#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v8o n VAL 3 N 0.00 1.13 0.00 0.00 0.31 -1.23 -4.44 118.33 114.10 1v8o n VAL 3 Ca 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 1v8o n VAL 3 Cb 0.00 -1.89 0.00 0.00 -0.91 0.00 0.00 33.84 31.04 1v8o n VAL 3 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1v8o n GLU 4 N 1.93 2.92 -4.98 5.55 1.02 0.20 -4.99 120.64 122.29 1v8o n GLU 4 Ca 0.08 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.93 1v8o n GLU 4 Cb 0.36 -0.93 -0.15 0.00 -0.02 0.00 0.00 31.44 30.70 1v8o n GLU 4 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1v8o s TYR 5 N -1.86 2.12 -0.26 -0.32 1.51 -0.52 -1.13 117.35 116.88 1v8o s TYR 5 Ca 0.00 -0.40 -0.09 0.00 -1.01 0.00 0.00 57.07 55.57 1v8o s TYR 5 Cb 0.00 -1.31 -0.04 0.00 -0.11 0.00 0.00 41.96 40.50 1v8o s TYR 5 CO 0.00 0.04 0.13 -1.17 -1.11 0.00 0.00 175.55 173.44 1v8o s LEU 6 N -0.90 3.75 -0.20 -1.29 2.96 -0.10 -0.53 118.68 122.37 1v8o s LEU 6 Ca 0.10 -0.09 -0.06 0.00 -0.22 0.00 0.00 54.13 53.85 1v8o s LEU 6 Cb -0.09 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 1v8o s LEU 6 CO 0.01 -0.03 0.04 -0.69 -1.32 0.00 0.00 176.35 174.35 1v8o s VAL 7 N 1.61 4.34 0.22 1.68 1.01 0.50 -0.38 120.40 129.39 1v8o s VAL 7 Ca 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 1v8o s VAL 7 Cb -0.15 -2.97 0.04 0.00 0.00 0.00 0.00 36.38 33.30 1v8o s VAL 7 CO 0.07 0.42 0.30 -0.90 0.00 0.00 0.00 175.10 174.99 1v8o n ASP 8 N 4.09 0.36 -0.01 3.32 5.68 -1.04 -4.40 116.55 124.55 1v8o n ASP 8 Ca -0.17 -1.31 -0.12 0.00 -0.50 0.00 0.00 54.79 52.69 1v8o n ASP 8 Cb 0.52 -0.20 -0.08 0.00 -1.14 0.00 0.00 41.12 40.22 1v8o n ASP 8 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1v8o h ALA 9 N -0.65 0.06 -0.90 2.12 0.00 -1.90 0.22 119.26 118.21 1v8o h ALA 9 Ca -0.10 -0.17 0.14 0.00 0.00 0.00 0.00 54.91 54.78 1v8o h ALA 9 Cb 0.36 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 1v8o h ALA 9 CO 0.10 -0.27 0.58 0.66 0.00 0.00 0.00 179.25 180.32 1v8o h SER 10 N -0.21 0.69 0.33 0.00 4.64 -1.96 0.18 113.55 117.22 1v8o h SER 10 Ca 0.01 0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 61.36 1v8o h SER 10 Cb 0.33 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1v8o h SER 10 CO 0.00 0.35 -0.16 0.00 -0.87 0.00 0.00 176.83 176.16 1v8o h ALA 11 N 1.59 -0.44 -0.97 5.18 0.00 -1.79 -3.07 119.26 119.77 1v8o h ALA 11 Ca 0.45 -0.13 0.30 0.00 0.00 0.00 0.00 54.91 55.53 1v8o h ALA 11 Cb 0.68 0.17 -0.18 0.00 0.00 0.00 0.00 17.79 18.47 1v8o h ALA 11 CO -0.21 -0.43 0.17 1.25 0.00 0.00 0.00 179.25 180.03 1v8o h LEU 12 N -1.08 -0.24 -0.06 0.00 7.12 0.06 0.31 115.31 121.42 1v8o h LEU 12 Ca -0.05 0.26 0.00 0.00 0.13 0.00 0.00 57.88 58.23 1v8o h LEU 12 Cb 0.41 0.41 -0.00 0.00 -0.53 0.00 0.00 40.66 40.94 1v8o h LEU 12 CO 0.07 -0.34 0.04 0.22 -0.13 0.00 0.00 178.44 178.30 1v8o h TYR 13 N 0.04 0.08 -0.69 1.25 3.20 -0.71 -1.38 116.97 118.75 1v8o h TYR 13 Ca 0.64 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.46 1v8o h TYR 13 Cb 1.42 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 39.64 1v8o h TYR 13 CO -0.36 0.08 0.20 0.00 -1.64 0.00 0.00 178.16 176.44 1v8o h ALA 14 N 0.99 0.91 -0.56 1.82 0.00 -0.41 -2.93 119.26 119.07 1v8o h ALA 14 Ca 0.02 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1v8o h ALA 14 Cb 0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1v8o h ALA 14 CO -0.00 0.59 0.21 -0.07 0.00 0.00 0.00 179.25 179.98 1v8o h LEU 15 N 1.02 0.75 -1.98 0.00 3.38 -0.63 -2.64 115.31 115.22 1v8o h LEU 15 Ca 0.22 -0.10 0.21 0.00 0.09 0.00 0.00 57.88 58.30 1v8o h LEU 15 Cb 0.32 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1v8o h LEU 15 CO -0.00 0.69 0.57 0.00 0.09 0.00 0.00 178.44 179.78 1v8o h ALA 16 N 1.42 2.63 -0.10 1.53 0.00 -1.06 -0.20 119.26 123.50 1v8o h ALA 16 Ca 0.19 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 1v8o h ALA 16 Cb 0.18 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1v8o h ALA 16 CO -0.02 -0.95 -0.35 0.00 0.00 0.00 0.00 179.25 177.94 1v8o h ALA 17 N 1.55 0.17 -0.78 0.00 0.00 -1.57 -3.29 119.26 115.34 1v8o h ALA 17 Ca 0.35 -0.44 -0.70 0.00 0.00 0.00 0.00 54.91 54.11 1v8o h ALA 17 Cb 1.48 -0.02 -0.18 0.00 0.00 0.00 0.00 17.79 19.08 1v8o h ALA 17 CO -0.00 0.24 1.50 0.72 0.00 0.00 0.00 179.25 181.70 1v8o n HIS 18 N -4.38 2.43 0.00 0.00 8.25 -0.09 -4.82 115.22 116.61 1v8o n HIS 18 Ca -0.08 -2.50 0.00 0.00 -0.26 0.00 0.00 57.72 54.88 1v8o n HIS 18 Cb 0.51 -1.53 0.00 0.00 1.12 0.00 0.00 29.99 30.09 1v8o n HIS 18 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1v8o