#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ilu s THR 5 N 0.00 4.37 0.00 3.15 2.01 -1.26 -4.55 115.64 119.35 3ilu s THR 5 Ca 0.00 1.63 -0.30 0.00 0.31 0.00 0.00 61.69 63.33 3ilu s THR 5 Cb 0.00 -4.12 -0.06 0.00 0.01 0.00 0.00 72.50 68.33 3ilu s THR 5 CO 0.00 -0.22 1.43 -0.69 -0.69 0.00 0.00 174.62 174.44 3ilu s VAL 6 N 3.58 3.66 -0.35 3.82 1.01 0.99 -4.82 120.40 128.29 3ilu s VAL 6 Ca 0.52 1.04 -0.26 0.00 0.00 0.00 0.00 61.98 63.28 3ilu s VAL 6 Cb -0.19 -3.67 0.01 0.00 0.00 0.00 0.00 36.38 32.54 3ilu s VAL 6 CO 0.14 -0.01 0.91 -0.69 0.00 0.00 0.00 175.10 175.45 3ilu s VAL 7 N 2.50 4.63 -0.24 2.92 1.01 -1.26 -0.98 120.40 128.96 3ilu s VAL 7 Ca 0.65 1.24 -0.10 0.00 0.00 0.00 0.00 61.98 63.78 3ilu s VAL 7 Cb -0.32 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.72 3ilu s VAL 7 CO 0.27 -0.47 0.14 -0.69 0.00 0.00 0.00 175.10 174.35 3ilu s VAL 8 N 3.37 5.05 -0.10 2.92 1.01 -0.42 -0.25 120.40 131.99 3ilu s VAL 8 Ca 0.37 0.08 -0.10 0.00 0.00 0.00 0.00 61.98 62.33 3ilu s VAL 8 Cb -0.12 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 3ilu s VAL 8 CO 0.17 0.33 0.23 0.28 0.00 0.00 0.00 175.10 176.11 3ilu s THR 9 N 1.26 5.34 0.18 3.92 -1.32 0.26 -0.74 115.64 124.55 3ilu s THR 9 Ca 0.06 0.42 -0.02 0.00 -1.21 0.00 0.00 61.69 60.95 3ilu s THR 9 Cb -0.14 -3.52 0.01 0.00 -1.51 0.00 0.00 72.50 67.33 3ilu s THR 9 CO 0.06 0.56 0.26 1.07 -2.21 0.00 0.00 174.62 174.36 3ilu n THR 10 N 2.30 0.00 -3.89 5.08 5.66 -0.34 -2.29 114.28 120.81 3ilu n THR 10 Ca -0.17 -0.82 -0.11 0.00 -3.05 0.00 0.00 64.05 59.91 3ilu n THR 10 Cb 0.54 0.53 -0.12 0.00 -1.55 0.00 0.00 70.33 69.73 3ilu n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 3ilu s ILE 11 N -2.61 0.06 -0.60 1.09 2.07 -1.26 -0.07 121.20 119.87 3ilu s ILE 11 Ca 0.13 -0.46 -0.27 0.00 -1.41 0.00 0.00 60.65 58.64 3ilu s ILE 11 Cb -0.01 -0.25 0.01 0.00 0.13 0.00 0.00 42.46 42.34 3ilu s ILE 11 CO 0.10 -0.25 1.52 -0.76 -1.91 0.00 0.00 174.94 173.64 3ilu s LEU 12 N -0.79 3.33 -0.18 8.50 1.43 -1.26 -4.42 118.68 125.29 3ilu s LEU 12 Ca -0.09 0.21 -0.04 0.00 -1.03 0.00 0.00 54.13 53.18 3ilu s LEU 12 Cb -0.05 -2.85 0.09 0.00 0.03 0.00 0.00 46.19 43.41 3ilu s LEU 12 CO 0.00 -1.91 0.28 -0.70 0.23 0.00 0.00 176.35 174.26 3ilu s GLU 13 N 5.95 0.21 0.34 1.70 2.56 -0.86 -4.99 118.70 123.61 3ilu s GLU 13 Ca 0.54 0.56 -0.28 0.00 0.00 0.00 0.00 54.97 55.79 3ilu s GLU 13 Cb -0.11 -0.46 -0.09 0.00 2.00 0.00 0.00 34.13 35.46 3ilu s GLU 13 CO 0.22 -0.47 1.17 -1.12 -0.56 0.00 0.00 175.26 174.50 3ilu s SER 14 N 2.43 6.90 -0.32 -1.70 0.01 -1.26 0.19 113.70 119.94 3ilu s SER 14 Ca 0.05 2.38 0.08 0.00 1.31 0.00 0.00 55.95 59.77 3ilu s SER 14 Cb -0.14 -2.63 0.67 0.00 0.21 0.00 0.00 66.02 64.14 3ilu s SER 14 CO -0.11 -0.42 1.74 -0.81 0.41 0.00 0.00 173.24 174.05 3ilu n PRO 15 N 0.69 3.24 -0.02 12.44 -0.04 -1.26 -4.93 135.00 145.12 3ilu n PRO 15 Ca 0.01 -2.78 -0.13 0.00 -0.04 0.00 0.00 63.50 60.56 3ilu n PRO 15 Cb 0.45 -2.13 -0.11 0.00 -0.04 0.00 0.00 33.50 31.68 3ilu n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3ilu h TYR 16 N 2.15 -0.03 -3.13 0.54 0.05 -0.58 0.14 116.97 116.11 3ilu h TYR 16 Ca 0.31 -0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.83 3ilu h TYR 16 Cb 2.31 0.01 -0.33 0.00 1.01 0.00 0.00 36.73 39.73 3ilu h TYR 16 CO 1.24 0.63 -0.60 0.08 -1.05 0.00 0.00 178.16 178.46 3ilu s VAL 17 N -3.32 -0.17 0.02 -2.88 1.01 -0.56 -1.07 120.40 113.42 3ilu s VAL 17 Ca -0.16 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.08 3ilu s VAL 17 Cb -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 36.38 36.07 3ilu s VAL 17 CO 0.64 0.11 -0.03 -0.04 0.00 0.00 0.00 175.10 175.78 3ilu s MET 18 N 1.76 0.26 0.02 2.72 -1.94 0.93 -2.03 119.30 121.02 3ilu s MET 18 Ca -0.03 -0.44 -0.30 0.00 -1.71 0.00 0.00 55.69 53.21 3ilu s MET 18 Cb -0.12 0.00 -0.06 0.00 2.01 0.00 0.00 34.83 36.66 3ilu s MET 18 CO -0.06 -0.01 1.41 -1.64 -0.01 0.00 0.00 175.02 174.70 3ilu s MET 19 N -1.00 4.29 0.45 2.03 -1.94 -1.26 -0.58 119.30 121.29 3ilu s MET 19 Ca -0.10 2.00 -0.24 0.00 -1.71 0.00 0.00 55.69 55.63 3ilu s MET 19 Cb -0.07 -3.52 -0.08 0.00 2.01 0.00 0.00 34.83 33.18 3ilu s MET 19 CO -0.01 -0.55 1.31 0.15 -0.01 0.00 0.00 175.02 175.92 3ilu s LYS 20 N 2.16 3.71 0.04 2.03 1.02 0.20 -4.88 119.74 124.02 3ilu s LYS 20 Ca 0.64 2.15 -0.35 0.00 0.02 0.00 0.00 55.97 58.44 3ilu s LYS 20 Cb -0.33 -2.58 -0.14 0.00 -0.52 0.00 0.00 37.83 34.26 3ilu s LYS 20 CO 0.27 -0.70 1.62 1.17 -0.92 0.00 0.00 175.35 176.79 3ilu n LYS 21 N -0.26 1.86 -1.62 1.68 4.81 -1.26 -1.79 118.16 121.58 3ilu n LYS 21 Ca 0.06 0.68 -0.13 0.00 -0.87 0.00 0.00 58.31 58.04 3ilu n LYS 21 Cb 0.44 -2.43 -0.04 0.00 0.02 0.00 0.00 35.03 33.02 3ilu n LYS 21 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3ilu n ASN 22 N 4.22 -4.47 -0.81 3.14 3.02 -1.26 -4.90 115.26 114.20 3ilu n ASN 22 Ca 0.20 0.24 0.08 0.00 -0.03 0.00 0.00 54.58 55.06 3ilu n ASN 22 Cb 0.26 -3.27 0.18 0.00 -0.61 0.00 0.00 39.78 36.33 3ilu n ASN 22 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3ilu n HIS 23 N -2.99 0.49 0.19 3.10 8.25 -0.74 -4.66 115.22 118.86 3ilu n HIS 23 Ca -0.14 -0.39 0.18 0.00 -0.26 0.00 0.00 57.72 57.11 3ilu n HIS 23 Cb 0.48 -0.01 0.81 0.00 1.12 0.00 0.00 29.99 32.39 3ilu n HIS 23 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 3ilu h GLU 24 N 2.80 0.00 -0.11 -0.41 3.07 -1.91 -1.79 114.58 116.23 3ilu h GLU 24 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3ilu h GLU 24 Cb 0.77 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 3ilu h GLU 24 CO 0.00 0.00 0.00 -1.33 -1.40 0.00 0.00 179.01 176.28 3ilu n MET 25 N -3.80 1.21 -0.55 2.33 2.81 -1.26 -4.99 117.12 112.87 3ilu n MET 25 Ca 0.02 -1.41 -0.11 0.00 -1.81 0.00 0.00 57.70 54.40 3ilu n MET 25 Cb 0.37 -1.22 0.08 0.00 -0.71 0.00 0.00 33.22 31.73 3ilu n MET 25 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 3ilu n LEU 26 N 0.57 0.00 -4.35 4.03 0.00 -0.68 -5.06 117.00 111.51 3ilu n LEU 26 Ca 0.08 -0.48 -0.32 0.00 0.00 0.00 0.00 56.01 55.29 3ilu n LEU 26 Cb 0.32 -0.37 -0.15 0.00 0.00 0.00 0.00 43.42 43.22 3ilu n LEU 26 CO 0.07 -1.09 -0.54 -1.61 0.00 0.00 0.00 177.39 174.22 3ilu s GLU 27 N -3.98 2.28 3.68 1.96 2.02 -1.26 -4.96 118.70 118.44 3ilu s GLU 27 Ca 0.27 -0.86 0.00 0.00 0.02 0.00 0.00 54.97 54.39 3ilu s GLU 27 Cb -0.01 -2.15 0.00 0.00 0.10 0.00 0.00 34.13 32.07 3ilu s GLU 27 CO 0.19 0.55 0.00 0.41 0.02 0.00 0.00 175.26 176.43 3ilu n GLY 28 N 2.48 0.67 0.23 -1.39 0.00 -1.26 -3.83 105.19 102.08 3ilu n GLY 28 Ca -0.16 -0.74 0.07 0.00 0.00 0.00 0.00 46.02 45.19 3ilu n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3ilu h ASN 29 N 8.07 0.00 -0.52 1.61 2.35 -1.93 -2.97 115.58 122.19 3ilu h ASN 29 Ca 0.00 0.00 0.12 0.00 -0.55 0.00 0.00 56.30 55.87 3ilu h ASN 29 Cb 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 3ilu h ASN 29 CO 0.00 0.22 0.36 -0.08 -1.65 0.00 0.00 177.43 176.28 3ilu h GLU 30 N 0.00 0.15 -0.73 0.81 4.57 -2.00 -2.58 114.58 114.80 3ilu h GLU 30 Ca -0.00 -0.01 0.18 0.00 -1.18 0.00 0.00 59.36 58.35 3ilu h GLU 30 Cb 0.45 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.96 3ilu h GLU 30 CO 0.03 0.10 0.51 0.00 -1.18 0.00 0.00 179.01 178.47 3ilu h ARG 31 N 0.15 0.17 -6.14 1.92 3.08 -1.71 -3.44 114.38 108.42 3ilu h ARG 31 Ca 0.25 -0.01 -0.63 0.00 0.07 0.00 0.00 59.98 59.66 3ilu h ARG 31 Cb 0.77 -0.04 -0.08 0.00 0.08 0.00 0.00 29.97 30.70 3ilu h ARG 31 CO -0.04 0.12 -0.58 0.71 -1.07 0.00 0.00 179.97 179.11 3ilu s TYR 32 N -5.18 3.24 0.07 3.04 2.02 -0.97 -0.63 117.35 118.93 3ilu s TYR 32 Ca -0.06 0.09 -0.00 0.00 -0.37 0.00 0.00 57.07 56.73 3ilu s TYR 32 Cb 0.21 -1.63 -0.04 0.00 -0.40 0.00 0.00 41.96 40.10 3ilu s TYR 32 CO 0.76 0.53 -0.03 -1.83 -1.57 0.00 0.00 175.55 173.40 3ilu s GLU 33 N -2.51 0.71 0.00 -0.62 -1.05 0.25 -4.86 118.70 110.62 3ilu s GLU 33 Ca 0.30 -1.28 0.00 0.00 -0.15 0.00 0.00 54.97 53.85 3ilu s GLU 33 Cb -0.12 0.08 0.00 