASP 101 CO 0.47 0.08 0.00 0.61 -1.72 0.00 0.00 179.24 178.68 1i9l n GLY 102 N -0.71 -0.35 3.35 2.75 0.00 -1.26 -3.15 105.19 105.82 1i9l n GLY 102 Ca -0.02 -0.12 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 1i9l n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1i9l s GLN 103 N -1.82 1.06 0.00 1.61 -2.07 -1.06 -4.71 119.66 112.67 1i9l s GLN 103 Ca 0.08 -0.51 0.00 0.00 -1.82 0.00 0.00 55.36 53.11 1i9l s GLN 103 Cb 0.04 0.47 0.00 0.00 -1.09 0.00 0.00 33.01 32.43 1i9l s GLN 103 CO 0.05 -0.41 0.00 0.41 -1.32 0.00 0.00 175.29 174.02 1i9l n GLY 104 N 0.04 2.75 3.84 2.60 0.00 -0.99 -3.48 105.19 109.95 1i9l n GLY 104 Ca -0.17 -0.34 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 1i9l n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i9l s SER 105 N 0.00 5.61 -0.23 1.61 1.04 -0.75 -3.28 113.70 117.71 1i9l s SER 105 Ca 0.00 1.46 -0.17 0.00 0.48 0.00 0.00 55.95 57.73 1i9l s SER 105 Cb 0.00 -2.38 -0.13 0.00 0.10 0.00 0.00 66.02 63.60 1i9l s SER 105 CO 0.00 -1.27 -0.12 -0.62 0.98 0.00 0.00 173.24 172.20 1i9l n GLU 106 N -3.01 0.56 -2.72 4.02 1.02 -1.26 -4.86 120.64 114.39 1i9l n GLU 106 Ca 0.07 0.40 -0.33 0.00 -0.02 0.00 0.00 57.16 57.28 1i9l n GLU 106 Cb 0.54 -1.60 -0.06 0.00 -0.02 0.00 0.00 31.44 30.31 1i9l n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1i9l s HIS 107 N -2.47 3.37 0.15 -0.32 3.76 -1.26 -4.36 115.29 114.16 1i9l s HIS 107 Ca -0.32 1.50 0.08 0.00 -0.15 0.00 0.00 55.06 56.16 1i9l s HIS 107 Cb 0.09 -2.78 -0.04 0.00 1.11 0.00 0.00 32.58 30.96 1i9l s HIS 107 CO 0.50 -0.17 -0.17 0.95 -0.85 0.00 0.00 174.74 175.00 1i9l s THR 108 N -2.31 1.68 -0.26 1.30 -4.23 -1.20 -4.74 115.64 105.89 1i9l s THR 108 Ca 0.60 -1.88 0.01 0.00 -1.18 0.00 0.00 61.69 59.24 1i9l s THR 108 Cb -0.09 -1.77 0.05 0.00 1.34 0.00 0.00 72.50 72.02 1i9l s THR 108 CO 0.20 -0.36 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.14 1i9l s VAL 109 N -2.12 2.38 -1.44 2.29 1.01 -0.86 -0.24 120.40 121.43 1i9l s VAL 109 Ca 0.14 -1.46 -0.10 0.00 0.00 0.00 0.00 61.98 60.56 1i9l s VAL 109 Cb -0.05 -2.34 0.05 0.00 0.00 0.00 0.00 36.38 34.04 1i9l s VAL 109 CO 0.06 0.04 1.01 0.47 0.00 0.00 0.00 175.10 176.67 1i9l n ASP 110 N 4.51 -4.66 0.00 3.32 8.00 0.12 -1.13 116.55 126.71 1i9l n ASP 110 Ca -0.15 -0.71 0.00 0.00 0.71 0.00 0.00 54.79 54.64 1i9l n ASP 110 Cb 0.44 -4.29 0.00 0.00 -0.02 0.00 0.00 41.12 37.24 1i9l n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1i9l n LYS 111 N -4.70 0.00 -2.75 -1.24 4.76 -1.26 -5.01 118.16 107.96 1i9l n LYS 111 Ca -0.03 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.00 1i9l n LYS 111 Cb 0.56 -3.11 -0.03 0.00 -1.84 0.00 0.00 35.03 30.61 1i9l n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1i9l s LYS 112 N -0.30 4.57 0.02 1.97 2.20 -0.28 -5.00 119.74 122.91 1i9l s LYS 112 Ca 0.00 1.37 -0.00 0.00 -0.36 0.00 0.00 55.97 56.98 1i9l s LYS 112 Cb 0.00 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.84 1i9l s LYS 112 CO 0.00 0.01 0.14 0.15 -0.36 0.00 0.00 175.35 175.29 1i9l s LYS 113 N 0.79 3.22 0.43 4.03 1.02 -1.26 -2.02 119.74 125.95 1i9l s LYS 113 Ca 0.50 -0.46 0.07 0.00 0.02 0.00 0.00 55.97 56.10 1i9l s LYS 113 Cb -0.21 -2.94 -0.02 0.00 -0.52 0.00 0.00 37.83 34.14 1i9l s LYS 113 CO 0.27 0.64 0.35 0.71 -0.92 0.00 0.00 175.35 176.40 1i9l s TYR 114 N -1.32 2.57 0.43 3.18 2.02 -1.26 -4.72 117.35 118.24 1i9l s TYR 114 Ca 0.27 -0.55 0.14 0.00 -0.37 0.00 0.00 57.07 56.57 1i9l s TYR 114 Cb -0.12 -2.11 0.93 0.00 -0.40 0.00 0.00 41.96 40.26 1i9l s TYR 114 CO 0.19 -0.12 1.95 0.00 -1.57 0.00 0.00 175.55 176.01 1i9l h ALA 115 N 1.06 1.62 -2.54 3.71 0.00 -1.36 -1.90 119.26 119.85 1i9l h ALA 115 Ca -0.41 -0.21 0.14 0.00 0.00 0.00 0.00 54.91 54.43 1i9l h ALA 115 Cb 1.27 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.96 1i9l h ALA 115 CO 0.59 0.28 0.43 0.00 0.00 0.00 0.00 179.25 180.56 1i9l s ALA 116 N -4.53 -1.49 -0.01 0.00 0.00 -1.13 -3.32 121.76 111.27 1i9l s ALA 116 Ca -0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 51.96 51.84 1i9l s ALA 116 Cb 0.15 0.70 0.01 0.00 0.00 0.00 0.00 23.12 23.99 1i9l s ALA 116 CO 0.70 -1.04 0.01 -2.00 0.00 0.00 0.00 175.76 173.44 1i9l s GLU 117 N -3.23 -0.02 -0.15 0.00 2.12 -0.34 -1.11 118.70 115.97 1i9l s GLU 117 Ca 0.13 0.09 -0.08 0.00 0.36 0.00 0.00 54.97 55.47 1i9l s GLU 117 Cb -0.03 -0.12 -0.04 0.00 0.26 0.00 0.00 34.13 34.20 1i9l s GLU 117 CO 0.04 -0.08 0.14 -1.17 -0.54 0.00 0.00 175.26 173.65 1i9l s LEU 118 N 0.50 4.31 -0.22 2.70 2.96 0.62 -1.67 118.68 127.88 1i9l s LEU 118 Ca -0.04 0.37 0.02 0.00 -0.22 0.00 0.00 54.13 54.26 1i9l s LEU 118 Cb -0.06 -2.08 0.05 0.00 0.50 0.00 0.00 46.19 44.59 1i9l s LEU 118 CO -0.01 0.31 -0.11 -1.00 -1.32 0.00 0.00 176.35 174.21 1i9l s HIS 119 N -0.42 2.75 -0.37 5.38 3.76 0.26 -1.39 115.29 125.25 1i9l s HIS 119 Ca 0.12 -1.87 -0.13 0.00 -0.15 0.00 0.00 55.06 53.03 1i9l s HIS 119 Cb -0.12 -1.77 0.01 0.00 1.11 0.00 0.00 32.58 31.81 1i9l s HIS 119 CO 0.02 -0.80 0.25 -0.51 -0.85 0.00 0.00 174.74 172.84 1i9l s LEU 120 N 1.28 4.76 -0.19 0.89 1.43 -0.76 -1.99 118.68 124.11 1i9l s LEU 120 Ca -0.04 -0.77 -0.17 0.00 -1.03 0.00 0.00 54.13 52.12 1i9l s LEU 120 Cb -0.17 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 1i9l s LEU 120 CO -0.08 -0.36 0.47 -0.69 0.23 0.00 0.00 176.35 175.93 1i9l s VAL 121 N 1.65 5.15 0.12 -1.59 1.01 0.09 -1.16 120.40 125.67 1i9l s VAL 121 Ca 0.04 0.87 0.07 0.00 0.00 0.00 0.00 61.98 62.96 