n TYR 19 N 0.91 0.00 -0.28 4.41 9.36 -1.20 -2.62 117.16 127.74 1v8o n TYR 19 Ca 0.55 0.00 0.02 0.00 3.32 0.00 0.00 57.90 61.79 1v8o n TYR 19 Cb 0.32 -0.26 0.07 0.00 -0.63 0.00 0.00 39.34 38.84 1v8o n TYR 19 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 1v8o n ASP 20 N -1.75 -0.37 -0.33 2.98 8.00 -1.26 -0.89 116.55 122.93 1v8o n ASP 20 Ca 0.00 1.31 0.16 0.00 0.71 0.00 0.00 54.79 56.97 1v8o n ASP 20 Cb 0.00 -0.36 0.35 0.00 -0.02 0.00 0.00 41.12 41.10 1v8o n ASP 20 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1v8o h LYS 21 N 0.00 0.50 0.00 -1.24 1.57 -1.90 -3.22 116.57 112.27 1v8o h LYS 21 Ca 0.32 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1v8o h LYS 21 Cb 0.51 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1v8o h LYS 21 CO -0.77 0.33 -0.73 -2.67 -0.57 0.00 0.00 179.45 175.04 1v8o n TRP 22 N -4.95 0.00 -0.87 -1.35 4.27 -0.07 -4.88 117.44 109.59 1v8o n TRP 22 Ca 0.25 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.57 1v8o n TRP 22 Cb 0.71 -0.01 0.21 0.00 -1.36 0.00 0.00 31.31 30.86 1v8o n TRP 22 CO 0.00 0.00 0.00 0.42 -2.29 0.00 0.00 177.69 175.82 1v8o s ILE 23 N -2.44 2.06 0.00 -1.67 1.09 -1.17 -1.66 121.20 117.42 1v8o s ILE 23 Ca 0.06 0.02 0.00 0.00 -1.10 0.00 0.00 60.65 59.63 1v8o s ILE 23 Cb 0.11 -2.30 0.00 0.00 -1.06 0.00 0.00 42.46 39.21 1v8o s ILE 23 CO 0.62 -0.03 0.00 0.29 -0.10 0.00 0.00 174.94 175.72 1v8o n LYS 24 N -4.53 0.00 0.00 2.79 5.02 -1.26 -4.43 118.16 115.75 1v8o n LYS 24 Ca 0.04 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.46 1v8o n LYS 24 Cb 0.56 -0.00 0.32 0.00 -0.02 0.00 0.00 35.03 35.88 1v8o n LYS 24 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1v8o n HIS 25 N 0.00 0.00 0.00 2.13 8.25 -0.66 -4.83 115.22 120.11 1v8o n HIS 25 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1v8o n HIS 25 Cb 0.00 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 30.87 1v8o n HIS 25 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1v8o n ARG 26 N -1.32 1.23 -0.37 -0.41 -4.01 -0.96 -2.90 116.66 107.93 1v8o n ARG 26 Ca 0.07 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.88 1v8o n ARG 26 Cb 0.34 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.76 1v8o n ARG 26 CO 0.00 0.00 0.00 -0.85 -3.04 0.00 0.00 177.63 173.74 1v8o n GLU 27 N 0.00 -0.00 0.00 2.89 0.00 -1.26 -4.06 120.64 118.21 1v8o n GLU 27 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1v8o n GLU 27 Cb 0.00 -3.56 0.00 0.00 0.00 0.00 0.00 31.44 27.88 1v8o n GLU 27 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1v8o n LYS 28 N -1.19 1.84 -3.71 3.44 4.81 -1.14 -3.55 118.16 118.65 1v8o n LYS 28 Ca 0.00 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.08 1v8o n LYS 28 Cb 0.00 -0.86 -0.06 0.00 0.02 0.00 0.00 35.03 34.13 1v8o n LYS 28 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1v8o s LEU 29 N -2.30 4.41 0.03 3.14 1.02 -1.25 0.62 118.68 124.35 1v8o s LEU 29 Ca 0.00 0.66 -0.07 0.00 0.02 0.00 0.00 54.13 54.75 1v8o s LEU 29 Cb 0.00 -2.46 -0.01 0.00 0.02 0.00 0.00 46.19 43.75 1v8o s LEU 29 CO 0.00 0.32 0.13 0.00 0.02 0.00 0.00 176.35 176.82 1v8o s ALA 30 N -1.15 -0.19 0.40 4.21 0.00 0.31 -2.90 121.76 122.44 1v8o s ALA 30 Ca 0.22 -0.41 0.04 0.00 0.00 0.00 0.00 51.96 51.82 1v8o s ALA 30 Cb -0.14 0.23 -0.03 0.00 0.00 0.00 0.00 23.12 23.19 1v8o s ALA 30 CO 0.11 -0.31 0.14 0.96 0.00 0.00 0.00 175.76 176.66 1v8o s ILE 31 N -2.36 0.57 0.39 0.00 -4.36 -0.02 0.19 121.20 115.60 1v8o s ILE 31 Ca -0.07 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.40 1v8o s ILE 31 Cb -0.02 -2.38 -0.03 0.00 1.25 0.00 0.00 42.46 41.28 1v8o s ILE 31 CO -0.03 0.00 0.33 -0.76 0.24 0.00 0.00 174.94 174.71 1v8o s LEU 32 N -3.58 3.42 0.46 0.37 1.43 -1.26 -1.40 118.68 118.11 1v8o s LEU 32 Ca 0.26 -0.70 0.14 0.00 -1.03 0.00 0.00 54.13 52.79 1v8o s LEU 32 Cb 0.03 -2.03 1.04 0.00 0.03 0.00 0.00 46.19 45.26 1v8o s LEU 32 CO 0.15 -0.54 2.03 0.45 0.23 0.00 0.00 176.35 178.68 1v8o h HIS 33 N 1.15 0.08 -0.83 0.29 3.86 -1.95 -1.79 115.15 115.96 1v8o h HIS 33 Ca -0.42 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 58.78 1v8o h HIS 33 Cb 1.26 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 29.67 1v8o h HIS 33 CO 0.53 0.17 0.50 1.25 0.86 0.00 0.00 177.93 181.24 1v8o h LEU 34 N 0.08 1.00 -0.55 2.43 6.46 -1.96 -3.05 115.31 119.73 1v8o h LEU 34 Ca 0.02 -0.07 0.11 0.00 -0.12 0.00 0.00 57.88 57.82 1v8o h LEU 34 Cb 0.20 -0.25 -0.11 0.00 -0.73 0.00 0.00 40.66 39.77 1v8o h LEU 34 CO 0.01 0.78 -0.22 0.74 -0.62 0.00 