#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v8o s VAL 3 N 0.00 3.20 -0.12 0.00 1.01 -1.26 -4.58 120.40 118.66 1v8o s VAL 3 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 61.98 62.92 1v8o s VAL 3 Cb 0.00 -3.60 -0.08 0.00 0.00 0.00 0.00 36.38 32.71 1v8o s VAL 3 CO 0.00 0.11 -0.11 -0.62 0.00 0.00 0.00 175.10 174.48 1v8o n GLU 4 N 3.20 0.30 -4.34 2.72 1.02 -0.08 -5.01 120.64 118.44 1v8o n GLU 4 Ca 0.09 0.07 -0.28 0.00 -0.02 0.00 0.00 57.16 57.02 1v8o n GLU 4 Cb 0.42 -1.22 -0.11 0.00 -0.02 0.00 0.00 31.44 30.51 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 -2.24 2.47 -0.19 -0.32 1.51 -0.03 -1.93 117.35 116.61 1v8o s TYR 5 Ca -0.16 -0.29 -0.02 0.00 -1.01 0.00 0.00 57.07 55.59 1v8o s TYR 5 Cb 0.04 -1.26 0.00 0.00 -0.11 0.00 0.00 41.96 40.63 1v8o s TYR 5 CO 0.27 0.44 -0.11 -1.17 -1.11 0.00 0.00 175.55 173.87 1v8o s LEU 6 N -2.44 2.60 -0.22 -1.29 2.96 -0.75 -0.86 118.68 118.68 1v8o s LEU 6 Ca 0.20 -0.47 -0.08 0.00 -0.22 0.00 0.00 54.13 53.56 1v8o s LEU 6 Cb -0.09 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 1v8o s LEU 6 CO 0.11 0.01 0.08 -0.69 -1.32 0.00 0.00 176.35 174.54 1v8o s VAL 7 N 1.26 4.67 0.41 1.68 1.01 0.27 0.64 120.40 130.34 1v8o s VAL 7 Ca 0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.91 1v8o s VAL 7 Cb -0.14 -3.15 0.09 0.00 0.00 0.00 0.00 36.38 33.18 1v8o s VAL 7 CO -0.05 0.39 0.56 -0.90 0.00 0.00 0.00 175.10 175.09 1v8o n ASP 8 N 4.24 0.42 -0.16 3.32 5.68 -0.81 -4.60 116.55 124.65 1v8o n ASP 8 Ca -0.16 -1.43 -0.08 0.00 -0.50 0.00 0.00 54.79 52.61 1v8o n ASP 8 Cb 0.52 -0.39 0.01 0.00 -1.14 0.00 0.00 41.12 40.11 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 -1.08 0.59 -0.58 2.12 0.00 -1.90 0.35 119.26 118.76 1v8o h ALA 9 Ca -0.18 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 1v8o h ALA 9 Cb 0.60 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1v8o h ALA 9 CO 0.17 0.16 0.29 0.66 0.00 0.00 0.00 179.25 180.52 1v8o h SER 10 N 0.60 0.72 0.09 0.00 4.64 -1.94 -1.45 113.55 116.22 1v8o h SER 10 Ca 0.16 -0.06 -0.28 0.00 -0.47 0.00 0.00 61.79 61.14 1v8o h SER 10 Cb 0.12 -0.18 0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1v8o h SER 10 CO -0.02 0.61 -1.14 0.00 -0.87 0.00 0.00 176.83 175.41 1v8o h ALA 11 N 1.51 0.01 -0.98 5.18 0.00 -1.78 -2.84 119.26 120.36 1v8o h ALA 11 Ca 0.20 -0.74 0.14 0.00 0.00 0.00 0.00 54.91 54.51 1v8o h ALA 11 Cb 0.07 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 17.87 1v8o h ALA 11 CO -0.03 0.64 0.60 1.25 0.00 0.00 0.00 179.25 181.71 1v8o h LEU 12 N 0.23 0.85 0.15 0.00 7.12 -0.54 0.38 115.31 123.50 1v8o h LEU 12 Ca -0.17 0.06 -0.01 0.00 0.13 0.00 0.00 57.88 57.90 1v8o h LEU 12 Cb 1.82 -0.10 0.00 0.00 -0.53 0.00 0.00 40.66 41.85 1v8o h LEU 12 CO 0.22 0.41 -0.07 0.22 -0.13 0.00 0.00 178.44 179.09 1v8o h TYR 13 N 0.90 -0.18 -0.58 1.25 3.20 -1.25 -0.75 116.97 119.55 1v8o h TYR 13 Ca 0.51 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.37 1v8o h TYR 13 Cb 0.59 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.89 1v8o h TYR 13 CO -0.01 0.11 0.33 0.00 -1.64 0.00 0.00 178.16 176.95 1v8o h ALA 14 N 0.33 1.49 -0.26 1.82 0.00 -1.10 -2.47 119.26 119.07 1v8o h ALA 14 Ca -0.02 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 1v8o h ALA 14 Cb 0.37 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1v8o h ALA 14 CO 0.03 0.43 -0.33 -0.07 0.00 0.00 0.00 179.25 179.31 1v8o h LEU 15 N 0.80 0.57 0.00 0.00 3.38 -0.08 -2.58 115.31 117.40 1v8o h LEU 15 Ca 0.21 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1v8o h LEU 15 Cb -0.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1v8o h LEU 15 CO -0.04 0.87 0.00 0.00 0.09 0.00 0.00 178.44 179.36 1v8o n ALA 16 N -2.50 1.15 1.10 1.53 0.00 -0.31 -0.31 120.51 121.17 1v8o n ALA 16 Ca -0.01 -0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.55 1v8o n ALA 16 Cb 0.47 -1.00 0.18 0.00 0.00 0.00 0.00 19.45 19.10 1v8o n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v8o n ALA 17 N -1.35 2.53 -2.72 0.00 0.00 -0.97 -4.27 120.51 113.73 1v8o n ALA 17 Ca 0.00 -0.64 0.01 0.00 0.00 0.00 0.00 53.44 52.81 1v8o n ALA 17 Cb 0.00 -0.88 0.04 0.00 0.00 0.00 0.00 19.45 18.61 1v8o n ALA 17 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1v8o n HIS 18 N 1.06 0.78 -0.27 0.00 8.25 0.57 -4.99 115.22 120.63 1v8o n HIS 18 Ca 0.15 -1.56 -0.07 0.00 -0.26 0.00 0.00 57.72 55.97 1v8o n HIS 18 Cb 0.55 -0.18 -0.06 0.00 1.12 0.00 0.00 29.99 31.41 