1i9l s VAL 121 Cb -0.18 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 1i9l s VAL 121 CO 0.09 0.23 -0.17 -1.00 0.00 0.00 0.00 175.10 174.25 1i9l s HIS 122 N 1.35 1.58 0.07 5.22 3.76 -0.29 -0.89 115.29 126.09 1i9l s HIS 122 Ca 0.23 -0.48 0.07 0.00 -0.15 0.00 0.00 55.06 54.72 1i9l s HIS 122 Cb -0.15 -0.84 -0.03 0.00 1.11 0.00 0.00 32.58 32.67 1i9l s HIS 122 CO 0.09 0.19 -0.18 1.67 -0.85 0.00 0.00 174.74 175.66 1i9l s TRP 123 N -1.67 1.55 -0.31 1.40 1.48 -0.56 -1.25 118.94 119.57 1i9l s TRP 123 Ca 0.08 -0.40 -0.29 0.00 -1.06 0.00 0.00 56.10 54.43 1i9l s TRP 123 Cb -0.07 -0.88 -0.02 0.00 -1.16 0.00 0.00 33.47 31.34 1i9l s TRP 123 CO 0.04 0.11 1.71 1.21 -4.06 0.00 0.00 176.95 175.96 1i9l s ASN 124 N -1.55 6.06 0.57 -2.66 3.84 0.44 -1.43 114.94 120.21 1i9l s ASN 124 Ca 0.04 1.32 0.28 0.00 0.21 0.00 0.00 52.86 54.71 1i9l s ASN 124 Cb -0.09 -2.53 1.49 0.00 -0.55 0.00 0.00 41.25 39.57 1i9l s ASN 124 CO 0.03 -1.57 1.95 0.71 -2.79 0.00 0.00 177.10 175.42 1i9l h THR 125 N 6.62 0.47 -0.12 -5.21 1.35 -1.47 -1.12 112.91 113.42 1i9l h THR 125 Ca -0.33 0.00 0.04 0.00 -0.55 0.00 0.00 66.41 65.57 1i9l h THR 125 Cb 1.16 0.67 -0.00 0.00 -1.73 0.00 0.00 68.15 68.24 1i9l h THR 125 CO 1.03 0.00 0.11 0.50 -0.25 0.00 0.00 175.52 176.91 1i9l h LYS 127 N 0.00 0.00 -0.00 4.72 3.64 -1.91 -2.38 116.57 120.64 1i9l h LYS 127 Ca 0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1i9l h LYS 127 Cb 1.08 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1i9l h LYS 127 CO -0.00 0.00 -0.12 0.66 -2.27 0.00 0.00 179.45 177.72 1i9l n TYR 128 N -4.10 0.00 0.00 1.91 4.01 -0.43 -4.98 117.16 113.58 1i9l n TYR 128 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1i9l n TYR 128 Cb 0.23 -0.28 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 1i9l n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i9l n GLY 129 N 1.36 1.85 3.28 2.72 0.00 -0.90 -4.63 105.19 108.87 1i9l n GLY 129 Ca 0.11 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 1i9l n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1i9l s ASP 130 N 0.00 -0.11 0.35 1.61 1.47 -1.26 -5.06 116.67 113.67 1i9l s ASP 130 Ca 0.00 -0.43 0.08 0.00 1.18 0.00 0.00 52.55 53.38 1i9l s ASP 130 Cb 0.00 0.42 0.79 0.00 -0.34 0.00 0.00 42.92 43.79 1i9l s ASP 130 CO 0.00 -0.80 1.88 0.58 0.68 0.00 0.00 175.17 177.50 1i9l h VAL 131 N 2.52 0.86 -0.75 2.11 2.07 -1.95 -1.40 116.25 119.71 1i9l h VAL 131 Ca -0.34 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 66.94 1i9l h VAL 131 Cb 1.23 0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1i9l h VAL 131 CO 0.50 0.13 0.50 1.23 0.02 0.00 0.00 177.57 179.95 1i9l h GLY 132 N 0.72 1.06 1.12 2.17 0.00 -1.97 -2.05 103.07 104.12 1i9l h GLY 132 Ca 0.44 -0.39 -0.23 0.00 0.00 0.00 0.00 47.33 47.14 1i9l h GLY 132 CO -0.20 0.38 -0.89 0.50 0.00 0.00 0.00 176.54 176.32 1i9l h LYS 133 N 1.01 0.67 -0.83 4.80 1.79 -1.56 -3.26 116.57 119.19 1i9l h LYS 133 Ca 0.28 -0.67 0.14 0.00 -2.18 0.00 0.00 60.65 58.21 1i9l h LYS 133 Cb -0.10 0.18 -0.06 0.00 -1.58 0.00 0.00 32.23 30.67 1i9l h LYS 133 CO -0.06 1.27 0.54 0.00 -1.08 0.00 0.00 179.45 180.12 1i9l h ALA 134 N 0.42 1.92 0.00 3.86 0.00 -0.89 -0.70 119.26 123.86 1i9l h ALA 134 Ca -0.10 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1i9l h ALA 134 Cb 1.55 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1i9l h ALA 134 CO 0.18 -0.13 0.00 1.33 0.00 0.00 0.00 179.25 180.63 1i9l n VAL 135 N -4.53 0.00 -0.19 0.00 0.24 -0.81 -2.09 118.33 110.96 1i9l n VAL 135 Ca 0.16 0.00 0.04 0.00 -2.04 0.00 0.00 64.34 62.50 1i9l n VAL 135 Cb 0.47 -0.32 0.12 0.00 -1.47 0.00 0.00 33.84 32.64 1i9l n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1i9l n GLN 136 N -0.66 2.88 -4.44 7.34 6.02 -0.27 -4.95 117.38 123.31 1i9l n GLN 136 Ca 0.05 -1.96 -0.24 0.00 -0.01 0.00 0.00 57.00 54.84 1i9l n GLN 136 Cb 0.02 -1.23 -0.13 0.00 1.02 0.00 0.00 30.24 29.92 1i9l n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1i9l s GLN 137 N -1.13 1.22 0.43 -1.09 -1.52 -0.89 -5.05 119.66 111.64 1i9l s GLN 137 Ca 0.18 -1.05 0.17 0.00 -1.95 0.00 0.00 55.36 52.71 1i9l s GLN 137 Cb 0.10 -1.41 0.99 0.00 -0.22 0.00 0.00 33.01 32.47 1i9l s GLN 137 CO 0.11 0.34 1.94 -1.35 -0.25 0.00 0.00 175.29 176.08 1i9l h PRO 138 N 4.45 0.00 -0.26 2.91 0.11 -1.86 -2.53 132.00 134.82 1i9l h PRO 138 Ca -0.44 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.49 1i9l h PRO 138 Cb 1.17 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.16 1i9l h PRO 138 CO 0.42 0.25 -0.44 -0.40 -0.21 0.00 0.00 178.00 177.61 1i9l n ASP 139 N -4.03 2.69 0.04 -2.05 5.75 -1.26 -4.22 116.55 113.47 1i9l n ASP 139 Ca -0.02 -3.85 -0.09 0.00 -0.01 0.00 0.00 54.79 50.82 1i9l n ASP 139 Cb 0.32 -0.53 0.04 0.00 -1.03 0.00 0.00 41.12 39.92 1i9l n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1i9l h GLY 140 N 1.27 0.48 -2.35 6.12 0.00 -1.19 -3.43 103.07 103.98 1i9l h GLY 140 Ca 0.14 -0.64 -0.52 0.00 0.00 0.00 0.00 47.33 46.31 1i9l h GLY 140 CO 0.29 0.57 -0.73 1.08 0.00 0.00 0.00 176.54 177.75 1i9l s LEU 141 N -8.07 2.57 -0.13 3.11 1.43 -0.14 -0.42 118.68 117.03 1i9l s LEU 141 Ca -0.06 -1.06 -0.04 0.00 -1.03 0.00 0.00 54.13 51.94 1i9l s LEU 141 Cb 0.11 -0.83 0.06 0.00 0.03 0.00 0.00 46.19 45.56 1i9l s LEU 141 CO 0.84 -0.13 0.22 0.00 0.23 0.00 0.00 176.35 177.51 1i9l s ALA 142 N -2.80 -0.35 -0.13 4.21 0.00 -0.38 -1.56 121.76 120.75 1i9l s ALA 142 Ca 0.27 0.65 -0.01 0.00 0.00 0.00 0.00 51.96 52.87 1i9l s ALA 142 Cb -0.01 -1.