0.00 178.44 179.13 1v8o h THR 35 N 1.14 0.33 -0.50 1.05 2.02 -1.70 -1.08 112.91 114.18 1v8o h THR 35 Ca 0.30 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.58 1v8o h THR 35 Cb -0.04 0.33 -0.10 0.00 -1.74 0.00 0.00 68.15 66.60 1v8o h THR 35 CO -0.06 0.00 -0.14 0.40 0.37 0.00 0.00 175.52 176.10 1v8o h ILE 36 N -0.08 0.48 -0.61 3.11 2.04 -1.64 0.32 117.51 121.12 1v8o h ILE 36 Ca 0.25 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 66.03 1v8o h ILE 36 Cb 0.48 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1v8o h ILE 36 CO -0.61 0.00 0.07 1.88 0.00 0.00 0.00 178.15 179.49 1v8o h TYR 37 N -0.01 1.11 -0.22 1.37 -1.99 -1.37 0.11 116.97 115.97 1v8o h TYR 37 Ca 0.24 -0.17 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 1v8o h TYR 37 Cb 0.38 -0.30 -0.01 0.00 2.00 0.00 0.00 36.73 38.80 1v8o h TYR 37 CO -0.44 0.96 0.11 0.93 -0.00 0.00 0.00 178.16 179.73 1v8o h GLU 38 N 0.94 0.32 -0.55 4.88 5.08 -0.14 0.25 114.58 125.35 1v8o h GLU 38 Ca 0.18 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1v8o h GLU 38 Cb 0.47 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 1v8o h GLU 38 CO 0.02 0.32 0.32 0.00 -1.00 0.00 0.00 179.01 178.67 1v8o h ALA 39 N 0.98 0.71 -0.38 3.43 0.00 -0.25 -0.78 119.26 122.96 1v8o h ALA 39 Ca 0.08 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1v8o h ALA 39 Cb 0.10 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1v8o h ALA 39 CO -0.01 0.20 0.24 0.78 0.00 0.00 0.00 179.25 180.46 1v8o h GLY 40 N 0.74 0.54 1.04 0.00 0.00 -0.38 -2.17 103.07 102.84 1v8o h GLY 40 Ca 0.20 -0.18 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 1v8o h GLY 40 CO -0.04 0.17 0.28 -0.57 0.00 0.00 0.00 176.54 176.38 1v8o h ASN 41 N 0.48 1.04 -0.18 0.19 -0.73 -0.13 -0.65 115.58 115.59 1v8o h ASN 41 Ca 0.15 -0.18 0.03 0.00 1.87 0.00 0.00 56.30 58.16 1v8o h ASN 41 Cb -0.02 -0.27 -0.03 0.00 0.27 0.00 0.00 38.32 38.27 1v8o h ASN 41 CO -0.05 0.94 0.01 0.00 -0.37 0.00 0.00 177.43 177.95 1v8o h ALA 42 N 1.14 0.16 -0.25 1.57 0.00 -0.87 -0.85 119.26 120.17 1v8o h ALA 42 Ca 0.24 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 1v8o h ALA 42 Cb 0.24 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1v8o h ALA 42 CO -0.02 -0.43 -0.02 1.25 0.00 0.00 0.00 179.25 180.03 1v8o h LEU 43 N 0.07 0.34 -0.58 0.00 6.46 -1.08 -2.09 115.31 118.43 1v8o h LEU 43 Ca 0.08 -0.06 -0.07 0.00 -0.12 0.00 0.00 57.88 57.72 1v8o h LEU 43 Cb 0.10 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 39.92 1v8o h LEU 43 CO -0.14 0.42 0.10 -0.25 -0.62 0.00 0.00 178.44 177.96 1v8o h TRP 44 N 0.36 1.02 -0.88 1.25 7.01 -0.25 -1.55 115.95 122.91 1v8o h TRP 44 Ca 0.08 -0.14 -0.01 0.00 2.11 0.00 0.00 58.89 60.93 1v8o h TRP 44 Cb 0.28 -0.28 -0.04 0.00 -2.10 0.00 0.00 29.16 27.02 1v8o h TRP 44 CO 0.01 0.88 0.52 0.87 -2.79 0.00 0.00 178.44 177.93 1v8o h LYS 45 N 0.86 1.20 0.06 2.65 1.57 -0.53 0.23 116.57 122.61 1v8o h LYS 45 Ca 0.18 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1v8o h LYS 45 Cb 0.41 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1v8o h LYS 45 CO 0.01 0.85 -0.13 0.93 -0.57 0.00 0.00 179.45 180.54 1v8o h GLU 46 N 1.22 -0.24 -0.51 3.15 4.39 -0.94 -1.31 114.58 120.34 1v8o h GLU 46 Ca 0.31 0.02 0.02 0.00 0.34 0.00 0.00 59.36 60.06 1v8o h GLU 46 Cb -0.04 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1v8o h GLU 46 CO -0.06 -0.16 0.30 0.00 -1.16 0.00 0.00 179.01 177.94 1v8o h ALA 47 N 0.66 0.65 -0.08 3.43 0.00 -0.56 -2.71 119.26 120.65 1v8o h ALA 47 Ca 0.03 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1v8o h ALA 47 Cb 0.27 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1v8o h ALA 47 CO -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 179.25 178.91 1v8o h ARG 48 N 0.60 -0.34 -0.79 0.00 2.47 -0.17 -1.03 114.38 115.12 1v8o h ARG 48 Ca 0.21 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 1v8o h ARG 48 Cb 0.03 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.42 1v8o h ARG 48 CO -0.10 -0.23 0.00 1.28 0.56 0.00 0.00 179.97 181.49 1v8o n LEU 49 N -5.38 0.91 -0.77 3.04 4.77 -0.53 -4.86 117.00 114.17 1v8o n LEU 49 Ca -0.04 -0.45 0.00 0.00 -0.03 0.00 0.00 56.01 55.49 1v8o n LEU 49 Cb 0.29 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1v8o n LEU 49 CO 0.19 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 1v8o n GLY 50 N 0.20 -1.96 2.99 -0.72 0.00 -0.39 -5.04 105.19 100.26 1v8o n GLY 50 Ca 0.00 -0.68 0.02 0.00 0.00 0.00 0.00 46.02 45.37 1v8o n GLY 50 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1v8o