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 -0.23 -0.28 -0.17 4.41 9.36 -1.17 -0.79 117.16 128.29 1v8o n TYR 19 Ca 0.06 0.81 0.24 0.00 3.32 0.00 0.00 57.90 62.33 1v8o n TYR 19 Cb 0.92 -0.53 0.64 0.00 -0.63 0.00 0.00 39.34 39.74 1v8o n TYR 19 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 1v8o h ASP 20 N 0.00 0.15 0.83 2.98 3.32 -1.94 -0.63 116.42 121.14 1v8o h ASP 20 Ca 0.10 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1v8o h ASP 20 Cb 0.27 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1v8o h ASP 20 CO -0.61 0.06 0.00 0.29 -1.72 0.00 0.00 179.24 177.26 1v8o n LYS 21 N -4.38 0.03 0.00 3.56 5.02 0.03 -4.20 118.16 118.23 1v8o n LYS 21 Ca 0.17 0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.60 1v8o n LYS 21 Cb 0.81 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 34.28 1v8o n LYS 21 CO 0.00 0.00 0.00 -2.67 -0.52 0.00 0.00 177.40 174.21 1v8o n TRP 22 N -1.59 0.00 -0.33 2.13 4.27 -0.35 -4.83 117.44 116.75 1v8o n TRP 22 Ca 0.05 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 53.78 1v8o n TRP 22 Cb 0.28 0.00 0.33 0.00 -1.36 0.00 0.00 31.31 30.56 1v8o n TRP 22 CO 0.00 0.00 0.00 0.82 -2.29 0.00 0.00 177.69 176.22 1v8o h ILE 23 N 0.09 0.79 0.00 -1.67 5.03 -1.44 0.47 117.51 120.78 1v8o h ILE 23 Ca 0.00 -0.26 0.00 0.00 -0.12 0.00 0.00 64.86 64.48 1v8o h ILE 23 Cb 0.04 -0.05 0.00 0.00 -3.03 0.00 0.00 36.82 33.78 1v8o h ILE 23 CO 0.00 0.14 0.00 2.29 -0.68 0.00 0.00 178.15 179.90 1v8o n LYS 24 N -4.65 0.03 -0.06 2.37 2.85 -1.26 -0.96 118.16 116.47 1v8o n LYS 24 Ca 0.21 0.35 0.02 0.00 -1.05 0.00 0.00 58.31 57.84 1v8o n LYS 24 Cb 0.51 -1.50 0.06 0.00 -0.65 0.00 0.00 35.03 33.45 1v8o n LYS 24 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1v8o n HIS 25 N -1.42 0.16 -0.37 5.58 8.25 0.16 -4.77 115.22 122.82 1v8o n HIS 25 Ca 0.02 -0.42 0.28 0.00 -0.26 0.00 0.00 57.72 57.34 1v8o n HIS 25 Cb 0.05 -0.03 0.54 0.00 1.12 0.00 0.00 29.99 31.67 1v8o n HIS 25 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1v8o h ARG 26 N 0.86 0.24 0.00 -0.41 0.11 -0.73 0.51 114.38 114.96 1v8o h ARG 26 Ca 0.00 -0.01 -0.00 0.00 0.10 0.00 0.00 59.98 60.06 1v8o h ARG 26 Cb 0.53 -0.05 -0.00 0.00 1.11 0.00 0.00 29.97 31.56 1v8o h ARG 26 CO 0.00 0.16 -0.02 0.93 0.10 0.00 0.00 179.97 181.14 1v8o h GLU 27 N 0.25 0.00 0.00 0.08 5.08 -1.84 -1.60 114.58 116.55 1v8o h GLU 27 Ca 0.74 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.10 1v8o h GLU 27 Cb 1.95 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.20 1v8o h GLU 27 CO -0.49 0.02 -0.40 0.87 -1.00 0.00 0.00 179.01 178.00 1v8o h LYS 28 N 0.00 0.00 -5.81 2.33 1.57 -0.21 -3.36 116.57 111.09 1v8o h LYS 28 Ca -0.00 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 58.14 1v8o h LYS 28 Cb 0.11 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 1v8o h LYS 28 CO 0.00 0.00 -0.45 -0.51 -0.57 0.00 0.00 179.45 177.93 1v8o s LEU 29 N -4.40 4.38 0.11 2.94 2.01 -0.60 -0.85 118.68 122.26 1v8o s LEU 29 Ca 0.08 0.46 -0.03 0.00 0.01 0.00 0.00 54.13 54.64 1v8o s LEU 29 Cb 0.13 -2.54 -0.03 0.00 0.01 0.00 0.00 46.19 43.76 1v8o s LEU 29 CO 0.68 0.29 0.09 0.00 1.01 0.00 0.00 176.35 178.41 1v8o s ALA 30 N -1.26 0.54 0.32 4.21 0.00 -0.04 -2.99 121.76 122.54 1v8o s ALA 30 Ca 0.25 -1.24 0.06 0.00 0.00 0.00 0.00 51.96 51.04 1v8o s ALA 30 Cb -0.13 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.66 1v8o s ALA 30 CO 0.15 -0.49 0.27 0.96 0.00 0.00 0.00 175.76 176.65 1v8o s ILE 31 N -3.99 0.00 0.21 0.00 -4.36 -0.33 -0.56 121.20 112.17 1v8o s ILE 31 Ca 0.17 -1.98 0.08 0.00 -0.26 0.00 0.00 60.65 58.66 1v8o s ILE 31 Cb 0.07 -2.51 -0.04 0.00 1.25 0.00 0.00 42.46 41.23 1v8o s ILE 31 CO -0.02 0.00 0.04 -0.76 0.24 0.00 0.00 174.94 174.44 1v8o s LEU 32 N -3.35 3.40 0.56 0.37 1.43 -1.26 -0.56 118.68 119.27 1v8o s LEU 32 Ca 0.40 -0.42 0.27 0.00 -1.03 0.00 0.00 54.13 53.35 1v8o s LEU 32 Cb 0.03 -2.00 1.48 0.00 0.03 0.00 0.00 46.19 45.73 1v8o s LEU 32 CO 0.26 0.05 2.01 0.45 0.23 0.00 0.00 176.35 179.34 1v8o h HIS 33 N 2.29 0.00 -0.74 0.29 3.86 -1.94 0.15 115.15 119.07 1v8o h HIS 33 Ca -0.47 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 58.77 1v8o h HIS 33 Cb 1.22 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.65 1v8o h HIS 33 CO 0.62 0.00 0.47 1.25 0.86 0.00 0.00 177.93 181.14 1v8o h LEU 34 N 0.00 0.79 -0.91 2.43 6.46 -1.96 -2.79 115.31 119.32 1v8o h LEU 34 Ca 0.20 -0.01 0.19 0.00 -0.12 0.00 0.00 57.88 58.14 1v8o h LEU 34 Cb 0.88 -0.18 -0.11 0.00 -0.73 0.00 0.00 40.66 40.52 1v8o h LEU 34 CO -0.00 0.55 0.47 0.74 -0.62 0.00 0.00 178.44 179.58 1v8o h THR 35 N 0.93 0.60 -0.69 1.05 2.02 -1.08 0.61 112.91 116.35 1v8o h THR 35 Ca 0.29 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.29 1v8o h THR 35 Cb -0.02 -0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.35 1v8o h THR 35 CO -0.10 0.10 0.45 0.40 0.37 0.00 0.00 175.52 176.74 1v8o h ILE 36 N 0.56 1.15 -0.14 3.11 2.04 -1.58 0.20 117.51 122.85 1v8o h ILE 36 Ca 0.54 -0.31 -0.13 0.00 1.00 0.00 0.00 64.86 65.96 1v8o h ILE 36 Cb 0.93 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 1v8o h ILE 36 CO -0.44 0.16 -0.43 1.88 0.00 0.00 0.00 178.15 179.32 1v8o h TYR 37 N 0.90 0.70 -0.23 1.37 -1.99 -1.21 -0.45 116.97 116.07 1v8o h TYR 37 Ca 0.26 -0.28 -0.01 0.00 2.00 0.00 0.00 58.73 60.70 1v8o h TYR 37 Cb -0.06 -0.12 -0.01 0.00 2.00 0.00 0.00 36.73 38.54 1v8o h TYR 37 CO -0.03 1.04 0.11 0.93 -0.00 0.00 0.00 178.16 180.21 1v8o h GLU 38 N 0.16 0.33 -0.32 4.88 5.08 -0.77 0.23 114.58 124.17 1v8o h GLU 38 Ca -0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1v8o h GLU 38 Cb 1.05 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 1v8o h GLU 38 CO 0.09 0.33 0.21 0.00 -1.00 0.00 0.00 179.01 178.64 1v8o h ALA 39 N 0.98 0.40 0.06 3.43 0.00 -0.63 -1.14 119.26 122.36 1v8o h ALA 39 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1v8o h ALA 39 Cb 0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1v8o h ALA 39 CO -0.01 -0.13 -0.05 0.78 0.00 0.00 0.00 179.25 179.84 1v8o h GLY 40 N 0.43 -0.11 2.00 0.00 0.00 -0.77 -1.88 103.07 102.74 1v8o h GLY 40 Ca 0.12 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 1v8o h GLY 40 CO -0.02 -0.05 -0.07 -0.57 0.00 0.00 0.00 176.54 175.82 1v8o h ASN 41 N -0.12 0.00 -0.12 0.19 -0.73 -0.39 -0.37 115.58 114.04 1v8o h ASN 41 Ca 0.00 0.00 -0.04 0.00 1.87 0.00 0.00 56.30 58.13 1v8o h ASN 41 Cb 0.11 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.70 1v8o h ASN 41 CO -0.01 0.07 -0.07 0.00 -0.37 0.00 0.00 177.43 177.05 1v8o h ALA 42 N 1.93 0.18 0.00 1.57 0.00 -0.61 -2.45 119.26 119.88 1v8o h ALA 42 Ca -0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1v8o h ALA 42 Cb 0.14 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1v8o h ALA 42 CO 0.01 -0.02 -0.25 1.25 0.00 0.00 0.00 179.25 180.24 1v8o h LEU 43 N -0.09 0.00 -0.60 0.00 7.12 -0.68 -2.37 115.31 118.69 1v8o h LEU 43 Ca 0.03 0.00 -0.11 0.00 0.13 0.00 0.00 57.88 57.93 1v8o h LEU 43 Cb 0.55 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.66 1v8o h LEU 43 CO 0.02 0.25 -0.09 -0.25 -0.13 0.00 0.00 178.44 178.23 1v8o h TRP 44 N 0.00 1.13 -0.74 1.25 7.01 -0.90 -2.24 115.95 121.46 1v8o h TRP 44 Ca -0.00 -0.23 -0.06 0.00 2.11 0.00 0.00 58.89 60.71 1v8o h TRP 44 Cb 0.46 -0.28 -0.03 0.00 -2.10 0.00 0.00 29.16 27.20 1v8o h TRP 44 CO 0.00 1.04 0.24 0.87 -2.79 0.00 0.00 178.44 177.80 1v8o h LYS 45 N 0.91 1.15 -0.29 2.65 1.57 -0.94 0.12 116.57 121.73 1v8o h LYS 45 Ca 0.14 -0.24 -0.09 0.00 -1.87 0.00 0.00 60.65 58.59 1v8o h LYS 45 Cb 0.65 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1v8o h LYS 45 CO 0.05 0.97 -0.20 0.93 -0.57 0.00 0.00 179.45 180.63 1v8o h GLU 46 N 1.10 0.53 -0.56 3.15 5.08 -1.38 0.88 114.58 123.37 1v8o h GLU 46 Ca 0.24 -0.18 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1v8o h GLU 46 Cb 0.30 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1v8o h GLU 46 CO -0.01 0.70 0.04 0.00 -1.00 0.00 0.00 179.01 178.74 1v8o h ALA 47 N 1.32 0.75 -0.49 3.43 0.00 -0.80 -2.74 119.26 120.74 1v8o h ALA 47 Ca 0.08 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1v8o h ALA 47 Cb 0.61 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1v8o h ALA 47 CO 0.04 0.54 0.30 -0.09 0.00 0.00 0.00 179.25 180.04 1v8o h ARG 48 N 0.85 0.58 -0.90 0.00 1.12 0.22 -0.37 114.38 115.87 1v8o h ARG 48 Ca 0.16 -0.03 0.00 0.00 -1.11 0.00 0.00 59.98 59.00 1v8o h ARG 48 Cb 0.49 -0.13 0.00 0.00 -0.01 0.00 0.00 29.97 30.32 1v8o h ARG 48 CO 0.02 0.38 0.00 1.28 -3.11 0.00 0.00 179.97 178.54 1v8o n LEU 49 N -4.80 0.90 -1.04 3.80 4.77 0.21 -4.95 117.00 115.88 1v8o n LEU 49 Ca 0.03 -0.45 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 1v8o n LEU 49 Cb 0.06 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.70 1v8o n LEU 49 CO 0.33 0.22 -0.32 0.61 -1.33 0.00 0.00 177.39 176.91 1v8o n GLY 50 N 0.05 -3.73 0.00 -0.72 0.00 -0.15 -5.03 105.19 95.61 1v8o n GLY 50 