0.00 -0.44 0.00 0.00 34.13 33.65 3ilu s GLU 33 CO 0.23 -0.09 0.00 0.41 0.95 0.00 0.00 175.26 176.76 3ilu n GLY 34 N 0.04 1.68 0.19 -3.83 0.00 -1.26 -0.05 105.19 101.97 3ilu n GLY 34 Ca -0.13 -1.72 -0.06 0.00 0.00 0.00 0.00 46.02 44.11 3ilu n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3ilu h TYR 35 N 0.00 -0.31 0.00 1.61 5.03 -0.57 -1.44 116.97 121.30 3ilu h TYR 35 Ca 0.00 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.29 3ilu h TYR 35 Cb 0.00 0.19 -0.01 0.00 1.55 0.00 0.00 36.73 38.46 3ilu h TYR 35 CO 0.00 -0.20 -0.24 0.00 -1.32 0.00 0.00 178.16 176.39 3ilu h VAL 37 N 0.00 1.28 -0.42 0.00 2.07 -1.45 0.84 116.25 118.56 3ilu h VAL 37 Ca -0.00 -1.42 -0.07 0.00 0.82 0.00 0.00 66.70 66.03 3ilu h VAL 37 Cb 0.88 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 3ilu h VAL 37 CO 0.03 0.48 -0.00 0.44 0.02 0.00 0.00 177.57 178.54 3ilu h ASP 38 N 0.72 0.73 -0.25 0.57 3.32 -0.88 -2.47 116.42 118.15 3ilu h ASP 38 Ca 0.08 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.82 3ilu h ASP 38 Cb 0.83 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 3ilu h ASP 38 CO 0.07 0.86 0.13 0.25 -1.72 0.00 0.00 179.24 178.83 3ilu h LEU 39 N 0.57 0.33 -0.83 1.55 5.85 -0.70 -2.42 115.31 119.67 3ilu h LEU 39 Ca 0.12 -0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.80 3ilu h LEU 39 Cb 0.49 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.37 3ilu h LEU 39 CO 0.02 0.35 0.49 0.00 -0.34 0.00 0.00 178.44 178.96 3ilu h ALA 40 N 0.99 1.16 -0.40 1.25 0.00 -0.81 -0.37 119.26 121.08 3ilu h ALA 40 Ca 0.09 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.04 3ilu h ALA 40 Cb 0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3ilu h ALA 40 CO -0.01 0.17 0.21 0.00 0.00 0.00 0.00 179.25 179.62 3ilu h ALA 41 N 1.42 0.50 -0.48 0.00 0.00 -1.04 -1.46 119.26 118.20 3ilu h ALA 41 Ca 0.38 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.17 3ilu h ALA 41 Cb 0.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3ilu h ALA 41 CO -0.21 -0.15 -0.20 0.93 0.00 0.00 0.00 179.25 179.63 3ilu h GLU 42 N 0.42 0.96 0.07 0.00 4.39 -0.93 -1.97 114.58 117.51 3ilu h GLU 42 Ca 0.17 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.47 3ilu h GLU 42 Cb 0.06 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 3ilu h GLU 42 CO -0.11 1.06 -0.06 0.82 -1.16 0.00 0.00 179.01 179.57 3ilu h ILE 43 N 0.83 0.87 -0.60 3.13 1.08 -0.97 -0.02 117.51 121.84 3ilu h ILE 43 Ca 0.11 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.53 3ilu h ILE 43 Cb 0.76 0.87 -0.03 0.00 -3.07 0.00 0.00 36.82 35.36 3ilu h ILE 43 CO 0.06 0.00 0.16 0.00 -0.69 0.00 0.00 178.15 177.68 3ilu h ALA 44 N 0.80 1.15 -0.44 1.87 0.00 -1.24 -0.31 119.26 121.09 3ilu h ALA 44 Ca 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 3ilu h ALA 44 Cb 0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3ilu h ALA 44 CO -0.01 0.58 0.13 -0.22 0.00 0.00 0.00 179.25 179.73 3ilu h LYS 45 N 0.88 0.69 0.00 0.00 3.64 -1.09 0.56 116.57 121.26 3ilu h LYS 45 Ca 0.19 -0.15 -0.12 0.00 -1.27 0.00 0.00 60.65 59.30 3ilu h LYS 45 Cb 0.30 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 3ilu h LYS 45 CO -0.00 0.67 -0.57 0.45 -2.27 0.00 0.00 179.45 177.73 3ilu h HIS 46 N 0.58 0.00 0.00 1.91 3.86 -0.46 -3.13 115.15 117.91 3ilu h HIS 46 Ca 0.14 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 3ilu h HIS 46 Cb 0.27 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.74 3ilu h HIS 46 CO 0.01 0.57 -1.23 0.00 0.86 0.00 0.00 177.93 178.15 3ilu n GLY 48 N 1.41 0.07 3.32 0.00 0.00 0.19 -5.05 105.19 105.13 3ilu n GLY 48 Ca 0.02 -0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 3ilu n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ilu s PHE 49 N -3.16 1.54 0.11 1.61 -0.12 -0.54 -5.03 117.98 112.39 3ilu s PHE 49 Ca 0.09 -0.76 -0.05 0.00 -0.05 0.00 0.00 56.93 56.16 3ilu s PHE 49 Cb -0.01 -0.82 -0.05 0.00 -0.63 0.00 0.00 43.02 41.51 3ilu s PHE 49 CO 0.31 0.13 0.34 0.15 -0.05 0.00 0.00 175.22 176.10 3ilu s LYS 50 N -3.76 3.59 0.07 1.99 1.02 -1.26 -4.66 119.74 116.73 3ilu s LYS 50 Ca 0.23 -0.12 -0.07 0.00 0.02 0.00 0.00 55.97 56.03 3ilu s LYS 50 Cb 0.03 -2.92 -0.01 0.00 -0.52 0.00 0.00 37.83 34.41 3ilu s LYS 50 CO 0.06 0.52 0.14 1.52 -0.92 0.00 0.00 175.35 176.67 3ilu s TYR 51 N -1.56 0.21 -0.12 3.18 1.13 -1.26 -0.01 117.35 118.91 3ilu s TYR 51 Ca 0.38 -0.61 0.01 0.00 -1.41 0.00 0.00 57.07 55.43 3ilu s TYR 51 Cb -0.13 -0.13 0.02 0.00 -1.10 0.00 0.00 41.96 40.63 3ilu s TYR 51 CO 0.23 -0.47 -0.13 0.21 -2.51 0.00 0.00 175.55 172.89 3ilu s LYS 52 N -3.46 2.07 -0.04 -3.49 2.20 -0.16 -4.87 119.74 111.98 3ilu s LYS 52 Ca 0.02 -0.48 -0.30 0.00 -0.36 0.00 0.00 55.97 54.85 3ilu s LYS 52 Cb 0.03 -1.89 -0.03 0.00 -1.51 0.00 0.00 37.83 34.44 3ilu s LYS 52 CO -0.09 -0.18 1.09 -0.51 -0.36 0.00 0.00 175.35 175.31 3ilu s LEU 53 N 1.35 4.30 0.00 5.43 1.43 -1.26 -1.30 118.68 128.63 3ilu s LEU 53 Ca 0.01 1.72 0.03 0.00 -1.03 0.00 0.00 54.13 54.86 3ilu s LEU 53 Cb -0.13 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.51 3ilu s LEU 53 CO -0.07 -0.46 -0.10 0.42 0.23 0.00 0.00 176.35 176.37 3ilu s THR 54 N 1.74 0.82 -0.14 5.49 -4.23 0.09 -4.89 115.64 114.52 3ilu s THR 54 Ca 0.53 -0.52 -0.22 0.00 -1.18 0.00 0.00 61.69 60.29 3ilu s THR 54 Cb -0.23 -0.70 -0.03 0.00 1.34 0.00 0.00 72.50 72.89 3ilu s THR 54 CO 0.23 0.17 0.69 -0.63 -0.54 0.00 0.00 174.62 174.54 3ilu s ILE 55 N -0.36 5.01 -0.06 2.99 -1.09 -1.26 -1.19 121.20 125.24 3ilu s ILE 55 Ca 0.03 1.36 -0.39 0.00 -2.23 0.00 0.00 60.65 59.42 3ilu s ILE 55 Cb -0.05 -4.01 -0.17 0.00 -1.58 0.00 0.00 42.46 36.65 3ilu s ILE 55 CO -0.00 0.16 1.42 0.55 -1.23 0.00 0.00 174.94 175.83 3ilu n VAL 56 N 4.32 0.08 -0.20 2.92 3.14 0.89 -4.88 118.33 124.60 3ilu n VAL 56 Ca -0.00 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.36 3ilu n VAL 56 Cb 0.50 -0.77 0.11 0.00 -1.06 0.00 0.00 33.84 32.62 3ilu n VAL 56 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 3ilu h GLY 57 N 5.00 0.81 -1.25 7.55 0.00 -1.93 -2.18 103.07 111.07 3ilu h GLY 57 Ca -0.48 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.77 3ilu h GLY 57 CO 0.82 -0.06 0.00 2.09 0.00 0.00 0.00 176.54 179.39 3ilu n ASP 58 N -5.05 2.11 -2.30 0.19 3.85 -1.26 -4.94 116.55 109.15 3ilu n ASP 58 Ca 0.09 -1.83 -0.21 0.00 -0.71 0.00 0.00 54.79 52.13 3ilu n ASP 58 Cb 0.29 -0.17 -0.02 0.00 -1.35 0.00 0.00 41.12 39.87 3ilu n ASP 58 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3ilu n GLY 59 N 1.20 -0.19 3.51 6.12 0.00 -0.82 -4.97 105.19 110.04 3ilu n GLY 59 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 3ilu n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ilu s LYS 60 N -4.89 1.81 -0.09 1.61 1.02 -1.26 -4.97 119.74 112.97 3ilu s LYS 60 Ca 0.00 -1.65 -0.23 0.00 0.02 0.00 0.00 55.97 54.12 3ilu s LYS 60 Cb 0.00 -1.88 -0.19 0.00 -0.52 0.00 0.00 37.83 35.25 3ilu s LYS 60 CO 0.00 0.35 0.79 1.88 -0.92 0.00 0.00 175.35 177.45 3ilu h TYR 61 N 2.30 -0.06 0.00 3.18 -1.99 -1.89 -2.31 116.97 116.21 3ilu h TYR 61 Ca -0.42 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.31 3ilu h TYR 61 Cb 1.25 0.02 0.00 0.00 2.00 0.00 0.00 36.73 40.00 3ilu h TYR 61 CO 0.76 0.55 0.00 0.41 -0.00 0.00 0.00 178.16 179.89 3ilu n GLY 62 N 1.09 3.49 3.27 3.88 0.00 -1.13 -1.20 105.19 114.58 3ilu n GLY 62 Ca -0.08 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.43 3ilu n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ilu s ALA 63 N 0.00 0.02 -0.29 4.61 0.00 -1.25 -4.70 121.76 120.15 3ilu s ALA 63 Ca 0.00 -0.86 -0.12 0.00 0.00 0.00 0.00 51.96 50.99 3ilu s ALA 63 Cb 0.00 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.79 3ilu s ALA 63 CO 0.00 -0.58 0.21 0.50 0.00 0.00 0.00 175.76 175.89 3ilu s ARG 64 N -3.94 3.87 0.23 0.00 3.52 -1.26 -1.69 118.95 119.68 3ilu s ARG 64 Ca 0.13 -0.36 -0.32 0.00 -0.13 0.00 0.00 55.73 55.06 3ilu s ARG 64 Cb 0.04 -3.69 -0.12 0.00 -1.56 0.00 0.00 34.95 