#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rql s ILE 6 N 0.00 4.27 -1.11 3.15 -1.09 -1.26 -4.60 121.20 120.56 1rql s ILE 6 Ca 0.00 1.36 0.17 0.00 -2.23 0.00 0.00 60.65 59.94 1rql s ILE 6 Cb 0.00 -4.52 -0.10 0.00 -1.58 0.00 0.00 42.46 36.25 1rql s ILE 6 CO 0.00 -0.84 0.78 -0.62 -1.23 0.00 0.00 174.94 173.03 1rql n GLU 7 N 7.57 1.62 -3.55 2.79 1.02 0.92 -4.94 120.64 126.07 1rql n GLU 7 Ca 0.12 -0.36 -0.17 0.00 -0.02 0.00 0.00 57.16 56.73 1rql n GLU 7 Cb 0.48 -1.29 -0.06 0.00 -0.02 0.00 0.00 31.44 30.55 1rql n GLU 7 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1rql s ALA 8 N -2.31 -1.64 -0.08 0.62 0.00 -1.13 -1.55 121.76 115.67 1rql s ALA 8 Ca 0.10 1.21 0.03 0.00 0.00 0.00 0.00 51.96 53.29 1rql s ALA 8 Cb 0.13 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.24 1rql s ALA 8 CO 0.57 -0.36 -0.18 0.08 0.00 0.00 0.00 175.76 175.88 1rql s VAL 9 N -1.18 1.55 -0.25 0.00 1.01 -0.99 -1.29 120.40 119.26 1rql s VAL 9 Ca -0.11 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 1rql s VAL 9 Cb -0.01 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 1rql s VAL 9 CO 0.09 0.45 0.07 -0.63 0.00 0.00 0.00 175.10 175.08 1rql s ILE 10 N 0.48 4.33 0.03 2.22 -1.09 0.27 -1.27 121.20 126.17 1rql s ILE 10 Ca -0.16 -0.17 0.00 0.00 -2.23 0.00 0.00 60.65 58.10 1rql s ILE 10 Cb -0.16 -3.02 -0.04 0.00 -1.58 0.00 0.00 42.46 37.65 1rql s ILE 10 CO 0.06 0.34 0.10 -0.36 -1.23 0.00 0.00 174.94 173.85 1rql s PHE 11 N 1.57 3.30 0.67 3.97 0.40 0.07 -1.09 117.98 126.88 1rql s PHE 11 Ca 0.06 0.19 -0.07 0.00 -0.60 0.00 0.00 56.93 56.51 1rql s PHE 11 Cb -0.15 -1.71 0.04 0.00 0.51 0.00 0.00 43.02 41.71 1rql s PHE 11 CO 0.04 0.55 0.99 0.34 0.70 0.00 0.00 175.22 177.84 1rql s ASP 12 N -2.02 5.06 0.00 1.36 2.15 -0.75 -1.48 116.67 121.00 1rql s ASP 12 Ca 0.26 0.56 0.00 0.00 0.43 0.00 0.00 52.55 53.80 1rql s ASP 12 Cb -0.12 -1.31 0.00 0.00 -0.30 0.00 0.00 42.92 41.18 1rql s ASP 12 CO 0.18 -1.44 0.00 0.79 -0.17 0.00 0.00 175.17 174.53 1rql n TRP 13 N -2.83 0.00 -2.03 -5.34 7.02 -1.24 -3.60 117.44 109.41 1rql n TRP 13 Ca 0.07 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.13 1rql n TRP 13 Cb 0.59 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.46 1rql n TRP 13 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1rql s ALA 14 N -3.11 3.68 -1.29 6.99 0.00 -1.26 -0.38 121.76 126.38 1rql s ALA 14 Ca 0.00 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1rql s ALA 14 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1rql s ALA 14 CO 0.00 -0.82 0.00 0.41 0.00 0.00 0.00 175.76 175.35 1rql n GLY 15 N 3.72 0.77 2.03 0.00 0.00 -0.15 -4.71 105.19 106.85 1rql n GLY 15 Ca 0.14 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1rql n GLY 15 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rql n THR 16 N -3.17 0.00 -0.11 2.61 -1.04 -1.08 -4.05 114.28 107.43 1rql n THR 16 Ca -0.14 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.70 1rql n THR 16 Cb 0.51 -0.34 -0.10 0.00 -1.82 0.00 0.00 70.33 68.57 1rql n THR 16 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1rql n THR 17 N -2.84 1.26 -3.87 12.58 -1.04 0.48 -4.85 114.28 116.01 1rql n THR 17 Ca 0.00 -0.46 0.00 0.00 -2.04 0.00 0.00 64.05 61.55 1rql n THR 17 Cb 0.00 -1.35 0.00 0.00 -1.82 0.00 0.00 70.33 67.16 1rql n THR 17 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1rql n VAL 18 N -3.26 0.00 -3.36 12.58 0.24 -0.23 -1.71 118.33 122.58 1rql n VAL 18 Ca -0.40 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 61.68 1rql n VAL 18 Cb 0.90 0.00 0.02 0.00 -1.47 0.00 0.00 33.84 33.30 1rql n VAL 18 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1rql n ASP 19 N -2.43 -5.91 -4.65 -1.34 -0.08 -0.64 -0.97 116.55 100.53 1rql n ASP 19 Ca 0.00 0.08 -0.42 0.00 -1.51 0.00 0.00 54.79 52.94 1rql n ASP 19 Cb 0.00 -1.57 -0.03 0.00 2.34 0.00 0.00 41.12 41.86 1rql n ASP 19 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 1rql s TYR 20 N -1.25 1.61 0.00 -0.67 6.14 -1.26 -0.83 117.35 121.10 1rql s TYR 20 Ca 0.22 -0.05 0.00 0.00 0.64 0.00 0.00 57.07 57.88 1rql s TYR 20 Cb -0.02 -4.07 0.00 0.00 0.42 0.00 0.00 41.96 38.29 1rql s TYR 20 CO 0.49 -4.57 0.00 0.41 0.64 0.00 0.00 175.55 172.52 1rql n GLY 21 N 4.48 0.97 3.72 8.97 0.00 0.38 -4.33 105.19 119.38 1rql n GLY 21 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 1rql n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rql n PHE 23 N -3.35 0.84 -0.24 0.00 3.01 -1.26 -4.43 117.46 112.04 1rql n PHE 23 Ca -0.18 0.28 -0.06 0.00 1.01 0.00 0.00 57.45 58.50 1rql n PHE 23 Cb 0.62 -1.15 -0.06 0.00 -0.01 0.00 0.00 39.48 38.88 1rql n PHE 23 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1rql n ALA 24 N -2.66 -0.36 -0.29 4.37 0.00 -1.26 0.12 120.51 120.43 1rql n ALA 24 Ca -0.22 0.48 -0.05 0.00 0.00 0.00 0.00 53.44 53.65 1rql n ALA 24 Cb 1.07 -0.06 0.07 0.00 0.00 0.00 0.00 19.45 20.52 1rql n ALA 24 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1rql h PRO 25 N 0.00 1.08 0.16 0.00 0.11 -2.00 -2.12 132.00 129.23 1rql h PRO 25 Ca 0.09 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1rql h PRO 25 Cb 0.23 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 1rql h PRO 25 CO -0.53 0.79 -0.14 1.25 -0.21 0.00 0.00 178.00 179.16 1rql h LEU 26 N 1.08 -0.37 -0.82 2.35 5.85 0.70 -1.35 115.31 122.76 1rql h LEU 26 Ca 0.28 0.03 0.18 0.00 0.84 0.00 0.00 57.88 59.21 1rql h LEU 26 Cb 0.01 0.12 -0.11 0.00 0.37 0.00 0.00 40.66 41.06 1rql h LEU 26 CO -0.05 -0.22 0.32 -0.08 -0.34 0.00 0.00 178.44 178.08 1rql h GLU 27 N -0.32 0.40 0.24 1.25 4.57 0.32 -2.46 114.58 118.58 1rql h GLU 27 Ca -0.00 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 1rql h GLU 27 Cb 0.29 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1rql h GLU 27 CO -0.02 0.26 -0.12 0.28 -1.18 0.00 0.00 179.01 178.23 1rql h VAL 28 N 0.41 0.72 -1.04 0.32 2.07 -0.91 -2.95 116.25 114.86 1rql h VAL 28 Ca 0.47 -0.87 0.28 0.00 0.82 0.00 0.00 66.70 67.40 1rql h VAL 28 Cb 0.81 1.15 -0.11 0.00 -1.52 0.00 0.00 31.29 31.61 1rql h VAL 28 CO -0.47 0.16 0.64 -0.26 0.02 0.00 0.00 177.57 177.66 1rql h PHE 29 N -0.84 0.82 -0.32 1.57 0.04 -1.08 0.25 116.94 117.38 1rql h PHE 29 Ca -0.03 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.68 1rql h PHE 29 Cb 0.51 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.41 1rql h PHE 29 CO 0.05 0.02 -0.17 0.52 -0.60 0.00 0.00 178.31 178.14 1rql h MET 30 N 0.44 0.58 -0.01 1.51 2.86 -1.44 -3.11 114.93 115.76 1rql h MET 30 Ca 0.65 -0.19 -0.00 0.00 -2.06 0.00 0.00 59.70 58.09 1rql h MET 30 Cb 1.49 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 33.10 1rql h MET 30 CO -0.41 0.72 -0.01 1.49 1.06 0.00 0.00 176.91 179.76 1rql h GLU 31 N 0.52 0.02 -0.27 1.72 4.57 -0.35 -0.29 114.58 120.50 1rql h GLU 31 Ca 0.09 -0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.33 1rql h GLU 31 Cb 0.59 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 1rql h GLU 31 CO 0.04 0.53 0.21 -0.84 -1.18 0.00 0.00 179.01 177.77 1rql h ILE 32 N -0.49 0.78 0.06 2.32 3.07 -1.42 -0.26 117.51 121.57 1rql h ILE 32 Ca 0.00 0.00 -0.21 0.00 1.55 0.00 0.00 64.86 66.20 1rql h ILE 32 Cb 0.53 0.85 -0.01 0.00 -0.27 0.00 0.00 36.82 37.92 1rql h ILE 32 CO 0.00 0.00 -1.10 -0.26 -1.05 0.00 0.00 178.15 175.75 1rql h PHE 33 N 0.00 0.23 -0.90 0.16 -1.00 -1.53 -3.33 116.94 110.56 1rql h PHE 33 Ca 0.13 -0.17 0.13 0.00 2.81 0.00 0.00 57.97 60.87 1rql h PHE 33 Cb 0.54 -0.01 -0.07 0.00 3.61 0.00 0.00 35.95 40.02 1rql h PHE 33 CO 0.00 1.43 0.58 1.25 -1.61 0.00 0.00 178.31 179.96 1rql h HIS 34 N -0.64 0.90 0.00 -0.55 2.76 -0.55 0.22 115.15 117.28 1rql h HIS 34 Ca -0.26 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 57.94 1rql h HIS 34 Cb 1.48 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 30.16 1rql h HIS 34 CO 0.15 0.36 0.00 0.36 -1.30 0.00 0.00 177.93 177.50 1rql n LYS 35 N -4.56 0.00 -0.32 5.26 2.85 -0.15 -2.17 118.16 119.07 1rql n LYS 35 Ca 0.17 0.17 0.08 0.00 -1.05 0.00 0.00 58.31 57.67 1rql n LYS 35 Cb 0.40 -1.50 0.23 0.00 -0.65 0.00 0.00 35.03 33.52 1rql n LYS 35 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1rql n ARG 36 N -1.50 3.01 -1.09 -1.58 1.74 0.71 -4.94 116.66 113.00 1rql n ARG 36 Ca 0.05 -2.42 -0.03 0.00 -0.77 0.00 0.00 57.85 54.68 1rql n ARG 36 Cb 0.23 -1.51 -0.01 0.00 -1.02 0.00 0.00 32.46 30.14 1rql n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rql n GLY 37 N 0.68 0.61 2.40 -0.13 0.00 -0.92 -4.94 105.19 102.89 1rql n GLY 37 Ca 0.18 -0.38 -0.26 0.00 0.00 0.00 0.00 46.02 45.55 1rql n GLY 37 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rql n VAL 38 N -2.75 0.94 -2.22 1.61 0.31 -0.80 -4.96 118.33 110.45 1rql n VAL 38 Ca -0.03 -4.61 -0.42 0.00 -0.01 0.00 0.00 64.34 59.26 1rql n VAL 38 Cb 0.18 -2.02 -0.03 0.00 -0.91 0.00 0.00 33.84 31.06 1rql n VAL 38 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rql s ALA 39 N -1.69 3.55 0.48 3.52 0.00 -1.26 -3.89 121.76 122.47 1rql s ALA 