s ARG 51 N -1.73 0.39 0.43 1.61 3.52 -1.25 -4.79 118.95 117.12 1v8o s ARG 51 Ca 0.00 -0.03 0.11 0.00 -0.13 0.00 0.00 55.73 55.68 1v8o s ARG 51 Cb 0.00 0.07 0.59 0.00 -1.56 0.00 0.00 34.95 34.05 1v8o s ARG 51 CO 0.00 -0.59 1.22 0.28 -0.81 0.00 0.00 175.30 175.40 1v8o h VAL 52 N 4.27 0.00 0.00 7.11 2.07 -1.94 -3.20 116.25 124.56 1v8o h VAL 52 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1v8o h VAL 52 Cb 1.21 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1v8o h VAL 52 CO -0.01 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.05 1v8o n ASP 53 N -2.18 0.00 0.00 0.57 8.00 -1.26 -4.57 116.55 117.11 1v8o n ASP 53 Ca -0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.49 1v8o n ASP 53 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 1v8o n ASP 53 CO 0.00 0.00 0.00 -2.67 -0.39 0.00 0.00 177.20 174.14 1v8o n TRP 54 N 0.00 0.00 -0.22 1.24 4.27 -1.21 -2.86 117.44 118.66 1v8o n TRP 54 Ca 0.00 0.00 -0.01 0.00 -3.89 0.00 0.00 57.50 53.60 1v8o n TRP 54 Cb 0.00 0.00 0.10 0.00 -1.36 0.00 0.00 31.31 30.05 1v8o n TRP 54 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1v8o h ALA 55 N 0.00 0.85 0.23 -1.67 0.00 -1.89 1.27 119.26 118.06 1v8o h ALA 55 Ca 0.00 0.03 -0.33 0.00 0.00 0.00 0.00 54.91 54.62 1v8o h ALA 55 Cb 0.00 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 17.74 1v8o h ALA 55 CO 0.00 -0.02 -1.50 0.00 0.00 0.00 0.00 179.25 177.73 1v8o h ALA 56 N 1.36 -0.07 -0.53 0.00 0.00 -1.84 -3.19 119.26 114.99 1v8o h ALA 56 Ca 0.30 -0.93 -0.05 0.00 0.00 0.00 0.00 54.91 54.23 1v8o h ALA 56 Cb 0.24 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1v8o h ALA 56 CO -0.21 0.75 0.14 0.00 0.00 0.00 0.00 179.25 179.94 1v8o h ALA 57 N 0.13 1.25 -0.82 0.00 0.00 -1.67 -2.39 119.26 115.76 1v8o h ALA 57 Ca -0.27 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 1v8o h ALA 57 Cb 2.10 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 19.64 1v8o h ALA 57 CO 0.24 0.53 0.36 0.66 0.00 0.00 0.00 179.25 181.03 1v8o h SER 58 N 0.78 1.10 -0.34 0.00 4.64 0.15 -0.98 113.55 118.91 1v8o h SER 58 Ca 0.18 -0.15 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1v8o h SER 58 Cb 0.27 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 1v8o h SER 58 CO -0.00 0.95 0.17 0.03 -0.87 0.00 0.00 176.83 177.11 1v8o h ARG 59 N 1.18 0.48 -0.12 4.77 3.08 -1.43 -0.56 114.38 121.78 1v8o h ARG 59 Ca 0.28 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.29 1v8o h ARG 59 Cb 0.17 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1v8o h ARG 59 CO -0.03 0.42 -0.06 1.25 -1.07 0.00 0.00 179.97 180.48 1v8o h HIS 60 N 0.42 -0.13 -0.27 3.04 2.76 -1.02 -1.49 115.15 118.45 1v8o h HIS 60 Ca 0.12 0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.35 1v8o h HIS 60 Cb 0.09 0.08 -0.05 0.00 1.55 0.00 0.00 27.41 29.08 1v8o h HIS 60 CO -0.02 -0.09 -0.03 1.25 -1.30 0.00 0.00 177.93 177.73 1v8o h LEU 61 N -0.05 -0.18 -0.80 0.26 6.46 -0.96 -1.02 115.31 119.02 1v8o h LEU 61 Ca 0.07 0.07 0.18 0.00 -0.12 0.00 0.00 57.88 58.08 1v8o h LEU 61 Cb 0.15 0.14 -0.11 0.00 -0.73 0.00 0.00 40.66 40.10 1v8o h LEU 61 CO -0.15 -0.06 0.26 0.50 -0.62 0.00 0.00 178.44 178.37 1v8o h LYS 62 N 0.04 0.32 0.01 1.25 3.64 -0.46 -1.95 116.57 119.42 1v8o h LYS 62 Ca 0.13 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1v8o h LYS 62 Cb 0.19 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1v8o h LYS 62 CO -0.25 0.21 -0.00 0.87 -2.27 0.00 0.00 179.45 178.01 1v8o h LYS 63 N 0.33 -0.01 -0.35 1.90 1.57 -0.23 -2.29 116.57 117.49 1v8o h LYS 63 Ca 0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.25 1v8o h LYS 63 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1v8o h LYS 63 CO -0.51 0.30 0.00 0.28 -0.57 0.00 0.00 179.45 178.95 1v8o n VAL 64 N -4.94 0.00 0.00 0.50 0.31 -0.51 -2.94 118.33 110.75 1v8o n VAL 64 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 1v8o n VAL 64 Cb 0.18 -0.08 0.00 0.00 -0.91 0.00 0.00 33.84 33.03 1v8o n VAL 64 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1v8o n SER 66 N 0.48 0.00 0.25 4.52 3.41 -0.86 -3.76 113.62 117.66 1v8o n SER 66 Ca 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.70 1v8o n SER 66 Cb 0.00 0.00 0.63 0.00 -0.26 0.00 0.00 64.21 64.58 1v8o n SER 66 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1v8o h SER 67 N 0.00 0.00 -3.26 4.04 0.02 -1.82 -3.44 113.55 109.09 1v8o h SER 67 Ca 0.00 0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.46 1v8o h SER 67 Cb 0.00 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.56 1v8o h