29.63 3ilu s ARG 64 CO -0.04 -0.23 1.68 -3.47 -0.81 0.00 0.00 175.30 172.42 3ilu n ASP 65 N 5.09 3.90 0.19 -2.12 -0.08 -0.76 -4.88 116.55 117.88 3ilu n ASP 65 Ca -0.13 1.09 0.04 0.00 -1.51 0.00 0.00 54.79 54.27 3ilu n ASP 65 Cb 0.52 -1.57 0.36 0.00 2.34 0.00 0.00 41.12 42.76 3ilu n ASP 65 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3ilu h ALA 66 N 6.13 1.20 0.00 -1.67 0.00 -1.96 0.28 119.26 123.25 3ilu h ALA 66 Ca -0.44 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.11 3ilu h ALA 66 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3ilu h ALA 66 CO 0.90 0.49 -0.01 -0.44 0.00 0.00 0.00 179.25 180.19 3ilu h ASP 67 N 0.00 0.00 1.02 0.00 3.32 -1.99 -3.39 116.42 115.38 3ilu h ASP 67 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ilu h ASP 67 Cb 0.76 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.31 3ilu h ASP 67 CO 0.05 0.10 0.00 0.35 -1.72 0.00 0.00 179.24 178.02 3ilu n THR 68 N -2.56 0.67 -1.60 0.35 -2.24 -1.25 -4.89 114.28 102.76 3ilu n THR 68 Ca -0.00 0.01 -0.21 0.00 -2.27 0.00 0.00 64.05 61.58 3ilu n THR 68 Cb 0.00 -0.85 -0.09 0.00 -2.10 0.00 0.00 70.33 67.29 3ilu n THR 68 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3ilu n LYS 69 N -2.09 -1.46 -3.34 -0.78 4.76 1.00 -4.96 118.16 111.29 3ilu n LYS 69 Ca 0.04 1.23 -0.38 0.00 -2.87 0.00 0.00 58.31 56.34 3ilu n LYS 69 Cb 0.31 -5.62 -0.06 0.00 -1.84 0.00 0.00 35.03 27.82 3ilu n LYS 69 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3ilu s ILE 70 N -2.76 5.20 0.08 -0.18 1.01 -1.25 -4.71 121.20 118.58 3ilu s ILE 70 Ca 0.00 0.90 -0.30 0.00 0.00 0.00 0.00 60.65 61.25 3ilu s ILE 70 Cb 0.00 -3.79 -0.05 0.00 0.01 0.00 0.00 42.46 38.62 3ilu s ILE 70 CO 0.00 0.32 1.06 0.26 0.00 0.00 0.00 174.94 176.58 3ilu s TRP 71 N 0.69 3.61 0.48 3.97 0.52 -1.26 -1.84 118.94 125.11 3ilu s TRP 71 Ca 0.25 1.59 0.05 0.00 0.02 0.00 0.00 56.10 58.01 3ilu s TRP 71 Cb -0.15 -3.22 0.05 0.00 -1.15 0.00 0.00 33.47 29.00 3ilu s TRP 71 CO 0.09 -0.44 0.45 0.27 0.02 0.00 0.00 176.95 177.34 3ilu n ASN 72 N 3.37 2.29 0.00 2.95 0.23 -0.68 -4.23 115.26 119.18 3ilu n ASN 72 Ca 0.05 -2.53 0.00 0.00 -0.53 0.00 0.00 54.58 51.58 3ilu n ASN 72 Cb 0.48 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 38.05 3ilu n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ilu n GLY 73 N -0.78 0.35 0.18 4.83 0.00 -1.26 -1.75 105.19 106.76 3ilu n GLY 73 Ca 0.03 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.19 3ilu n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3ilu h MET 74 N 0.00 0.06 -0.18 1.61 2.86 -0.55 -1.93 114.93 116.79 3ilu h MET 74 Ca 0.00 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3ilu h MET 74 Cb 0.00 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 3ilu h MET 74 CO 0.00 0.49 0.08 0.28 1.06 0.00 0.00 176.91 178.82 3ilu h VAL 75 N 0.05 1.15 -0.83 -2.22 2.07 -1.50 -2.46 116.25 112.50 3ilu h VAL 75 Ca 0.00 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 3ilu h VAL 75 Cb 0.80 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 3ilu h VAL 75 CO 0.06 0.14 0.47 1.23 0.02 0.00 0.00 177.57 179.49 3ilu h GLY 76 N 0.16 1.22 0.67 2.17 0.00 -1.03 0.11 103.07 106.37 3ilu h GLY 76 Ca 0.06 -0.53 0.08 0.00 0.00 0.00 0.00 47.33 46.94 3ilu h GLY 76 CO -0.01 0.51 0.64 0.83 0.00 0.00 0.00 176.54 178.52 3ilu h GLU 77 N 1.15 1.08 -0.10 4.80 4.39 -1.11 0.04 114.58 124.83 3ilu h GLU 77 Ca 0.29 -0.06 -0.12 0.00 0.34 0.00 0.00 59.36 59.81 3ilu h GLU 77 Cb 0.00 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.41 3ilu h GLU 77 CO -0.05 0.71 -0.40 -0.07 -1.16 0.00 0.00 179.01 178.05 3ilu h LEU 78 N 1.11 0.53 -0.77 1.33 3.38 -0.84 0.25 115.31 120.30 3ilu h LEU 78 Ca 0.45 -0.62 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 3ilu h LEU 78 Cb 0.27 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 3ilu h LEU 78 CO -0.20 1.07 0.38 0.58 0.09 0.00 0.00 178.44 180.36 3ilu h VAL 79 N 0.03 1.24 -0.60 1.22 2.07 -0.21 -2.95 116.25 117.05 3ilu h VAL 79 Ca -0.02 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.83 3ilu h VAL 79 Cb 1.03 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 3ilu h VAL 79 CO 0.08 0.28 0.00 -1.22 0.02 0.00 0.00 177.57 176.74 3ilu n TYR 80 N -4.39 0.80 -0.99 1.57 4.01 -0.06 -4.94 117.16 113.17 3ilu n TYR 80 Ca 0.07 -0.40 0.00 0.00 -0.16 0.00 0.00 57.90 57.41 3ilu n TYR 80 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 3ilu n TYR 80 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ilu n GLY 81 N 1.53 0.55 0.09 2.72 0.00 -1.12 -4.95 105.19 104.01 3ilu n GLY 81 Ca 0.21 -0.84 0.12 0.00 0.00 0.00 0.00 46.02 45.51 3ilu n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ilu h LYS 82 N 0.00 0.00 -4.01 1.61 1.79 -0.76 -3.47 116.57 111.73 3ilu h LYS 82 Ca 0.00 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.35 3ilu h LYS 82 Cb 0.19 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 30.68 3ilu h LYS 82 CO 0.00 0.00 -0.57 0.00 -1.08 0.00 0.00 179.45 177.80 3ilu s ALA 83 N -3.25 0.16 -0.11 3.86 0.00 -0.95 -4.99 121.76 116.48 3ilu s ALA 83 Ca 0.04 -0.86 0.17 0.00 0.00 0.00 0.00 51.96 51.31 3ilu s ALA 83 Cb 0.11 0.30 -0.19 0.00 0.00 0.00 0.00 23.12 23.35 3ilu s ALA 83 CO 0.75 -0.37 0.64 -0.25 0.00 0.00 0.00 175.76 176.53 3ilu n ASP 84 N 0.35 0.65 -3.51 0.00 8.00 0.66 -4.59 116.55 118.12 3ilu n ASP 84 Ca -0.16 0.29 -0.17 0.00 0.71 0.00 0.00 54.79 55.46 3ilu n ASP 84 Cb 0.60 0.41 -0.05 0.00 -0.02 0.00 0.00 41.12 42.06 3ilu n ASP 84 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3ilu s ILE 85 N -2.85 0.00 -0.13 0.53 2.07 -1.05 -4.17 121.20 115.60 3ilu s ILE 85 Ca -0.05 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.22 3ilu s ILE 85 Cb 0.09 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.68 3ilu s ILE 85 CO 0.82 0.00 -0.21 0.00 -1.91 0.00 0.00 174.94 173.65 3ilu s ALA 86 N -1.58 2.30 -0.32 1.50 0.00 0.53 -0.57 121.76 123.62 3ilu s ALA 86 Ca -0.09 -1.03 0.03 0.00 0.00 0.00 0.00 51.96 50.87 3ilu s ALA 86 Cb -0.00 -0.99 0.09 0.00 0.00 0.00 0.00 23.12 22.22 3ilu s ALA 86 CO 0.06 0.09 0.04 0.42 0.00 0.00 0.00 175.76 176.38 3ilu s ILE 87 N 0.63 1.91 0.16 0.00 1.01 -0.97 -2.18 121.20 121.76 3ilu s ILE 87 Ca -0.11 -2.00 -0.25 0.00 0.00 0.00 0.00 60.65 58.30 3ilu s ILE 87 Cb -0.16 -2.36 0.06 0.00 0.01 0.00 0.00 42.46 40.00 3ilu s ILE 87 CO 0.03 -0.53 0.90 0.00 0.00 0.00 0.00 174.94 175.33 3ilu s ALA 88 N 1.11 -1.59 -1.15 9.38 0.00 -1.26 -4.61 121.76 123.64 3ilu s ALA 88 Ca 0.08 0.15 -0.13 0.00 0.00 0.00 0.00 51.96 52.05 3ilu s ALA 88 Cb -0.19 0.66 -0.07 0.00 0.00 0.00 0.00 23.12 23.53 3ilu s ALA 88 CO -0.11 -1.00 2.25 -0.35 0.00 0.00 0.00 175.76 176.55 3ilu n PRO 89 N -0.44 2.42 -3.57 0.00 -0.04 -1.26 -4.72 135.00 127.39 3ilu n PRO 89 Ca -0.06 -2.01 -0.39 0.00 -0.04 0.00 0.00 63.50 61.00 3ilu n PRO 89 Cb 0.61 -2.87 -0.11 0.00 -0.04 0.00 0.00 33.50 31.09 3ilu n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3ilu s LEU 90 N 0.96 4.25 0.09 1.53 2.96 -1.26 -5.01 118.68 122.20 3ilu s LEU 90 Ca 0.52 -0.23 -0.31 0.00 -0.22 0.00 0.00 54.13 53.89 3ilu s LEU 90 Cb 0.14 -2.12 -0.07 0.00 0.50 0.00 0.00 46.19 44.64 3ilu s LEU 90 CO -0.01 -0.14 1.30 -0.89 -1.32 0.00 0.00 176.35 175.28 3ilu s THR 91 N 1.73 3.65 -0.27 3.68 2.01 -1.26 -1.79 115.64 123.40 3ilu s THR 91 Ca 0.06 1.19 -0.29 0.00 0.31 0.00 0.00 61.69 62.97 3ilu s THR 91 Cb -0.17 -3.76 -0.02 0.00 0.01 0.00 0.00 72.50 68.56 3ilu s THR 91 CO 0.10 0.09 1.75 -0.63 -0.69 0.00 0.00 174.62 175.25 3ilu s ILE 92 N 1.06 3.53 0.17 1.82 1.01 -0.48 -4.88 121.20 123.43 3ilu s ILE 92 Ca 0.62 0.57 0.06 0.00 0.00 0.00 0.00 60.65 61.89 3ilu s ILE 92 Cb -0.33 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 3ilu s ILE 92 CO 0.30 -0.34 -0.13 0.42 0.00 0.00 0.00 174.94 175.19 3ilu s THR 93 N 6.18 1.48 0.13 2.92 -4.23 -1.26 -4.76 115.64 116.09 3ilu s THR 93 Ca 0.78 -2.05 -0.19 0.00 -1.18 0.00 0.00 61.69 59.05 3ilu s THR 93 Cb -0.25 -1.87 -0.04 