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.07 1i9l s ALA 142 CO 0.11 -0.73 -0.08 0.08 0.00 0.00 0.00 175.76 175.13 1i9l s VAL 143 N 2.36 3.50 -0.40 0.00 1.01 -1.14 -1.14 120.40 124.60 1i9l s VAL 143 Ca 0.03 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.35 1i9l s VAL 143 Cb -0.13 -2.49 0.01 0.00 0.00 0.00 0.00 36.38 33.77 1i9l s VAL 143 CO -0.08 0.52 0.35 -0.22 0.00 0.00 0.00 175.10 175.67 1i9l s LEU 144 N 0.16 4.90 -0.12 3.92 2.96 -0.30 -2.35 118.68 127.85 1i9l s LEU 144 Ca -0.04 -0.71 -0.13 0.00 -0.22 0.00 0.00 54.13 53.03 1i9l s LEU 144 Cb -0.14 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.25 1i9l s LEU 144 CO 0.04 -0.46 0.30 -0.83 -1.32 0.00 0.00 176.35 174.08 1i9l s GLY 145 N 1.73 2.27 -0.06 7.98 0.00 -0.14 -1.82 107.32 117.29 1i9l s GLY 145 Ca 0.08 -0.42 0.01 0.00 0.00 0.00 0.00 44.72 44.39 1i9l s GLY 145 CO 0.11 0.26 -0.07 -0.42 0.00 0.00 0.00 173.10 172.98 1i9l s ILE 146 N -0.10 0.74 0.32 0.90 1.01 -0.49 -1.43 121.20 122.15 1i9l s ILE 146 Ca 0.18 -0.23 -0.21 0.00 0.00 0.00 0.00 60.65 60.39 1i9l s ILE 146 Cb -0.14 -0.73 -0.10 0.00 0.01 0.00 0.00 42.46 41.51 1i9l s ILE 146 CO 0.06 0.27 0.85 -0.36 0.00 0.00 0.00 174.94 175.76 1i9l s PHE 147 N 0.93 3.54 -0.12 3.97 0.08 -1.26 -0.28 117.98 124.84 1i9l s PHE 147 Ca -0.11 1.54 0.03 0.00 0.12 0.00 0.00 56.93 58.51 1i9l s PHE 147 Cb -0.15 -2.76 0.00 0.00 -0.57 0.00 0.00 43.02 39.55 1i9l s PHE 147 CO 0.01 0.15 -0.21 -0.51 -0.10 0.00 0.00 175.22 174.55 1i9l s LEU 148 N -2.44 2.18 0.14 -0.37 1.02 -0.27 -0.34 118.68 118.60 1i9l s LEU 148 Ca 0.51 -0.55 0.11 0.00 0.02 0.00 0.00 54.13 54.22 1i9l s LEU 148 Cb -0.14 -1.45 -0.04 0.00 0.02 0.00 0.00 46.19 44.57 1i9l s LEU 148 CO 0.19 0.12 -0.25 -1.59 0.02 0.00 0.00 176.35 174.84 1i9l s LYS 149 N 0.59 1.48 -0.09 1.70 -2.85 -0.49 -2.05 119.74 118.03 1i9l s LYS 149 Ca -0.12 -1.34 -0.26 0.00 -1.00 0.00 0.00 55.97 53.24 1i9l s LYS 149 Cb -0.17 -1.93 -0.02 0.00 -2.06 0.00 0.00 37.83 33.65 1i9l s LYS 149 CO 0.03 0.45 0.85 0.08 0.10 0.00 0.00 175.35 176.86 1i9l s VAL 150 N -1.15 4.92 0.00 1.79 1.01 -1.26 -1.13 120.40 124.58 1i9l s VAL 150 Ca 0.15 1.72 0.00 0.00 0.00 0.00 0.00 61.98 63.85 1i9l s VAL 150 Cb -0.10 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.11 1i9l s VAL 150 CO 0.07 0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.90 1i9l n GLY 151 N 3.18 0.69 3.88 4.51 0.00 0.56 -4.89 105.19 113.12 1i9l n GLY 151 Ca 0.04 0.46 -0.30 0.00 0.00 0.00 0.00 46.02 46.21 1i9l n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i9l s SER 152 N 2.00 6.44 0.55 1.61 1.04 -1.26 -3.82 113.70 120.27 1i9l s SER 152 Ca 0.00 1.20 -0.20 0.00 0.48 0.00 0.00 55.95 57.43 1i9l s SER 152 Cb 0.00 -2.36 -0.05 0.00 0.10 0.00 0.00 66.02 63.71 1i9l s SER 152 CO 0.00 -0.53 1.19 0.00 0.98 0.00 0.00 173.24 174.88 1i9l s ALA 153 N -2.61 2.68 -0.36 5.32 0.00 -1.26 -2.43 121.76 123.10 1i9l s ALA 153 Ca 0.52 0.97 -0.08 0.00 0.00 0.00 0.00 51.96 53.37 1i9l s ALA 153 Cb -0.10 -3.42 0.04 0.00 0.00 0.00 0.00 23.12 19.64 1i9l s ALA 153 CO 0.37 -0.98 0.16 0.21 0.00 0.00 0.00 175.76 175.53 1i9l s LYS 154 N -3.17 2.66 0.18 0.00 2.47 -1.25 -4.82 119.74 115.81 1i9l s LYS 154 Ca 0.73 -1.22 -0.17 0.00 -1.56 0.00 0.00 55.97 53.76 1i9l s LYS 154 Cb -0.29 -3.59 0.13 0.00 -1.46 0.00 0.00 37.83 32.62 1i9l s LYS 154 CO 0.33 -0.74 1.65 -1.35 0.16 0.00 0.00 175.35 175.40 1i9l h PRO 155 N 8.31 -0.04 0.00 4.03 0.11 -1.93 -1.47 132.00 141.02 1i9l h PRO 155 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1i9l h PRO 155 Cb 1.09 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1i9l h PRO 155 CO 0.65 -0.03 0.07 0.41 -0.21 0.00 0.00 178.00 178.89 1i9l n GLY 156 N -1.36 -0.74 0.08 -0.55 0.00 -1.26 -1.56 105.19 99.80 1i9l n GLY 156 Ca 0.04 0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.28 1i9l n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1i9l n LEU 157 N -2.07 0.56 -0.31 0.99 7.94 -0.56 -4.41 117.00 119.14 1i9l n LEU 157 Ca -0.01 0.23 0.05 0.00 -1.11 0.00 0.00 56.01 55.17 1i9l n LEU 157 Cb 0.10 0.03 0.26 0.00 0.53 0.00 0.00 43.42 44.33 1i9l n LEU 157 CO 0.07 -0.01 1.24 -0.61 -1.11 0.00 0.00 177.39 176.98 1i9l h GLN 158 N 0.00 0.95 -0.86 1.96 5.75 -1.27 -1.12 115.11 120.52 1i9l h GLN 158 Ca -0.08 -0.06 0.07 0.00 -0.15 0.00 0.00 58.65 58.44 1i9l h GLN 158 Cb 1.23 -0.22 -0.06 0.00 1.07 0.00 0.00 27.48 29.51 1i9l h GLN 158 CO 0.01 0.63 0.56 -0.22 -2.65 0.00 0.00 178.83 177.17 1i9l h LYS 159 N 0.98 0.91 -0.13 1.69 3.64 -1.77 -0.63 116.57 121.26 1i9l h LYS 159 Ca 0.41 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.69 1i9l h LYS 159 Cb 0.30 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1i9l h LYS 159 CO -0.17 0.60 -0.09 0.28 -2.27 0.00 0.00 179.45 177.80 1i9l h VAL 160 N 0.94 1.33 -0.82 2.00 2.07 -1.50 -3.23 116.25 117.04 1i9l h VAL 160 Ca 0.38 -1.19 0.04 0.00 0.82 0.00 0.00 66.70 66.76 1i9l h VAL 160 Cb 0.26 1.