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1v8o n GLY 50 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1v8o n ARG 51 N -1.97 0.00 -1.51 1.61 1.85 -1.26 -4.76 116.66 110.62 1v8o n ARG 51 Ca 0.00 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.43 1v8o n ARG 51 Cb 0.25 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.59 1v8o n ARG 51 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 1v8o n VAL 52 N 0.00 0.03 0.00 8.89 0.24 -1.26 -3.72 118.33 122.52 1v8o n VAL 52 Ca 0.00 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 1v8o n VAL 52 Cb 0.00 -1.90 0.00 0.00 -1.47 0.00 0.00 33.84 30.47 1v8o n VAL 52 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1v8o n ASP 53 N 12.70 0.00 -0.26 -1.34 3.85 -1.26 -5.03 116.55 125.22 1v8o n ASP 53 Ca 0.45 0.00 0.07 0.00 -0.71 0.00 0.00 54.79 54.60 1v8o n ASP 53 Cb 0.33 0.00 0.21 0.00 -1.35 0.00 0.00 41.12 40.30 1v8o n ASP 53 CO 0.00 0.00 0.00 4.11 -1.01 0.00 0.00 177.20 180.30 1v8o h TRP 54 N 0.00 0.42 -0.06 2.11 5.08 -1.96 1.61 115.95 123.15 1v8o h TRP 54 Ca 0.00 0.04 -0.00 0.00 1.08 0.00 0.00 58.89 60.01 1v8o h TRP 54 Cb 0.00 -0.06 -0.00 0.00 -3.00 0.00 0.00 29.16 26.09 1v8o h TRP 54 CO 0.00 -0.03 0.03 0.00 -1.28 0.00 0.00 178.44 177.16 1v8o h ALA 55 N 1.61 0.07 0.10 0.11 0.00 -1.95 0.65 119.26 119.84 1v8o h ALA 55 Ca 0.44 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.33 1v8o h ALA 55 Cb 0.75 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1v8o h ALA 55 CO -0.48 -0.42 -0.05 0.00 0.00 0.00 0.00 179.25 178.30 1v8o h ALA 56 N 0.99 -0.13 -0.76 0.00 0.00 -1.58 -1.40 119.26 116.38 1v8o h ALA 56 Ca 0.02 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 54.89 1v8o h ALA 56 Cb 0.03 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.79 1v8o h ALA 56 CO -0.00 -0.43 0.37 0.00 0.00 0.00 0.00 179.25 179.19 1v8o h ALA 57 N 0.45 1.08 -0.20 0.00 0.00 0.24 0.64 119.26 121.48 1v8o h ALA 57 Ca -0.01 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1v8o h ALA 57 Cb 0.35 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1v8o h ALA 57 CO 0.02 -0.07 -0.29 0.66 0.00 0.00 0.00 179.25 179.56 1v8o h SER 58 N 0.59 0.40 -0.08 0.00 4.64 0.42 -0.12 113.55 119.41 1v8o h SER 58 Ca 0.39 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1v8o h SER 58 Cb 0.48 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 1v8o h SER 58 CO -0.31 0.68 0.03 -0.09 -0.87 0.00 0.00 176.83 176.27 1v8o h ARG 59 N 0.35 0.08 -0.34 4.77 2.43 0.23 0.95 114.38 122.83 1v8o h ARG 59 Ca 0.05 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1v8o h ARG 59 Cb 0.70 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.21 1v8o h ARG 59 CO 0.05 0.05 0.20 1.25 -1.51 0.00 0.00 179.97 180.01 1v8o h HIS 60 N 0.08 0.46 -0.86 2.20 2.76 -0.76 -1.64 115.15 117.38 1v8o h HIS 60 Ca 0.03 -0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 1v8o h HIS 60 Cb 0.01 -0.15 -0.05 0.00 1.55 0.00 0.00 27.41 28.77 1v8o h HIS 60 CO -0.09 0.34 0.56 1.25 -1.30 0.00 0.00 177.93 178.69 1v8o h LEU 61 N 0.44 0.95 -0.65 0.26 6.46 -0.80 -0.78 115.31 121.19 1v8o h LEU 61 Ca 0.12 -0.01 0.05 0.00 -0.12 0.00 0.00 57.88 57.92 1v8o h LEU 61 Cb 0.02 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 39.68 1v8o h LEU 61 CO -0.02 0.67 0.37 0.50 -0.62 0.00 0.00 178.44 179.33 1v8o h LYS 62 N 1.12 0.67 0.73 1.25 3.64 -0.26 -2.75 116.57 120.97 1v8o h LYS 62 Ca 0.33 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.64 1v8o h LYS 62 Cb -0.05 -0.15 0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1v8o h LYS 62 CO -0.10 0.44 -0.35 -0.22 -2.27 0.00 0.00 179.45 176.95 1v8o h LYS 63 N 0.69 -0.95 -0.78 1.90 3.64 -0.32 -2.39 116.57 118.35 1v8o h LYS 63 Ca 0.29 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 1v8o h LYS 63 Cb 0.15 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1v8o h LYS 63 CO -0.17 -0.63 0.00 0.28 -2.27 0.00 0.00 179.45 176.67 1v8o n VAL 64 N -5.51 0.00 0.00 2.00 0.31 -0.41 -3.36 118.33 111.37 1v8o n VAL 64 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1v8o n VAL 64 Cb 0.40 -0.16 0.00 0.00 -0.91 0.00 0.00 33.84 33.17 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 0.57 0.00 0.24 4.52 3.41 -0.90 -4.17 113.62 117.29 1v8o n SER 66 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 1v8o n SER 66 Cb 0.00 0.00 0.61 0.00 -0.26 0.00 0.00 64.21 64.56 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 -3.13 4.04 0.02 -1.85 -3.44 113.55 109.18 1v8o h