0.00 1.34 0.00 0.00 72.50 71.69 3ilu s THR 93 CO 0.32 -0.60 1.75 0.25 -0.54 0.00 0.00 174.62 175.81 3ilu h LEU 94 N 2.85 0.11 -1.46 4.79 5.85 -1.98 -0.14 115.31 125.33 3ilu h LEU 94 Ca -0.38 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.30 3ilu h LEU 94 Cb 1.21 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 3ilu h LEU 94 CO 0.60 0.10 -0.27 -0.37 -0.34 0.00 0.00 178.44 178.15 3ilu h VAL 95 N 0.21 1.16 -0.02 1.05 -1.51 -2.00 -2.51 116.25 112.62 3ilu h VAL 95 Ca 0.10 -0.95 -0.25 0.00 -1.23 0.00 0.00 66.70 64.37 3ilu h VAL 95 Cb 0.06 1.52 0.02 0.00 -2.13 0.00 0.00 31.29 30.76 3ilu h VAL 95 CO -0.10 0.27 -0.99 0.03 -1.23 0.00 0.00 177.57 175.55 3ilu h ARG 96 N 0.00 0.68 0.00 5.19 3.08 -1.88 -3.20 114.38 118.25 3ilu h ARG 96 Ca -0.00 -0.70 0.00 0.00 0.07 0.00 0.00 59.98 59.35 3ilu h ARG 96 Cb 0.50 0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.74 3ilu h ARG 96 CO 0.04 1.29 0.00 1.49 -1.07 0.00 0.00 179.97 181.71 3ilu h GLU 97 N 0.40 0.00 0.00 0.04 4.57 -0.62 0.95 114.58 119.92 3ilu h GLU 97 Ca -0.11 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 57.97 3ilu h GLU 97 Cb 1.64 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.21 3ilu h GLU 97 CO 0.19 0.00 -0.47 0.93 -1.18 0.00 0.00 179.01 178.49 3ilu h GLU 98 N 0.00 0.00 0.00 1.92 5.08 -1.45 -3.36 114.58 116.77 3ilu h GLU 98 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ilu h GLU 98 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3ilu h GLU 98 CO 0.00 0.47 -0.70 1.33 -1.00 0.00 0.00 179.01 179.10 3ilu n VAL 99 N -3.42 0.00 -4.28 3.13 0.24 -0.02 -5.05 118.33 108.94 3ilu n VAL 99 Ca 0.01 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.34 61.92 3ilu n VAL 99 Cb 0.62 0.69 -0.10 0.00 -1.47 0.00 0.00 33.84 33.57 3ilu n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 3ilu s ILE 100 N -1.82 0.58 -0.00 1.34 -4.36 0.12 -4.17 121.20 112.90 3ilu s ILE 100 Ca -0.00 -1.99 -0.05 0.00 -0.26 0.00 0.00 60.65 58.35 3ilu s ILE 100 Cb 0.02 -2.39 -0.04 0.00 1.25 0.00 0.00 42.46 41.30 3ilu s ILE 100 CO 0.14 -0.22 0.23 -1.81 0.24 0.00 0.00 174.94 173.53 3ilu s ASP 101 N -3.24 6.45 -0.01 4.36 1.01 -0.07 -4.30 116.67 120.87 3ilu s ASP 101 Ca 0.31 0.48 0.08 0.00 0.71 0.00 0.00 52.55 54.13 3ilu s ASP 101 Cb 0.07 -2.06 -0.02 0.00 1.01 0.00 0.00 42.92 41.92 3ilu s ASP 101 CO 0.09 0.26 -0.24 -0.36 0.21 0.00 0.00 175.17 175.13 3ilu s PHE 102 N -1.30 2.15 0.99 4.23 0.08 -1.26 -1.28 117.98 121.59 3ilu s PHE 102 Ca 0.27 -0.41 -0.12 0.00 0.12 0.00 0.00 56.93 56.80 3ilu s PHE 102 Cb -0.13 -1.37 0.18 0.00 -0.57 0.00 0.00 43.02 41.13 3ilu s PHE 102 CO 0.16 -0.01 1.08 -1.54 -0.10 0.00 0.00 175.22 174.81 3ilu s SER 103 N -0.66 2.60 0.72 1.36 1.04 0.34 -4.95 113.70 114.15 3ilu s SER 103 Ca 0.09 1.50 -0.16 0.00 0.48 0.00 0.00 55.95 57.87 3ilu s SER 103 Cb -0.09 -2.18 -0.02 0.00 0.10 0.00 0.00 66.02 63.83 3ilu s SER 103 CO -0.00 -3.19 0.73 0.29 0.98 0.00 0.00 173.24 172.05 3ilu n LYS 104 N -4.25 0.40 -1.78 4.02 4.76 -1.26 -4.54 118.16 115.51 3ilu n LYS 104 Ca 0.06 0.18 -0.41 0.00 -2.87 0.00 0.00 58.31 55.27 3ilu n LYS 104 Cb 0.55 -2.01 -0.00 0.00 -1.84 0.00 0.00 35.03 31.73 3ilu n LYS 104 CO 0.00 0.00 0.00 -2.14 -1.37 0.00 0.00 177.40 173.89 3ilu s PRO 105 N -3.01 4.09 0.00 1.97 0.02 -1.26 -4.58 135.00 132.23 3ilu s PRO 105 Ca 0.69 2.60 0.18 0.00 0.02 0.00 0.00 61.00 64.49 3ilu s PRO 105 Cb -0.35 -2.97 -0.18 0.00 0.02 0.00 0.00 34.50 31.02 3ilu s PRO 105 CO 0.54 -0.57 0.77 1.97 -0.33 0.00 0.00 177.00 179.39 3ilu n PHE 106 N 0.58 0.00 -3.68 6.54 1.16 -0.03 -4.98 117.46 117.05 3ilu n PHE 106 Ca 0.02 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.47 3ilu n PHE 106 Cb 0.39 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 38.17 3ilu n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 3ilu s MET 107 N -2.66 0.62 0.13 3.97 0.00 -1.25 -5.00 119.30 115.12 3ilu s MET 107 Ca 0.07 0.82 -0.11 0.00 0.00 0.00 0.00 55.69 56.48 3ilu s MET 107 Cb 0.14 0.25 -0.06 0.00 0.00 0.00 0.00 34.83 35.15 3ilu s MET 107 CO 0.72 -0.10 0.47 0.45 0.00 0.00 0.00 175.02 176.57 3ilu s SER 108 N 0.60 6.69 0.30 1.11 0.15 -1.26 -1.17 113.70 120.12 3ilu s SER 108 Ca -0.02 0.89 -0.20 0.00 0.70 0.00 0.00 55.95 57.32 3ilu s SER 108 Cb -0.05 -2.21 0.03 0.00 -1.71 0.00 0.00 66.02 62.08 3ilu s SER 108 CO -0.03 0.10 0.74 -1.48 1.20 0.00 0.00 173.24 173.76 3ilu s LEU 109 N -2.14 -0.20 0.08 3.45 -0.00 -0.70 -4.81 118.68 114.36 3ilu s LEU 109 Ca 0.38 -0.71 -0.09 0.00 -0.00 0.00 0.00 54.13 53.70 3ilu s LEU 109 Cb -0.14 2.74 0.00 0.00 -0.00 0.00 0.00 46.19 48.79 3ilu s LEU 109 CO 0.19 -1.41 0.21 -0.83 -0.00 0.00 0.00 176.35 174.51 3ilu s GLY 110 N -2.95 0.06 0.24 -3.48 0.00 -1.26 -1.01 107.32 98.92 3ilu s GLY 110 Ca 0.12 -0.53 -0.30 0.00 0.00 0.00 0.00 44.72 44.01 3ilu s GLY 110 CO 0.08 -0.72 1.44 -0.42 0.00 0.00 0.00 173.10 173.48 3ilu s ILE 111 N -3.68 2.67 0.27 0.90 1.01 -1.26 0.04 121.20 121.15 3ilu s ILE 111 Ca 0.03 0.56 0.03 0.00 0.00 0.00 0.00 60.65 61.27 3ilu s ILE 111 Cb 0.04 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.12 3ilu s ILE 111 CO -0.10 0.09 0.19 -0.94 0.00 0.00 0.00 174.94 174.18 3ilu s SER 112 N 0.39 0.96 -0.18 3.58 1.04 0.12 0.32 113.70 119.94 3ilu s SER 112 Ca 0.60 -1.56 -0.04 0.00 0.48 0.00 0.00 55.95 55.43 3ilu s SER 112 Cb -0.42 0.44 -0.02 0.00 0.10 0.00 0.00 66.02 66.13 3ilu s SER 112 CO 0.43 -0.93 -0.04 -0.63 0.98 0.00 0.00 173.24 173.05 3ilu s ILE 113 N -3.80 3.71 -0.17 -1.02 1.01 -1.26 -1.50 121.20 118.17 3ilu s ILE 113 Ca 0.39 -0.41 -0.06 0.00 0.00 0.00 0.00 60.65 60.57 3ilu s ILE 113 Cb 0.05 -2.64 -0.04 0.00 0.01 0.00 0.00 42.46 39.84 3ilu s ILE 113 CO 0.19 0.47 0.02 -0.32 0.00 0.00 0.00 174.94 175.30 3ilu s MET 114 N 0.73 3.86 0.18 2.79 -2.45 0.26 -1.90 119.30 122.77 3ilu s MET 114 Ca -0.02 -0.41 0.08 0.00 -1.25 0.00 0.00 55.69 54.09 3ilu s MET 114 Cb -0.15 -3.10 -0.04 0.00 1.25 0.00 0.00 34.83 32.79 3ilu s MET 114 CO 0.02 0.26 -0.16 0.96 1.05 0.00 0.00 175.02 177.16 3ilu s ILE 115 N 0.36 1.76 0.25 10.11 -4.36 -0.11 -1.23 121.20 127.96 3ilu s ILE 115 Ca 0.00 -2.06 -0.30 0.00 -0.26 0.00 0.00 60.65 58.03 3ilu s ILE 115 Cb -0.13 -1.93 -0.09 0.00 1.25 0.00 0.00 42.46 41.56 3ilu s ILE 115 CO 0.01 -0.47 1.26 -0.75 0.24 0.00 0.00 174.94 175.23 3ilu s LYS 116 N -3.23 4.44 0.22 0.37 2.47 -1.26 -0.93 119.74 121.81 3ilu s LYS 116 Ca 0.19 2.03 -0.32 0.00 -1.56 0.00 0.00 55.97 56.32 3ilu s LYS 116 Cb -0.03 -3.16 -0.14 0.00 -1.46 0.00 0.00 37.83 33.03 3ilu s LYS 116 CO 0.07 -0.13 1.29 1.63 0.16 0.00 0.00 175.35 178.36 3ilu n LYS 117 N 1.86 1.65 0.00 4.03 5.02 -0.52 -1.81 118.16 128.40 3ilu n LYS 117 Ca 0.03 0.59 0.00 0.00 -2.02 0.00 0.00 58.31 56.91 3ilu n LYS 117 Cb 0.43 -2.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.27 3ilu n LYS 117 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ilu n GLY 118 N 2.04 2.08 3.72 0.72 0.00 -1.26 -4.99 105.19 107.49 3ilu n GLY 118 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3ilu n GLY 118 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ilu s THR 119 N -2.41 2.60 -1.09 2.61 2.01 -0.75 -4.86 115.64 113.75 3ilu s THR 119 Ca 0.00 0.43 -0.08 0.00 0.31 0.00 0.00 61.69 62.35 3ilu s THR 119 Cb 0.00 -3.28 -0.13 0.00 0.01 0.00 0.00 72.50 69.11 3ilu s THR 119 CO 0.00 0.04 2.94 -0.81 -0.69 0.00 0.00 174.62 176.10 3ilu n PRO 120 N 3.86 2.96 -4.56 4.92 -0.05 -1.26 -4.82 135.00 136.05 3ilu n PRO 120 Ca 0.13 -1.75 -0.23 0.00 -0.05 0.00 0.00 63.50 61.61 3ilu n PRO 120 Cb 0.38 -2.52 -0.16 0.00 -0.05 0.00 0.00 33.50 31.15 3ilu n PRO 120 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 175.50 175.87 3ilu s ILE 121 N 2.09 1.04 -0.03 0.52 -1.09 -1.26 -5.03 121.20 117.44 3ilu s ILE 121 Ca 0.63 -0.50 0.03 0.00 -2.23 0.00 0.00 60.65 58.59 3ilu s ILE 121 Cb 0.20 -0.91 -0.05 0.00 -1.58 0.00 0.00 42.46 40.12 3ilu s ILE 121 CO -0.04 0.31 0.02 -0.62 -1.23 0.00 0.00 174.94 173.38 3ilu n GLU 122 N 3.26 