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 1i9l h VAL 160 CO -0.14 0.34 0.54 0.58 0.02 0.00 0.00 177.57 178.90 1i9l h VAL 161 N -0.07 1.11 -0.57 2.57 2.07 -0.72 -2.96 116.25 117.67 1i9l h VAL 161 Ca 0.03 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.14 1i9l h VAL 161 Cb 0.58 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1i9l h VAL 161 CO 0.02 0.18 0.06 0.44 0.02 0.00 0.00 177.57 178.30 1i9l h ASP 162 N 0.98 0.90 1.23 0.57 3.32 -1.17 -3.10 116.42 119.14 1i9l h ASP 162 Ca 0.33 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1i9l h ASP 162 Cb 0.09 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.40 1i9l h ASP 162 CO -0.10 0.92 0.00 0.55 -1.72 0.00 0.00 179.24 178.89 1i9l n VAL 163 N -4.22 0.65 -0.19 -1.35 3.14 -1.12 -4.18 118.33 111.06 1i9l n VAL 163 Ca 0.04 -0.12 0.23 0.00 -2.96 0.00 0.00 64.34 61.52 1i9l n VAL 163 Cb 0.29 -0.76 0.61 0.00 -1.06 0.00 0.00 33.84 32.93 1i9l n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1i9l h LEU 164 N 0.00 0.20 -1.99 6.55 3.38 -1.57 -1.58 115.31 120.30 1i9l h LEU 164 Ca 0.00 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1i9l h LEU 164 Cb 0.62 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1i9l h LEU 164 CO 0.00 0.08 -0.06 0.44 0.09 0.00 0.00 178.44 179.00 1i9l h ASP 165 N 0.20 0.00 0.58 -0.43 3.32 -1.82 -2.08 116.42 116.19 1i9l h ASP 165 Ca 0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.47 1i9l h ASP 165 Cb 1.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.89 1i9l h ASP 165 CO -0.09 0.06 -0.24 -1.54 -1.72 0.00 0.00 179.24 175.71 1i9l n SER 166 N -4.28 0.40 -1.42 6.45 3.41 -0.59 -3.88 113.62 113.71 1i9l n SER 166 Ca -0.03 -0.19 -0.05 0.00 -0.26 0.00 0.00 58.87 58.34 1i9l n SER 166 Cb 0.14 -0.05 0.11 0.00 -0.26 0.00 0.00 64.21 64.14 1i9l n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1i9l n ILE 167 N -1.28 1.96 -0.23 -1.33 -5.35 -0.80 -4.65 119.36 107.68 1i9l n ILE 167 Ca 0.09 -3.28 0.11 0.00 -0.27 0.00 0.00 62.75 59.40 1i9l n ILE 167 Cb 0.32 -0.25 0.39 0.00 -1.74 0.00 0.00 39.64 38.37 1i9l n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1i9l h LYS 168 N 1.56 0.64 -6.38 6.28 3.64 -1.63 -3.41 116.57 117.27 1i9l h LYS 168 Ca 0.09 -0.04 -0.62 0.00 -1.27 0.00 0.00 60.65 58.81 1i9l h LYS 168 Cb 1.32 -0.14 -0.14 0.00 -0.41 0.00 0.00 32.23 32.86 1i9l h LYS 168 CO 0.29 0.42 -0.74 0.95 -2.27 0.00 0.00 179.45 178.11 1i9l s THR 169 N -5.63 2.89 0.11 1.00 -4.23 -1.26 -0.50 115.64 108.03 1i9l s THR 169 Ca -0.09 -1.96 -0.36 0.00 -1.18 0.00 0.00 61.69 58.10 1i9l s THR 169 Cb 0.21 -2.47 -0.16 0.00 1.34 0.00 0.00 72.50 71.43 1i9l s THR 169 CO 0.78 -0.23 1.42 1.17 -0.54 0.00 0.00 174.62 177.22 1i9l n LYS 170 N -0.24 1.50 0.00 3.99 4.81 -0.31 -1.75 118.16 126.15 1i9l n LYS 170 Ca -0.09 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 1i9l n LYS 170 Cb 0.57 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 33.40 1i9l n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1i9l n GLY 171 N 2.81 2.79 3.81 3.14 0.00 -0.26 -4.47 105.19 113.01 1i9l n GLY 171 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1i9l n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i9l s LYS 172 N -0.84 4.04 -0.01 1.61 1.02 -0.72 -4.88 119.74 119.96 1i9l s LYS 172 Ca 0.00 1.24 -0.13 0.00 0.02 0.00 0.00 55.97 57.11 1i9l s LYS 172 Cb 0.00 -2.16 0.02 0.00 -0.52 0.00 0.00 37.83 35.17 1i9l s LYS 172 CO 0.00 -0.21 0.27 -1.54 -0.92 0.00 0.00 175.35 172.95 1i9l s SER 173 N -2.06 -0.14 0.08 2.83 1.04 -1.26 -1.01 113.70 113.17 1i9l s SER 173 Ca 0.64 0.03 0.06 0.00 0.48 0.00 0.00 55.95 57.15 1i9l s SER 173 Cb -0.13 0.29 -0.03 0.00 0.10 0.00 0.00 66.02 66.26 1i9l s SER 173 CO 0.17 -0.42 -0.15 0.00 0.98 0.00 0.00 173.24 173.82 1i9l s ALA 174 N -1.29 1.26 0.27 5.32 0.00 -0.12 -4.94 121.76 122.25 1i9l s ALA 174 Ca -0.13 -1.04 -0.29 0.00 0.00 0.00 0.00 51.96 50.50 1i9l s ALA 174 Cb -0.06 -0.12 -0.10 0.00 0.00 0.00 0.00 23.12 22.85 1i9l s ALA 174 CO 0.03 0.19 1.32 -0.51 0.00 0.00 0.00 175.76 176.79 1i9l s ASP 175 N -1.77 6.83 -0.43 0.00 1.01 -1.26 -1.56 116.67 119.49 1i9l s ASP 175 Ca -0.01 2.56 0.06 0.00 0.71 0.00 0.00 52.55 55.87 1i9l s ASP 175 Cb -0.10 -2.63 0.20 0.00 1.01 0.00 0.00 42.92 41.40 1i9l s ASP 175 CO 0.03 -0.53 0.49 0.33 0.21 0.00 0.00 175.17 175.69 1i9l n PHE 176 N 1.70 -1.36 -3.62 4.23 7.35 -0.19 -4.79 117.46 120.77 1i9l n PHE 176 Ca 0.03 -2.99 -0.22 0.00 -0.76 0.00 0.00 57.45 53.51 1i9l n PHE 176 Cb 0.42 0.35 -0.01 0.00 0.35 0.00 0.00 39.48 40.59 1i9l n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1i9l s THR 177 N -0.14 4.97 -1.61 -2.13 -4.23 -1.26 -2.73 115.64 108.51 1i9l s THR 177 Ca 0.33 -0.76 0.00 0.00 -1.18 0.00 0.00 61.69 60.08 1i9l s THR 177 Cb 0.09 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 70.15 1i9l s THR 177 CO -0.16 -0.39 0.00 0.59 -0.54 0.00 0.00 174.62 174.12 1i9l n ASN 178 N -1.62 -5.18 -4.76 3.99 4.13 -1.26 -4.97 115.26 105.59 1i9l n ASN 178 Ca -0.06 0.10 -0.39 0.00 1.68 0.00 0.00 54.58 55.91 1i9l n ASN 178 Cb 0.57 -4.25 -0.06 0.00 -1.54 0.00 0.00 39.78 34.50 1i9l n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1i9l s PHE 179 N -2.83 3.66 -0.36 3.10 5.36 -1.26 -5.02 117.98 120.63 1i9l s PHE 179 Ca 0.00 1.14 -0.13 0.00 -0.96 0.00 0.00 56.93 56.98 1i9l s PHE 179 Cb 0.00 -2.58 -0.00 0.00 -0.34 0.00 0.00 43.02 40.10 1i9l s PHE 179 CO 0.00 0.34 0.25 0.34 -1.46 0.00 0.00 175.22 174.69 1i9l s ASP 180 N -0.12 6.01 0.44 6.13 -1.08 -1.26 -4.44 116.67 122.35 1i9l s ASP 180 Ca 0.30 -0.61 0.30 0.00 -0.52 0.00 0.00 52.55 52.02 1i9l s ASP 180 Cb -0.18 -2.13 1.33 0.00 -1.46 0.00 0.00 42.92 40.49 1i9l s ASP 180 CO 0.16 -0.31 1.91 1.55 0.52 0.00 0.00 175.17 179.00 1i9l h PRO 181 N 8.52 0.00 0.00 4.34 0.13 -1.95 -2.97 132.00 140.07 1i9l h PRO 181 Ca -0.30 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1i9l h PRO 181 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 1i9l h PRO 181 CO 0.66 