39 Ca 0.36 1.02 0.07 0.00 0.00 0.00 0.00 51.96 53.41 1rql s ALA 39 Cb 0.12 -3.54 0.01 0.00 0.00 0.00 0.00 23.12 19.72 1rql s ALA 39 CO -0.08 -0.66 0.42 0.96 0.00 0.00 0.00 175.76 176.41 1rql s ILE 40 N 1.41 2.25 0.17 0.00 -4.36 -1.26 -4.97 121.20 114.44 1rql s ILE 40 Ca 0.63 -1.37 0.08 0.00 -0.26 0.00 0.00 60.65 59.73 1rql s ILE 40 Cb -0.34 -2.62 -0.04 0.00 1.25 0.00 0.00 42.46 40.71 1rql s ILE 40 CO 0.29 0.00 -0.05 0.42 0.24 0.00 0.00 174.94 175.84 1rql s THR 41 N -2.60 3.45 0.35 8.37 -4.23 -1.26 -4.98 115.64 114.75 1rql s THR 41 Ca 0.45 -1.53 0.15 0.00 -1.18 0.00 0.00 61.69 59.58 1rql s THR 41 Cb -0.03 -2.72 0.34 0.00 1.34 0.00 0.00 72.50 71.44 1rql s THR 41 CO 0.27 -0.10 1.68 0.00 -0.54 0.00 0.00 174.62 175.93 1rql h ALA 42 N 2.84 2.02 0.55 3.99 0.00 -1.98 -0.47 119.26 126.22 1rql h ALA 42 Ca -0.47 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1rql h ALA 42 Cb 1.20 0.12 0.01 0.00 0.00 0.00 0.00 17.79 19.12 1rql h ALA 42 CO 0.56 -0.59 -0.27 0.93 0.00 0.00 0.00 179.25 179.88 1rql h GLU 43 N 0.36 -0.71 0.00 0.00 3.07 -1.98 -0.16 114.58 115.16 1rql h GLU 43 Ca 0.71 0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 59.59 1rql h GLU 43 Cb 1.66 0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 29.73 1rql h GLU 43 CO -0.54 -0.46 -0.14 1.05 -1.40 0.00 0.00 179.01 177.52 1rql h GLU 44 N -0.78 0.00 0.02 2.33 4.11 -1.74 0.26 114.58 118.77 1rql h GLU 44 Ca -0.08 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.09 1rql h GLU 44 Cb 0.58 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.85 1rql h GLU 44 CO 0.12 0.14 -1.05 0.00 0.07 0.00 0.00 179.01 178.29 1rql h ALA 45 N 1.86 0.16 0.00 1.06 0.00 -1.00 -3.12 119.26 118.22 1rql h ALA 45 Ca -0.00 -0.71 -0.01 0.00 0.00 0.00 0.00 54.91 54.18 1rql h ALA 45 Cb 0.72 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1rql h ALA 45 CO 0.02 0.72 -0.19 -0.09 0.00 0.00 0.00 179.25 179.72 1rql h ARG 46 N 0.34 0.00 -0.88 0.00 2.43 -0.83 -3.35 114.38 112.07 1rql h ARG 46 Ca -0.13 0.00 0.15 0.00 -0.81 0.00 0.00 59.98 59.20 1rql h ARG 46 Cb 1.71 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 31.10 1rql h ARG 46 CO 0.20 0.06 -0.32 -0.22 -1.51 0.00 0.00 179.97 178.17 1rql h LYS 47 N 0.00 -0.03 0.05 0.20 1.63 -0.42 -0.72 116.57 117.28 1rql h LYS 47 Ca -0.00 0.00 -0.23 0.00 -0.85 0.00 0.00 60.65 59.57 1rql h LYS 47 Cb 1.05 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.68 1rql h LYS 47 CO 0.01 -0.02 -1.05 -1.35 -3.45 0.00 0.00 179.45 173.59 1rql h PRO 48 N -0.03 0.23 0.00 1.90 0.11 -1.73 -3.46 132.00 129.02 1rql h PRO 48 Ca 0.35 -0.32 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1rql h PRO 48 Cb 0.61 0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1rql h PRO 48 CO -0.91 1.09 0.00 -0.12 -0.21 0.00 0.00 178.00 177.85 1rql n MET 49 N -3.58 0.00 0.00 1.05 1.56 -0.28 -3.64 117.12 112.23 1rql n MET 49 Ca -0.05 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.38 1rql n MET 49 Cb 0.92 0.00 0.00 0.00 2.15 0.00 0.00 33.22 36.29 1rql n MET 49 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1rql n GLY 50 N 0.00 0.00 3.68 -5.12 0.00 -1.26 -5.02 105.19 97.47 1rql n GLY 50 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1rql n GLY 50 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rql s LEU 51 N 0.00 2.65 -0.05 0.99 1.43 -1.24 -4.96 118.68 117.49 1rql s LEU 51 Ca 0.00 -1.48 -0.40 0.00 -1.03 0.00 0.00 54.13 51.21 1rql s LEU 51 Cb 0.00 -0.83 -0.19 0.00 0.03 0.00 0.00 46.19 45.20 1rql s LEU 51 CO 0.00 -0.61 1.20 0.18 0.23 0.00 0.00 176.35 177.35 1rql n LEU 52 N -1.09 0.50 -0.34 1.79 4.77 -1.26 -4.50 117.00 116.88 1rql n LEU 52 Ca -0.11 1.15 0.17 0.00 -0.03 0.00 0.00 56.01 57.20 1rql n LEU 52 Cb 0.67 -0.97 0.38 0.00 -2.33 0.00 0.00 43.42 41.17 1rql n LEU 52 CO 0.45 -1.58 1.15 0.11 -1.33 0.00 0.00 177.39 176.18 1rql h LYS 53 N 3.64 0.54 -0.21 3.23 1.79 -1.97 1.25 116.57 124.85 1rql h LYS 53 Ca -0.49 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 57.94 1rql h LYS 53 Cb 1.40 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 31.92 1rql h LYS 53 CO 0.72 0.36 0.12 0.82 -1.08 0.00 0.00 179.45 180.38 1rql h ILE 54 N 0.55 1.10 0.00 1.86 2.04 -1.97 -1.45 117.51 119.64 1rql h ILE 54 Ca 0.64 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 66.24 1rql h ILE 54 Cb 1.23 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1rql h ILE 54 CO -0.49 0.10 0.00 0.44 0.00 0.00 0.00 178.15 178.20 1rql h ASP 55 N 0.23 0.00 -0.38 1.72 3.32 -0.92 -2.87 116.42 117.52 1rql h ASP 55 Ca 0.07 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.99 1rql h ASP 55 Cb 0.05 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1rql h ASP 55 CO -0.01 0.00 -0.29 -0.74 -1.72 0.00 0.00 179.24 176.48 1rql h HIS 56 N 0.00 1.03 0.11 4.55 2.76 0.20 -1.24 115.15 122.56 1rql h HIS 56 Ca 0.00 -0.29 -0.01 0.00 -2.20 0.00 0.00 60.37 57.88 1rql h HIS 56 Cb 0.82 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.55 1rql h HIS 56 CO 0.00 1.08 -0.05 0.28 -1.30 0.00 0.00 177.93 177.94 1rql h VAL 57 N 0.68 1.03 -0.60 5.26 2.07 -1.17 -2.61 116.25 120.91 1rql h VAL 57 Ca 0.07 -0.55 0.15 0.00 0.82 0.00 0.00 66.70 67.19 1rql h VAL 57 Cb 0.87 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.99 1rql h VAL 57 CO 0.08 0.13 0.42 -0.09 0.02 0.00 0.00 177.57 178.13 1rql h ARG 58 N -0.40 0.15 -0.11 1.57 2.43 -1.45 -0.33 114.38 116.24 1rql h ARG 58 Ca -0.01 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1rql h ARG 58 Cb 0.33 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1rql h ARG 58 CO 0.02 0.10 0.03 0.00 -1.51 0.00 0.00 179.97 178.62 1rql h ALA 59 N 1.71 0.14 -0.75 2.80 0.00 -0.87 -2.18 119.26 120.12 1rql h ALA 59 Ca 0.29 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.11 1rql h ALA 59 Cb 0.92 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 1rql h ALA 59 CO -0.04 -0.24 0.46 -0.07 0.00 0.00 0.00 179.25 179.36 1rql h LEU 60 N -0.02 0.75 -1.44 0.00 3.38 -0.76 -1.43 115.31 115.78 1rql h LEU 60 Ca 0.03 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.14 1rql h LEU 60 Cb 0.23 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 1rql h LEU 60 CO -0.00 0.51 0.52 0.74 0.09 0.00 0.00 178.44 180.30 1rql h THR 61 N 0.89 0.85 -0.49 0.22 2.02 -0.97 -0.23 112.91 115.19 1rql h THR 61 Ca 0.31 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.29 1rql h THR 61 Cb 0.06 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 1rql h THR 61 CO -0.13 0.10 0.00 -0.62 0.37 0.00 0.00 175.52 175.25 1rql n GLU 62 N -4.51 2.41 -2.72 6.66 1.02 -0.57 -4.00 120.64 118.94 1rql n GLU 62 Ca 0.15 -1.89 -0.42 0.00 -0.02 0.00 0.00 57.16 54.98 1rql n GLU 62 Cb 0.45 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.35 1rql n GLU 62 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1rql s MET 63 N -1.45 3.17 0.10 3.49 1.75 -0.10 -4.90 119.30 121.36 1rql s MET 63 Ca 0.35 -0.52 0.04 0.00 -1.25 0.00 0.00 55.69 54.31 1rql s MET 63 Cb 0.19 -4.19 0.34 0.00 2.84 0.00 0.00 34.83 34.01 1rql s MET 63 CO 0.21 -1.94 0.46 -2.30 -0.65 0.00 0.00 175.02 170.81 1rql n PRO 64 N 8.42 -0.02 0.05 4.11 -0.02 -1.26 0.16 135.00 146.44 1rql n PRO 64 Ca -0.00 0.42 -0.09 0.00 -2.02 0.00 0.00 63.50 61.80 1rql n PRO 64 Cb 0.47 -0.72 0.05 0.00 -0.02 0.00 0.00 33.50 33.28 1rql n PRO 64 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1rql h ARG 65 N 0.00 0.40 0.18 -0.52 1.12 -1.94 -2.80 114.38 110.82 1rql h ARG 65 Ca 0.23 -0.31 -0.30 0.00 -1.11 0.00 0.00 59.98 58.49 1rql h ARG 65 Cb 0.57 0.06 0.02 0.00 -0.01 0.00 0.00 29.97 30.60 1rql h ARG 65 CO -0.24 0.93 -1.41 0.82 -3.11 0.00 0.00 179.97 176.97 1rql h ILE 66 N 0.28 1.18 -0.41 1.20 2.04 0.13 -3.25 117.51 118.68 1rql h ILE 66 Ca -0.02 -2.55 0.07 0.00 1.00 0.00 0.00 64.86 63.36 1rql h ILE 66 Cb 1.24 2.93 -0.06 0.00 -0.74 0.00 0.00 36.82 40.18 1rql h ILE 66 CO 0.12 0.78 0.02 0.00 0.00 0.00 0.00 178.15 179.06 1rql h ALA 67 N 0.08 0.39 0.14 1.87 0.00 -1.02 -0.54 119.26 120.18 1rql h ALA 67 Ca -0.27 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1rql h ALA 67 Cb 1.96 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.93 1rql h ALA 67 CO 0.18 -0.38 -0.07 0.66 0.00 0.00 0.00 179.25 179.64 1rql h SER 68 N 0.12 -0.17 0.02 0.00 4.64 -1.64 -1.33 113.55 115.21 1rql h SER 68 Ca 0.20 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1rql h SER 68 Cb 0.28 0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1rql h SER 68 CO -0.32 -0.12 -0.02 -0.33 -0.87 0.00 0.00 176.83 175.18 1rql h GLU 69 N -0.19 0.00 -0.15 4.77 4.39 -1.49 -0.46 114.58 121.45 1rql h GLU 69 Ca -0.02 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.57 1rql h GLU 69 Cb 0.