2.99 -4.04 2.79 1.02 -1.26 -4.94 120.64 120.46 3ilu n GLU 122 Ca -0.18 -0.01 -0.12 0.00 -0.02 0.00 0.00 57.16 56.83 3ilu n GLU 122 Cb 0.54 -1.09 -0.04 0.00 -0.02 0.00 0.00 31.44 30.82 3ilu n GLU 122 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3ilu s SER 123 N -3.32 0.44 0.18 1.62 1.04 -1.26 -2.59 113.70 109.80 3ilu s SER 123 Ca -0.02 -1.26 -0.08 0.00 0.48 0.00 0.00 55.95 55.08 3ilu s SER 123 Cb 0.01 0.63 0.07 0.00 0.10 0.00 0.00 66.02 66.84 3ilu s SER 123 CO 0.15 -1.25 1.59 0.00 0.98 0.00 0.00 173.24 174.72 3ilu h ALA 124 N 2.18 0.77 -0.46 5.32 0.00 -1.93 -2.62 119.26 122.52 3ilu h ALA 124 Ca -0.28 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.32 3ilu h ALA 124 Cb 1.24 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.81 3ilu h ALA 124 CO 0.39 0.66 0.14 1.49 0.00 0.00 0.00 179.25 181.93 3ilu h GLU 125 N 0.83 0.29 -0.29 0.00 4.81 -1.96 -0.85 114.58 117.42 3ilu h GLU 125 Ca 0.12 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.40 3ilu h GLU 125 Cb 0.74 -0.07 -0.08 0.00 0.63 0.00 0.00 28.75 29.97 3ilu h GLU 125 CO 0.06 0.19 -0.23 -0.44 -0.73 0.00 0.00 179.01 177.86 3ilu h ASP 126 N 0.30 -0.76 -0.59 1.04 5.19 -1.92 -1.77 116.42 117.91 3ilu h ASP 126 Ca 0.22 0.15 0.11 0.00 -0.62 0.00 0.00 57.03 56.88 3ilu h ASP 126 Cb 0.24 0.37 -0.08 0.00 0.18 0.00 0.00 39.33 40.04 3ilu h ASP 126 CO -0.24 -0.27 0.15 -0.07 -3.12 0.00 0.00 179.24 175.69 3ilu h LEU 127 N -0.21 0.05 -0.81 1.55 3.38 -0.99 -2.11 115.31 116.16 3ilu h LEU 127 Ca 0.15 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3ilu h LEU 127 Cb 0.45 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3ilu h LEU 127 CO -0.42 0.04 0.00 0.77 0.09 0.00 0.00 178.44 178.92 3ilu h SER 128 N 0.29 0.00 -0.72 -0.43 4.64 -0.35 -3.05 113.55 113.93 3ilu h SER 128 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3ilu h SER 128 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3ilu h SER 128 CO -0.37 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 175.88 3ilu n LYS 129 N -2.42 2.90 -4.14 4.77 5.02 -0.80 -4.96 118.16 118.53 3ilu n LYS 129 Ca 0.02 -2.69 -0.11 0.00 -2.02 0.00 0.00 58.31 53.51 3ilu n LYS 129 Cb 0.26 -1.62 -0.09 0.00 -0.02 0.00 0.00 35.03 33.57 3ilu n LYS 129 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 3ilu s GLN 130 N -1.13 1.26 0.00 1.97 1.03 -1.15 -5.07 119.66 116.56 3ilu s GLN 130 Ca 0.49 -1.52 0.00 0.00 0.04 0.00 0.00 55.36 54.37 3ilu s GLN 130 Cb 0.26 0.32 0.00 0.00 0.03 0.00 0.00 33.01 33.62 3ilu s GLN 130 CO 0.32 -0.44 0.10 -2.37 -2.54 0.00 0.00 175.29 170.36 3ilu n THR 131 N -0.28 0.00 0.04 3.63 5.66 -1.26 -4.82 114.28 117.25 3ilu n THR 131 Ca 0.00 -0.14 -0.13 0.00 -3.05 0.00 0.00 64.05 60.73 3ilu n THR 131 Cb 0.65 1.56 -0.02 0.00 -1.55 0.00 0.00 70.33 70.96 3ilu n THR 131 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 3ilu h GLU 132 N 0.00 0.51 -4.93 1.09 4.57 -1.97 -3.42 114.58 110.43 3ilu h GLU 132 Ca 0.00 -0.47 -0.64 0.00 -1.18 0.00 0.00 59.36 57.07 3ilu h GLU 132 Cb 0.28 0.11 -0.19 0.00 -0.16 0.00 0.00 28.75 28.79 3ilu h GLU 132 CO 0.00 1.10 -0.56 0.42 -1.18 0.00 0.00 179.01 178.79 3ilu s ILE 133 N -3.52 4.93 0.66 2.32 1.01 -1.26 -4.91 121.20 120.43 3ilu s ILE 133 Ca -0.07 0.04 -0.11 0.00 0.00 0.00 0.00 60.65 60.51 3ilu s ILE 133 Cb 0.09 -3.33 -0.01 0.00 0.01 0.00 0.00 42.46 39.23 3ilu s ILE 133 CO 0.87 0.29 1.05 0.00 0.00 0.00 0.00 174.94 177.15 3ilu s ALA 134 N 1.66 3.01 -0.16 9.38 0.00 -0.36 -4.90 121.76 130.39 3ilu s ALA 134 Ca 0.07 -0.29 -0.28 0.00 0.00 0.00 0.00 51.96 51.45 3ilu s ALA 134 Cb -0.16 -3.00 0.08 0.00 0.00 0.00 0.00 23.12 20.04 3ilu s ALA 134 CO 0.08 -0.94 0.75 1.52 0.00 0.00 0.00 175.76 177.16 3ilu s TYR 135 N -3.26 -0.67 0.00 0.00 1.13 -1.26 -1.07 117.35 112.22 3ilu s TYR 135 Ca 0.56 1.39 0.00 0.00 -1.41 0.00 0.00 57.07 57.62 3ilu s TYR 135 Cb -0.11 0.36 0.00 0.00 -1.10 0.00 0.00 41.96 41.11 3ilu s TYR 135 CO 0.52 -0.47 0.00 0.41 -2.51 0.00 0.00 175.55 173.49 3ilu n GLY 136 N 1.66 3.08 3.39 5.49 0.00 -1.17 -4.80 105.19 112.84 3ilu n GLY 136 Ca -0.16 -1.06 -0.15 0.00 0.00 0.00 0.00 46.02 44.65 3ilu n GLY 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ilu s THR 137 N -2.60 0.00 0.47 2.61 -4.23 -1.24 -0.66 115.64 109.99 3ilu s THR 137 Ca 0.00 -1.76 -0.23 0.00 -1.18 0.00 0.00 61.69 58.52 3ilu s THR 137 Cb 0.00 -2.54 -0.07 0.00 1.34 0.00 0.00 72.50 71.23 3ilu s THR 137 CO 0.00 0.00 1.20 -0.22 -0.54 0.00 0.00 174.62 175.06 3ilu s LEU 138 N -3.24 4.01 0.28 4.79 2.96 -1.26 -2.26 118.68 123.96 3ilu s LEU 138 Ca 0.34 2.39 -0.13 0.00 -0.22 0.00 0.00 54.13 56.51 3ilu s LEU 138 Cb 0.02 -4.22 -0.08 0.00 0.50 0.00 0.00 46.19 42.41 3ilu s LEU 138 CO 0.20 -0.99 0.67 -0.62 -1.32 0.00 0.00 176.35 174.28 3ilu s ASP 139 N -1.26 6.73 -1.06 3.68 3.68 -0.59 -4.24 116.67 123.62 3ilu s ASP 139 Ca 0.64 1.16 -0.01 0.00 2.13 0.00 0.00 52.55 56.47 3ilu s ASP 139 Cb -0.31 -2.32 0.00 0.00 -1.45 0.00 0.00 42.92 38.84 3ilu s ASP 139 CO 0.37 -0.15 0.07 -1.20 0.13 0.00 0.00 175.17 174.40 3ilu n SER 140 N -0.22 -4.05 -4.00 -0.34 7.64 -1.26 -4.84 113.62 106.55 3ilu n SER 140 Ca 0.02 -0.04 -0.20 0.00 1.01 0.00 0.00 58.87 59.66 3ilu n SER 140 Cb 0.53 -3.19 -0.09 0.00 -1.01 0.00 0.00 64.21 60.44 3ilu n SER 140 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3ilu s GLY 141 N -2.50 2.13 0.42 0.23 0.00 -1.26 -2.85 107.32 103.49 3ilu s GLY 141 Ca 0.03 -1.73 0.22 0.00 0.00 0.00 0.00 44.72 43.25 3ilu s GLY 141 CO 0.04 -1.62 1.82 1.48 0.00 0.00 0.00 173.10 174.83 3ilu h SER 142 N 2.16 0.00 -0.20 1.64 4.64 -1.92 -2.85 113.55 117.03 3ilu h SER 142 Ca -0.34 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.93 3ilu h SER 142 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 3ilu h SER 142 CO 0.52 0.28 -0.07 0.74 -0.87 0.00 0.00 176.83 177.43 3ilu h THR 143 N 0.00 1.30 -0.36 2.95 2.02 -1.97 0.24 112.91 117.10 3ilu h THR 143 Ca -0.00 -1.09 0.01 0.00 0.77 0.00 0.00 66.41 66.09 3ilu h THR 143 Cb 0.74 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.74 3ilu h THR 143 CO 0.04 0.33 0.22 0.50 0.37 0.00 0.00 175.52 176.98 3ilu h LYS 144 N 0.10 0.44 -0.65 6.66 3.64 -1.71 -1.84 116.57 123.21 3ilu h LYS 144 Ca 0.05 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.42 3ilu h LYS 144 Cb 0.54 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 3ilu h LYS 144 CO 0.02 0.29 0.43 0.93 -2.27 0.00 0.00 179.45 178.85 3ilu h GLU 145 N 0.45 0.82 -0.30 1.90 4.39 -1.40 0.39 114.58 120.84 3ilu h GLU 145 Ca 0.14 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.79 3ilu h GLU 145 Cb -0.02 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.43 3ilu h GLU 145 CO -0.05 0.55 0.20 0.35 -1.16 0.00 0.00 179.01 178.89 3ilu h PHE 146 N 0.85 0.37 -0.50 4.33 3.57 -0.13 -1.34 116.94 124.10 3ilu h PHE 146 Ca 0.25 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.63 3ilu h PHE 146 Cb -0.05 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 3ilu h PHE 146 CO -0.00 0.23 -0.18 0.74 -2.23 0.00 0.00 178.31 176.88 3ilu h PHE 147 N 0.40 1.12 -0.85 0.41 0.04 -0.87 -2.19 116.94 115.00 3ilu h PHE 147 Ca 0.11 -0.26 0.09 0.00 2.80 0.00 0.00 57.97 60.71 3ilu h PHE 147 Cb -0.04 -0.27 -0.06 0.00 2.20 0.00 0.00 35.95 37.78 3ilu h PHE 147 CO -0.06 1.07 0.55 -0.09 -0.60 0.00 0.00 178.31 179.19 3ilu h ARG 148 N 0.86 0.84 0.00 1.51 2.43 -0.51 -3.07 114.38 116.45 3ilu h ARG 148 Ca 0.12 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3ilu h ARG 148 Cb 0.75 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 3ilu h ARG 148 CO 0.06 0.56 -1.28 0.54 -1.51 0.00 0.00 179.97 178.33 3ilu n ARG 149 N -4.51 0.29 -2.07 0.20 5.12 -0.54 -5.00 116.66 110.14 3ilu n ARG 149 Ca 0.14 -0.06 -0.40 0.00 -1.93 0.00 0.00 57.85 55.60 3ilu n ARG 149 Cb 0.28 -1.54 -0.01 0.00 -1.16 0.00 0.00 32.46 30.03 3ilu n ARG 149 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3ilu s SER 150 N -3.76 6.49 0.00 0.55 0.15 -0.83 -4.91 113.70 111.38 