SER 67 Ca 0.00 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.36 1v8o h SER 67 Cb 0.00 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 1v8o h SER 67 CO 0.00 0.18 -0.26 -0.36 -1.14 0.00 0.00 176.83 175.25 1v8o s PHE 68 N -4.08 3.54 0.52 3.45 0.40 -1.26 -4.71 117.98 115.85 1v8o s PHE 68 Ca -0.02 0.72 -0.18 0.00 -0.60 0.00 0.00 56.93 56.85 1v8o s PHE 68 Cb 0.13 -2.12 -0.07 0.00 0.51 0.00 0.00 43.02 41.47 1v8o s PHE 68 CO 0.62 0.49 1.03 0.21 0.70 0.00 0.00 175.22 178.27 1v8o s LYS 69 N -2.15 3.69 -0.23 0.44 2.47 -1.16 -4.85 119.74 117.95 1v8o s LYS 69 Ca 0.36 1.23 0.01 0.00 -1.56 0.00 0.00 55.97 56.00 1v8o s LYS 69 Cb -0.13 -2.09 0.04 0.00 -1.46 0.00 0.00 37.83 34.19 1v8o s LYS 69 CO 0.20 -0.51 -0.12 0.08 0.16 0.00 0.00 175.35 175.16 1v8o s VAL 70 N -2.25 2.39 1.02 4.02 1.01 -1.26 -1.19 120.40 124.14 1v8o s VAL 70 Ca 0.64 -1.23 -0.12 0.00 0.00 0.00 0.00 61.98 61.27 1v8o s VAL 70 Cb -0.15 -2.23 0.20 0.00 0.00 0.00 0.00 36.38 34.20 1v8o s VAL 70 CO 0.27 0.21 1.08 -0.76 0.00 0.00 0.00 175.10 175.90 1v8o s LEU 71 N 1.23 1.53 0.27 3.92 1.43 0.28 -4.94 118.68 122.40 1v8o s LEU 71 Ca -0.02 1.27 -0.27 0.00 -1.03 0.00 0.00 54.13 54.08 1v8o s LEU 71 Cb -0.17 -3.43 -0.09 0.00 0.03 0.00 0.00 46.19 42.53 1v8o s LEU 71 CO -0.07 -3.28 0.92 -0.70 0.23 0.00 0.00 176.35 173.45 1v8o s GLU 72 N -4.88 4.68 0.37 1.70 2.12 -1.26 -4.40 118.70 117.04 1v8o s GLU 72 Ca 0.66 1.36 -0.27 0.00 0.36 0.00 0.00 54.97 57.08 1v8o s GLU 72 Cb -0.20 -3.05 -0.11 0.00 0.26 0.00 0.00 34.13 31.03 1v8o s GLU 72 CO 0.59 0.42 1.18 -0.25 -0.54 0.00 0.00 175.26 176.66 1v8o n ASP 73 N 1.06 2.17 -4.88 -1.70 10.43 -1.26 -4.96 116.55 117.41 1v8o n ASP 73 Ca -0.01 1.14 -0.30 0.00 2.57 0.00 0.00 54.79 58.19 1v8o n ASP 73 Cb 0.49 -1.43 0.01 0.00 1.84 0.00 0.00 41.12 42.03 1v8o n ASP 73 CO 0.00 0.00 0.00 -2.84 -1.07 0.00 0.00 177.20 173.29 1v8o s PRO 74 N -1.95 3.47 -0.17 -0.24 0.02 -1.26 -4.98 135.00 129.90 1v8o s PRO 74 Ca 0.59 0.56 -0.29 0.00 0.02 0.00 0.00 61.00 61.88 1v8o s PRO 74 Cb -0.57 -2.15 -0.04 0.00 0.02 0.00 0.00 34.50 31.77 1v8o s PRO 74 CO 0.60 -0.55 1.65 -2.14 -0.33 0.00 0.00 177.00 176.23 1v8o s PRO 75 N -5.10 3.90 0.53 5.54 0.02 -1.26 -4.82 135.00 133.81 1v8o s PRO 75 Ca 0.54 1.85 0.36 0.00 0.02 0.00 0.00 61.00 63.76 1v8o s PRO 75 Cb -0.11 -4.03 1.53 0.00 0.02 0.00 0.00 34.50 31.91 1v8o s PRO 75 CO 0.51 -1.18 1.80 1.25 -0.33 0.00 0.00 177.00 179.05 1v8o h LEU 76 N 11.35 0.03 0.01 -5.54 6.46 -2.00 -0.97 115.31 124.65 1v8o h LEU 76 Ca -0.36 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.41 1v8o h LEU 76 Cb 1.16 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.09 1v8o h LEU 76 CO 0.98 0.00 -0.02 -0.78 -0.62 0.00 0.00 178.44 178.00 1v8o h ASP 77 N 0.02 -0.07 -0.37 1.25 -0.00 -2.04 -3.25 116.42 111.97 1v8o h ASP 77 Ca 0.58 0.01 0.05 0.00 -0.00 0.00 0.00 57.03 57.66 1v8o h ASP 77 Cb 2.26 0.02 -0.04 0.00 -0.00 0.00 0.00 39.33 41.57 1v8o h ASP 77 CO -0.03 -0.03 0.11 -0.33 -0.00 0.00 0.00 179.24 178.96 1v8o h GLU 78 N -0.04 0.24 -1.29 0.28 4.39 -1.58 -2.93 114.58 113.65 1v8o h GLU 78 Ca -0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1v8o h GLU 78 Cb 0.04 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1v8o h GLU 78 CO -0.01 0.16 0.00 0.28 -1.16 0.00 0.00 179.01 178.28 1v8o n VAL 79 N -5.04 0.00 0.00 3.13 0.31 -0.91 -2.25 118.33 113.57 1v8o n VAL 79 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1v8o n VAL 79 Cb 0.14 -0.28 0.00 0.00 -0.91 0.00 0.00 33.84 32.80 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 0.74 0.00 -0.21 5.55 0.63 -1.11 -0.35 116.66 121.92 1v8o n ARG 81 Ca 0.00 0.00 -0.07 0.00 -0.92 0.00 0.00 57.85 56.86 1v8o n ARG 81 Cb 0.00 0.00 0.03 0.00 0.45 0.00 0.00 32.46 32.94 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 1.22 -0.26 5.15 2.07 -1.77 0.10 116.25 122.77 1v8o h VAL 82 Ca 0.00 -0.64 0.05 0.00 0.82 0.00 0.00 66.70 66.93 1v8o h VAL 82 Cb 0.00 0.54 -0.05 0.00 -1.52 0.00 0.00 31.29 30.26 1v8o h VAL 82 CO 0.00 0.26 -0.06 0.00 0.02 0.00 0.00 177.57 177.79 1v8o h ALA 83 N 1.11 0.18 0.41 1.67 0.00 -0.94 -0.38 119.26 121.30 1v8o h ALA 83 Ca 0.20 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1v8o h ALA 83 Cb 0.15 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1v8o h ALA 83 CO -0.02 -0.46 -0.20 0.28 0.00 0.00 0.00 179.25 178.85 1v8o h VAL 84 N 0.01 0.39 -0.31 0.00 2.07 -1.74 -0.39 116.25 116.28 1v8o h VAL 84 Ca 0.12 -0.61 0.09 0.00 0.82 0.00 