0.00 -0.01 0.00 -0.23 0.00 0.00 178.00 178.42 1i9l h ARG 182 N 0.00 0.00 0.00 0.86 3.08 -1.93 -1.25 114.38 115.14 1i9l h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1i9l h ARG 182 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1i9l h ARG 182 CO 0.00 0.01 0.00 0.41 -1.07 0.00 0.00 179.97 179.32 1i9l n GLY 183 N -0.96 -1.30 0.91 0.04 0.00 -1.12 -2.77 105.19 99.99 1i9l n GLY 183 Ca -0.02 0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.19 1i9l n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1i9l n LEU 184 N -2.23 2.75 -4.82 0.99 4.77 -0.47 -4.52 117.00 113.48 1i9l n LEU 184 Ca 0.02 -1.10 -0.37 0.00 -0.03 0.00 0.00 56.01 54.53 1i9l n LEU 184 Cb 0.24 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.13 1i9l n LEU 184 CO 0.20 0.55 0.29 -0.76 -1.33 0.00 0.00 177.39 176.34 1i9l s LEU 185 N -1.67 4.44 0.91 2.23 1.43 -1.11 -4.96 118.68 119.96 1i9l s LEU 185 Ca 0.35 1.24 -0.13 0.00 -1.03 0.00 0.00 54.13 54.56 1i9l s LEU 185 Cb 0.21 -3.13 0.14 0.00 0.03 0.00 0.00 46.19 43.44 1i9l s LEU 185 CO 0.30 0.18 1.16 -2.16 0.23 0.00 0.00 176.35 176.07 1i9l s PRO 186 N -1.51 1.10 0.12 1.29 0.04 -1.26 -4.98 135.00 129.80 1i9l s PRO 186 Ca 0.34 0.16 -0.16 0.00 0.04 0.00 0.00 61.00 61.39 1i9l s PRO 186 Cb -0.18 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 1i9l s PRO 186 CO 0.20 -2.20 1.60 1.49 0.04 0.00 0.00 177.00 178.13 1i9l h GLU 187 N -1.50 0.62 -6.05 4.56 4.81 -1.92 -3.44 114.58 111.67 1i9l h GLU 187 Ca -0.49 -0.17 -0.60 0.00 -0.13 0.00 0.00 59.36 57.98 1i9l h GLU 187 Cb 1.32 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.59 1i9l h GLU 187 CO 0.59 0.68 -0.37 0.45 -0.73 0.00 0.00 179.01 179.62 1i9l s SER 188 N -6.03 6.46 -0.25 1.04 0.15 -1.26 -5.02 113.70 108.78 1i9l s SER 188 Ca -0.13 0.50 0.13 0.00 0.70 0.00 0.00 55.95 57.15 1i9l s SER 188 Cb 0.10 -2.06 0.56 0.00 -1.71 0.00 0.00 66.02 62.91 1i9l s SER 188 CO 0.77 0.12 1.52 0.18 1.20 0.00 0.00 173.24 177.03 1i9l n LEU 189 N 0.36 4.44 -4.77 3.45 4.77 -1.26 -4.76 117.00 119.23 1i9l n LEU 189 Ca -0.05 -3.32 -0.41 0.00 -0.03 0.00 0.00 56.01 52.20 1i9l n LEU 189 Cb 0.52 -0.62 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 1i9l n LEU 189 CO 0.48 0.90 0.92 -1.81 -1.33 0.00 0.00 177.39 176.55 1i9l s ASP 190 N -1.96 6.92 0.20 -1.43 1.01 -1.26 -4.74 116.67 115.40 1i9l s ASP 190 Ca 0.46 2.57 -0.06 0.00 0.71 0.00 0.00 52.55 56.22 1i9l s ASP 190 Cb 0.38 -2.64 -0.02 0.00 1.01 0.00 0.00 42.92 41.65 1i9l s ASP 190 CO 0.07 -0.42 0.25 -0.72 0.21 0.00 0.00 175.17 174.56 1i9l s TYR 191 N -1.14 0.72 0.12 4.23 -0.85 -1.26 -0.78 117.35 118.39 1i9l s TYR 191 Ca 0.48 -1.03 0.10 0.00 -0.52 0.00 0.00 57.07 56.09 1i9l s TYR 191 Cb -0.37 -0.23 -0.04 0.00 0.38 0.00 0.00 41.96 41.70 1i9l s TYR 191 CO 0.49 -0.74 -0.21 -1.58 -1.52 0.00 0.00 175.55 172.00 1i9l s TRP 192 N -4.06 2.47 -0.00 -3.49 0.51 -0.32 -1.75 118.94 112.29 1i9l s TRP 192 Ca 0.27 -0.30 -0.03 0.00 -2.12 0.00 0.00 56.10 53.92 1i9l s TRP 192 Cb 0.04 -1.32 -0.00 0.00 -0.81 0.00 0.00 33.47 31.38 1i9l s TRP 192 CO 0.07 0.37 0.06 -0.08 -0.51 0.00 0.00 176.95 176.86 1i9l s THR 193 N -1.12 0.06 0.04 2.01 -1.32 0.10 -1.32 115.64 114.09 1i9l s THR 193 Ca 0.17 -0.51 -0.27 0.00 -1.21 0.00 0.00 61.69 59.87 1i9l s THR 193 Cb -0.10 -0.26 0.08 0.00 -1.51 0.00 0.00 72.50 70.71 1i9l s THR 193 CO 0.09 -0.28 0.74 -0.72 -2.21 0.00 0.00 174.62 172.23 1i9l s TYR 194 N -0.89 -0.49 -0.19 9.09 1.13 -1.06 -1.61 117.35 123.33 1i9l s TYR 194 Ca -0.10 0.48 -0.24 0.00 -1.41 0.00 0.00 57.07 55.79 1i9l s TYR 194 Cb -0.06 0.51 -0.01 0.00 -1.10 0.00 0.00 41.96 41.30 1i9l s TYR 194 CO 0.00 -0.67 0.80 -1.25 -2.51 0.00 0.00 175.55 171.93 1i9l s PRO 195 N -2.83 4.26 0.00 -3.49 0.04 -1.26 -1.40 135.00 130.32 1i9l s PRO 195 Ca -0.00 0.95 0.00 0.00 0.04 0.00 0.00 61.00 61.98 1i9l s PRO 195 Cb -0.01 -3.59 0.00 0.00 0.04 0.00 0.00 34.50 30.94 1i9l s PRO 195 CO -0.06 -0.35 0.00 0.41 0.04 0.00 0.00 177.00 177.04 1i9l n GLY 196 N 3.56 5.48 3.46 0.56 0.00 0.53 -4.79 105.19 114.00 1i9l n GLY 196 Ca 0.04 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 45.07 1i9l n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i9l s SER 197 N 1.11 1.17 0.49 1.61 1.04 -1.12 -3.12 113.70 114.88 1i9l s SER 197 Ca 0.00 -1.59 -0.22 0.00 0.48 0.00 0.00 55.95 54.63 1i9l s SER 197 Cb 0.00 0.67 -0.07 0.00 0.10 0.00 0.00 66.02 66.72 1i9l s SER 197 CO 0.00 -1.30 1.16 -0.76 0.98 0.00 0.00 173.24 173.32 1i9l s LEU 198 N -3.28 3.93 0.00 2.42 1.43 -0.78 -4.48 118.68 117.91 1i9l s LEU 198 Ca 0.32 2.27 0.20 0.00 -1.03 0.00 0.00 54.13 55.89 1i9l s LEU 198 Cb -0.00 -4.35 0.55 0.00 0.03 0.00 0.00 46.19 42.42 1i9l s LEU 198 CO 0.23 -1.02 1.46 0.35 0.23 0.00 0.00 176.35 177.60 1i9l n THR 199 N -0.75 0.82 -4.09 5.49 -2.24 -1.26 -4.46 114.28 107.79 1i9l n THR 199 Ca 0.09 -0.83 -0.08 0.00 -2.27 0.00 0.00 64.05 60.96 1i9l n THR 199 Cb 0.49 0.45 -0.10 0.00 -2.10 0.00 0.00 70.33 69.07 1i9l n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1i9l s THR 200 N -1.18 0.27 0.48 4.28 -4.23 -1.26 -4.71 115.64 109.29 1i9l s THR 200 Ca 0.42 -1.76 -0.22 0.00 -1.18 0.00 0.00 61.69 58.94 1i9l s THR 200 Cb 0.22 -1.46 -0.08 0.00 1.34 0.00 0.00 72.50 72.52 1i9l s THR 200 CO 0.29 -0.95 1.04 -2.65 -0.54 0.00 0.00 174.62 171.81 1i9l n PRO 201 N 0.19 1.31 0.00 3.99 -0.02 -1.26 -0.09 135.00 139.12 1i9l n PRO 201 Ca -0.14 0.48 0.04 0.00 -2.02 0.00 0.00 63.50 61.85 1i9l n PRO 201 Cb 0.61 -2.15 0.22 