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1rql h GLU 69 CO 0.03 0.02 -0.35 2.35 -1.16 0.00 0.00 179.01 179.89 1rql h TRP 70 N 0.00 0.65 0.00 4.33 2.91 -0.64 -2.15 115.95 121.04 1rql h TRP 70 Ca -0.00 -0.24 0.00 0.00 1.13 0.00 0.00 58.89 59.78 1rql h TRP 70 Cb 0.03 -0.12 0.00 0.00 -0.51 0.00 0.00 29.16 28.57 1rql h TRP 70 CO 0.00 0.98 0.00 -0.97 -1.03 0.00 0.00 178.44 177.42 1rql h ASN 71 N 0.13 0.00 0.08 2.65 -1.24 -0.16 0.68 115.58 117.72 1rql h ASN 71 Ca -0.00 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 56.90 1rql h ASN 71 Cb 0.96 0.00 0.01 0.00 0.73 0.00 0.00 38.32 40.02 1rql h ASN 71 CO 0.08 0.00 -0.50 -0.09 -1.29 0.00 0.00 177.43 175.63 1rql h ARG 72 N 0.00 0.17 0.54 6.67 1.12 -0.86 -0.79 114.38 121.23 1rql h ARG 72 Ca 0.00 -0.29 -0.03 0.00 -1.11 0.00 0.00 59.98 58.56 1rql h ARG 72 Cb 0.34 0.11 0.01 0.00 -0.01 0.00 0.00 29.97 30.42 1rql h ARG 72 CO 0.00 1.14 -0.26 0.28 -3.11 0.00 0.00 179.97 178.02 1rql h VAL 73 N -0.64 0.00 -0.10 0.20 2.07 -0.95 -3.29 116.25 113.54 1rql h VAL 73 Ca -0.09 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1rql h VAL 73 Cb 1.37 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1rql h VAL 73 CO 0.08 0.00 0.00 0.49 0.02 0.00 0.00 177.57 178.16 1rql n PHE 74 N -4.81 0.13 -3.69 1.57 3.01 0.19 -4.91 117.46 108.95 1rql n PHE 74 Ca -0.09 -0.06 -0.28 0.00 1.01 0.00 0.00 57.45 58.03 1rql n PHE 74 Cb 0.29 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.77 1rql n PHE 74 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1rql n ARG 75 N -0.12 -4.40 -3.64 -1.08 1.74 -0.32 -4.88 116.66 103.96 1rql n ARG 75 Ca 0.15 0.55 -0.02 0.00 -0.77 0.00 0.00 57.85 57.76 1rql n ARG 75 Cb 0.22 -5.36 -0.03 0.00 -1.02 0.00 0.00 32.46 26.28 1rql n ARG 75 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1rql s GLN 76 N -6.37 0.04 0.45 5.56 0.74 -1.12 -5.00 119.66 113.95 1rql s GLN 76 Ca 0.56 -0.01 -0.14 0.00 0.05 0.00 0.00 55.36 55.82 1rql s GLN 76 Cb -0.28 0.02 -0.07 0.00 1.10 0.00 0.00 33.01 33.77 1rql s GLN 76 CO 0.68 -0.02 0.87 -0.51 -0.55 0.00 0.00 175.29 175.77 1rql s LEU 77 N -1.69 3.76 0.41 3.68 1.43 -1.26 -3.44 118.68 121.57 1rql s LEU 77 Ca 0.11 1.36 -0.23 0.00 -1.03 0.00 0.00 54.13 54.34 1rql s LEU 77 Cb -0.01 -4.26 -0.13 0.00 0.03 0.00 0.00 46.19 41.82 1rql s LEU 77 CO -0.04 -0.47 0.57 -2.65 0.23 0.00 0.00 176.35 173.98 1rql n PRO 78 N -1.34 0.59 -4.24 1.29 -0.02 -1.26 -4.99 135.00 125.03 1rql n PRO 78 Ca 0.05 0.22 -0.28 0.00 -2.02 0.00 0.00 63.50 61.46 1rql n PRO 78 Cb 0.54 -1.51 -0.09 0.00 -0.02 0.00 0.00 33.50 32.42 1rql n PRO 78 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1rql s THR 79 N -1.45 3.40 0.60 3.45 -4.23 -1.26 -4.97 115.64 111.18 1rql s THR 79 Ca 0.63 -1.46 0.29 0.00 -1.18 0.00 0.00 61.69 59.97 1rql s THR 79 Cb -0.61 -2.66 0.37 0.00 1.34 0.00 0.00 72.50 70.93 1rql s THR 79 CO 0.58 -0.03 1.89 -0.08 -0.54 0.00 0.00 174.62 176.43 1rql h GLU 80 N 3.09 0.00 -0.26 3.99 4.57 -2.00 0.78 114.58 124.75 1rql h GLU 80 Ca -0.48 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 57.53 1rql h GLU 80 Cb 1.19 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.78 1rql h GLU 80 CO 0.55 0.00 -0.54 0.00 -1.18 0.00 0.00 179.01 177.84 1rql h ALA 81 N 1.42 0.55 -0.47 2.92 0.00 -1.99 -2.49 119.26 119.21 1rql h ALA 81 Ca 0.19 -0.51 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1rql h ALA 81 Cb 1.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1rql h ALA 81 CO -0.00 0.68 0.15 -0.44 0.00 0.00 0.00 179.25 179.64 1rql h ASP 82 N 0.60 0.68 -0.44 0.00 3.32 0.18 -1.20 116.42 119.56 1rql h ASP 82 Ca 0.02 -0.21 0.03 0.00 0.02 0.00 0.00 57.03 56.89 1rql h ASP 82 Cb 1.12 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 40.46 1rql h ASP 82 CO 0.11 0.71 0.23 0.40 -1.72 0.00 0.00 179.24 178.97 1rql h ILE 83 N 0.62 0.99 -0.02 0.35 1.08 -1.31 0.20 117.51 119.43 1rql h ILE 83 Ca 0.15 -0.16 -0.06 0.00 -0.39 0.00 0.00 64.86 64.40 1rql h ILE 83 Cb 0.27 0.48 -0.01 0.00 -3.07 0.00 0.00 36.82 34.49 1rql h ILE 83 CO -0.00 0.09 -0.28 -0.61 -0.69 0.00 0.00 178.15 176.65 1rql h GLN 84 N 0.47 0.03 0.07 2.37 5.75 -1.14 0.08 115.11 122.74 1rql h GLN 84 Ca 0.19 -0.01 -0.19 0.00 -0.15 0.00 0.00 58.65 58.49 1rql h GLN 84 Cb 0.07 -0.00 0.02 0.00 1.07 0.00 0.00 27.48 28.64 1rql h GLN 84 CO -0.12 0.30 -0.80 1.49 -2.65 0.00 0.00 178.83 177.06 1rql h GLU 85 N 0.03 0.41 0.00 1.69 4.81 -0.54 -2.79 114.58 118.18 1rql h GLU 85 Ca 0.00 -0.54 -0.05 0.00 -0.13 0.00 0.00 59.36 58.64 1rql h GLU 85 Cb 0.50 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1rql h GLU 85 CO 0.04 1.21 -0.23 0.52 -0.73 0.00 0.00 179.01 179.81 1rql h MET 86 N -0.14 0.00 -0.07 1.92 2.86 -0.38 -1.88 114.93 117.25 1rql h MET 86 Ca -0.12 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.37 1rql h MET 86 Cb 1.55 0.00 0.01 0.00 0.06 0.00 0.00 31.60 33.21 1rql h MET 86 CO 0.15 0.23 -0.53 -0.92 1.06 0.00 0.00 176.91 176.91 1rql h TYR 87 N 0.00 0.66 -0.84 -0.22 3.20 -1.01 -1.42 116.97 117.34 1rql h TYR 87 Ca -0.00 -0.31 0.01 0.00 3.14 0.00 0.00 58.73 61.56 1rql h TYR 87 Cb 0.44 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.58 1rql h TYR 87 CO 0.00 1.10 0.55 0.93 -1.64 0.00 0.00 178.16 179.10 1rql h GLU 88 N 0.04 1.12 -0.47 1.82 5.08 -1.25 -2.42 114.58 118.50 1rql h GLU 88 Ca -0.05 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 1rql h GLU 88 Cb 1.19 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.17 1rql h GLU 88 CO 0.11 0.75 0.09 1.49 -1.00 0.00 0.00 179.01 180.45 1rql h GLU 89 N 1.15 0.77 -0.54 2.33 4.81 -1.35 -2.79 114.58 118.96 1rql h GLU 89 Ca 0.31 -0.20 0.11 0.00 -0.13 0.00 0.00 59.36 59.45 1rql h GLU 89 Cb -0.12 -0.09 -0.09 0.00 0.63 0.00 0.00 28.75 29.08 1rql h GLU 89 CO -0.07 0.77 -0.03 0.35 -0.73 0.00 0.00 179.01 179.31 1rql h PHE 90 N 0.64 -0.08 0.84 0.92 3.57 -0.77 -2.05 116.94 120.00 1rql h PHE 90 Ca 0.14 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 1rql h PHE 90 Cb 0.36 0.12 0.01 0.00 2.79 0.00 0.00 35.95 39.23 1rql h PHE 90 CO 0.02 -0.15 -0.41 0.93 -2.23 0.00 0.00 178.31 176.48 1rql h GLU 91 N 0.09 -1.09 -0.90 1.11 5.08 -1.37 -0.97 114.58 116.54 1rql h GLU 91 Ca 0.27 0.07 0.25 0.00 -1.00 0.00 0.00 59.36 58.96 1rql h GLU 91 Cb 0.43 0.25 -0.15 0.00 0.50 0.00 0.00 28.75 29.78 1rql h GLU 91 CO -0.48 -0.72 0.25 1.49 -1.00 0.00 0.00 179.01 178.55 1rql h GLU 92 N -1.19 0.19 -0.07 2.33 4.81 -1.22 0.20 114.58 119.64 1rql h GLU 92 Ca -0.12 -0.01 -0.23 0.00 -0.13 0.00 0.00 59.36 58.87 1rql h GLU 92 Cb 0.88 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.22 1rql h GLU 92 CO 0.19 0.13 -0.88 0.82 -0.73 0.00 0.00 179.01 178.54 1rql h ILE 93 N 0.20 1.31 -0.26 2.32 2.04 -1.33 -2.87 117.51 118.91 1rql h ILE 93 Ca 0.57 -2.16 -0.01 0.00 1.00 0.00 0.00 64.86 64.27 1rql h ILE 93 Cb 1.19 2.19 -0.01 0.00 -0.74 0.00 0.00 36.82 39.44 1rql h ILE 93 CO -0.67 0.67 0.14 0.25 0.00 0.00 0.00 178.15 178.53 1rql h LEU 94 N 0.41 0.34 -0.51 1.44 5.85 0.51 -1.92 115.31 121.42 1rql h LEU 94 Ca -0.08 -0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.60 1rql h LEU 94 Cb 1.51 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 42.39 1rql h LEU 94 CO 0.17 0.35 0.19 -0.26 -0.34 0.00 0.00 178.44 178.55 1rql h PHE 95 N 0.30 0.34 -0.50 1.25 0.04 -0.75 0.11 116.94 117.73 1rql h PHE 95 Ca 0.09 0.03 0.07 0.00 2.80 0.00 0.00 57.97 60.96 1rql h PHE 95 Cb 0.09 -0.08 -0.06 0.00 2.20 0.00 0.00 35.95 38.11 1rql h PHE 95 CO -0.03 0.12 0.16 0.00 -0.60 0.00 0.00 178.31 177.96 1rql h ALA 96 N 1.34 0.60 -0.18 2.45 0.00 -1.20 -3.19 119.26 119.07 1rql h ALA 96 Ca 0.25 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1rql h ALA 96 Cb 0.25 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1rql h ALA 96 CO -0.24 -0.24 0.00 0.44 0.00 0.00 0.00 179.25 179.21 1rql n ILE 97 N -5.03 0.29 -0.26 0.00 -6.64 -0.77 -4.59 119.36 102.36 1rql n ILE 97 Ca 0.05 -0.64 0.08 0.00 -1.77 0.00 0.00 62.75 60.47 1rql n ILE 97 Cb 0.22 1.13 0.32 0.00 -1.44 0.00 0.00 39.64 39.87 1rql n ILE 97 CO 0.00 0.00 0.00 0.25 -1.77 0.00 0.00 176.55 175.03 1rql h LEU 98 N 3.58 0.75 -1.50 7.28 5.85 -0.78 -2.07 115.31 128.41 1rql h LEU 98 Ca 0.00 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.76 1rql h LEU 98 Cb 0.81 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 1rql h LEU 98 CO 0.00 0.44 0.36 -0.65 -0.34 0.00 0.00 178.44 178.25 1rql h PRO 99 N 0.82 0.65 0.00 5.25 0.11 -1.81 -1.79 132.00 135.24 1rql h PRO 99 Ca 0.40 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.47 1rql h PRO 99 Cb 0.45 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.41 1rql h PRO 99 CO -0.17 0.43 0.00 -2.13 -0.21 0.00 0.00 178.00 175.92 1rql n ARG 100 N -4.46 0.05 0.00 1.05 0.63 -0.78 -2.55 116.66 110.59 1rql n ARG 100 Ca 0.06 0.35 0.03 0.00 -0.92 0.00 0.00 57.85 57.37 1rql n ARG 100 Cb 0.10 -1.60 0.00 0.00 0.45 0.00 0.00 32.46 31.42 1rql n ARG 100 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1rql n TYR 101 N -1.69 0.00 0.81 -0.14 4.02 -0.69 -4.70 117.16 114.77 1rql n TYR 101 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 1rql n TYR 101 Cb 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.47 1rql n TYR 101 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1rql