0.00 66.70 67.13 1v8o h VAL 84 Cb 0.19 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1v8o h VAL 84 CO -0.26 0.08 0.22 -0.33 0.02 0.00 0.00 177.57 177.30 1v8o h GLU 85 N -0.99 0.00 -0.16 1.57 5.08 -0.74 -2.76 114.58 116.58 1v8o h GLU 85 Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1v8o h GLU 85 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1v8o h GLU 85 CO 0.09 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.64 1v8o n ARG 86 N -4.42 1.57 -2.47 2.33 1.74 -0.16 -4.99 116.66 110.25 1v8o n ARG 86 Ca 0.04 -1.58 -0.13 0.00 -0.77 0.00 0.00 57.85 55.41 1v8o n ARG 86 Cb 0.39 -1.26 0.01 0.00 -1.02 0.00 0.00 32.46 30.58 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 0.65 -0.10 3.88 -0.13 0.00 -0.75 -5.03 105.19 103.71 1v8o n GLY 87 Ca 0.09 -0.29 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.95 3.73 0.00 0.99 1.43 -0.23 -5.04 118.68 115.62 1v8o s LEU 88 Ca 0.09 -0.38 -0.18 0.00 -1.03 0.00 0.00 54.13 52.63 1v8o s LEU 88 Cb -0.04 -2.37 0.25 0.00 0.03 0.00 0.00 46.19 44.07 1v8o s LEU 88 CO 0.11 -0.32 1.21 0.35 0.23 0.00 0.00 176.35 177.92 1v8o n THR 89 N -1.41 0.00 0.01 5.49 -2.24 -1.26 -4.52 114.28 110.34 1v8o n THR 89 Ca -0.02 -0.76 -0.16 0.00 -2.27 0.00 0.00 64.05 60.83 1v8o n THR 89 Cb 0.59 -1.40 -0.06 0.00 -2.10 0.00 0.00 70.33 67.36 1v8o n THR 89 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1v8o h PHE 90 N -2.14 0.94 0.73 4.78 3.57 -1.95 -2.00 116.94 120.87 1v8o h PHE 90 Ca -0.41 -0.44 -0.04 0.00 3.53 0.00 0.00 57.97 60.61 1v8o h PHE 90 Cb 1.19 -0.14 0.01 0.00 2.79 0.00 0.00 35.95 39.80 1v8o h PHE 90 CO 0.00 1.26 -0.35 1.88 -2.23 0.00 0.00 178.31 178.87 1v8o h TYR 91 N 0.45 -0.91 -0.88 0.41 0.05 -1.99 -1.06 116.97 113.04 1v8o h TYR 91 Ca -0.06 -0.02 0.12 0.00 0.05 0.00 0.00 58.73 58.82 1v8o h TYR 91 Cb 1.45 0.30 -0.08 0.00 1.01 0.00 0.00 36.73 39.41 1v8o h TYR 91 CO 0.08 -0.54 0.51 -0.44 -1.05 0.00 0.00 178.16 176.71 1v8o h ASP 92 N -1.06 0.70 -0.67 3.88 3.45 -1.94 -0.42 116.42 120.36 1v8o h ASP 92 Ca -0.10 0.06 0.05 0.00 0.43 0.00 0.00 57.03 57.48 1v8o h ASP 92 Cb 0.77 -0.07 -0.05 0.00 -0.56 0.00 0.00 39.33 39.42 1v8o h ASP 92 CO 0.16 0.36 0.38 0.00 -1.57 0.00 0.00 179.24 178.57 1v8o h ALA 93 N 1.51 0.89 -0.53 3.45 0.00 -1.19 -2.24 119.26 121.16 1v8o h ALA 93 Ca 0.45 0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.48 1v8o h ALA 93 Cb 0.51 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.06 1v8o h ALA 93 CO -0.29 0.07 -0.09 0.77 0.00 0.00 0.00 179.25 179.71 1v8o h SER 94 N 0.71 -0.41 -0.25 0.00 0.02 0.29 0.36 113.55 114.26 1v8o h SER 94 Ca 0.29 0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 61.37 1v8o h SER 94 Cb 0.16 0.30 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1v8o h SER 94 CO -0.17 -0.15 0.08 1.88 -1.14 0.00 0.00 176.83 177.33 1v8o h TYR 95 N 0.03 0.39 -0.61 3.45 -1.99 -1.33 -0.61 116.97 116.30 1v8o h TYR 95 Ca 0.26 -0.04 0.02 0.00 2.00 0.00 0.00 58.73 60.97 1v8o h TYR 95 Cb 0.40 -0.11 -0.03 0.00 2.00 0.00 0.00 36.73 38.98 1v8o h TYR 95 CO -0.41 0.44 0.39 0.00 -0.00 0.00 0.00 178.16 178.58 1v8o h ALA 96 N 0.91 0.78 0.61 3.88 0.00 -0.76 0.17 119.26 124.85 1v8o h ALA 96 Ca 0.08 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1v8o h ALA 96 Cb 0.23 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.81 1v8o h ALA 96 CO -0.00 0.15 -0.29 -0.92 0.00 0.00 0.00 179.25 178.19 1v8o h TYR 97 N 0.77 -0.76 -0.65 0.00 3.20 -0.14 -1.12 116.97 118.28 1v8o h TYR 97 Ca 0.23 -0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.19 1v8o h TYR 97 Cb -0.03 0.25 -0.08 0.00 1.54 0.00 0.00 36.73 38.41 1v8o h TYR 97 CO -0.04 -0.47 0.24 0.28 -1.64 0.00 0.00 178.16 176.52 1v8o h VAL 98 N -0.93 0.73 0.10 1.81 2.07 -1.08 0.49 116.25 119.43 1v8o h VAL 98 Ca -0.08 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.32 1v8o h VAL 98 Cb 0.63 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1v8o h VAL 98 CO 0.14 0.07 -0.22 0.00 0.02 0.00 0.00 177.57 177.58 1v8o h ALA 99 N 1.46 -0.37 0.47 1.67 0.00 -0.62 0.66 119.26 122.54 1v8o h ALA 99 Ca 0.34 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1v8o h ALA 99 Cb 0.45 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1v8o h ALA 99 CO -0.34 -0.75 -0.23 0.93 0.00 0.00 0.00 179.25 178.86 1v8o h GLU 100 N -0.41 -0.61 -0.72 0.00 5.08 -0.59 0.17 114.58 117.50 1v8o h GLU 100 Ca 0.03 0.04 0.20 0.00 -1.00 0.00 0.00 59.36 58.63 1v8o h GLU 100 Cb 0.44 