0.00 -0.02 0.00 0.00 33.50 32.15 1i9l n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1i9l n PRO 202 N -0.26 0.90 -3.15 0.52 -0.04 -1.26 -5.01 135.00 126.70 1i9l n PRO 202 Ca 0.10 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.34 1i9l n PRO 202 Cb 0.42 -1.13 0.01 0.00 -0.04 0.00 0.00 33.50 32.77 1i9l n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1i9l n LEU 203 N -0.63 -2.03 -4.72 1.53 4.77 0.87 -4.90 117.00 111.88 1i9l n LEU 203 Ca 0.05 -0.31 -0.42 0.00 -0.03 0.00 0.00 56.01 55.31 1i9l n LEU 203 Cb 0.03 -2.51 -0.03 0.00 -2.33 0.00 0.00 43.42 38.58 1i9l n LEU 203 CO 0.04 0.17 1.30 -0.76 -1.33 0.00 0.00 177.39 176.81 1i9l s LEU 204 N -6.52 4.37 -1.27 2.23 1.43 -1.26 -4.37 118.68 113.28 1i9l s LEU 204 Ca 0.33 2.80 -0.15 0.00 -1.03 0.00 0.00 54.13 56.08 1i9l s LEU 204 Cb -0.16 -3.60 0.12 0.00 0.03 0.00 0.00 46.19 42.57 1i9l s LEU 204 CO 0.41 -0.91 1.65 -0.62 0.23 0.00 0.00 176.35 177.11 1i9l n GLU 205 N 3.64 3.28 -0.20 1.70 1.02 -1.26 -1.87 120.64 126.95 1i9l n GLU 205 Ca 0.14 -3.50 0.01 0.00 -0.02 0.00 0.00 57.16 53.79 1i9l n GLU 205 Cb 0.37 -3.25 0.02 0.00 -0.02 0.00 0.00 31.44 28.56 1i9l n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1i9l s VAL 207 N -0.47 3.35 -0.37 0.00 1.01 -1.18 -0.96 120.40 121.77 1i9l s VAL 207 Ca 0.04 -0.58 -0.12 0.00 0.00 0.00 0.00 61.98 61.32 1i9l s VAL 207 Cb 0.03 -2.39 0.02 0.00 0.00 0.00 0.00 36.38 34.04 1i9l s VAL 207 CO 0.00 0.55 0.23 -0.89 0.00 0.00 0.00 175.10 175.00 1i9l s THR 208 N -0.19 4.85 0.04 3.92 2.01 -0.60 -0.34 115.64 125.32 1i9l s THR 208 Ca 0.01 -0.68 -0.23 0.00 0.31 0.00 0.00 61.69 61.10 1i9l s THR 208 Cb -0.13 -3.65 -0.06 0.00 0.01 0.00 0.00 72.50 68.67 1i9l s THR 208 CO 0.03 -0.20 0.68 0.26 -0.69 0.00 0.00 174.62 174.71 1i9l s TRP 209 N 1.61 3.73 -0.32 4.92 0.52 -0.50 -2.87 118.94 126.04 1i9l s TRP 209 Ca 0.04 1.36 0.00 0.00 0.02 0.00 0.00 56.10 57.52 1i9l s TRP 209 Cb -0.19 -2.71 0.10 0.00 -1.15 0.00 0.00 33.47 29.53 1i9l s TRP 209 CO 0.08 0.35 0.09 0.42 0.02 0.00 0.00 176.95 177.90 1i9l s ILE 210 N -0.26 1.20 -0.31 2.03 1.01 -0.99 -2.55 121.20 121.31 1i9l s ILE 210 Ca 0.34 -1.62 -0.12 0.00 0.00 0.00 0.00 60.65 59.26 1i9l s ILE 210 Cb -0.20 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 1i9l s ILE 210 CO 0.20 -0.66 0.21 -0.69 0.00 0.00 0.00 174.94 174.00 1i9l s VAL 211 N 1.45 5.16 0.25 2.92 1.01 -0.44 -0.96 120.40 129.79 1i9l s VAL 211 Ca 0.10 -0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.66 1i9l s VAL 211 Cb -0.18 -3.58 -0.09 0.00 0.00 0.00 0.00 36.38 32.53 1i9l s VAL 211 CO -0.21 0.09 1.27 -0.76 0.00 0.00 0.00 175.10 175.49 1i9l s LEU 212 N 1.71 4.44 0.25 3.92 1.43 -0.52 -1.18 118.68 128.74 1i9l s LEU 212 Ca 0.06 2.45 0.02 0.00 -1.03 0.00 0.00 54.13 55.63 1i9l s LEU 212 Cb -0.17 -3.62 0.30 0.00 0.03 0.00 0.00 46.19 42.73 1i9l s LEU 212 CO 0.10 -0.46 1.62 0.50 0.23 0.00 0.00 176.35 178.34 1i9l h LYS 213 N 4.58 0.42 -5.04 1.70 3.64 -1.31 -3.44 116.57 117.13 1i9l h LYS 213 Ca -0.46 -0.22 -0.66 0.00 -1.27 0.00 0.00 60.65 58.04 1i9l h LYS 213 Cb 1.22 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 32.88 1i9l h LYS 213 CO 0.72 0.78 -0.21 -2.00 -2.27 0.00 0.00 179.45 176.47 1i9l s GLU 214 N -4.16 3.59 0.75 1.90 2.12 -1.26 -5.04 118.70 116.60 1i9l s GLU 214 Ca -0.06 -0.33 -0.11 0.00 0.36 0.00 0.00 54.97 54.83 1i9l s GLU 214 Cb 0.13 -3.80 0.04 0.00 0.26 0.00 0.00 34.13 30.76 1i9l s GLU 214 CO 0.80 -0.56 1.09 -1.25 -0.54 0.00 0.00 175.26 174.81 1i9l s PRO 215 N 2.13 2.45 0.10 4.30 0.04 -1.26 -4.71 135.00 138.05 1i9l s PRO 215 Ca 0.14 0.64 0.02 0.00 0.04 0.00 0.00 61.00 61.84 1i9l s PRO 215 Cb -0.16 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1i9l s PRO 215 CO 0.12 -1.36 0.20 0.96 0.04 0.00 0.00 177.00 176.95 1i9l s ILE 216 N -3.19 5.12 -0.16 0.56 -4.36 0.54 -4.90 121.20 114.81 1i9l s ILE 216 Ca 0.60 -0.60 -0.10 0.00 -0.26 0.00 0.00 60.65 60.28 1i9l s ILE 216 Cb -0.13 -3.54 -0.05 0.00 1.25 0.00 0.00 42.46 39.99 1i9l s ILE 216 CO 0.54 0.06 0.17 -0.44 0.24 0.00 0.00 174.94 175.50 1i9l s SER 217 N -2.72 6.33 0.08 4.36 0.01 -1.26 -1.39 113.70 119.10 1i9l s SER 217 Ca 0.33 0.38 0.04 0.00 1.31 0.00 0.00 55.95 58.02 1i9l s SER 217 Cb -0.12 -2.10 -0.03 0.00 0.21 0.00 0.00 66.02 63.98 1i9l s SER 217 CO 0.26 0.26 -0.12 0.68 0.41 0.00 0.00 173.24 174.73 1i9l s VAL 218 N -0.18 1.01 0.63 3.43 -7.23 -0.28 -3.77 120.40 114.00 1i9l s VAL 218 Ca 0.12 -1.38 -0.10 0.00 -1.81 0.00 0.00 61.98 58.81 1i9l s VAL 218 Cb -0.12 -1.11 -0.02 0.00 0.56 0.00 0.00 36.38 35.69 1i9l s VAL 218 CO 0.02 -0.34 1.01 -0.94 -0.31 0.00 0.00 175.10 174.54 1i9l s SER 219 N -1.94 5.98 0.18 4.85 1.04 -1.13 -0.32 113.70 122.36 1i9l s SER 219 Ca -0.01 1.24 -0.13 0.00 0.48 0.00 0.00 55.95 57.53 1i9l s SER 219 Cb -0.08 -2.25 0.15 0.00 0.10 0.00 0.00 66.02 63.94 1i9l s SER 219 CO 0.02 -0.98 1.79 -1.28 0.98 0.00 0.00 173.24 173.76 1i9l h SER 220 N -0.34 0.38 -0.59 7.02 0.87 -1.94 -2.06 113.55 116.89 1i9l h SER 220 Ca -0.45 0.03 0.04 0.00 -1.23 0.00 0.00 61.79 60.18 1i9l h SER 220 Cb 1.21 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 63.09 1i9l h SER 220 CO 0.62 0.26 0.34 -0.33 -0.53 0.00 0.00 176.83 177.20 1i9l h GLU 221 N 0.51 0.64 -0.09 2.24 3.07 -1.95 0.08 114.58 119.08 1i9l h GLU 221 Ca 0.23 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.05 1i9l h GLU 221 Cb 0.14 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 27.90 1i9l h GLU 221 CO -0.16 0.42 