n ALA 102 N -0.25 2.22 -2.53 -0.72 0.00 -1.06 -1.62 120.51 116.55 1rql n ALA 102 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.06 1rql n ALA 102 Cb 0.14 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.55 1rql n ALA 102 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1rql s SER 103 N -0.17 7.35 0.10 0.00 0.01 -1.26 -3.82 113.70 115.91 1rql s SER 103 Ca 0.00 1.63 -0.31 0.00 1.31 0.00 0.00 55.95 58.58 1rql s SER 103 Cb 0.00 -2.55 -0.10 0.00 0.21 0.00 0.00 66.02 63.59 1rql s SER 103 CO 0.00 -0.15 1.78 -2.84 0.41 0.00 0.00 173.24 172.44 1rql s PRO 104 N 0.54 4.16 -0.08 12.44 0.02 -1.26 -3.61 135.00 147.20 1rql s PRO 104 Ca 0.47 2.51 -0.34 0.00 0.02 0.00 0.00 61.00 63.66 1rql s PRO 104 Cb -0.21 -3.62 -0.12 0.00 0.02 0.00 0.00 34.50 30.57 1rql s PRO 104 CO 0.27 -0.81 1.87 -0.89 -0.33 0.00 0.00 177.00 177.11 1rql n ILE 105 N 4.77 0.56 -0.19 2.83 5.41 -0.69 -4.79 119.36 127.26 1rql n ILE 105 Ca 0.17 -0.10 0.16 0.00 1.00 0.00 0.00 62.75 63.98 1rql n ILE 105 Cb 0.39 -1.86 0.27 0.00 -0.71 0.00 0.00 39.64 37.74 1rql n ILE 105 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1rql n ASN 106 N 6.50 0.09 -0.02 4.38 3.02 -1.26 -1.34 115.26 126.63 1rql n ASN 106 Ca 0.22 0.56 -0.10 0.00 -0.03 0.00 0.00 54.58 55.24 1rql n ASN 106 Cb 0.29 -0.28 -0.08 0.00 -0.61 0.00 0.00 39.78 39.11 1rql n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rql h ALA 107 N 0.65 -0.07 -0.73 5.41 0.00 -1.99 -3.41 119.26 119.11 1rql h ALA 107 Ca 0.36 -0.28 0.12 0.00 0.00 0.00 0.00 54.91 55.10 1rql h ALA 107 Cb 1.14 0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.84 1rql h ALA 107 CO -0.19 -0.11 -0.27 0.28 0.00 0.00 0.00 179.25 178.96 1rql n VAL 108 N -4.77 -0.37 -0.17 0.00 0.31 -0.45 -2.95 118.33 109.93 1rql n VAL 108 Ca -0.07 1.71 -0.03 0.00 -0.01 0.00 0.00 64.34 65.95 1rql n VAL 108 Cb 0.29 -2.28 0.04 0.00 -0.91 0.00 0.00 33.84 30.97 1rql n VAL 108 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1rql h LYS 109 N 0.00 -0.04 -0.78 5.55 1.57 -1.80 -1.05 116.57 120.03 1rql h LYS 109 Ca 0.27 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.04 1rql h LYS 109 Cb 0.46 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.74 1rql h LYS 109 CO -0.73 -0.03 0.43 1.05 -0.57 0.00 0.00 179.45 179.60 1rql h GLU 110 N -0.04 1.09 -0.07 3.15 9.09 -1.83 -2.08 114.58 123.88 1rql h GLU 110 Ca 0.25 -0.12 0.03 0.00 0.05 0.00 0.00 59.36 59.57 1rql h GLU 110 Cb 0.43 -0.21 -0.04 0.00 -1.65 0.00 0.00 28.75 27.28 1rql h GLU 110 CO -0.57 0.80 -0.14 0.28 0.05 0.00 0.00 179.01 179.43 1rql h VAL 111 N 1.08 0.63 -0.89 -1.06 2.07 -1.35 -0.79 116.25 115.95 1rql h VAL 111 Ca 0.28 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.90 1rql h VAL 111 Cb 0.03 0.63 -0.08 0.00 -1.52 0.00 0.00 31.29 30.35 1rql h VAL 111 CO -0.04 0.00 0.52 0.40 0.02 0.00 0.00 177.57 178.47 1rql h ILE 112 N -0.20 0.90 -0.68 4.57 1.08 -0.91 -0.74 117.51 121.53 1rql h ILE 112 Ca 0.07 -0.29 0.01 0.00 -0.39 0.00 0.00 64.86 64.26 1rql h ILE 112 Cb 0.30 -0.02 -0.04 0.00 -3.07 0.00 0.00 36.82 33.99 1rql h ILE 112 CO -0.19 0.16 0.45 0.00 -0.69 0.00 0.00 178.15 177.87 1rql h ALA 113 N 1.49 0.87 -0.16 1.87 0.00 -0.64 -1.43 119.26 121.26 1rql h ALA 113 Ca 0.44 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 1rql h ALA 113 Cb 0.42 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1rql h ALA 113 CO -0.26 0.27 0.05 1.03 0.00 0.00 0.00 179.25 180.34 1rql h SER 114 N 0.91 0.23 -0.94 0.00 0.87 0.21 -2.71 113.55 112.13 1rql h SER 114 Ca 0.26 -0.21 0.01 0.00 -1.23 0.00 0.00 61.79 60.62 1rql h SER 114 Cb -0.08 -0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 61.77 1rql h SER 114 CO -0.07 0.38 0.63 -0.07 -0.53 0.00 0.00 176.83 177.17 1rql h LEU 115 N 0.08 1.08 -1.46 2.23 3.38 -1.00 -1.90 115.31 117.72 1rql h LEU 115 Ca 0.05 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1rql h LEU 115 Cb 0.23 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1rql h LEU 115 CO -0.00 0.78 -0.27 0.03 0.09 0.00 0.00 178.44 179.07 1rql h ARG 116 N 1.28 0.00 -0.11 1.13 3.08 -1.16 -1.55 114.38 117.05 1rql h ARG 116 Ca 0.35 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.26 1rql h ARG 116 Cb -0.15 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 1rql h ARG 116 CO -0.07 0.27 -0.53 0.93 -1.07 0.00 0.00 179.97 179.49 1rql h GLU 117 N 0.00 0.31 -0.52 0.04 5.08 -1.03 -2.34 114.58 116.13 1rql h GLU 117 Ca -0.00 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1rql h GLU 117 Cb 0.51 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1rql h GLU 117 CO 0.04 0.77 0.00 0.54 -1.00 0.00 0.00 179.01 179.36 1rql n ARG 118 N -3.93 1.06 -1.11 2.33 1.74 -0.87 -4.83 116.66 111.04 1rql n ARG 118 Ca -0.02 -0.06 -0.04 0.00 -0.77 0.00 0.00 57.85 56.96 1rql n ARG 118 Cb 0.57 -1.27 -0.02 0.00 -1.02 0.00 0.00 32.46 30.73 1rql n ARG 118 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rql n GLY 119 N 0.26 0.52 3.67 -0.13 0.00 -0.88 -4.96 105.19 103.66 1rql n GLY 119 Ca 0.01 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1rql n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rql s ILE 120 N -1.66 4.90 0.45 -0.61 1.01 -0.64 -5.00 121.20 119.66 1rql s ILE 120 Ca 0.00 1.57 -0.23 0.00 0.00 0.00 0.00 60.65 61.99 1rql s ILE 120 Cb 0.00 -4.11 -0.08 0.00 0.01 0.00 0.00 42.46 38.28 1rql s ILE 120 CO 0.00 0.05 1.16 -0.54 0.00 0.00 0.00 174.94 175.61 1rql s LYS 121 N 2.06 3.82 -0.27 2.79 1.02 -0.59 -4.04 119.74 124.53 1rql s LYS 121 Ca 0.37 1.78 -0.04 0.00 0.02 0.00 0.00 55.97 58.10 1rql s LYS 121 Cb -0.17 -2.46 0.02 0.00 -0.52 0.00 0.00 37.83 34.71 1rql s LYS 121 CO 0.12 -0.50 0.00 0.42 -0.92 0.00 0.00 175.35 174.48 1rql s ILE 122 N -1.53 3.34 0.44 2.17 -1.09 -1.26 -2.35 121.20 120.92 1rql s ILE 122 Ca 0.62 -0.92 0.01 0.00 -2.23 0.00 0.00 60.65 58.13 1rql s ILE 122 Cb -0.29 -2.73 0.01 0.00 -1.58 0.00 0.00 42.46 37.87 1rql s ILE 122 CO 0.35 0.12 0.07 0.61 -1.23 0.00 0.00 174.94 174.86 1rql n GLY 123 N 4.75 3.47 3.58 6.18 0.00 -0.39 -0.51 105.19 122.27 1rql n GLY 123 Ca -0.15 -2.33 -0.07 0.00 0.00 0.00 0.00 46.02 43.46 1rql n GLY 123 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rql s SER 124 N -3.45 -0.26 0.22 1.61 1.04 -1.17 -0.75 113.70 110.94 1rql s SER 124 Ca 0.06 0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.66 1rql s SER 124 Cb -0.00 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 1rql s SER 124 CO 0.04 -0.32 0.10 0.42 0.98 0.00 0.00 173.24 174.46 1rql s THR 125 N -1.80 0.28 0.30 2.02 -4.23 -0.55 -2.64 115.64 109.01 1rql s THR 125 Ca 0.04 -1.99 -0.20 0.00 -1.18 0.00 0.00 61.69 58.36 1rql s THR 125 Cb -0.01 -2.50 0.03 0.00 1.34 0.00 0.00 72.50 71.36 1rql s THR 125 CO -0.03 -0.07 0.73 0.28 -0.54 0.00 0.00 174.62 174.99 1rql s THR 126 N -3.96 0.00 -0.04 3.99 -1.32 -1.22 -3.66 115.64 109.43 1rql s THR 126 Ca 0.36 -1.01 0.19 0.00 -1.21 0.00 0.00 61.69 60.02 1rql s THR 126 Cb 0.07 -2.20 -0.29 0.00 -1.51 0.00 0.00 72.50 68.57 1rql s THR 126 CO 0.11 0.00 0.42 0.61 -2.21 0.00 0.00 174.62 173.56 1rql n GLY 127 N -0.47 -0.86 3.78 6.08 0.00 -1.26 -4.38 105.19 108.07 1rql n GLY 127 Ca -0.05 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 1rql n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rql s TYR 128 N -3.30 2.73 0.76 1.61 2.02 -1.26 -4.90 117.35 115.01 1rql s TYR 128 Ca -0.07 1.55 -0.11 0.00 -0.37 0.00 0.00 57.07 58.07 1rql s TYR 128 Cb 0.12 -3.29 0.05 0.00 -0.40 0.00 0.00 41.96 38.44 1rql s TYR 128 CO 0.78 -1.51 1.09 0.95 -1.57 0.00 0.00 175.55 175.30 1rql s THR 129 N -1.75 3.35 0.26 -0.71 -4.23 -1.26 -4.46 115.64 106.84 1rql s THR 129 Ca 0.71 0.44 -0.01 0.00 -1.18 0.00 0.00 61.69 61.64 1rql s THR 129 Cb -0.24 -3.21 0.25 0.00 1.34 0.00 0.00 72.50 70.63 1rql s THR 129 CO 0.27 -0.57 1.81 -0.09 -0.54 0.00 0.00 174.62 175.51 1rql h ARG 130 N -0.95 0.83 0.06 3.99 2.43 -1.95 0.29 114.38 119.08 1rql h ARG 130 Ca -0.46 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 58.68 1rql h ARG 130 Cb 1.25 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 30.57 1rql h ARG 130 CO 0.59 0.55 -0.42 0.93 -1.51 0.00 0.00 179.97 180.12 1rql h GLU 131 N 0.86 -0.59 -0.37 0.20 5.08 -2.01 -0.62 114.58 117.13 1rql h GLU 131 Ca 0.45 0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.89 1rql h GLU 131 Cb 0.46 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 1rql h GLU 131 CO -0.27 -0.39 0.14 0.52 -1.00 0.00 0.00 179.01 178.01 1rql h MET 132 N -0.61 0.29 -0.91 2.33 2.86 -1.68 -2.64 114.93 114.57 1rql h MET 132 Ca 0.03 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.70 1rql h MET 132 Cb 0.66 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.20 1rql h MET 132 CO -0.28 0.19 0.59 0.52 1.06 0.00 0.00 176.91 179.00 1rql h MET 133 N 0.30 1.07 -0.61 1.72 2.86 -0.62 -0.31 114.93 119.33 1rql h MET 133 Ca 0.17 -0.06 0.10 0.00 -2.06 0.00 0.00 59.70 57.85 1rql h MET 133 Cb 0.14 -0.24 -0.08 0.00 0.06 0.00 0.00 31.60 