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1v8o h GLU 100 CO -0.14 -0.31 0.51 0.66 -1.00 0.00 0.00 179.01 178.73 1v8o h SER 101 N -1.00 0.05 0.01 1.42 4.64 -0.03 0.35 113.55 119.00 1v8o h SER 101 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1v8o h SER 101 Cb 0.58 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1v8o h SER 101 CO 0.11 0.02 -0.04 -1.20 -0.87 0.00 0.00 176.83 174.85 1v8o n SER 102 N -4.35 1.66 -3.12 4.97 7.64 0.22 -4.96 113.62 115.68 1v8o n SER 102 Ca 0.14 -1.50 -0.14 0.00 1.01 0.00 0.00 58.87 58.39 1v8o n SER 102 Cb 0.75 0.02 0.07 0.00 -1.01 0.00 0.00 64.21 64.04 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 1.22 -0.96 3.18 0.23 0.00 0.12 -5.03 105.19 103.96 1v8o n GLY 103 Ca 0.17 0.49 -0.11 0.00 0.00 0.00 0.00 46.02 46.57 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 -5.26 2.11 -0.33 0.99 1.43 0.01 -5.02 118.68 112.62 1v8o s LEU 104 Ca 0.39 -1.14 -0.18 0.00 -1.03 0.00 0.00 54.13 52.17 1v8o s LEU 104 Cb -0.05 0.08 -0.01 0.00 0.03 0.00 0.00 46.19 46.24 1v8o s LEU 104 CO 0.68 -0.61 0.52 -0.69 0.23 0.00 0.00 176.35 176.48 1v8o s VAL 105 N -3.80 5.02 -0.06 -1.59 1.01 -0.81 -4.46 120.40 115.70 1v8o s VAL 105 Ca 0.20 0.51 -0.30 0.00 0.00 0.00 0.00 61.98 62.39 1v8o s VAL 105 Cb 0.07 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1v8o s VAL 105 CO 0.00 -0.14 1.08 -0.22 0.00 0.00 0.00 175.10 175.82 1v8o s LEU 106 N 2.39 4.28 -0.35 3.92 0.20 -1.26 -1.81 118.68 126.05 1v8o s LEU 106 Ca 0.20 1.67 -0.11 0.00 0.69 0.00 0.00 54.13 56.58 1v8o s LEU 106 Cb -0.15 -3.56 0.01 0.00 -0.43 0.00 0.00 46.19 42.06 1v8o s LEU 106 CO 0.12 -0.47 0.20 -0.69 -0.29 0.00 0.00 176.35 175.23 1v8o s VAL 107 N 1.87 4.73 0.04 1.68 1.01 0.21 -1.76 120.40 128.18 1v8o s VAL 107 Ca 0.52 -0.63 -0.03 0.00 0.00 0.00 0.00 61.98 61.83 1v8o s VAL 107 Cb -0.21 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 1v8o s VAL 107 CO 0.21 -0.12 0.04 0.28 0.00 0.00 0.00 175.10 175.51 1v8o s THR 108 N 1.60 0.15 -0.94 3.92 -1.32 -0.79 -1.91 115.64 116.34 1v8o s THR 108 Ca 0.04 -1.22 0.21 0.00 -1.21 0.00 0.00 61.69 59.51 1v8o s THR 108 Cb -0.18 -0.91 -0.23 0.00 -1.51 0.00 0.00 72.50 69.66 1v8o s THR 108 CO 0.07 -0.67 0.88 1.67 -2.21 0.00 0.00 174.62 174.36 1v8o n GLN 109 N 0.78 0.04 -2.39 7.08 -0.06 -1.26 -3.94 117.38 117.63 1v8o n GLN 109 Ca -0.19 -0.01 -0.43 0.00 -2.00 0.00 0.00 57.00 54.37 1v8o n GLN 109 Cb 0.58 -1.50 -0.02 0.00 -4.06 0.00 0.00 30.24 25.24 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 -3.09 6.52 0.33 1.69 -1.08 -1.26 -4.91 116.67 114.88 1v8o s ASP 110 Ca 0.07 1.03 0.07 0.00 -0.52 0.00 0.00 52.55 53.19 1v8o s ASP 110 Cb 0.16 -2.54 0.74 0.00 -1.46 0.00 0.00 42.92 39.82 1v8o s ASP 110 CO 0.87 -1.24 1.86 0.03 0.52 0.00 0.00 175.17 177.21 1v8o h ARG 111 N 9.91 0.76 0.05 4.34 -0.00 -1.98 0.53 114.38 127.98 1v8o h ARG 111 Ca -0.27 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 59.16 1v8o h ARG 111 Cb 1.10 -0.17 0.00 0.00 0.00 0.00 0.00 29.97 30.90 1v8o h ARG 111 CO 1.06 0.50 -0.02 1.49 0.00 0.00 0.00 179.97 183.00 1v8o h GLU 112 N 0.78 -0.06 -0.54 0.04 4.57 -1.99 -1.50 114.58 115.88 1v8o h GLU 112 Ca 0.46 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.59 1v8o h GLU 112 Cb 0.64 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.22 1v8o h GLU 112 CO -0.22 0.17 0.13 -0.07 -1.18 0.00 0.00 179.01 177.84 1v8o h LEU 113 N -0.28 0.77 -0.78 1.64 3.38 -1.84 -0.67 115.31 117.52 1v8o h LEU 113 Ca -0.01 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1v8o h LEU 113 Cb 0.26 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1v8o h LEU 113 CO 0.01 0.76 0.43 0.25 0.09 0.00 0.00 178.44 179.97 1v8o h LEU 114 N 0.80 0.98 -0.41 1.67 6.46 -0.78 -1.85 115.31 122.18 1v8o h LEU 114 Ca 0.18 -0.10 -0.18 0.00 -0.12 0.00 0.00 57.88 57.65 1v8o h LEU 114 Cb 0.29 -0.25 -0.00 0.00 -0.73 0.00 0.00 40.66 39.96 1v8o h LEU 114 CO -0.00 0.80 -0.72 0.00 -0.62 0.00 0.00 178.44 177.90 1v8o h ALA 115 N 1.22 0.60 -0.60 1.25 0.00 -0.72 -3.30 119.26 117.71 1v8o h ALA 115 Ca 0.28 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1v8o h ALA 115 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1v8o h ALA 115 CO -0.04 0.76 0.00 1.63 0.00 0.00 0.00 179.25 181.59 1v8o n LYS 116 N -3.85 3.09 -4.40 0.00 5.02 -0.31 -4.89 118.16 112.83 1v8o n LYS 116 Ca -0.04 -2.45 -0.28 0.00 -2.02 0.00 0.00 58.31 53.52 1v8o n LYS 116 Cb 0.70 -1.71 -0.17 0.00 -0.02 0.00 0.00 35.03 33.83 