SER 67 CO 0.00 0.14 -0.03 -0.36 -1.14 0.00 0.00 176.83 175.44 1v8o s PHE 68 N -4.46 3.52 -0.10 3.45 0.40 -1.25 -4.45 117.98 115.08 1v8o s PHE 68 Ca -0.04 0.64 -0.15 0.00 -0.60 0.00 0.00 56.93 56.79 1v8o s PHE 68 Cb 0.15 -2.14 -0.05 0.00 0.51 0.00 0.00 43.02 41.49 1v8o s PHE 68 CO 0.64 -0.05 0.37 0.21 0.70 0.00 0.00 175.22 177.08 1v8o s LYS 69 N -4.32 4.15 -0.18 0.44 2.36 -1.14 -4.92 119.74 116.12 1v8o s LYS 69 Ca 0.45 0.26 -0.09 0.00 -2.55 0.00 0.00 55.97 54.04 1v8o s LYS 69 Cb -0.10 -3.36 -0.05 0.00 -1.05 0.00 0.00 37.83 33.27 1v8o s LYS 69 CO 0.38 0.36 0.14 0.08 1.55 0.00 0.00 175.35 177.86 1v8o s VAL 70 N 0.03 5.43 0.39 4.02 1.01 -1.26 -0.84 120.40 129.18 1v8o s VAL 70 Ca 0.21 0.20 -0.00 0.00 0.00 0.00 0.00 61.98 62.39 1v8o s VAL 70 Cb -0.14 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 1v8o s VAL 70 CO 0.08 0.49 0.61 -0.76 0.00 0.00 0.00 175.10 175.52 1v8o s LEU 71 N -0.03 3.86 0.45 3.92 1.43 -0.50 -4.95 118.68 122.87 1v8o s LEU 71 Ca 0.10 0.46 -0.25 0.00 -1.03 0.00 0.00 54.13 53.41 1v8o s LEU 71 Cb -0.11 -3.34 -0.08 0.00 0.03 0.00 0.00 46.19 42.69 1v8o s LEU 71 CO -0.00 -0.45 1.37 -0.70 0.23 0.00 0.00 176.35 176.80 1v8o s GLU 72 N -4.44 3.68 0.42 1.70 2.56 -1.26 -4.39 118.70 116.97 1v8o s GLU 72 Ca 0.43 2.28 -0.25 0.00 0.00 0.00 0.00 54.97 57.43 1v8o s GLU 72 Cb -0.10 -2.61 -0.08 0.00 2.00 0.00 0.00 34.13 33.34 1v8o s GLU 72 CO 0.38 -0.77 1.26 -0.51 -0.56 0.00 0.00 175.26 175.05 1v8o s ASP 73 N -0.69 6.25 0.80 -1.70 -0.00 -1.26 -4.99 116.67 115.09 1v8o s ASP 73 Ca 0.62 2.54 -0.11 0.00 -0.00 0.00 0.00 52.55 55.59 1v8o s ASP 73 Cb -0.41 -2.63 0.07 0.00 -0.00 0.00 0.00 42.92 39.96 1v8o s ASP 73 CO 0.52 -0.88 1.09 -2.84 -0.00 0.00 0.00 175.17 173.06 1v8o s PRO 74 N -2.37 2.06 0.06 8.23 0.02 -1.26 -4.99 135.00 136.76 1v8o s PRO 74 Ca 0.59 0.68 -0.30 0.00 0.02 0.00 0.00 61.00 61.98 1v8o s PRO 74 Cb -0.35 -1.91 -0.05 0.00 0.02 0.00 0.00 34.50 32.20 1v8o s PRO 74 CO 0.44 -1.64 1.15 -2.14 -0.33 0.00 0.00 177.00 174.48 1v8o s PRO 75 N -5.13 4.47 0.40 5.54 0.02 -1.26 -4.86 135.00 134.17 1v8o s PRO 75 Ca 0.61 1.70 0.17 0.00 0.02 0.00 0.00 61.00 63.49 1v8o s PRO 75 Cb -0.15 -3.36 1.05 0.00 0.02 0.00 0.00 34.50 32.06 1v8o s PRO 75 CO 0.54 -0.19 1.81 1.25 -0.33 0.00 0.00 177.00 180.08 1v8o h LEU 76 N 6.65 0.47 0.00 -5.54 6.46 -2.00 -2.45 115.31 118.90 1v8o h LEU 76 Ca -0.42 0.07 0.00 0.00 -0.12 0.00 0.00 57.88 57.41 1v8o h LEU 76 Cb 1.22 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 41.13 1v8o h LEU 76 CO 0.79 0.15 0.00 -0.67 -0.62 0.00 0.00 178.44 178.09 1v8o n ASP 77 N -4.59 0.00 -0.27 1.25 4.64 -1.26 -3.25 116.55 113.07 1v8o n ASP 77 Ca 0.23 0.57 0.03 0.00 -1.38 0.00 0.00 54.79 54.23 1v8o n ASP 77 Cb 0.77 -0.07 0.16 0.00 -1.04 0.00 0.00 41.12 40.94 1v8o n ASP 77 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 1v8o h GLU 78 N 0.00 0.68 -1.98 -0.67 4.39 -1.88 -3.14 114.58 111.98 1v8o h GLU 78 Ca 0.00 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1v8o h GLU 78 Cb 0.00 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.50 1v8o h GLU 78 CO 0.00 0.45 0.00 0.28 -1.16 0.00 0.00 179.01 178.58 1v8o n VAL 79 N -4.80 0.00 0.00 3.13 0.31 -0.95 -2.27 118.33 113.74 1v8o n VAL 79 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 1v8o n VAL 79 Cb 0.29 -0.54 0.00 0.00 -0.91 0.00 0.00 33.84 32.68 1v8o n VAL 79 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1v8o n ARG 81 N 1.09 0.00 -0.06 5.55 0.63 -1.19 -0.33 116.66 122.36 1v8o n ARG 81 Ca 0.00 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 56.85 1v8o n ARG 81 Cb 0.00 0.00 -0.02 0.00 0.45 0.00 0.00 32.46 32.89 1v8o n ARG 81 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1v8o h VAL 82 N 0.00 0.38 -0.11 5.15 2.07 -1.78 0.51 116.25 122.47 1v8o h VAL 82 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1v8o h VAL 82 Cb 0.00 0.38 -0.06 0.00 -1.52 0.00 0.00 31.29 30.09 1v8o h VAL 82 CO 0.00 0.00 -0.51 0.00 0.02 0.00 0.00 177.57 177.08 1v8o h ALA 83 N 0.81 -0.88 0.01 1.67 0.00 -0.95 0.64 119.26 120.56 1v8o h ALA 83 Ca 0.14 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1v8o h ALA 83 Cb 0.47 0.98 -0.04 0.00 0.00 0.00 0.00 17.79 19.20 1v8o h ALA 83 CO -0.41 -1.06 -0.21 0.28 0.00 0.00 0.00 179.25 177.86 1v8o h VAL 84 N -0.56 0.51 -0.46 0.00 2.07 -1.63 -1.24 116.25 114.94 1v8o h VAL 84 Ca 0.03 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.49 1v8o h VAL 84 Cb 0.65 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1v8o h VAL 84 CO -0.40 0.00 0.07 -0.33 0.02 