31.48 1rql h MET 133 CO -0.16 0.71 0.19 -0.44 1.06 0.00 0.00 176.91 178.26 1rql h ASP 134 N 1.10 0.14 -0.11 1.22 3.32 -0.74 0.97 116.42 122.32 1rql h ASP 134 Ca 0.37 0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.49 1rql h ASP 134 Cb 0.09 0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1rql h ASP 134 CO -0.12 0.08 -0.05 0.40 -1.72 0.00 0.00 179.24 177.83 1rql h ILE 135 N 0.35 1.31 -0.17 0.35 2.04 -1.29 -2.20 117.51 117.91 1rql h ILE 135 Ca 0.32 -1.05 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 1rql h ILE 135 Cb 0.43 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1rql h ILE 135 CO -0.35 0.30 0.03 0.58 0.00 0.00 0.00 178.15 178.71 1rql h VAL 136 N -0.11 1.22 -0.90 1.67 2.07 -0.42 -2.75 116.25 117.04 1rql h VAL 136 Ca 0.03 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 1rql h VAL 136 Cb 0.49 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 1rql h VAL 136 CO 0.02 0.22 0.54 0.00 0.02 0.00 0.00 177.57 178.37 1rql h ALA 137 N 0.81 1.27 -0.08 1.67 0.00 0.89 -1.16 119.26 122.67 1rql h ALA 137 Ca 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1rql h ALA 137 Cb 0.31 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1rql h ALA 137 CO 0.00 0.63 0.03 -0.22 0.00 0.00 0.00 179.25 179.69 1rql h LYS 138 N 1.23 0.12 -0.39 0.00 3.64 -1.32 -1.45 116.57 118.40 1rql h LYS 138 Ca 0.32 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.58 1rql h LYS 138 Cb -0.05 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1rql h LYS 138 CO -0.06 0.25 -0.16 1.49 -2.27 0.00 0.00 179.45 178.70 1rql h GLU 139 N -0.04 0.73 -0.43 1.90 4.57 -1.33 -2.81 114.58 117.18 1rql h GLU 139 Ca 0.03 -0.26 -0.10 0.00 -1.18 0.00 0.00 59.36 57.84 1rql h GLU 139 Cb 0.18 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 1rql h GLU 139 CO -0.00 0.85 -0.15 0.00 -1.18 0.00 0.00 179.01 178.53 1rql h ALA 140 N 1.17 0.94 -0.54 2.92 0.00 -1.06 -1.60 119.26 121.08 1rql h ALA 140 Ca 0.10 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1rql h ALA 140 Cb 0.64 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1rql h ALA 140 CO 0.04 0.62 0.01 0.00 0.00 0.00 0.00 179.25 179.93 1rql h ALA 141 N 1.12 1.00 -0.30 0.00 0.00 -0.86 0.13 119.26 120.35 1rql h ALA 141 Ca 0.11 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 1rql h ALA 141 Cb 0.65 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1rql h ALA 141 CO 0.05 0.61 -0.24 -0.07 0.00 0.00 0.00 179.25 179.60 1rql h LEU 142 N 0.85 0.59 -1.69 0.00 3.38 -1.25 -2.79 115.31 114.40 1rql h LEU 142 Ca 0.16 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1rql h LEU 142 Cb 0.48 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1rql h LEU 142 CO 0.02 0.82 0.00 0.00 0.09 0.00 0.00 178.44 179.37 1rql n GLN 143 N -4.12 2.22 -0.07 1.13 6.02 -0.62 -4.90 117.38 117.04 1rql n GLN 143 Ca -0.00 -1.09 0.00 0.00 -0.01 0.00 0.00 57.00 55.90 1rql n GLN 143 Cb 0.42 -1.64 0.00 0.00 1.02 0.00 0.00 30.24 30.03 1rql n GLN 143 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1rql n GLY 144 N 0.39 0.49 3.11 1.08 0.00 -0.78 -4.68 105.19 104.81 1rql n GLY 144 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1rql n GLY 144 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1rql s TYR 145 N -2.15 2.07 -0.29 1.61 5.04 0.37 -4.98 117.35 119.03 1rql s TYR 145 Ca 0.00 -0.88 0.03 0.00 -2.44 0.00 0.00 57.07 53.78 1rql s TYR 145 Cb 0.00 -1.44 0.17 0.00 0.35 0.00 0.00 41.96 41.04 1rql s TYR 145 CO 0.00 -0.40 0.48 0.21 -1.34 0.00 0.00 175.55 174.50 1rql s LYS 146 N 0.65 0.47 0.89 4.97 2.20 -1.26 -2.34 119.74 125.32 1rql s LYS 146 Ca -0.13 0.36 -0.11 0.00 -0.36 0.00 0.00 55.97 55.73 1rql s LYS 146 Cb -0.16 -0.07 0.13 0.00 -1.51 0.00 0.00 37.83 36.22 1rql s LYS 146 CO 0.04 -0.98 1.10 -1.25 -0.36 0.00 0.00 175.35 173.89 1rql s PRO 147 N 2.66 1.25 0.47 4.03 0.04 -1.26 -4.91 135.00 137.29 1rql s PRO 147 Ca 0.11 1.11 0.26 0.00 0.04 0.00 0.00 61.00 62.51 1rql s PRO 147 Cb -0.12 -1.79 1.06 0.00 0.04 0.00 0.00 34.50 33.69 1rql s PRO 147 CO -0.27 -2.33 1.88 -0.44 0.04 0.00 0.00 177.00 175.88 1rql h ASP 148 N -1.62 0.00 -5.08 6.66 3.32 -1.15 -3.45 116.42 115.10 1rql h ASP 148 Ca -0.47 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.52 1rql h ASP 148 Cb 1.27 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.68 1rql h ASP 148 CO 0.50 0.18 -0.11 0.12 -1.72 0.00 0.00 179.24 178.21 1rql s PHE 149 N -3.72 -0.17 -0.05 4.55 5.36 -1.11 -5.03 117.98 117.81 1rql s PHE 149 Ca 0.00 -0.13 -0.11 0.00 -0.96 0.00 0.00 56.93 55.73 1rql s PHE 149 Cb 0.10 0.22 0.02 0.00 -0.34 0.00 0.00 43.02 43.02 1rql s PHE 149 CO 0.62 -0.67 0.27 -1.17 -1.46 0.00 0.00 175.22 172.81 1rql s LEU 150 N -2.72 1.00 0.01 6.12 2.96 -1.26 -3.03 118.68 121.76 1rql s LEU 150 Ca 0.02 0.25 -0.03 0.00 -0.22 0.00 0.00 54.13 54.15 1rql s LEU 150 Cb 0.02 1.03 -0.01 0.00 0.50 0.00 0.00 46.19 47.73 1rql s LEU 150 CO -0.11 -0.28 0.05 -0.69 -1.32 0.00 0.00 176.35 174.00 1rql s VAL 151 N -0.69 0.10 0.31 1.68 1.01 -1.08 -5.00 120.40 116.73 1rql s VAL 151 Ca -0.08 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.14 1rql s VAL 151 Cb -0.04 -0.34 -0.06 0.00 0.00 0.00 0.00 36.38 35.94 1rql s VAL 151 CO 0.02 -0.44 0.08 0.42 0.00 0.00 0.00 175.10 175.18 1rql s THR 152 N -1.40 0.94 0.51 3.92 -4.23 -1.26 -3.37 115.64 110.74 1rql s THR 152 Ca -0.15 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 58.55 1rql s THR 152 Cb -0.09 -2.71 0.34 0.00 1.34 0.00 0.00 72.50 71.38 1rql s THR 152 CO 0.00 0.00 2.05 -0.65 -0.54 0.00 0.00 174.62 175.48 1rql h PRO 153 N 2.18 0.09 -0.34 3.99 0.11 -1.78 -1.10 132.00 135.15 1rql h PRO 153 Ca -0.40 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.77 1rql h PRO 153 Cb 1.25 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 1rql h PRO 153 CO 0.66 0.06 0.23 -0.44 -0.21 0.00 0.00 178.00 178.30 1rql h ASP 154 N 0.09 0.17 1.43 -2.05 3.32 -1.96 -1.36 116.42 116.07 1rql h ASP 154 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1rql h ASP 154 Cb 0.56 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1rql h ASP 154 CO -0.02 0.11 0.00 0.44 -1.72 0.00 0.00 179.24 178.06 1rql h ASP 155 N 0.20 0.00 -2.14 6.45 3.32 -1.60 -3.47 116.42 119.18 1rql h ASP 155 Ca 0.15 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.62 1rql h ASP 155 Cb 0.35 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.77 1rql h ASP 155 CO -0.03 0.00 -0.58 0.68 -1.72 0.00 0.00 179.24 177.60 1rql s VAL 156 N -3.42 1.41 0.40 -1.35 -7.23 -0.51 -5.04 120.40 104.66 1rql s VAL 156 Ca 0.04 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.31 1rql s VAL 156 Cb 0.08 -2.70 0.19 0.00 0.56 0.00 0.00 36.38 34.51 1rql s VAL 156 CO 0.59 0.00 1.97 -0.65 -0.31 0.00 0.00 175.10 176.70 1rql h PRO 157 N 1.81 0.31 -2.02 4.82 0.11 -1.91 -3.45 132.00 131.68 1rql h PRO 157 Ca -0.42 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.58 1rql h PRO 157 Cb 1.26 -0.05 -0.20 0.00 0.11 0.00 0.00 31.00 32.12 1rql h PRO 157 CO 0.73 0.35 0.17 0.00 -0.21 0.00 0.00 178.00 179.04 1rql s ALA 158 N -4.96 -1.76 0.56 -0.75 0.00 -1.26 -5.09 121.76 108.50 1rql s ALA 158 Ca -0.06 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.37 1rql s ALA 158 Cb 0.16 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.00 1rql s ALA 158 CO 0.73 -0.36 0.00 0.41 0.00 0.00 0.00 175.76 176.54 1rql n GLY 159 N 1.34 0.71 3.76 0.00 0.00 -1.26 -4.69 105.19 105.05 1rql n GLY 159 Ca -0.18 -1.40 -0.36 0.00 0.00 0.00 0.00 46.02 44.08 1rql n GLY 159 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rql s ARG 160 N 0.00 3.14 0.00 1.61 0.52 -1.26 -1.86 118.95 121.10 1rql s ARG 160 Ca 0.00 1.74 0.11 0.00 -0.52 0.00 0.00 55.73 57.07 1rql s ARG 160 Cb 0.00 -1.97 0.46 0.00 0.52 0.00 0.00 34.95 33.96 1rql s ARG 160 CO 0.00 -1.05 1.33 -0.35 0.02 0.00 0.00 175.30 175.24 1rql n PRO 161 N -1.45 1.42 -1.52 3.54 -0.04 -1.26 -5.05 135.00 130.63 1rql n PRO 161 Ca 0.13 -0.65 -0.36 0.00 -0.04 0.00 0.00 63.50 62.58 1rql n PRO 161 Cb 0.50 -1.22 0.08 0.00 -0.04 0.00 0.00 33.50 32.82 1rql n PRO 161 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1rql n TYR 162 N -0.04 1.46 1.45 0.54 4.02 -0.77 -3.61 117.16 120.21 1rql n TYR 162 Ca 0.10 0.41 0.11 0.00 -0.01 0.00 0.00 57.90 58.51 1rql n TYR 162 Cb 0.18 -2.19 0.45 0.00 -0.02 0.00 0.00 39.34 37.77 1rql n TYR 162 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1rql n PRO 163 N -2.12 1.54 -0.05 -0.72 -0.04 -1.26 -4.53 135.00 127.82 1rql n PRO 163 Ca 0.15 -0.81 -0.14 0.00 -0.04 0.00 0.00 63.50 62.66 1rql n PRO 163 Cb 0.49 -1.39 -0.09 0.00 -0.04 0.00 0.00 33.50 32.47 1rql n PRO 163 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1rql h TRP 164 N 1.68 -1.57 -0.78 0.54 -0.00 -1.89 -1.20 115.95 112.72 1rql h TRP 164 Ca 0.00 0.07 0.16 0.00 -0.00 0.00 0.00 58.89 59.12 1rql h TRP 164 Cb 0.37 0.72 -0.05 0.00 -0.00 0.00 0.00 29.16 30.19 1rql h TRP 164 CO 0.07 -0.52 0.53 0.52 -0.00 0.00 0.00 178.44 179.03 1rql h MET 