0.06 1.96 -1.40 0.00 0.00 179.01 179.89 1i9l h GLN 222 N 0.66 0.11 -0.07 2.33 4.20 -1.81 -2.85 115.11 117.69 1i9l h GLN 222 Ca 0.25 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.86 1i9l h GLN 222 Cb 0.08 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1i9l h GLN 222 CO -0.13 0.08 -0.35 0.28 -0.67 0.00 0.00 178.83 178.05 1i9l h VAL 223 N 0.11 1.27 -0.73 -0.54 2.07 -1.12 -2.90 116.25 114.41 1i9l h VAL 223 Ca 0.03 -1.29 0.04 0.00 0.82 0.00 0.00 66.70 66.30 1i9l h VAL 223 Cb -0.01 1.60 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 1i9l h VAL 223 CO -0.01 0.38 0.45 -0.07 0.02 0.00 0.00 177.57 178.34 1i9l h LEU 224 N 0.12 0.72 -1.83 2.57 3.38 -0.76 -2.40 115.31 117.11 1i9l h LEU 224 Ca 0.01 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1i9l h LEU 224 Cb 0.67 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 1i9l h LEU 224 CO 0.05 0.48 -0.08 0.11 0.09 0.00 0.00 178.44 179.08 1i9l h LYS 225 N 0.85 0.00 -0.56 1.13 1.57 -1.33 -1.83 116.57 116.39 1i9l h LYS 225 Ca 0.31 -0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 59.01 1i9l h LYS 225 Cb 0.09 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1i9l h LYS 225 CO -0.14 0.09 0.07 0.74 -0.57 0.00 0.00 179.45 179.63 1i9l h PHE 226 N 0.00 1.02 0.00 -1.35 -1.00 -1.50 -2.90 116.94 111.21 1i9l h PHE 226 Ca -0.00 -0.15 0.00 0.00 2.81 0.00 0.00 57.97 60.63 1i9l h PHE 226 Cb 0.15 -0.28 0.00 0.00 3.61 0.00 0.00 35.95 39.44 1i9l h PHE 226 CO 0.00 0.90 0.00 0.54 -1.61 0.00 0.00 178.31 178.14 1i9l n ARG 227 N -4.31 0.18 0.00 1.51 1.74 -0.70 -2.85 116.66 112.22 1i9l n ARG 227 Ca 0.02 0.46 0.14 0.00 -0.77 0.00 0.00 57.85 57.70 1i9l n ARG 227 Cb 0.29 -1.88 0.54 0.00 -1.02 0.00 0.00 32.46 30.39 1i9l n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1i9l n LYS 228 N -2.23 0.38 -1.34 5.56 5.02 -1.09 -4.28 118.16 120.18 1i9l n LYS 228 Ca 0.01 -0.13 -0.29 0.00 -2.02 0.00 0.00 58.31 55.88 1i9l n LYS 228 Cb 0.19 -1.50 0.13 0.00 -0.02 0.00 0.00 35.03 33.84 1i9l n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1i9l s LEU 229 N -2.71 2.17 0.01 -0.35 1.43 -1.13 -4.88 118.68 113.22 1i9l s LEU 229 Ca 0.22 1.29 0.08 0.00 -1.03 0.00 0.00 54.13 54.69 1i9l s LEU 229 Cb 0.19 -3.70 -0.02 0.00 0.03 0.00 0.00 46.19 42.69 1i9l s LEU 229 CO 0.53 -2.56 -0.25 0.20 0.23 0.00 0.00 176.35 174.51 1i9l s ASN 230 N -3.65 2.94 0.11 2.29 0.02 0.35 -0.38 114.94 116.62 1i9l s ASN 230 Ca 0.63 -0.51 -0.09 0.00 -1.02 0.00 0.00 52.86 51.87 1i9l s ASN 230 Cb -0.17 -0.29 -0.14 0.00 0.02 0.00 0.00 41.25 40.67 1i9l s ASN 230 CO 0.56 0.27 1.28 -0.26 0.02 0.00 0.00 177.10 178.97 1i9l h PHE 231 N 5.17 0.87 -4.34 2.20 0.04 -1.50 -3.36 116.94 116.02 1i9l h PHE 231 Ca -0.44 -0.44 -0.50 0.00 2.80 0.00 0.00 57.97 59.39 1i9l h PHE 231 Cb 1.14 -0.11 0.10 0.00 2.20 0.00 0.00 35.95 39.27 1i9l h PHE 231 CO 0.44 1.26 0.37 0.54 -0.60 0.00 0.00 178.31 180.32 1i9l s ASN 232 N -7.15 5.05 0.65 2.17 4.22 -1.26 -4.46 114.94 114.16 1i9l s ASN 232 Ca -0.08 1.38 -0.05 0.00 -2.14 0.00 0.00 52.86 51.97 1i9l s ASN 232 Cb 0.08 -2.19 0.04 0.00 1.28 0.00 0.00 41.25 40.46 1i9l s ASN 232 CO 0.89 -1.63 0.95 -0.83 -2.04 0.00 0.00 177.10 174.45 1i9l s GLY 233 N -3.96 1.69 0.26 0.45 0.00 -1.26 -1.16 107.32 103.33 1i9l s GLY 233 Ca 0.59 -0.94 -0.30 0.00 0.00 0.00 0.00 44.72 44.07 1i9l s GLY 233 CO 0.54 -0.58 1.46 1.85 0.00 0.00 0.00 173.10 176.37 1i9l s GLU 234 N -5.11 4.24 0.00 2.90 2.12 -1.26 -2.27 118.70 119.32 1i9l s GLU 234 Ca 0.58 2.34 0.00 0.00 0.36 0.00 0.00 54.97 58.26 1i9l s GLU 234 Cb -0.11 -3.09 0.00 0.00 0.26 0.00 0.00 34.13 31.19 1i9l s GLU 234 CO 0.44 -0.45 0.00 0.41 -0.54 0.00 0.00 175.26 175.12 1i9l n GLY 235 N 2.15 1.06 3.96 -1.50 0.00 -1.26 -5.05 105.19 104.54 1i9l n GLY 235 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 1i9l n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i9l s GLU 236 N -0.57 3.26 0.63 1.61 2.02 -0.96 -5.06 118.70 119.63 1i9l s GLU 236 Ca 0.00 -0.62 -0.18 0.00 0.02 0.00 0.00 54.97 54.18 1i9l s GLU 236 Cb 0.00 -2.71 -0.02 0.00 0.10 0.00 0.00 34.13 31.50 1i9l s GLU 236 CO 0.00 0.06 1.27 -1.25 0.02 0.00 0.00 175.26 175.36 1i9l s PRO 237 N -4.29 2.70 -0.08 0.39 0.04 -1.26 -4.90 135.00 127.60 1i9l s PRO 237 Ca 0.43 2.00 -0.30 0.00 0.04 0.00 0.00 61.00 63.17 1i9l s PRO 237 Cb -0.10 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 1i9l s PRO 237 CO 0.34 -1.47 1.03 -2.00 0.04 0.00 0.00 177.00 174.95 1i9l s GLU 238 N -3.34 4.43 -0.21 4.56 2.12 -1.26 -4.75 118.70 120.25 1i9l s GLU 238 Ca 0.81 1.44 -0.02 0.00 0.36 0.00 0.00 54.97 57.56 1i9l s GLU 238 Cb -0.36 -3.53 0.06 0.00 0.26 0.00 0.00 34.13 30.57 1i9l s GLU 238 CO 0.38 -0.29 0.01 -1.21 -0.54 0.00 0.00 175.26 173.61 1i9l s GLU 239 N 1.86 0.96 0.46 4.30 2.02 -1.26 -5.07 118.70 121.96 1i9l s GLU 239 Ca 0.50 -0.61 -0.25 0.00 0.02 0.00 0.00 54.97 54.63 1i9l s GLU 239 Cb -0.20 -2.26 -0.08 0.00 0.10 0.00 0.00 34.13 31.69 1i9l s GLU 239 CO 0.20 -0.64 1.44 -0.51 0.02 0.00 0.00 175.26 175.78 1i9l s LEU 240 N 1.71 4.10 -0.77 1.80 1.43 -1.26 -1.45 118.68 124.24 1i9l s LEU 240 Ca -0.02 2.95 -0.22 0.00 -1.03 0.00 0.00 54.13 55.80 1i9l s LEU 240 Cb -0.18 -3.94 0.08 0.00 0.03 0.00 0.00 46.19 42.18 1i9l s LEU 240 CO -0.08 -1.22 1.08 -0.32 0.23 0.00 0.00 176.35 176.04 1i9l s MET 241 N -2.48 3.29 0.07 1.70 -2.45 0.49 -4.60 119.30 115.32 1i9l s MET 241 Ca 0.62 -1.04 -0.10 0.00 -1.25 0.00 0.00 55.69 53.92 1i9l s MET 241 Cb -0.44 -4.50 0.01 