3ilu s SER 150 Ca 0.02 2.67 0.18 0.00 0.70 0.00 0.00 55.95 59.53 3ilu s SER 150 Cb 0.15 -2.64 0.09 0.00 -1.71 0.00 0.00 66.02 61.90 3ilu s SER 150 CO 0.85 -0.73 1.03 0.29 1.20 0.00 0.00 173.24 175.88 3ilu n LYS 151 N 0.38 1.60 -2.24 5.44 4.76 -1.26 -4.39 118.16 122.45 3ilu n LYS 151 Ca 0.02 -1.33 -0.41 0.00 -2.87 0.00 0.00 58.31 53.72 3ilu n LYS 151 Cb 0.43 -1.35 -0.03 0.00 -1.84 0.00 0.00 35.03 32.24 3ilu n LYS 151 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3ilu s ILE 152 N -1.76 3.16 0.15 -0.18 1.09 -1.26 -4.87 121.20 117.52 3ilu s ILE 152 Ca 0.19 1.03 -0.20 0.00 -1.10 0.00 0.00 60.65 60.57 3ilu s ILE 152 Cb 0.15 -3.65 0.03 0.00 -1.06 0.00 0.00 42.46 37.93 3ilu s ILE 152 CO 0.32 0.19 1.67 0.00 -0.10 0.00 0.00 174.94 177.02 3ilu h ALA 153 N 4.68 0.11 -0.53 9.38 0.00 -1.99 0.88 119.26 131.80 3ilu h ALA 153 Ca -0.46 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 3ilu h ALA 153 Cb 1.22 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 3ilu h ALA 153 CO 0.73 -0.52 0.02 0.28 0.00 0.00 0.00 179.25 179.77 3ilu h VAL 154 N -0.07 1.26 -0.14 0.00 2.07 -1.99 -1.35 116.25 116.03 3ilu h VAL 154 Ca 0.14 -1.06 -0.19 0.00 0.82 0.00 0.00 66.70 66.41 3ilu h VAL 154 Cb 0.28 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 3ilu h VAL 154 CO -0.31 0.38 -0.68 -0.26 0.02 0.00 0.00 177.57 176.71 3ilu h PHE 155 N 0.79 0.78 -0.60 1.57 0.04 -1.86 -1.33 116.94 116.34 3ilu h PHE 155 Ca 0.15 -0.32 -0.01 0.00 2.80 0.00 0.00 57.97 60.59 3ilu h PHE 155 Cb 0.49 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.49 3ilu h PHE 155 CO 0.04 1.10 0.33 0.22 -0.60 0.00 0.00 178.31 179.40 3ilu h ASP 156 N 0.42 0.74 -0.86 2.17 3.58 -0.81 -0.22 116.42 121.44 3ilu h ASP 156 Ca -0.02 -0.09 -0.03 0.00 0.42 0.00 0.00 57.03 57.31 3ilu h ASP 156 Cb 1.27 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 42.09 3ilu h ASP 156 CO 0.13 0.62 0.43 0.50 -2.88 0.00 0.00 179.24 178.04 3ilu h LYS 157 N 0.81 1.24 -0.47 0.28 3.64 -1.04 -1.04 116.57 119.98 3ilu h LYS 157 Ca 0.21 -0.17 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 3ilu h LYS 157 Cb 0.04 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.61 3ilu h LYS 157 CO -0.03 0.94 -0.05 0.52 -2.27 0.00 0.00 179.45 178.56 3ilu h MET 158 N 1.23 0.82 -0.29 1.90 2.86 -0.92 -2.45 114.93 118.07 3ilu h MET 158 Ca 0.30 -0.25 -0.14 0.00 -2.06 0.00 0.00 59.70 57.55 3ilu h MET 158 Cb 0.10 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 3ilu h MET 158 CO -0.04 0.85 -0.40 2.35 1.06 0.00 0.00 176.91 180.73 3ilu h TRP 159 N 0.75 0.83 -0.69 -0.22 2.91 -0.58 -0.51 115.95 118.44 3ilu h TRP 159 Ca 0.14 -0.25 0.01 0.00 1.13 0.00 0.00 58.89 59.92 3ilu h TRP 159 Cb 0.52 -0.18 -0.03 0.00 -0.51 0.00 0.00 29.16 28.96 3ilu h TRP 159 CO 0.03 0.98 0.46 1.15 -1.03 0.00 0.00 178.44 180.03 3ilu h THR 160 N 0.57 1.18 0.56 2.65 2.02 -0.91 -0.56 112.91 118.41 3ilu h THR 160 Ca 0.05 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 3ilu h THR 160 Cb 0.94 0.16 0.01 0.00 -1.74 0.00 0.00 68.15 67.51 3ilu h THR 160 CO 0.09 0.17 -0.27 0.22 0.37 0.00 0.00 175.52 176.10 3ilu h TYR 161 N 0.94 -0.70 -0.95 3.16 3.20 -1.30 -3.32 116.97 118.01 3ilu h TYR 161 Ca 0.25 -0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.19 3ilu h TYR 161 Cb -0.11 0.23 -0.07 0.00 1.54 0.00 0.00 36.73 38.32 3ilu h TYR 161 CO -0.03 -0.37 0.59 0.52 -1.64 0.00 0.00 178.16 177.24 3ilu h MET 162 N -0.99 1.00 0.00 1.82 2.86 -0.89 -2.48 114.93 116.25 3ilu h MET 162 Ca -0.08 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.48 3ilu h MET 162 Cb 0.64 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 3ilu h MET 162 CO 0.13 0.66 -0.10 0.07 1.06 0.00 0.00 176.91 178.73 3ilu h ARG 163 N 1.03 0.00 0.00 1.72 0.11 -1.19 -3.01 114.38 113.04 3ilu h ARG 163 Ca 0.43 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.51 3ilu h ARG 163 Cb 0.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.35 3ilu h ARG 163 CO -0.21 0.10 -0.01 -1.13 0.10 0.00 0.00 179.97 178.83 3ilu n SER 164 N -3.68 1.94 -4.76 0.08 3.41 -1.07 -5.05 113.62 104.48 3ilu n SER 164 Ca -0.02 -2.14 -0.40 0.00 -0.26 0.00 0.00 58.87 56.05 3ilu n SER 164 Cb 0.22 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 3ilu n SER 164 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ilu s ALA 165 N -1.27 3.46 -0.03 7.33 0.00 -0.96 -5.05 121.76 125.24 3ilu s ALA 165 Ca 0.06 1.09 0.02 0.00 0.00 0.00 0.00 51.96 53.13 3ilu s ALA 165 Cb 0.05 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.76 3ilu s ALA 165 CO 0.01 -0.42 -0.10 -1.21 0.00 0.00 0.00 175.76 174.04 3ilu s GLU 166 N -1.60 1.09 0.89 0.00 0.41 -1.26 -3.64 118.70 114.58 3ilu s GLU 166 Ca 0.47 -0.32 -0.11 0.00 -0.41 0.00 0.00 54.97 54.59 3ilu s GLU 166 Cb -0.36 -1.00 0.13 0.00 -1.78 0.00 0.00 34.13 31.12 3ilu s GLU 166 CO 0.47 0.10 1.09 -2.14 -0.49 0.00 0.00 175.26 174.30 3ilu s PRO 167 N 0.28 1.28 0.03 0.39 0.02 -1.26 -5.04 135.00 130.70 3ilu s PRO 167 Ca -0.05 0.96 -0.37 0.00 0.02 0.00 0.00 61.00 61.56 3ilu s PRO 167 Cb -0.10 -1.80 -0.16 0.00 0.02 0.00 0.00 34.50 32.46 3ilu s PRO 167 CO 0.01 -2.27 1.42 0.45 -0.33 0.00 0.00 177.00 176.28 3ilu n SER 168 N -3.92 1.84 -0.03 2.53 2.88 -1.24 -4.85 113.62 110.83 3ilu n SER 168 Ca 0.08 1.11 0.15 0.00 -1.33 0.00 0.00 58.87 58.87 3ilu n SER 168 Cb 0.54 -1.20 0.70 0.00 -0.75 0.00 0.00 64.21 63.51 3ilu n SER 168 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3ilu n VAL 169 N 2.90 0.00 -3.35 2.46 0.24 -1.26 -4.88 118.33 114.44 3ilu n VAL 169 Ca 0.20 -0.02 -0.33 0.00 -2.04 0.00 0.00 64.34 62.15 3ilu n VAL 169 Cb 0.19 -0.37 -0.06 0.00 -1.47 0.00 0.00 33.84 32.14 3ilu n VAL 169 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 3ilu s PHE 170 N -2.56 3.49 0.26 6.34 0.08 -1.26 -3.64 117.98 120.69 3ilu s PHE 170 Ca 0.28 1.00 0.08 0.00 0.12 0.00 0.00 56.93 58.41 3ilu s PHE 170 Cb 0.20 -2.34 -0.05 0.00 -0.57 0.00 0.00 43.02 40.26 3ilu s PHE 170 CO 0.47 0.31 -0.12 0.14 -0.10 0.00 0.00 175.22 175.92 3ilu s VAL 171 N -1.70 1.89 -0.21 -0.44 -7.23 -0.96 -4.95 120.40 106.80 3ilu s VAL 171 Ca 0.45 -2.22 0.22 0.00 -1.81 0.00 0.00 61.98 58.63 3ilu s VAL 171 Cb -0.13 -2.30 -0.07 0.00 0.56 0.00 0.00 36.38 34.44 3ilu s VAL 171 CO 0.20 -0.41 0.93 -2.11 -0.31 0.00 0.00 175.10 173.40 3ilu n ARG 172 N -0.54 0.60 -3.95 4.82 1.85 -1.26 -1.54 116.66 116.64 3ilu n ARG 172 Ca -0.06 0.05 -0.08 0.00 -1.00 0.00 0.00 57.85 56.76 3ilu n ARG 172 Cb 0.62 -1.76 -0.08 0.00 -1.05 0.00 0.00 32.46 30.19 3ilu n ARG 172 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 3ilu s THR 173 N -3.39 0.17 0.21 8.89 -4.23 -1.26 -4.75 115.64 111.28 3ilu s THR 173 Ca -0.02 -1.42 -0.10 0.00 -1.18 0.00 0.00 61.69 58.97 3ilu s THR 173 Cb 0.11 -1.41 0.14 0.00 1.34 0.00 0.00 72.50 72.68 3ilu s THR 173 CO 0.81 -0.78 1.84 0.74 -0.54 0.00 0.00 174.62 176.69 3ilu h THR 174 N 2.90 1.07 -0.91 3.99 2.02 -1.95 -2.15 112.91 117.88 3ilu h THR 174 Ca -0.34 -0.28 0.11 0.00 0.77 0.00 0.00 66.41 66.66 3ilu h THR 174 Cb 1.18 0.17 -0.08 0.00 -1.74 0.00 0.00 68.15 67.68 3ilu h THR 174 CO 0.60 0.15 0.55 0.00 0.37 0.00 0.00 175.52 177.19 3ilu h ALA 175 N 1.31 1.34 -0.60 6.16 0.00 -1.96 -0.03 119.26 125.48 3ilu h ALA 175 Ca 0.29 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 3ilu h ALA 175 Cb 0.06 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3ilu h ALA 175 CO -0.12 0.16 0.18 1.49 0.00 0.00 0.00 179.25 180.96 3ilu h GLU 176 N 0.89 0.93 -0.53 0.00 4.81 -1.81 0.93 114.58 119.81 3ilu h GLU 176 Ca 0.45 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 3ilu h GLU 176 Cb 0.42 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 3ilu h GLU 176 CO -0.26 0.84 0.24 0.78 -0.73 0.00 0.00 179.01 179.89 3ilu h GLY 177 N 0.85 0.82 0.90 1.92 0.00 -0.90 -0.84 103.07 105.81 3ilu h GLY 177 Ca 0.19 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 3ilu h GLY 177 CO -0.00 0.39 0.06 -2.08 0.00 0.00 0.00 176.54 174.91 