165 N -0.50 0.38 -0.06 0.49 2.86 -1.84 -0.03 114.93 116.22 1rql h MET 165 Ca 0.06 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.55 1rql h MET 165 Cb 0.65 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 1rql h MET 165 CO -0.49 0.25 -0.53 0.00 1.06 0.00 0.00 176.91 177.20 1rql h TYR 167 N 0.13 0.88 -0.47 0.00 0.05 -0.22 -2.55 116.97 114.79 1rql h TYR 167 Ca 0.00 -0.52 0.05 0.00 0.05 0.00 0.00 58.73 58.31 1rql h TYR 167 Cb 0.98 -0.08 -0.05 0.00 1.01 0.00 0.00 36.73 38.59 1rql h TYR 167 CO 0.01 1.36 0.22 -0.22 -1.05 0.00 0.00 178.16 178.48 1rql h LYS 168 N 0.29 0.42 0.38 4.88 1.63 -1.03 0.54 116.57 123.68 1rql h LYS 168 Ca -0.14 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.63 1rql h LYS 168 Cb 1.77 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 33.29 1rql h LYS 168 CO 0.21 0.27 -0.33 -0.91 -3.45 0.00 0.00 179.45 175.24 1rql h ASN 169 N 0.43 -0.89 -0.98 4.20 2.35 -1.37 -0.73 115.58 118.59 1rql h ASN 169 Ca 0.21 0.07 0.17 0.00 -0.55 0.00 0.00 56.30 56.20 1rql h ASN 169 Cb 0.15 0.29 -0.09 0.00 0.05 0.00 0.00 38.32 38.72 1rql h ASN 169 CO -0.17 -0.48 0.61 0.00 -1.65 0.00 0.00 177.43 175.74 1rql h ALA 170 N -0.25 1.71 0.35 -0.83 0.00 -1.10 0.38 119.26 119.53 1rql h ALA 170 Ca -0.03 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1rql h ALA 170 Cb 0.64 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1rql h ALA 170 CO -0.03 -0.03 -0.17 1.98 0.00 0.00 0.00 179.25 181.00 1rql h MET 171 N 0.78 -0.46 -0.24 0.00 -1.53 -0.32 0.22 114.93 113.39 1rql h MET 171 Ca 0.53 0.03 -0.10 0.00 -3.44 0.00 0.00 59.70 56.73 1rql h MET 171 Cb 0.81 0.10 -0.00 0.00 -0.55 0.00 0.00 31.60 31.96 1rql h MET 171 CO -0.31 -0.28 -0.24 0.93 0.14 0.00 0.00 176.91 177.15 1rql h GLU 172 N -0.51 0.59 0.00 0.39 3.07 -0.18 -3.00 114.58 114.95 1rql h GLU 172 Ca -0.05 -0.31 -0.00 0.00 -0.50 0.00 0.00 59.36 58.50 1rql h GLU 172 Cb 0.38 0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.30 1rql h GLU 172 CO 0.08 0.90 -0.01 -0.07 -1.40 0.00 0.00 179.01 178.52 1rql h LEU 173 N 0.30 0.00 -0.61 1.33 3.38 -0.32 -3.47 115.31 115.92 1rql h LEU 173 Ca 0.04 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1rql h LEU 173 Cb 0.79 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.58 1rql h LEU 173 CO 0.06 0.01 -0.19 0.61 0.09 0.00 0.00 178.44 179.01 1rql n GLY 174 N 0.21 0.44 3.36 0.83 0.00 0.64 -5.05 105.19 105.62 1rql n GLY 174 Ca 0.01 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 1rql n GLY 174 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rql s VAL 175 N -2.95 2.58 0.02 1.61 1.01 -0.33 -5.03 120.40 117.31 1rql s VAL 175 Ca 0.14 -0.88 -0.21 0.00 0.00 0.00 0.00 61.98 61.03 1rql s VAL 175 Cb -0.06 -1.99 0.04 0.00 0.00 0.00 0.00 36.38 34.38 1rql s VAL 175 CO 0.17 0.57 0.47 -0.72 0.00 0.00 0.00 175.10 175.59 1rql s TYR 176 N -0.32 -0.35 1.01 5.22 1.13 -1.26 -4.66 117.35 118.11 1rql s TYR 176 Ca 0.02 0.43 -0.17 0.00 -1.41 0.00 0.00 57.07 55.94 1rql s TYR 176 Cb -0.13 0.26 0.22 0.00 -1.10 0.00 0.00 41.96 41.22 1rql s TYR 176 CO 0.02 -0.57 1.31 -2.14 -2.51 0.00 0.00 175.55 171.66 1rql s PRO 177 N -2.12 0.26 0.57 -3.49 0.02 -1.26 -4.89 135.00 124.09 1rql s PRO 177 Ca -0.07 -0.42 0.26 0.00 0.02 0.00 0.00 61.00 60.78 1rql s PRO 177 Cb -0.01 -1.80 1.65 0.00 0.02 0.00 0.00 34.50 34.35 1rql s PRO 177 CO 0.00 -2.67 2.21 0.52 -0.33 0.00 0.00 177.00 176.74 1rql h MET 178 N -1.82 0.00 -0.22 5.54 2.86 -1.87 -1.82 114.93 117.60 1rql h MET 178 Ca -0.44 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.20 1rql h MET 178 Cb 1.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.89 1rql h MET 178 CO 0.35 0.01 0.00 0.27 1.06 0.00 0.00 176.91 178.60 1rql n ASN 179 N -4.01 0.26 -1.12 1.22 0.23 -1.23 -2.15 115.26 108.47 1rql n ASN 179 Ca -0.03 -2.00 0.09 0.00 -0.53 0.00 0.00 54.58 52.11 1rql n ASN 179 Cb 0.10 -0.11 0.27 0.00 -2.08 0.00 0.00 39.78 37.95 1rql n ASN 179 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1rql n HIS 180 N -0.37 0.83 -4.15 -2.53 8.25 -0.68 -4.80 115.22 111.77 1rql n HIS 180 Ca 0.00 -0.51 -0.17 0.00 -0.26 0.00 0.00 57.72 56.78 1rql n HIS 180 Cb 0.06 -0.03 -0.12 0.00 1.12 0.00 0.00 29.99 31.03 1rql n HIS 180 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1rql s MET 181 N -1.08 0.77 0.02 -0.41 -1.94 -0.91 -0.06 119.30 115.69 1rql s MET 181 Ca 0.40 -0.94 0.06 0.00 -1.71 0.00 0.00 55.69 53.50 1rql s MET 181 Cb 0.21 -0.71 -0.03 0.00 2.01 0.00 0.00 34.83 36.31 1rql s MET 181 CO 0.26 0.15 -0.15 0.42 -0.01 0.00 0.00 175.02 175.69 1rql s ILE 182 N -1.40 2.98 -0.15 2.53 1.01 -0.41 -2.26 121.20 123.50 1rql s ILE 182 Ca -0.03 -1.04 -0.01 0.00 0.00 0.00 0.00 60.65 59.57 1rql s ILE 182 Cb -0.09 -2.25 -0.01 0.00 0.01 0.00 0.00 42.46 40.12 1rql s ILE 182 CO 0.02 0.39 -0.11 -0.75 0.00 0.00 0.00 174.94 174.48 1rql s LYS 183 N -1.32 3.37 -0.15 2.79 2.36 0.46 0.94 119.74 128.19 1rql s LYS 183 Ca 0.15 -0.68 0.01 0.00 -2.55 0.00 0.00 55.97 52.90 1rql s LYS 183 Cb -0.11 -2.72 0.02 0.00 -1.05 0.00 0.00 37.83 33.98 1rql s LYS 183 CO 0.05 0.10 -0.17 0.08 1.55 0.00 0.00 175.35 176.96 1rql s VAL 184 N 0.64 1.75 0.03 4.02 1.01 -0.25 -0.87 120.40 126.72 1rql s VAL 184 Ca -0.06 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.16 1rql s VAL 184 Cb -0.15 -1.60 -0.00 0.00 0.00 0.00 0.00 36.38 34.63 1rql s VAL 184 CO 0.03 0.49 0.03 0.61 0.00 0.00 0.00 175.10 176.25 1rql n GLY 185 N 4.51 3.81 0.00 4.51 0.00 -1.11 -1.81 105.19 115.11 1rql n GLY 185 Ca -0.19 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.19 1rql n GLY 185 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rql n ASP 186 N -2.78 0.72 -4.09 1.61 5.75 -1.26 -1.45 116.55 115.06 1rql n ASP 186 Ca 0.01 -1.34 -0.08 0.00 -0.01 0.00 0.00 54.79 53.36 1rql n ASP 186 Cb 0.06 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.05 1rql n ASP 186 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1rql s THR 187 N -0.34 0.15 0.19 2.12 -4.23 -1.26 -3.57 115.64 108.71 1rql s THR 187 Ca 0.00 -1.77 -0.18 0.00 -1.18 0.00 0.00 61.69 58.56 1rql s THR 187 Cb 0.00 -1.75 0.16 0.00 1.34 0.00 0.00 72.50 72.25 1rql s THR 187 CO 0.00 -0.70 1.60 0.58 -0.54 0.00 0.00 174.62 175.57 1rql h VAL 188 N 2.95 0.25 -0.91 2.29 2.07 -1.95 0.34 116.25 121.29 1rql h VAL 188 Ca -0.34 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.37 1rql h VAL 188 Cb 1.18 0.25 -0.07 0.00 -1.52 0.00 0.00 31.29 31.12 1rql h VAL 188 CO 0.61 0.00 0.59 0.28 0.02 0.00 0.00 177.57 179.07 1rql h SER 189 N -0.12 0.51 -0.29 0.57 0.02 -1.96 0.17 113.55 112.45 1rql h SER 189 Ca 0.25 0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 61.22 1rql h SER 189 Cb 0.52 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1rql h SER 189 CO -0.65 0.21 0.09 0.44 -1.14 0.00 0.00 176.83 175.78 1rql h ASP 190 N 0.52 0.50 -0.06 3.07 3.32 -1.34 -0.94 116.42 121.49 1rql h ASP 190 Ca 0.48 -0.07 -0.05 0.00 0.02 0.00 0.00 57.03 57.41 1rql h ASP 190 Cb 1.04 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1rql h ASP 190 CO -0.21 0.51 -0.15 0.24 -1.72 0.00 0.00 179.24 177.90 1rql h MET 191 N 0.54 0.21 0.23 3.56 2.86 -0.50 -2.36 114.93 119.46 1rql h MET 191 Ca 0.13 -0.14 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1rql h MET 191 Cb 0.21 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.86 1rql h MET 191 CO -0.00 0.76 -0.42 0.87 1.06 0.00 0.00 176.91 179.17 1rql h LYS 192 N -0.31 -0.71 -0.57 1.72 1.57 -1.07 -1.38 116.57 115.82 1rql h LYS 192 Ca -0.00 0.05 0.11 0.00 -1.87 0.00 0.00 60.65 58.94 1rql h LYS 192 Cb 0.77 0.16 -0.09 0.00 0.08 0.00 0.00 32.23 33.14 1rql h LYS 192 CO 0.03 -0.47 0.02 1.49 -0.57 0.00 0.00 179.45 179.95 1rql h GLU 193 N -0.73 0.13 -0.04 3.15 4.81 -1.24 0.26 114.58 120.92 1rql h GLU 193 Ca -0.00 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1rql h GLU 193 Cb 0.71 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.03 1rql h GLU 193 CO -0.18 0.09 -0.10 0.78 -0.73 0.00 0.00 179.01 178.87 1rql h GLY 194 N 0.14 -0.08 0.83 1.92 0.00 -0.97 -1.97 103.07 102.94 1rql h GLY 194 Ca 0.29 0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.73 1rql h GLY 194 CO -0.47 -0.11 -0.14 3.21 0.00 0.00 0.00 176.54 179.03 1rql h ARG 195 N -0.15 -0.38 -0.53 4.80 2.47 -0.63 -2.22 114.38 117.74 1rql h ARG 195 Ca 0.05 0.03 0.15 0.00 -1.26 0.00 0.00 59.98 58.95 1rql h ARG 195 Cb 0.22 0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.61 1rql h ARG 195 CO -0.13 -0.14 0.64 -0.91 0.56 0.00 0.00 179.97 179.98 1rql h ASN 196 N -0.57 0.00 -0.01 7.04 2.35 -0.41 1.66 115.58 125.64 1rql h ASN 196 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1rql h ASN 196 Cb 0.42 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.79 1rql h ASN 196 CO 0.07 0.00 -0.01 0.00 -1.65 0.00 0.00 177.43 175.84 1rql n ALA 197 N -2.26 2.57 -2.74 -0.83 0.00 -0.75 -4.74 120.51 111.76 1rql n ALA 197 Ca 0.10 -0.48 -0.15 0.00 0.00 0.00 0.00 53.44 52.91 1rql n ALA 197 Cb 0.84 -1.11 0.02 