0.00 1.25 0.00 0.00 34.83 31.14 1i9l s MET 241 CO 0.57 -1.88 0.22 0.14 1.05 0.00 0.00 175.02 175.12 1i9l s VAL 242 N 3.97 0.12 -1.47 10.11 -7.23 -1.26 -4.45 120.40 120.18 1i9l s VAL 242 Ca 0.28 -1.00 -0.07 0.00 -1.81 0.00 0.00 61.98 59.38 1i9l s VAL 242 Cb -0.11 -1.17 0.03 0.00 0.56 0.00 0.00 36.38 35.68 1i9l s VAL 242 CO 0.04 -0.55 0.74 0.47 -0.31 0.00 0.00 175.10 175.49 1i9l n ASP 243 N 0.18 -5.66 -3.13 4.85 8.00 -0.01 -4.86 116.55 115.92 1i9l n ASP 243 Ca -0.16 -0.41 -0.35 0.00 0.71 0.00 0.00 54.79 54.58 1i9l n ASP 243 Cb 0.61 -4.55 -0.04 0.00 -0.02 0.00 0.00 41.12 37.13 1i9l n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1i9l n ASN 244 N -2.62 7.81 -4.01 -2.24 6.94 -1.11 -4.87 115.26 115.16 1i9l n ASN 244 Ca -0.06 -2.87 -0.15 0.00 -0.02 0.00 0.00 54.58 51.48 1i9l n ASN 244 Cb 0.59 -1.42 -0.13 0.00 -2.36 0.00 0.00 39.78 36.45 1i9l n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 1i9l s TRP 245 N 0.19 0.60 -0.13 -2.53 1.48 -1.26 -4.52 118.94 112.77 1i9l s TRP 245 Ca 0.62 -0.26 -0.11 0.00 -1.06 0.00 0.00 56.10 55.29 1i9l s TRP 245 Cb 0.22 -0.37 -0.05 0.00 -1.16 0.00 0.00 33.47 32.11 1i9l s TRP 245 CO -0.09 -0.03 0.22 0.50 -4.06 0.00 0.00 176.95 173.49 1i9l s ARG 246 N -0.72 3.94 0.68 3.25 3.52 -1.26 -5.00 118.95 123.36 1i9l s ARG 246 Ca -0.02 -0.00 -0.17 0.00 -0.13 0.00 0.00 55.73 55.41 1i9l s ARG 246 Cb -0.05 -3.32 -0.01 0.00 -1.56 0.00 0.00 34.95 30.01 1i9l s ARG 246 CO 0.00 0.49 1.05 -2.30 -0.81 0.00 0.00 175.30 173.73 1i9l n PRO 247 N 2.81 0.73 -1.77 5.12 -0.02 -1.26 -4.62 135.00 135.98 1i9l n PRO 247 Ca -0.16 0.30 -0.41 0.00 -2.02 0.00 0.00 63.50 61.21 1i9l n PRO 247 Cb 0.53 -2.29 -0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1i9l n PRO 247 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1i9l n ALA 248 N -2.21 2.33 -2.81 3.55 0.00 -1.26 -4.43 120.51 115.67 1i9l n ALA 248 Ca 0.14 0.34 -0.22 0.00 0.00 0.00 0.00 53.44 53.70 1i9l n ALA 248 Cb 0.49 -2.41 -0.05 0.00 0.00 0.00 0.00 19.45 17.48 1i9l n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1i9l s GLN 249 N -2.03 2.89 0.24 0.00 -1.52 0.24 -4.93 119.66 114.56 1i9l s GLN 249 Ca 0.54 -1.07 -0.31 0.00 -1.95 0.00 0.00 55.36 52.57 1i9l s GLN 249 Cb -0.48 -2.55 -0.12 0.00 -0.22 0.00 0.00 33.01 29.64 1i9l s GLN 249 CO 0.63 0.40 1.64 -2.30 -0.25 0.00 0.00 175.29 175.41 1i9l n PRO 250 N -1.14 2.65 0.16 2.91 -0.02 -1.26 -4.58 135.00 133.71 1i9l n PRO 250 Ca -0.08 0.95 0.01 0.00 -2.02 0.00 0.00 63.50 62.36 1i9l n PRO 250 Cb 0.58 -2.75 0.30 0.00 -0.02 0.00 0.00 33.50 31.60 1i9l n PRO 250 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1i9l h LEU 251 N 5.67 0.06 0.00 2.45 5.85 -1.93 -3.44 115.31 123.97 1i9l h LEU 251 Ca -0.45 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1i9l h LEU 251 Cb 1.22 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1i9l h LEU 251 CO 0.87 0.47 0.00 0.29 -0.34 0.00 0.00 178.44 179.73 1i9l n LYS 252 N -4.03 0.00 -1.81 1.25 4.76 -1.26 -3.04 118.16 114.03 1i9l n LYS 252 Ca -0.02 0.00 -0.37 0.00 -2.87 0.00 0.00 58.31 55.06 1i9l n LYS 252 Cb 0.46 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.62 1i9l n LYS 252 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1i9l n ASN 253 N 2.88 7.73 -4.29 4.39 4.13 -1.26 -4.92 115.26 123.92 1i9l n ASN 253 Ca 0.00 -3.09 -0.17 0.00 1.68 0.00 0.00 54.58 53.00 1i9l n ASN 253 Cb 0.00 -1.35 -0.10 0.00 -1.54 0.00 0.00 39.78 36.78 1i9l n ASN 253 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1i9l s ARG 254 N -0.94 1.16 -0.04 3.52 0.52 -1.17 -5.13 118.95 116.86 1i9l s ARG 254 Ca 0.57 -1.46 0.03 0.00 -0.52 0.00 0.00 55.73 54.35 1i9l s ARG 254 Cb 0.23 -0.88 0.00 0.00 0.52 0.00 0.00 34.95 34.82 1i9l s ARG 254 CO -0.11 0.14 -0.12 -1.14 0.02 0.00 0.00 175.30 174.08 1i9l s GLN 255 N -3.46 1.43 -0.26 3.54 0.74 -1.26 -5.05 119.66 115.35 1i9l s GLN 255 Ca 0.17 -0.43 -0.15 0.00 0.05 0.00 0.00 55.36 55.00 1i9l s GLN 255 Cb -0.00 -1.25 -0.04 0.00 1.10 0.00 0.00 33.01 32.82 1i9l s GLN 255 CO 0.04 0.13 0.39 0.42 -0.55 0.00 0.00 175.29 175.72 1i9l s ILE 256 N 0.29 5.17 -0.14 -2.34 1.01 -1.26 -4.72 121.20 119.21 1i9l s ILE 256 Ca -0.07 0.63 -0.07 0.00 0.00 0.00 0.00 60.65 61.14 1i9l s ILE 256 Cb -0.12 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 1i9l s ILE 256 CO 0.02 0.16 0.11 -0.54 0.00 0.00 0.00 174.94 174.69 1i9l s LYS 257 N 1.98 3.59 0.08 2.79 1.02 -0.63 -0.71 119.74 127.86 1i9l s LYS 257 Ca 0.16 -0.21 0.04 0.00 0.02 0.00 0.00 55.97 55.98 1i9l s LYS 257 Cb -0.16 -3.18 -0.04 0.00 -0.52 0.00 0.00 37.83 33.93 1i9l s LYS 257 CO 0.09 0.62 0.05 0.00 -0.92 0.00 0.00 175.35 175.19 1i9l s ALA 258 N -0.58 3.47 -2.02 5.17 0.00 0.46 -0.72 121.76 127.53 1i9l s ALA 258 Ca 0.12 -1.04 0.17 0.00 0.00 0.00 0.00 51.96 51.21 1i9l s ALA 258 Cb -0.12 -1.36 0.48 0.00 0.00 0.00 0.00 23.12 22.13 1i9l s ALA 258 CO 0.02 0.73 1.40 -1.13 0.00 0.00 0.00 175.76 176.78 1i9l n SER 259 N 0.53 2.84 -3.87 0.00 3.41 -0.72 -1.93 113.62 113.89 1i9l n SER 259 Ca -0.09 -1.99 -0.10 0.00 -0.26 0.00 0.00 58.87 56.43 1i9l n SER 259 Cb 0.52 -0.35 -0.06 0.00 -0.26 0.00 0.00 64.21 64.06 1i9l n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1i9l s PHE 260 N -1.30 0.18 0.00 7.33 -0.71 -1.26 -4.90 117.98 117.31 1i9l s PHE 260 Ca 0.36 -0.54 0.00 0.00 -1.04 0.00 0.00 56.93 55.71 1i9l s PHE 260 Cb 0.19 0.13 0.00 0.00 -1.21 0.00 0.00 43.02 42.13 1i9l s PHE 260 CO 0.25 -0.80 0.41 0.36 -1.34 0.00 0.00 175.22 174.09