3ilu h VAL 178 N 0.70 1.23 -1.01 4.60 2.07 -0.85 -1.38 116.25 121.62 3ilu h VAL 178 Ca 0.18 -0.78 0.06 0.00 0.82 0.00 0.00 66.70 66.98 3ilu h VAL 178 Cb 0.13 1.14 -0.07 0.00 -1.52 0.00 0.00 31.29 30.98 3ilu h VAL 178 CO -0.02 0.26 0.65 0.00 0.02 0.00 0.00 177.57 178.48 3ilu h ALA 179 N 0.89 1.39 -0.60 1.67 0.00 -0.72 -1.58 119.26 120.32 3ilu h ALA 179 Ca 0.10 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3ilu h ALA 179 Cb 0.32 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3ilu h ALA 179 CO 0.00 0.45 0.03 -0.09 0.00 0.00 0.00 179.25 179.65 3ilu h ARG 180 N 1.19 1.03 -0.07 0.00 2.43 -0.65 -1.22 114.38 117.09 3ilu h ARG 180 Ca 0.43 -0.31 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 3ilu h ARG 180 Cb 0.16 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 3ilu h ARG 180 CO -0.17 1.00 -0.03 0.28 -1.51 0.00 0.00 179.97 179.54 3ilu h VAL 181 N 0.93 0.88 -0.54 0.20 2.07 -0.86 -2.63 116.25 116.30 3ilu h VAL 181 Ca 0.17 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.67 3ilu h VAL 181 Cb 0.52 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3ilu h VAL 181 CO 0.02 0.00 0.23 0.03 0.02 0.00 0.00 177.57 177.87 3ilu h ARG 182 N -0.03 0.77 -0.01 1.57 3.08 -0.94 -2.75 114.38 116.07 3ilu h ARG 182 Ca 0.04 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3ilu h ARG 182 Cb 0.09 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.00 3ilu h ARG 182 CO -0.09 0.62 -0.27 0.36 -1.07 0.00 0.00 179.97 179.52 3ilu n LYS 183 N -4.35 0.89 -0.08 0.04 2.85 -0.49 -4.29 118.16 112.73 3ilu n LYS 183 Ca 0.04 -0.55 0.12 0.00 -1.05 0.00 0.00 58.31 56.87 3ilu n LYS 183 Cb 0.15 -1.49 0.34 0.00 -0.65 0.00 0.00 35.03 33.38 3ilu n LYS 183 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 3ilu n SER 184 N -0.58 2.13 -3.10 -5.58 7.64 -1.00 -4.92 113.62 108.21 3ilu n SER 184 Ca 0.12 -1.76 -0.22 0.00 1.01 0.00 0.00 58.87 58.02 3ilu n SER 184 Cb 0.36 -0.11 0.02 0.00 -1.01 0.00 0.00 64.21 63.48 3ilu n SER 184 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3ilu n LYS 185 N 0.63 -4.45 -0.66 1.43 5.02 -1.26 -1.36 118.16 117.51 3ilu n LYS 185 Ca 0.17 0.79 0.00 0.00 -2.02 0.00 0.00 58.31 57.25 3ilu n LYS 185 Cb 0.42 -5.61 0.00 0.00 -0.02 0.00 0.00 35.03 29.82 3ilu n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ilu n GLY 186 N -1.42 0.79 0.86 0.72 0.00 -1.26 -4.92 105.19 99.95 3ilu n GLY 186 Ca -0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.04 3ilu n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ilu n LYS 187 N -2.18 2.12 -4.08 1.61 4.76 -0.46 -4.79 118.16 115.13 3ilu n LYS 187 Ca 0.00 -1.69 -0.19 0.00 -2.87 0.00 0.00 58.31 53.55 3ilu n LYS 187 Cb 0.00 -1.45 -0.16 0.00 -1.84 0.00 0.00 35.03 31.58 3ilu n LYS 187 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3ilu s TYR 188 N -1.65 0.64 -0.00 2.13 5.04 -1.26 -1.22 117.35 121.02 3ilu s TYR 188 Ca 0.35 -0.15 0.05 0.00 -2.44 0.00 0.00 57.07 54.87 3ilu s TYR 188 Cb 0.20 -0.61 -0.03 0.00 0.35 0.00 0.00 41.96 41.87 3ilu s TYR 188 CO 0.29 -0.18 -0.14 0.00 -1.34 0.00 0.00 175.55 174.17 3ilu s ALA 189 N 1.01 2.72 -0.15 3.97 0.00 -0.24 -4.54 121.76 124.54 3ilu s ALA 189 Ca -0.10 -1.06 -0.01 0.00 0.00 0.00 0.00 51.96 50.79 3ilu s ALA 189 Cb -0.14 -0.92 -0.01 0.00 0.00 0.00 0.00 23.12 22.04 3ilu s ALA 189 CO -0.01 0.58 -0.11 -0.47 0.00 0.00 0.00 175.76 175.75 3ilu s TYR 190 N -0.86 2.86 -0.30 0.00 5.04 -0.37 -3.03 117.35 120.69 3ilu s TYR 190 Ca 0.14 -0.66 -0.19 0.00 -2.44 0.00 0.00 57.07 53.92 3ilu s TYR 190 Cb -0.11 -1.90 -0.01 0.00 0.35 0.00 0.00 41.96 40.29 3ilu s TYR 190 CO 0.04 -0.25 0.57 -0.51 -1.34 0.00 0.00 175.55 174.06 3ilu s LEU 191 N 0.54 4.15 0.30 6.97 1.43 0.17 -0.57 118.68 131.65 3ilu s LEU 191 Ca -0.07 0.38 -0.10 0.00 -1.03 0.00 0.00 54.13 53.30 3ilu s LEU 191 Cb -0.15 -2.72 0.01 0.00 0.03 0.00 0.00 46.19 43.35 3ilu s LEU 191 CO 0.04 -0.41 0.52 -1.48 0.23 0.00 0.00 176.35 175.25 3ilu s LEU 192 N 2.47 0.49 0.39 1.79 2.34 -0.56 -4.30 118.68 121.29 3ilu s LEU 192 Ca 0.23 -1.14 -0.25 0.00 0.06 0.00 0.00 54.13 53.03 3ilu s LEU 192 Cb -0.15 1.84 -0.09 0.00 -0.56 0.00 0.00 46.19 47.22 3ilu s LEU 192 CO 0.11 -1.27 1.05 -1.61 -1.06 0.00 0.00 176.35 173.57 3ilu s GLU 193 N -3.46 4.22 0.41 1.48 2.02 -1.26 0.15 118.70 122.26 3ilu s GLU 193 Ca 0.24 1.54 0.09 0.00 0.02 0.00 0.00 54.97 56.86 3ilu s GLU 193 Cb -0.01 -2.61 0.91 0.00 0.10 0.00 0.00 34.13 32.51 3ilu s GLU 193 CO 0.13 -0.10 2.02 0.66 0.02 0.00 0.00 175.26 177.99 3ilu h SER 194 N 2.63 0.46 -0.27 -0.19 4.64 -0.70 -1.65 113.55 118.47 3ilu h SER 194 Ca -0.48 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3ilu h SER 194 Cb 1.21 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 3ilu h SER 194 CO 0.63 0.31 0.17 0.71 -0.87 0.00 0.00 176.83 177.78 3ilu h THR 195 N 0.53 1.08 -0.40 2.95 1.35 -1.87 0.11 112.91 116.65 3ilu h THR 195 Ca 0.21 -0.16 -0.09 0.00 -0.55 0.00 0.00 66.41 65.82 3ilu h THR 195 Cb 0.19 0.71 -0.01 0.00 -1.73 0.00 0.00 68.15 67.30 3ilu h THR 195 CO -0.06 0.08 -0.10 0.24 -0.25 0.00 0.00 175.52 175.44 3ilu h MET 196 N 0.36 0.77 -0.38 4.72 2.86 -1.73 -2.20 114.93 119.33 3ilu h MET 196 Ca 0.10 -0.30 0.03 0.00 -2.06 0.00 0.00 59.70 57.47 3ilu h MET 196 Cb -0.02 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 3ilu h MET 196 CO -0.02 0.91 0.20 -0.97 1.06 0.00 0.00 176.91 178.08 3ilu h ASN 197 N 0.59 0.30 0.14 1.22 -0.73 -1.12 -1.29 115.58 114.69 3ilu h ASN 197 Ca 0.10 0.02 -0.11 0.00 1.87 0.00 0.00 56.30 58.18 3ilu h ASN 197 Cb 0.62 -0.04 -0.01 0.00 0.27 0.00 0.00 38.32 39.15 3ilu h ASN 197 CO 0.04 0.22 -0.39 -0.33 -0.37 0.00 0.00 177.43 176.59 3ilu h GLU 198 N 0.40 0.33 -0.01 6.67 5.08 -0.77 -1.65 114.58 124.64 3ilu h GLU 198 Ca 0.16 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ilu h GLU 198 Cb 0.05 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 3ilu h GLU 198 CO -0.10 0.68 0.01 -0.92 -1.00 0.00 0.00 179.01 177.67 3ilu h TYR 199 N 0.28 0.02 -0.17 4.33 3.20 -1.01 -3.16 116.97 120.46 3ilu h TYR 199 Ca 0.03 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.83 3ilu h TYR 199 Cb 0.82 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.07 3ilu h TYR 199 CO 0.02 0.13 -0.20 0.82 -1.64 0.00 0.00 178.16 177.29 3ilu h ILE 200 N -0.10 1.22 0.00 1.81 1.08 -1.07 -1.94 117.51 118.51 3ilu h ILE 200 Ca 0.00 -1.01 -0.02 0.00 -0.39 0.00 0.00 64.86 63.44 3ilu h ILE 200 Cb 0.12 1.32 -0.00 0.00 -3.07 0.00 0.00 36.82 35.18 3ilu h ILE 200 CO -0.00 0.31 -0.08 -0.08 -0.69 0.00 0.00 178.15 177.61 3ilu h GLU 201 N 0.26 0.00 -0.61 2.37 4.81 -1.28 -1.96 114.58 118.17 3ilu h GLU 201 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3ilu h GLU 201 Cb 0.51 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.89 3ilu h GLU 201 CO 0.03 0.08 0.00 1.04 -0.73 0.00 0.00 179.01 179.44 3ilu n GLN 202 N -3.96 4.53 -5.21 1.92 1.13 -0.73 -4.81 117.38 110.25 3ilu n GLN 202 Ca -0.02 -3.09 -0.31 0.00 -1.94 0.00 0.00 57.00 51.63 3ilu n GLN 202 Cb 0.17 -2.15 -0.15 0.00 0.11 0.00 0.00 30.24 28.22 3ilu n GLN 202 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3ilu s ARG 203 N -2.45 2.19 0.42 -1.09 1.81 -0.74 0.01 118.95 119.10 3ilu s ARG 203 Ca 0.54 -0.88 -0.25 0.00 -1.72 0.00 0.00 55.73 53.42 3ilu s ARG 203 Cb 0.39 -2.11 -0.10 0.00 -0.45 0.00 0.00 34.95 32.67 3ilu s ARG 203 CO 0.19 0.57 1.07 1.63 -0.68 0.00 0.00 175.30 178.08 3ilu n LYS 204 N 2.40 1.47 0.00 3.54 5.02 -1.26 -0.47 118.16 128.85 3ilu n LYS 204 Ca -0.16 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 3ilu n LYS 204 Cb 0.51 -2.11 0.02 0.00 -0.02 0.00 0.00 35.03 33.43 3ilu n LYS 204 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 3ilu n PRO 205 N 0.12 0.92 -3.70 1.97 -0.02 -1.26 -4.97 135.00 128.07 3ilu n PRO 205 Ca 0.09 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.33 3ilu n PRO 205 Cb 0.39 -1.01 0.05 0.00 -0.02 0.00 0.00 33.50 32.91 3ilu n PRO 205 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ilu