0.00 0.00 177.57 176.93 1v8o h GLU 85 N -0.34 0.76 -0.08 1.57 5.08 0.41 -3.20 114.58 118.78 1v8o h GLU 85 Ca 0.06 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1v8o h GLU 85 Cb 0.41 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1v8o h GLU 85 CO -0.19 0.78 0.00 0.54 -1.00 0.00 0.00 179.01 179.14 1v8o n ARG 86 N -4.45 1.70 -3.12 2.33 1.74 0.22 -4.94 116.66 110.14 1v8o n ARG 86 Ca 0.00 -1.03 -0.14 0.00 -0.77 0.00 0.00 57.85 55.91 1v8o n ARG 86 Cb 0.25 -1.45 0.06 0.00 -1.02 0.00 0.00 32.46 30.30 1v8o n ARG 86 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1v8o n GLY 87 N 1.16 -0.11 3.63 -0.13 0.00 -0.57 -5.03 105.19 104.14 1v8o n GLY 87 Ca 0.18 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 1v8o n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1v8o s LEU 88 N -5.21 2.91 0.69 0.99 1.43 -0.59 -5.06 118.68 113.84 1v8o s LEU 88 Ca 0.19 -1.25 -0.07 0.00 -1.03 0.00 0.00 54.13 51.97 1v8o s LEU 88 Cb -0.08 -1.06 0.05 0.00 0.03 0.00 0.00 46.19 45.13 1v8o s LEU 88 CO 0.51 -0.41 1.00 0.42 0.23 0.00 0.00 176.35 178.10 1v8o s THR 89 N -2.66 2.53 0.27 5.49 -4.23 -1.26 -4.54 115.64 111.24 1v8o s THR 89 Ca 0.36 -0.19 -0.02 0.00 -1.18 0.00 0.00 61.69 60.65 1v8o s THR 89 Cb 0.07 -3.09 0.15 0.00 1.34 0.00 0.00 72.50 70.97 1v8o s THR 89 CO 0.19 -0.10 1.81 0.15 -0.54 0.00 0.00 174.62 176.13 1v8o h PHE 90 N -0.55 0.90 -0.05 3.99 3.57 -1.94 0.37 116.94 123.23 1v8o h PHE 90 Ca -0.45 -0.09 -0.00 0.00 3.53 0.00 0.00 57.97 60.96 1v8o h PHE 90 Cb 1.30 -0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.78 1v8o h PHE 90 CO 0.36 0.76 0.02 1.88 -2.23 0.00 0.00 178.31 179.10 1v8o h TYR 91 N 0.84 0.08 -0.51 0.41 0.05 -1.99 -1.87 116.97 113.99 1v8o h TYR 91 Ca 0.18 -0.01 -0.12 0.00 0.05 0.00 0.00 58.73 58.84 1v8o h TYR 91 Cb 0.31 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.01 1v8o h TYR 91 CO 0.02 0.22 -0.13 -0.44 -1.05 0.00 0.00 178.16 176.78 1v8o h ASP 92 N -0.08 0.99 0.19 3.88 3.45 -1.90 -2.07 116.42 120.88 1v8o h ASP 92 Ca 0.02 -0.36 0.00 0.00 0.43 0.00 0.00 57.03 57.11 1v8o h ASP 92 Cb 0.18 -0.27 0.00 0.00 -0.56 0.00 0.00 39.33 38.68 1v8o h ASP 92 CO -0.00 1.13 0.00 0.00 -1.57 0.00 0.00 179.24 178.80 1v8o h ALA 93 N 0.90 1.00 -0.00 3.45 0.00 -0.84 -1.48 119.26 122.28 1v8o h ALA 93 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 1v8o h ALA 93 Cb 0.70 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1v8o h ALA 93 CO 0.05 0.00 -0.60 0.77 0.00 0.00 0.00 179.25 179.47 1v8o h SER 94 N 0.00 0.54 -0.31 0.00 0.02 -0.60 -1.18 113.55 112.02 1v8o h SER 94 Ca 0.00 -0.76 -0.18 0.00 -0.84 0.00 0.00 61.79 60.02 1v8o h SER 94 Cb 0.10 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 1v8o h SER 94 CO 0.00 1.22 -0.49 1.88 -1.14 0.00 0.00 176.83 178.30 1v8o h TYR 95 N -0.09 1.10 -0.59 3.45 -1.99 -1.28 -2.09 116.97 115.49 1v8o h TYR 95 Ca -0.07 -0.37 0.01 0.00 2.00 0.00 0.00 58.73 60.29 1v8o h TYR 95 Cb 1.31 -0.22 -0.03 0.00 2.00 0.00 0.00 36.73 39.80 1v8o h TYR 95 CO 0.14 1.20 0.39 0.00 -0.00 0.00 0.00 178.16 179.89 1v8o h ALA 96 N 0.73 0.74 0.32 3.88 0.00 -1.37 0.09 119.26 123.66 1v8o h ALA 96 Ca 0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1v8o h ALA 96 Cb 1.09 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1v8o h ALA 96 CO 0.11 0.18 -0.16 -0.92 0.00 0.00 0.00 179.25 178.46 1v8o h TYR 97 N 0.79 -0.40 0.10 0.00 3.20 -1.12 -2.82 116.97 116.71 1v8o h TYR 97 Ca 0.21 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.08 1v8o h TYR 97 Cb -0.09 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.29 1v8o h TYR 97 CO -0.03 -0.08 -0.14 0.28 -1.64 0.00 0.00 178.16 176.55 1v8o h VAL 98 N -0.75 0.68 -0.82 1.81 2.07 -1.35 -0.41 116.25 117.49 1v8o h VAL 98 Ca -0.04 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.67 1v8o h VAL 98 Cb 0.50 0.68 -0.14 0.00 -1.52 0.00 0.00 31.29 30.82 1v8o h VAL 98 CO 0.07 0.00 0.07 0.00 0.02 0.00 0.00 177.57 177.73 1v8o h ALA 99 N 0.59 0.95 0.05 1.67 0.00 -1.02 0.10 119.26 121.60 1v8o h ALA 99 Ca 0.02 0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1v8o h ALA 99 Cb 0.29 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1v8o h ALA 99 CO -0.07 -0.45 -0.02 0.93 0.00 0.00 0.00 179.25 179.65 1v8o h GLU 100 N 0.12 -0.06 -0.58 0.00 5.08 -1.28 0.96 114.58 118.82 1v8o h GLU 100 Ca 0.47 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 59.00 1v8o h GLU 100 Cb 0.88 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 1v8o h GLU 100 CO -0.69 0.18 0.56 0.66 -1.00 0.00 0.00 179.01 178.72 1v8o h SER 