0.00 0.00 0.00 0.00 19.45 19.20 1rql n ALA 197 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rql n GLY 198 N 1.21 -0.16 3.57 0.00 0.00 0.57 -4.82 105.19 105.54 1rql n GLY 198 Ca 0.18 -0.16 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 1rql n GLY 198 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1rql s MET 199 N -5.28 1.86 -0.00 1.61 0.23 -0.87 -3.50 119.30 113.34 1rql s MET 199 Ca 0.19 -2.01 -0.30 0.00 -1.03 0.00 0.00 55.69 52.54 1rql s MET 199 Cb -0.08 -1.56 -0.06 0.00 -1.53 0.00 0.00 34.83 31.59 1rql s MET 199 CO 0.24 0.01 1.57 -1.58 -2.03 0.00 0.00 175.02 173.23 1rql s TRP 200 N -2.75 2.39 -0.17 3.16 0.52 -0.96 -4.38 118.94 116.75 1rql s TRP 200 Ca 0.34 0.43 -0.06 0.00 0.02 0.00 0.00 56.10 56.83 1rql s TRP 200 Cb 0.07 -3.85 -0.04 0.00 -1.15 0.00 0.00 33.47 28.50 1rql s TRP 200 CO 0.17 -3.40 0.04 0.99 0.02 0.00 0.00 176.95 174.76 1rql s THR 201 N 3.13 4.55 0.13 2.01 2.01 -1.26 -0.40 115.64 125.80 1rql s THR 201 Ca 0.70 -0.12 0.05 0.00 0.31 0.00 0.00 61.69 62.64 1rql s THR 201 Cb -0.34 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.09 1rql s THR 201 CO 0.29 0.47 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.87 1rql s VAL 202 N 0.33 1.28 -0.04 3.82 1.01 -0.05 -0.31 120.40 126.43 1rql s VAL 202 Ca 0.01 -1.79 0.01 0.00 0.00 0.00 0.00 61.98 60.22 1rql s VAL 202 Cb -0.13 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.69 1rql s VAL 202 CO 0.01 -0.50 -0.05 -0.83 0.00 0.00 0.00 175.10 173.73 1rql s GLY 203 N -2.61 0.45 0.20 4.51 0.00 -1.01 -2.74 107.32 106.12 1rql s GLY 203 Ca 0.10 -0.07 -0.17 0.00 0.00 0.00 0.00 44.72 44.58 1rql s GLY 203 CO 0.02 0.37 0.66 0.14 0.00 0.00 0.00 173.10 174.30 1rql s VAL 204 N 0.82 4.68 -0.10 1.40 1.01 -0.53 0.52 120.40 128.20 1rql s VAL 204 Ca -0.11 1.10 -0.12 0.00 0.00 0.00 0.00 61.98 62.85 1rql s VAL 204 Cb -0.14 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.39 1rql s VAL 204 CO 0.00 0.20 -0.23 -0.38 0.00 0.00 0.00 175.10 174.69 1rql n ILE 205 N 0.69 1.35 -1.96 2.22 5.41 0.12 -4.62 119.36 122.56 1rql n ILE 205 Ca -0.03 0.15 -0.43 0.00 1.00 0.00 0.00 62.75 63.44 1rql n ILE 205 Cb 0.51 -2.04 -0.03 0.00 -0.71 0.00 0.00 39.64 37.38 1rql n ILE 205 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1rql s LEU 206 N -7.51 3.49 0.00 1.39 1.43 0.60 -1.56 118.68 116.52 1rql s LEU 206 Ca -0.20 1.31 0.00 0.00 -1.03 0.00 0.00 54.13 54.20 1rql s LEU 206 Cb 0.04 -3.46 0.00 0.00 0.03 0.00 0.00 46.19 42.80 1rql s LEU 206 CO 0.29 -1.77 0.00 0.61 0.23 0.00 0.00 176.35 175.71 1rql n GLY 207 N 5.47 0.90 3.86 -3.19 0.00 -1.26 -4.87 105.19 106.10 1rql n GLY 207 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 1rql n GLY 207 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rql s SER 208 N -2.21 4.62 0.34 1.61 1.04 -0.60 -0.47 113.70 118.03 1rql s SER 208 Ca 0.00 0.99 0.25 0.00 0.48 0.00 0.00 55.95 57.67 1rql s SER 208 Cb 0.00 -1.62 0.65 0.00 0.10 0.00 0.00 66.02 65.15 1rql s SER 208 CO 0.00 -1.85 1.71 -1.28 0.98 0.00 0.00 173.24 172.80 1rql h SER 209 N -1.01 0.00 0.03 7.02 0.87 -1.78 -2.70 113.55 115.97 1rql h SER 209 Ca -0.47 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.01 1rql h SER 209 Cb 1.30 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.27 1rql h SER 209 CO 0.64 0.00 -0.33 -0.33 -0.53 0.00 0.00 176.83 176.28 1rql h GLU 210 N 0.00 0.18 0.00 2.24 4.39 -1.91 -3.18 114.58 116.30 1rql h GLU 210 Ca 0.00 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.47 1rql h GLU 210 Cb 0.82 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.54 1rql h GLU 210 CO 0.00 1.01 0.00 1.25 -1.16 0.00 0.00 179.01 180.11 1rql h LEU 211 N -0.55 0.00 1.23 1.33 5.85 -1.78 -3.47 115.31 117.92 1rql h LEU 211 Ca -0.05 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1rql h LEU 211 Cb 1.15 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.17 1rql h LEU 211 CO 0.06 0.00 -0.01 0.61 -0.34 0.00 0.00 178.44 178.76 1rql n GLY 212 N 0.05 -0.07 3.90 3.75 0.00 -1.02 -4.93 105.19 106.87 1rql n GLY 212 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 1rql n GLY 212 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rql s LEU 213 N -2.73 3.82 0.36 0.99 1.43 -1.26 -5.03 118.68 116.27 1rql s LEU 213 Ca 0.00 -0.30 0.06 0.00 -1.03 0.00 0.00 54.13 52.86 1rql s LEU 213 Cb 0.00 -2.46 -0.00 0.00 0.03 0.00 0.00 46.19 43.75 1rql s LEU 213 CO 0.00 -0.29 0.51 0.42 0.23 0.00 0.00 176.35 177.22 1rql s THR 214 N -2.20 3.85 0.33 5.49 -4.23 -1.26 -4.12 115.64 113.49 1rql s THR 214 Ca 0.40 -0.95 0.03 0.00 -1.18 0.00 0.00 61.69 59.99 1rql s THR 214 Cb -0.08 -3.34 0.29 0.00 1.34 0.00 0.00 72.50 70.72 1rql s THR 214 CO 0.28 -0.14 1.92 -0.33 -0.54 0.00 0.00 174.62 175.81 1rql h GLU 215 N 0.79 0.88 0.26 3.99 5.08 -2.00 -2.14 114.58 121.44 1rql h GLU 215 Ca -0.45 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 1rql h GLU 215 Cb 1.26 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1rql h GLU 215 CO 0.52 0.58 -0.26 0.93 -1.00 0.00 0.00 179.01 179.78 1rql h GLU 216 N 0.91 -0.49 0.00 2.33 4.39 -1.99 -1.38 114.58 118.34 1rql h GLU 216 Ca 0.37 0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.10 1rql h GLU 216 Cb 0.27 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 1rql h GLU 216 CO -0.14 -0.33 0.00 1.05 -1.16 0.00 0.00 179.01 178.43 1rql h GLU 217 N -0.51 0.00 0.07 2.33 4.11 -1.86 -1.96 114.58 116.76 1rql h GLU 217 Ca -0.03 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.28 1rql h GLU 217 Cb 0.44 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.71 1rql h GLU 217 CO -0.03 0.00 -0.50 0.28 0.07 0.00 0.00 179.01 178.83 1rql h VAL 218 N 0.00 1.60 0.00 -1.06 2.07 -1.06 -2.75 116.25 115.05 1rql h VAL 218 Ca 0.00 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 65.13 1rql h VAL 218 Cb 0.07 3.17 0.00 0.00 -1.52 0.00 0.00 31.29 33.01 1rql h VAL 218 CO 0.00 0.66 0.00 -0.33 0.02 0.00 0.00 177.57 177.92 1rql h GLU 219 N -0.55 0.00 -0.90 1.57 5.08 -0.72 -3.20 114.58 115.86 1rql h GLU 219 Ca -0.08 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.79 1rql h GLU 219 Cb 1.36 0.00 -0.42 0.00 0.50 0.00 0.00 28.75 30.19 1rql h GLU 219 CO 0.09 0.00 -0.89 0.09 -1.00 0.00 0.00 179.01 177.30 1rql n ASN 220 N -2.55 3.90 -4.45 1.42 4.13 -0.79 -5.06 115.26 111.87 1rql n ASN 220 Ca 0.02 -3.31 -0.26 0.00 1.68 0.00 0.00 54.58 52.71 1rql n ASN 220 Cb 0.26 -0.41 -0.11 0.00 -1.54 0.00 0.00 39.78 37.98 1rql n ASN 220 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 1rql s MET 221 N -3.58 1.60 -0.15 3.52 1.75 -1.04 -4.88 119.30 116.53 1rql s MET 221 Ca 0.43 -1.63 -0.29 0.00 -1.25 0.00 0.00 55.69 52.95 1rql s MET 221 Cb 0.40 -1.81 -0.05 0.00 2.84 0.00 0.00 34.83 36.20 1rql s MET 221 CO -0.03 0.37 1.80 0.34 -0.65 0.00 0.00 175.02 176.85 1rql s ASP 222 N -3.05 6.26 0.03 1.11 2.15 -1.26 -4.86 116.67 117.05 1rql s ASP 222 Ca 0.25 1.96 -0.06 0.00 0.43 0.00 0.00 52.55 55.13 1rql s ASP 222 Cb -0.07 -2.53 -0.01 0.00 -0.30 0.00 0.00 42.92 40.01 1rql s ASP 222 CO 0.12 -1.30 0.99 -1.20 -0.17 0.00 0.00 175.17 173.61 1rql n SER 223 N 8.69 -0.20 -0.30 -0.34 7.64 -1.26 0.19 113.62 128.04 1rql n SER 223 Ca 0.21 1.04 0.12 0.00 1.01 0.00 0.00 58.87 61.25 1rql n SER 223 Cb 0.44 -0.40 0.27 0.00 -1.01 0.00 0.00 64.21 63.52 1rql n SER 223 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1rql h VAL 224 N 0.00 0.22 0.16 0.44 2.07 -1.97 0.49 116.25 117.66 1rql h VAL 224 Ca 0.03 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1rql h VAL 224 Cb 0.08 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 29.94 1rql h VAL 224 CO -0.17 0.02 -0.08 -0.08 0.02 0.00 0.00 177.57 177.28 1rql h GLU 225 N 0.12 -0.21 -0.20 1.57 4.22 -0.64 -3.02 114.58 116.42 1rql h GLU 225 Ca 0.55 0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.99 1rql h GLU 225 Cb 1.11 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1rql h GLU 225 CO -0.74 -0.07 0.06 1.25 -2.18 0.00 0.00 179.01 177.33 1rql h LEU 226 N -0.30 0.30 0.00 1.64 5.85 0.16 -2.19 115.31 120.76 1rql h LEU 226 Ca -0.02 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1rql h LEU 226 Cb 0.24 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1rql h LEU 226 CO 0.04 0.42 0.09 0.54 -0.34 0.00 0.00 178.44 179.19 1rql n ARG 227 N -4.79 0.00 -0.11 1.25 5.12 0.15 -0.98 116.66 117.30 1rql n ARG 227 Ca -0.04 0.40 -0.15 0.00 -1.93 0.00 0.00 57.85 56.14 1rql n ARG 227 Cb 0.15 -1.59 -0.14 0.00 -1.16 0.00 0.00 32.46 29.72 1rql n ARG 227 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1rql n GLU 228 N -1.40 0.67 0.20 5.56 1.02 -0.85 -4.12 120.64 121.72 1rql n GLU 228 Ca 0.00 0.10 0.08 0.00 -0.02 0.00 0.00 57.16 57.32 1rql n GLU 228 Cb 0.09 -1.54 0.38 0.00 -0.02 0.00 0.00 31.44 30.35 1rql n GLU 228 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1rql h LYS 229 N 0.00 0.00 -0.18 3.49 3.11 -0.78 -2.65 116.57 119.56 1rql h LYS 229 Ca -0.55 0.00 -0.08 0.00 -2.81 0.00 0.00 60.65 57.22 1rql h LYS 229 Cb 