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 -1.58 1.37 -0.42 -0.18 2.01 -0.72 -5.03 115.64 111.10 1v8o s THR 117 Ca 0.44 -0.57 -0.27 0.00 0.31 0.00 0.00 61.69 61.61 1v8o s THR 117 Cb 0.27 -1.27 -0.06 0.00 0.01 0.00 0.00 72.50 71.44 1v8o s THR 117 CO 0.24 0.42 2.37 -0.54 -0.69 0.00 0.00 174.62 176.42 1v8o s LYS 118 N 1.03 2.35 0.00 4.92 1.02 -1.26 -2.51 119.74 125.30 1v8o s LYS 118 Ca -0.06 1.57 0.00 0.00 0.02 0.00 0.00 55.97 57.50 1v8o s LYS 118 Cb -0.15 -4.53 0.00 0.00 -0.52 0.00 0.00 37.83 32.63 1v8o s LYS 118 CO -0.02 -2.99 0.00 0.41 -0.92 0.00 0.00 175.35 171.83 1v8o n GLY 119 N 5.95 0.59 3.67 -3.33 0.00 -1.26 -4.82 105.19 105.98 1v8o n GLY 119 Ca 0.35 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.52 0.19 -2.32 4.61 0.00 -1.04 -4.45 120.51 115.97 1v8o n ALA 120 Ca 0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 53.44 53.18 1v8o n ALA 120 Cb 0.00 -2.21 -0.09 0.00 0.00 0.00 0.00 19.45 17.15 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 -1.78 0.13 0.60 0.00 -4.36 -0.72 -4.95 121.20 110.12 1v8o s ILE 121 Ca 0.76 -1.65 0.07 0.00 -0.26 0.00 0.00 60.65 59.56 1v8o s ILE 121 Cb -0.34 -1.76 0.10 0.00 1.25 0.00 0.00 42.46 41.72 1v8o s ILE 121 CO 0.48 -0.59 0.82 -0.90 0.24 0.00 0.00 174.94 174.99 1v8o n ASP 122 N -0.06 1.84 -0.15 4.36 5.75 -1.25 -1.89 116.55 125.14 1v8o n ASP 122 Ca -0.10 -2.38 0.00 0.00 -0.01 0.00 0.00 54.79 52.31 1v8o n ASP 122 Cb 0.63 -0.46 0.27 0.00 -1.03 0.00 0.00 41.12 40.52 1v8o n ASP 122 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1v8o h VAL 123 N -0.08 1.18 -0.30 2.12 2.07 -1.93 -2.24 116.25 117.08 1v8o h VAL 123 Ca -0.28 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 1v8o h VAL 123 Cb 1.20 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1v8o h VAL 123 CO 0.36 0.20 0.04 1.05 0.02 0.00 0.00 177.57 179.25 1v8o h GLU 124 N 0.87 0.49 -0.55 1.57 4.11 -1.96 -2.06 114.58 117.06 1v8o h GLU 124 Ca 0.23 -0.13 0.08 0.00 0.07 0.00 0.00 59.36 59.60 1v8o h GLU 124 Cb -0.01 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.12 1v8o h GLU 124 CO -0.04 0.60 0.19 1.15 0.07 0.00 0.00 179.01 180.98 1v8o h THR 125 N 0.31 0.79 -0.46 -1.06 2.02 -1.87 -2.14 112.91 110.50 1v8o h THR 125 Ca 0.09 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 67.16 1v8o h THR 125 Cb 0.35 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 1v8o h THR 125 CO 0.01 0.07 0.28 0.25 0.37 0.00 0.00 175.52 176.50 1v8o h LEU 126 N 0.37 0.47 -1.98 2.58 5.85 -1.18 -2.09 115.31 119.34 1v8o h LEU 126 Ca 0.27 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 1v8o h LEU 126 Cb 0.32 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 1v8o h LEU 126 CO -0.28 0.34 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.00 1v8o h LEU 127 N 0.57 0.00 0.09 2.25 3.38 -0.73 -0.55 115.31 120.32 1v8o h LEU 127 Ca 0.18 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.87 1v8o h LEU 127 Cb -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1v8o h LEU 127 CO -0.07 0.09 -1.36 -0.37 0.09 0.00 0.00 178.44 176.82 1v8o h VAL 128 N 0.00 1.34 -0.39 1.22 -1.51 -1.12 -2.36 116.25 113.43 1v8o h VAL 128 Ca -0.00 -2.99 -0.03 0.00 -1.23 0.00 0.00 66.70 62.45 1v8o h VAL 128 Cb 0.19 2.80 -0.02 0.00 -2.13 0.00 0.00 31.29 32.13 1v8o h VAL 128 CO 0.01 0.84 0.13 0.03 -1.23 0.00 0.00 177.57 177.35 1v8o h ARG 129 N 0.05 0.59 -0.54 5.19 3.08 -0.68 -2.90 114.38 119.17 1v8o h ARG 129 Ca -0.17 -0.12 -0.06 0.00 0.07 0.00 0.00 59.98 59.70 1v8o h ARG 129 Cb 1.96 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.90 1v8o h ARG 129 CO 0.16 0.59 0.10 -0.07 -1.07 0.00 0.00 179.97 179.69 1v8o h LEU 130 N 0.48 0.84 -0.30 3.04 3.38 -1.19 -1.87 115.31 119.70 1v8o h LEU 130 Ca 0.13 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1v8o h LEU 130 Cb 0.24 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1v8o h LEU 130 CO -0.01 0.88 0.01 0.00 0.09 0.00 0.00 178.44 179.42 1v8o n ALA 131 N -2.41 0.98 -0.03 1.53 0.00 -0.89 -0.49 120.51 119.20 1v8o n ALA 131 Ca 0.02 0.04 0.03 0.00 0.00 0.00 0.00 53.44 53.53 1v8o n ALA 131 Cb 0.25 -1.04 -0.12 0.00 0.00 0.00 0.00 19.45 18.55 1v8o n ALA 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v8o n ALA 132 N -1.55 2.26 1.55 0.00 0.00 -0.82 -5.08 120.51 116.87 1v8o n ALA 132 Ca -0.00 -0.55 0.14 0.00 0.00 0.00 0.00 53.44 53.02 1v8o n ALA 132 Cb 0.02 -0.37 0.56 0.00 0.00 0.00 0.00 19.45 19.67 1v8o n ALA 132 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54