101 N -1.00 0.00 -0.26 1.42 4.64 -0.90 0.49 113.55 117.95 1v8o h SER 101 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1v8o h SER 101 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1v8o h SER 101 CO 0.01 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.77 1v8o n SER 102 N -3.79 2.99 -3.49 4.97 7.64 0.33 -4.94 113.62 117.32 1v8o n SER 102 Ca 0.11 -1.93 -0.24 0.00 1.01 0.00 0.00 58.87 57.82 1v8o n SER 102 Cb 0.78 -0.16 0.07 0.00 -1.01 0.00 0.00 64.21 63.89 1v8o n SER 102 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v8o n GLY 103 N 1.40 -0.54 3.72 0.23 0.00 0.17 -4.99 105.19 105.17 1v8o n GLY 103 Ca 0.18 0.23 -0.24 0.00 0.00 0.00 0.00 46.02 46.19 1v8o n GLY 103 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1v8o s LEU 104 N -7.19 3.46 -0.26 0.99 1.43 0.33 -5.01 118.68 112.42 1v8o s LEU 104 Ca 0.54 -0.41 -0.18 0.00 -1.03 0.00 0.00 54.13 53.05 1v8o s LEU 104 Cb -0.24 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 43.92 1v8o s LEU 104 CO 0.66 0.02 0.52 -0.69 0.23 0.00 0.00 176.35 177.10 1v8o s VAL 105 N -2.03 5.06 -0.12 -1.59 1.01 -0.29 -4.39 120.40 118.06 1v8o s VAL 105 Ca 0.31 0.88 -0.29 0.00 0.00 0.00 0.00 61.98 62.87 1v8o s VAL 105 Cb -0.08 -3.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 1v8o s VAL 105 CO 0.21 0.08 1.01 -0.22 0.00 0.00 0.00 175.10 176.18 1v8o s LEU 106 N 2.32 4.23 -0.25 3.92 0.20 -1.26 -0.92 118.68 126.92 1v8o s LEU 106 Ca 0.21 1.52 -0.08 0.00 0.69 0.00 0.00 54.13 56.47 1v8o s LEU 106 Cb -0.16 -3.55 -0.03 0.00 -0.43 0.00 0.00 46.19 42.02 1v8o s LEU 106 CO 0.09 -0.48 0.08 -0.69 -0.29 0.00 0.00 176.35 175.07 1v8o s VAL 107 N 2.15 4.43 0.09 1.68 1.01 0.49 -1.21 120.40 129.04 1v8o s VAL 107 Ca 0.48 -0.13 -0.15 0.00 0.00 0.00 0.00 61.98 62.17 1v8o s VAL 107 Cb -0.18 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.16 1v8o s VAL 107 CO 0.17 0.34 0.36 0.28 0.00 0.00 0.00 175.10 176.25 1v8o s THR 108 N 1.55 0.08 -0.16 3.92 -1.32 -0.72 -2.50 115.64 116.49 1v8o s THR 108 Ca 0.06 -0.65 0.21 0.00 -1.21 0.00 0.00 61.69 60.10 1v8o s THR 108 Cb -0.15 -1.12 -0.31 0.00 -1.51 0.00 0.00 72.50 69.42 1v8o s THR 108 CO 0.04 -0.36 0.51 1.67 -2.21 0.00 0.00 174.62 174.27 1v8o n GLN 109 N 0.05 0.59 -1.93 7.08 -0.06 -1.26 -4.03 117.38 117.82 1v8o n GLN 109 Ca -0.17 -0.16 -0.42 0.00 -2.00 0.00 0.00 57.00 54.25 1v8o n GLN 109 Cb 0.62 -1.48 -0.03 0.00 -4.06 0.00 0.00 30.24 25.29 1v8o n GLN 109 CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 1v8o s ASP 110 N -4.16 6.61 0.28 1.69 -1.08 -1.26 -4.89 116.67 113.86 1v8o s ASP 110 Ca -0.05 2.38 -0.01 0.00 -0.52 0.00 0.00 52.55 54.35 1v8o s ASP 110 Cb 0.13 -2.54 0.40 0.00 -1.46 0.00 0.00 42.92 39.45 1v8o s ASP 110 CO 0.85 -0.94 1.82 0.03 0.52 0.00 0.00 175.17 177.45 1v8o h ARG 111 N 9.38 0.81 -0.26 4.34 2.47 -2.00 -2.18 114.38 126.95 1v8o h ARG 111 Ca -0.42 -0.17 -0.15 0.00 -1.26 0.00 0.00 59.98 57.98 1v8o h ARG 111 Cb 1.20 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 29.39 1v8o h ARG 111 CO 0.94 0.75 -0.44 1.49 0.56 0.00 0.00 179.97 183.27 1v8o h GLU 112 N 0.78 0.65 -0.55 0.04 4.81 -2.00 -2.58 114.58 115.74 1v8o h GLU 112 Ca 0.17 -0.36 -0.10 0.00 -0.13 0.00 0.00 59.36 58.94 1v8o h GLU 112 Cb 0.32 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 1v8o h GLU 112 CO 0.00 0.96 -0.06 -0.07 -0.73 0.00 0.00 179.01 179.12 1v8o h LEU 113 N 0.53 1.00 -0.97 1.64 3.38 -1.92 -0.46 115.31 118.51 1v8o h LEU 113 Ca 0.04 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.72 1v8o h LEU 113 Cb 0.98 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 1v8o h LEU 113 CO 0.09 1.10 0.63 -0.07 0.09 0.00 0.00 178.44 180.28 1v8o h LEU 114 N 0.89 1.03 -0.13 1.67 3.38 -1.30 -0.89 115.31 119.95 1v8o h LEU 114 Ca 0.15 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.95 1v8o h LEU 114 Cb 0.62 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 41.15 1v8o h LEU 114 CO 0.04 0.69 -0.58 0.00 0.09 0.00 0.00 178.44 178.68 1v8o h ALA 115 N 1.42 0.25 -0.35 1.53 0.00 -1.18 -3.29 119.26 117.63 1v8o h ALA 115 Ca 0.40 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1v8o h ALA 115 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1v8o h ALA 115 CO -0.14 0.48 0.00 1.63 0.00 0.00 0.00 179.25 181.22 1v8o n LYS 116 N -4.14 1.92 -4.06 0.00 5.02 -0.20 -4.79 118.16 111.91 1v8o n LYS 116 Ca -0.08 -1.31 -0.28 0.00 -2.02 0.00 0.00 58.31 54.63 1v8o n LYS 116 Cb 0.64 -1.33 -0.17 0.00 -0.02 0.00 0.00 35.03 34.15 1v8o n LYS 116 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1v8o