2.04 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 33.26 1rql h LYS 229 CO -0.03 0.30 -0.22 0.82 -2.81 0.00 0.00 179.45 177.51 1rql h ILE 230 N 0.00 1.24 0.15 2.00 2.04 -1.48 -3.08 117.51 118.37 1rql h ILE 230 Ca -0.00 -1.09 -0.29 0.00 1.00 0.00 0.00 64.86 64.48 1rql h ILE 230 Cb 0.85 1.34 0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1rql h ILE 230 CO 0.04 0.34 -1.28 -0.33 0.00 0.00 0.00 178.15 176.92 1rql h GLU 231 N 0.29 0.35 0.00 2.37 4.39 -1.63 0.39 114.58 120.75 1rql h GLU 231 Ca 0.05 -0.58 0.00 0.00 0.34 0.00 0.00 59.36 59.17 1rql h GLU 231 Cb 0.55 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 1rql h GLU 231 CO 0.04 1.27 0.00 0.28 -1.16 0.00 0.00 179.01 179.44 1rql n VAL 232 N -3.59 1.76 -0.04 3.13 0.31 -1.11 -0.91 118.33 117.87 1rql n VAL 232 Ca -0.10 0.48 -0.10 0.00 -0.01 0.00 0.00 64.34 64.61 1rql n VAL 232 Cb 1.03 -1.45 -0.03 0.00 -0.91 0.00 0.00 33.84 32.48 1rql n VAL 232 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1rql n VAL 233 N -1.58 0.58 -0.32 2.52 0.31 -1.19 -3.74 118.33 114.92 1rql n VAL 233 Ca 0.00 -0.10 0.17 0.00 -0.01 0.00 0.00 64.34 64.40 1rql n VAL 233 Cb 0.03 -1.65 0.41 0.00 -0.91 0.00 0.00 33.84 31.73 1rql n VAL 233 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1rql h ARG 234 N -0.34 0.57 -0.05 5.55 2.43 -0.77 0.65 114.38 122.42 1rql h ARG 234 Ca -0.23 -0.03 -0.16 0.00 -0.81 0.00 0.00 59.98 58.75 1rql h ARG 234 Cb 1.15 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 30.58 1rql h ARG 234 CO -0.14 0.38 -0.58 -0.97 -1.51 0.00 0.00 179.97 177.15 1rql h ASN 235 N 0.59 0.61 -0.96 -3.80 -1.24 -1.26 -3.13 115.58 106.38 1rql h ASN 235 Ca 0.56 -0.70 0.20 0.00 0.71 0.00 0.00 56.30 57.08 1rql h ASN 235 Cb 1.12 -0.18 -0.09 0.00 0.73 0.00 0.00 38.32 39.90 1rql h ASN 235 CO -0.32 1.22 0.61 -0.09 -1.29 0.00 0.00 177.43 177.56 1rql h ARG 236 N 0.05 0.56 0.49 6.67 2.43 -0.04 -1.82 114.38 122.72 1rql h ARG 236 Ca -0.06 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.05 1rql h ARG 236 Cb 1.26 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1rql h ARG 236 CO 0.12 0.37 -0.24 0.74 -1.51 0.00 0.00 179.97 179.45 1rql h PHE 237 N 0.58 -0.61 -0.81 2.20 0.04 -0.17 -3.13 116.94 115.03 1rql h PHE 237 Ca 0.53 -0.01 0.23 0.00 2.80 0.00 0.00 57.97 61.52 1rql h PHE 237 Cb 1.07 0.20 -0.03 0.00 2.20 0.00 0.00 35.95 39.39 1rql h PHE 237 CO -0.00 -0.30 0.58 0.28 -0.60 0.00 0.00 178.31 178.27 1rql h VAL 238 N -1.06 0.60 0.00 -0.55 2.07 -1.41 0.73 116.25 116.63 1rql h VAL 238 Ca -0.07 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1rql h VAL 238 Cb 0.58 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1rql h VAL 238 CO 0.11 0.00 0.00 1.21 0.02 0.00 0.00 177.57 178.91 1rql n GLU 239 N -4.31 0.81 0.00 1.57 2.13 -0.72 -3.01 120.64 117.12 1rql n GLU 239 Ca 0.17 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.99 1rql n GLU 239 Cb 0.87 -1.12 0.00 0.00 0.27 0.00 0.00 31.44 31.46 1rql n GLU 239 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1rql n ASN 240 N -0.62 0.32 0.00 4.31 3.02 0.25 -5.03 115.26 117.51 1rql n ASN 240 Ca 0.05 -1.05 0.00 0.00 -0.03 0.00 0.00 54.58 53.55 1rql n ASN 240 Cb 0.02 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 1rql n ASN 240 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rql n GLY 241 N -0.03 1.17 3.56 7.41 0.00 -1.07 -4.30 105.19 111.93 1rql n GLY 241 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1rql n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rql s ALA 242 N -1.97 2.08 0.60 4.61 0.00 -1.18 -4.69 121.76 121.20 1rql s ALA 242 Ca 0.00 -0.02 0.29 0.00 0.00 0.00 0.00 51.96 52.22 1rql s ALA 242 Cb 0.00 -4.26 1.49 0.00 0.00 0.00 0.00 23.12 20.35 1rql s ALA 242 CO 0.00 -3.85 1.89 0.45 0.00 0.00 0.00 175.76 174.25 1rql h HIS 243 N 16.89 0.00 -3.64 0.00 3.86 -1.05 -3.42 115.15 127.79 1rql h HIS 243 Ca -0.28 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 58.87 1rql h HIS 243 Cb 1.22 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.61 1rql h HIS 243 CO 0.98 0.00 -0.11 -0.06 0.86 0.00 0.00 177.93 179.60 1rql s PHE 244 N -4.53 0.37 -0.06 2.45 0.40 -0.97 -5.04 117.98 110.61 1rql s PHE 244 Ca -0.04 -0.74 -0.07 0.00 -0.60 0.00 0.00 56.93 55.48 1rql s PHE 244 Cb 0.14 0.20 0.02 0.00 0.51 0.00 0.00 43.02 43.89 1rql s PHE 244 CO 0.50 -1.01 0.18 0.95 0.70 0.00 0.00 175.22 176.54 1rql s THR 245 N -3.95 0.01 -0.02 0.64 -4.23 -1.26 -2.42 115.64 104.42 1rql s THR 245 Ca 0.22 -0.10 0.02 0.00 -1.18 0.00 0.00 61.69 60.65 1rql s THR 245 Cb -0.01 -0.29 0.01 0.00 1.34 0.00 0.00 72.50 73.54 1rql s THR 245 CO 0.09 -0.05 -0.05 0.27 -0.54 0.00 0.00 174.62 174.34 1rql s ILE 246 N -0.11 0.48 0.33 2.99 -4.36 0.19 -4.89 121.20 115.82 1rql s ILE 246 Ca -0.02 -0.20 0.07 0.00 -0.26 0.00 0.00 60.65 60.24 1rql s ILE 246 Cb -0.02 -0.44 0.11 0.00 1.25 0.00 0.00 42.46 43.35 1rql s ILE 246 CO 0.00 0.16 1.81 -0.33 0.24 0.00 0.00 174.94 176.83 1rql h GLU 247 N 6.42 0.32 -3.90 0.37 5.08 -1.93 0.35 114.58 121.29 1rql h GLU 247 Ca -0.33 -0.10 -0.11 0.00 -1.00 0.00 0.00 59.36 57.82 1rql h GLU 247 Cb 1.17 -0.03 -0.16 0.00 0.50 0.00 0.00 28.75 30.24 1rql h GLU 247 CO 0.49 0.53 -0.50 0.95 -1.00 0.00 0.00 179.01 179.48 1rql s THR 248 N -4.55 0.16 -1.12 1.13 -4.23 -1.26 -0.29 115.64 105.48 1rql s THR 248 Ca -0.06 -1.29 0.06 0.00 -1.18 0.00 0.00 61.69 59.22 1rql s THR 248 Cb 0.15 -1.22 0.06 0.00 1.34 0.00 0.00 72.50 72.83 1rql s THR 248 CO 0.76 -0.71 1.14 0.80 -0.54 0.00 0.00 174.62 176.07 1rql n MET 249 N 0.29 0.02 0.13 3.99 1.56 -1.26 -1.73 117.12 120.12 1rql n MET 249 Ca -0.16 0.35 0.12 0.00 -0.27 0.00 0.00 57.70 57.74 1rql n MET 249 Cb 0.61 -1.50 0.50 0.00 2.15 0.00 0.00 33.22 34.97 1rql n MET 249 CO 0.00 0.00 0.00 0.94 -0.73 0.00 0.00 175.97 176.18 1rql n GLN 250 N -1.44 0.19 -0.06 2.12 -0.06 -1.26 -2.00 117.38 114.86 1rql n GLN 250 Ca 0.02 0.44 0.12 0.00 -2.00 0.00 0.00 57.00 55.58 1rql n GLN 250 Cb 0.06 -1.88 0.17 0.00 -4.06 0.00 0.00 30.24 24.54 1rql n GLN 250 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 1rql n GLU 251 N -2.23 2.33 0.37 3.69 1.02 -0.71 -4.65 120.64 120.46 1rql n GLU 251 Ca 0.02 -1.95 -0.18 0.00 -0.02 0.00 0.00 57.16 55.03 1rql n GLU 251 Cb 0.21 -1.48 -0.09 0.00 -0.02 0.00 0.00 31.44 30.06 1rql n GLU 251 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1rql h LEU 252 N 4.43 -0.87 -1.47 -4.62 5.85 -1.60 -2.62 115.31 114.41 1rql h LEU 252 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1rql h LEU 252 Cb 0.95 0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1rql h LEU 252 CO 0.00 -0.59 0.00 -0.33 -0.34 0.00 0.00 178.44 177.18 1rql h GLU 253 N -0.96 0.00 0.12 1.25 5.08 -1.82 -1.29 114.58 116.96 1rql h GLU 253 Ca -0.09 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.11 1rql h GLU 253 Cb 0.75 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.02 1rql h GLU 253 CO 0.13 0.00 -0.70 1.03 -1.00 0.00 0.00 179.01 178.47 1rql h SER 254 N 0.00 0.40 -0.45 1.42 0.87 -1.81 -2.72 113.55 111.27 1rql h SER 254 Ca 0.00 -0.96 -0.04 0.00 -1.23 0.00 0.00 61.79 59.56 1rql h SER 254 Cb 0.03 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.84 1rql h SER 254 CO 0.00 1.34 0.16 0.58 -0.53 0.00 0.00 176.83 178.37 1rql h VAL 255 N -0.46 1.20 -0.25 2.23 2.07 -0.91 -1.21 116.25 118.93 1rql h VAL 255 Ca -0.12 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 1rql h VAL 255 Cb 1.55 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1rql h VAL 255 CO 0.13 0.26 0.14 0.24 0.02 0.00 0.00 177.57 178.37 1rql h MET 256 N 0.73 0.34 -0.95 1.57 2.07 -1.38 0.20 114.93 117.51 1rql h MET 256 Ca 0.17 -0.03 0.03 0.00 -2.07 0.00 0.00 59.70 57.80 1rql h MET 256 Cb 0.22 -0.07 -0.05 0.00 -1.87 0.00 0.00 31.60 29.83 1rql h MET 256 CO -0.01 0.28 0.63 1.49 1.07 0.00 0.00 176.91 180.37 1rql h GLU 257 N 0.30 1.18 0.39 1.72 4.81 -1.07 -0.92 114.58 120.98 1rql h GLU 257 Ca 0.09 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 1rql h GLU 257 Cb 0.04 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.15 1rql h GLU 257 CO -0.02 0.78 -0.19 1.25 -0.73 0.00 0.00 179.01 180.11 1rql h HIS 258 N 1.21 -0.49 -0.92 0.92 2.76 -0.66 -3.22 115.15 114.76 1rql h HIS 258 Ca 0.38 -0.01 0.19 0.00 -2.20 0.00 0.00 60.37 58.73 1rql h HIS 258 Cb -0.01 0.16 -0.17 0.00 1.55 0.00 0.00 27.41 28.94 1rql h HIS 258 CO -0.00 -0.30 -0.20 -0.89 -1.30 0.00 0.00 177.93 175.24 1rql n ILE 259 N -3.87 -0.38 -0.76 6.26 5.41 0.66 -1.87 119.36 124.80 1rql n ILE 259 Ca -0.07 2.09 -0.18 0.00 1.00 0.00 0.00 62.75 65.59 1rql n ILE 259 Cb 0.21 -2.91 -0.05 0.00 -0.71 0.00 0.00 39.64 36.18 1rql n ILE 259 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1rql n GLU 260 N -5.47 1.95 0.00 0.38 1.02 -0.37 -5.10 120.64 113.05 1rql n GLU 260 Ca 0.16 -1.22 0.00 0.00 -0.02 0.00 0.00 57.16 56.08 1rql n GLU 260 Cb 0.49 -2.24 0.00 0.00 -0.02 0.00 0.00 31.44 29.67 1rql n GLU 260 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94