s THR 117 N -1.55 1.26 -0.08 -0.18 2.01 -0.36 -5.02 115.64 111.71 1v8o s THR 117 Ca 0.24 -0.45 -0.30 0.00 0.31 0.00 0.00 61.69 61.49 1v8o s THR 117 Cb 0.13 -1.22 -0.05 0.00 0.01 0.00 0.00 72.50 71.38 1v8o s THR 117 CO 0.16 0.40 1.58 -0.75 -0.69 0.00 0.00 174.62 175.32 1v8o s LYS 118 N 1.47 4.17 0.00 4.92 2.20 -1.26 -2.70 119.74 128.54 1v8o s LYS 118 Ca 0.02 2.06 0.00 0.00 -0.36 0.00 0.00 55.97 57.69 1v8o s LYS 118 Cb -0.13 -3.95 0.00 0.00 -1.51 0.00 0.00 37.83 32.24 1v8o s LYS 118 CO -0.07 -0.85 0.00 0.41 -0.36 0.00 0.00 175.35 174.48 1v8o n GLY 119 N 4.07 0.47 3.69 5.54 0.00 -1.26 -4.82 105.19 112.88 1v8o n GLY 119 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1v8o n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v8o n ALA 120 N -1.68 0.67 -2.48 4.61 0.00 -1.10 -4.39 120.51 116.14 1v8o n ALA 120 Ca 0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 53.44 53.29 1v8o n ALA 120 Cb 0.00 -2.25 -0.08 0.00 0.00 0.00 0.00 19.45 17.12 1v8o n ALA 120 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1v8o s ILE 121 N -1.53 0.07 0.63 0.00 -4.36 -0.35 -4.94 121.20 110.72 1v8o s ILE 121 Ca 0.80 -1.65 0.07 0.00 -0.26 0.00 0.00 60.65 59.61 1v8o s ILE 121 Cb -0.38 -2.02 0.11 0.00 1.25 0.00 0.00 42.46 41.42 1v8o s ILE 121 CO 0.44 -0.30 0.87 -0.90 0.24 0.00 0.00 174.94 175.29 1v8o n ASP 122 N -0.19 1.97 -0.12 4.36 5.68 -1.26 -1.76 116.55 125.23 1v8o n ASP 122 Ca -0.05 -2.47 -0.03 0.00 -0.50 0.00 0.00 54.79 51.73 1v8o n ASP 122 Cb 0.64 -0.49 0.19 0.00 -1.14 0.00 0.00 41.12 40.31 1v8o n ASP 122 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1v8o h VAL 123 N -0.08 1.23 -0.49 2.12 2.07 -1.94 -1.72 116.25 117.44 1v8o h VAL 123 Ca -0.29 -0.86 -0.06 0.00 0.82 0.00 0.00 66.70 66.31 1v8o h VAL 123 Cb 1.27 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 1v8o h VAL 123 CO 0.39 0.32 0.06 -0.08 0.02 0.00 0.00 177.57 178.27 1v8o h GLU 124 N 0.78 0.78 -0.31 1.57 4.81 -1.96 -1.60 114.58 118.65 1v8o h GLU 124 Ca 0.17 -0.18 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 1v8o h GLU 124 Cb 0.33 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1v8o h GLU 124 CO 0.00 0.75 -0.08 1.15 -0.73 0.00 0.00 179.01 180.11 1v8o h THR 125 N 0.74 1.28 -0.83 0.32 2.02 -1.84 -2.76 112.91 111.84 1v8o h THR 125 Ca 0.15 -1.12 0.04 0.00 0.77 0.00 0.00 66.41 66.26 1v8o h THR 125 Cb 0.37 1.36 -0.05 0.00 -1.74 0.00 0.00 68.15 68.09 1v8o h THR 125 CO 0.01 0.36 0.53 0.25 0.37 0.00 0.00 175.52 177.04 1v8o h LEU 126 N 0.38 0.87 -0.97 2.58 5.85 -0.95 -1.93 115.31 121.13 1v8o h LEU 126 Ca 0.08 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1v8o h LEU 126 Cb 0.57 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 1v8o h LEU 126 CO 0.03 0.59 0.47 -0.07 -0.34 0.00 0.00 178.44 179.11 1v8o h LEU 127 N 1.01 1.07 -0.61 2.25 3.38 -1.14 -1.21 115.31 120.06 1v8o h LEU 127 Ca 0.34 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 58.07 1v8o h LEU 127 Cb 0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1v8o h LEU 127 CO -0.13 0.86 -0.67 -0.37 0.09 0.00 0.00 178.44 178.22 1v8o h VAL 128 N 1.20 1.44 -0.19 1.22 -1.51 -1.18 -1.21 116.25 116.00 1v8o h VAL 128 Ca 0.30 -2.18 -0.03 0.00 -1.23 0.00 0.00 66.70 63.56 1v8o h VAL 128 Cb 0.03 2.16 -0.01 0.00 -2.13 0.00 0.00 31.29 31.34 1v8o h VAL 128 CO -0.05 0.63 0.02 0.03 -1.23 0.00 0.00 177.57 176.98 1v8o h ARG 129 N 0.09 0.33 -0.02 5.19 3.08 -0.88 -2.60 114.38 119.58 1v8o h ARG 129 Ca -0.01 -0.09 -0.11 0.00 0.07 0.00 0.00 59.98 59.84 1v8o h ARG 129 Cb 1.19 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.19 1v8o h ARG 129 CO 0.10 0.50 -0.49 -0.07 -1.07 0.00 0.00 179.97 178.93 1v8o h LEU 130 N 0.11 0.05 -1.31 3.04 3.38 -1.20 -2.47 115.31 116.91 1v8o h LEU 130 Ca 0.06 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1v8o h LEU 130 Cb 0.34 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1v8o h LEU 130 CO 0.01 0.53 -0.31 0.00 0.09 0.00 0.00 178.44 178.76 1v8o h ALA 131 N 1.47 1.22 -0.19 1.53 0.00 -1.08 -2.58 119.26 119.62 1v8o h ALA 131 Ca -0.00 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 1v8o h ALA 131 Cb 0.89 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1v8o h ALA 131 CO 0.07 0.39 -0.18 0.00 0.00 0.00 0.00 179.25 179.53 1v8o h ALA 132 N 1.69 0.28 -0.00 0.00 0.00 -1.05 -3.51 119.26 116.67 1v8o h ALA 132 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1v8o h ALA 132 Cb 0.66 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1v8o h ALA 132 CO 0.04 0.19 0.00 1.04 0.00 0.00 0.00 179.25 180.52