n ASP 207 N -2.99 2.22 -4.50 0.00 5.75 -1.26 -5.02 116.55 110.76 3ilu n ASP 207 Ca -0.10 -2.05 -0.24 0.00 -0.01 0.00 0.00 54.79 52.38 3ilu n ASP 207 Cb 0.60 -0.07 -0.10 0.00 -1.03 0.00 0.00 41.12 40.51 3ilu n ASP 207 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3ilu s THR 208 N -1.09 1.96 -0.07 2.12 -4.23 -1.26 -1.44 115.64 111.63 3ilu s THR 208 Ca 0.06 -2.16 -0.11 0.00 -1.18 0.00 0.00 61.69 58.31 3ilu s THR 208 Cb 0.04 -2.59 0.02 0.00 1.34 0.00 0.00 72.50 71.32 3ilu s THR 208 CO 0.03 -0.23 0.28 -0.32 -0.54 0.00 0.00 174.62 173.84 3ilu s MET 209 N -3.67 0.44 0.01 3.99 1.75 -0.10 -4.74 119.30 116.97 3ilu s MET 209 Ca 0.32 0.16 -0.24 0.00 -1.25 0.00 0.00 55.69 54.68 3ilu s MET 209 Cb 0.03 0.20 -0.05 0.00 2.84 0.00 0.00 34.83 37.86 3ilu s MET 209 CO 0.15 -0.08 0.72 0.21 -0.65 0.00 0.00 175.02 175.36 3ilu s LYS 210 N -0.40 4.45 0.06 4.11 2.20 -1.26 -0.94 119.74 127.96 3ilu s LYS 210 Ca -0.05 0.96 0.05 0.00 -0.36 0.00 0.00 55.97 56.57 3ilu s LYS 210 Cb -0.03 -3.38 -0.03 0.00 -1.51 0.00 0.00 37.83 32.88 3ilu s LYS 210 CO 0.01 0.24 -0.15 0.14 -0.36 0.00 0.00 175.35 175.23 3ilu s VAL 211 N 0.16 1.18 0.17 4.02 -7.23 -0.80 -4.99 120.40 112.91 3ilu s VAL 211 Ca 0.37 -1.20 0.00 0.00 -1.81 0.00 0.00 61.98 59.34 3ilu s VAL 211 Cb -0.19 -1.10 0.00 0.00 0.56 0.00 0.00 36.38 35.65 3ilu s VAL 211 CO 0.21 -0.10 0.00 0.61 -0.31 0.00 0.00 175.10 175.50 3ilu n GLY 212 N 1.53 -1.70 3.95 2.32 0.00 -1.07 -4.12 105.19 106.11 3ilu n GLY 212 Ca -0.20 -1.35 -0.25 0.00 0.00 0.00 0.00 46.02 44.22 3ilu n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ilu s GLY 213 N -4.72 1.74 0.42 -0.02 0.00 -1.26 -4.90 107.32 98.58 3ilu s GLY 213 Ca 0.00 -1.21 -0.25 0.00 0.00 0.00 0.00 44.72 43.26 3ilu s GLY 213 CO 0.00 -0.71 1.21 -1.31 0.00 0.00 0.00 173.10 172.28 3ilu s ASN 214 N -4.63 6.32 0.34 1.64 0.01 -1.26 -4.78 114.94 112.58 3ilu s ASN 214 Ca 0.64 2.43 0.18 0.00 -0.71 0.00 0.00 52.86 55.40 3ilu s ASN 214 Cb -0.08 -2.62 0.28 0.00 0.41 0.00 0.00 41.25 39.24 3ilu s ASN 214 CO 0.45 -0.82 1.55 -0.07 -1.51 0.00 0.00 177.10 176.70 3ilu h LEU 215 N 2.44 0.00 0.00 0.60 4.07 -0.45 -3.48 115.31 118.49 3ilu h LEU 215 Ca -0.49 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.28 3ilu h LEU 215 Cb 1.24 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.94 3ilu h LEU 215 CO 0.62 0.36 -0.05 -0.90 -1.08 0.00 0.00 178.44 177.39 3ilu n ASP 216 N -3.23 -1.27 -3.76 -0.43 5.68 -1.26 -4.93 116.55 107.34 3ilu n ASP 216 Ca 0.02 -2.49 -0.20 0.00 -0.50 0.00 0.00 54.79 51.62 3ilu n ASP 216 Cb 0.64 2.29 -0.17 0.00 -1.14 0.00 0.00 41.12 42.74 3ilu n ASP 216 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 3ilu s SER 217 N -2.75 1.07 0.00 -1.12 0.01 -1.26 -4.16 113.70 105.49 3ilu s SER 217 Ca 0.21 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.45 3ilu s SER 217 Cb -0.01 -0.29 0.00 0.00 0.21 0.00 0.00 66.02 65.93 3ilu s SER 217 CO 0.15 -0.18 0.00 2.29 0.41 0.00 0.00 173.24 175.92 3ilu n LYS 218 N 4.84 0.00 -3.86 12.44 2.85 -0.18 -5.02 118.16 129.23 3ilu n LYS 218 Ca -0.13 0.00 -0.09 0.00 -1.05 0.00 0.00 58.31 57.04 3ilu n LYS 218 Cb 0.50 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.81 3ilu n LYS 218 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3ilu s GLY 219 N -0.87 0.15 0.07 2.58 0.00 -1.26 -1.72 107.32 106.27 3ilu s GLY 219 Ca 0.00 -0.64 -0.16 0.00 0.00 0.00 0.00 44.72 43.93 3ilu s GLY 219 CO 0.00 -0.78 0.50 -0.19 0.00 0.00 0.00 173.10 172.63 3ilu s TYR 220 N -3.88 3.71 0.15 1.90 2.02 -0.31 -1.38 117.35 119.55 3ilu s TYR 220 Ca 0.07 1.09 0.06 0.00 -0.37 0.00 0.00 57.07 57.92 3ilu s TYR 220 Cb 0.04 -2.37 -0.04 0.00 -0.40 0.00 0.00 41.96 39.19 3ilu s TYR 220 CO -0.09 0.55 -0.14 0.20 -1.57 0.00 0.00 175.55 174.51 3ilu s GLY 221 N -1.34 1.16 0.02 0.71 0.00 -0.74 -0.85 107.32 106.29 3ilu s GLY 221 Ca 0.30 -1.41 -0.28 0.00 0.00 0.00 0.00 44.72 43.33 3ilu s GLY 221 CO 0.17 -1.49 0.90 -0.42 0.00 0.00 0.00 173.10 172.27 3ilu s ILE 222 N -2.51 4.79 -0.04 0.90 1.01 -1.26 -4.50 121.20 119.58 3ilu s ILE 222 Ca 0.13 1.90 0.04 0.00 0.00 0.00 0.00 60.65 62.72 3ilu s ILE 222 Cb -0.03 -4.25 -0.03 0.00 0.01 0.00 0.00 42.46 38.17 3ilu s ILE 222 CO 0.03 0.24 -0.14 0.00 0.00 0.00 0.00 174.94 175.08 3ilu s ALA 223 N 0.57 2.68 0.16 9.38 0.00 -0.92 -0.50 121.76 133.11 3ilu s ALA 223 Ca 0.46 -1.00 0.04 0.00 0.00 0.00 0.00 51.96 51.47 3ilu s ALA 223 Cb -0.21 -0.96 -0.05 0.00 0.00 0.00 0.00 23.12 21.91 3ilu s ALA 223 CO 0.26 0.56 -0.08 0.95 0.00 0.00 0.00 175.76 177.45 3ilu s THR 224 N -0.76 1.09 0.65 0.00 -4.23 -0.40 -0.34 115.64 111.64 3ilu s THR 224 Ca 0.12 -2.04 -0.18 0.00 -1.18 0.00 0.00 61.69 58.41 3ilu s THR 224 Cb -0.11 -1.91 -0.01 0.00 1.34 0.00 0.00 72.50 71.81 3ilu s THR 224 CO 0.01 -0.69 1.25 -2.84 -0.54 0.00 0.00 174.62 171.81 3ilu s PRO 225 N -3.78 2.57 0.08 3.99 0.02 -1.26 -0.89 135.00 135.73 3ilu s PRO 225 Ca 0.18 1.93 -0.37 0.00 0.02 0.00 0.00 61.00 62.77 3ilu s PRO 225 Cb 0.03 -1.86 -0.18 0.00 0.02 0.00 0.00 34.50 32.51 3ilu s PRO 225 CO 0.01 -1.55 1.17 1.63 -0.33 0.00 0.00 177.00 177.93 3ilu n LYS 226 N -2.01 0.68 -1.33 5.54 4.76 -1.26 -1.01 118.16 123.53 3ilu n LYS 226 Ca 0.15 0.24 -0.11 0.00 -2.87 0.00 0.00 58.31 55.72 3ilu n LYS 226 Cb 0.49 -1.77 -0.05 0.00 -1.84 0.00 0.00 35.03 31.86 3ilu n LYS 226 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ilu n GLY 227 N 2.04 1.09 3.77 0.72 0.00 -1.26 -4.96 105.19 106.59 3ilu n GLY 227 Ca 0.18 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3ilu n GLY 227 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ilu s SER 228 N -2.45 6.10 0.44 1.61 0.15 -0.18 -4.92 113.70 114.45 3ilu s SER 228 Ca 0.00 2.75 0.24 0.00 0.70 0.00 0.00 55.95 59.64 3ilu s SER 228 Cb 0.00 -2.64 0.87 0.00 -1.71 0.00 0.00 66.02 62.53 3ilu s SER 228 CO 0.00 -1.01 1.80 0.77 1.20 0.00 0.00 173.24 176.00 3ilu h SER 229 N 2.47 0.00 0.13 5.45 4.64 -1.92 -2.47 113.55 121.84 3ilu h SER 229 Ca -0.50 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.81 3ilu h SER 229 Cb 1.26 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3ilu h SER 229 CO 0.62 0.21 -0.04 -0.07 -0.87 0.00 0.00 176.83 176.68 3ilu h LEU 230 N 0.00 0.00 -0.22 5.97 3.38 -1.96 -3.31 115.31 119.18 3ilu h LEU 230 Ca -0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.02 3ilu h LEU 230 Cb 0.79 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 3ilu h LEU 230 CO 0.03 0.04 -0.19 1.23 0.09 0.00 0.00 178.44 179.64 3ilu h GLY 231 N 0.30 -0.07 0.95 0.83 0.00 -1.81 -1.24 103.07 102.02 3ilu h GLY 231 Ca -0.00 0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.55 3ilu h GLY 231 CO 0.01 -0.18 -0.14 -0.57 0.00 0.00 0.00 176.54 175.66 3ilu h ASN 232 N -0.20 -0.33 -0.69 0.19 -1.24 -1.79 -1.58 115.58 109.96 3ilu h ASN 232 Ca 0.13 -0.03 -0.00 0.00 0.71 0.00 0.00 56.30 57.11 3ilu h ASN 232 Cb 0.39 0.08 -0.03 0.00 0.73 0.00 0.00 38.32 39.49 3ilu h ASN 232 CO -0.33 -0.18 0.41 0.00 -1.29 0.00 0.00 177.43 176.03 3ilu h ALA 233 N 0.26 0.87 -0.88 1.57 0.00 -1.74 -1.55 119.26 117.79 3ilu h ALA 233 Ca -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3ilu h ALA 233 Cb 0.33 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3ilu h ALA 233 CO 0.06 0.35 0.50 0.28 0.00 0.00 0.00 179.25 180.45 3ilu h VAL 234 N 0.93 1.25 -0.48 0.00 2.07 -1.10 0.10 116.25 119.03 3ilu h VAL 234 Ca 0.25 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 3ilu h VAL 234 Cb -0.03 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.76 3ilu h VAL 234 CO -0.05 0.28 0.19 -1.13 0.02 0.00 0.00 177.57 176.88 3ilu h ASN 235 N 1.23 0.67 -0.31 0.57 -1.24 -0.88 -1.47 115.58 114.15 3ilu h ASN 235 Ca 0.31 -0.17 -0.08 0.00 0.71 0.00 0.00 56.30 57.08 3ilu h ASN 235 Cb -0.00 -0.17 -0.02 0.00 0.73 0.00 0.00 38.32 38.86 3ilu h ASN 235 CO -0.05 0.66 -0.05 -0.07 -1.29 0.00 0.00 177.43 176.62 3ilu h LEU 236 N 0.64 0.67 -0.46 0.34 3.38 -0.75 -2.43 115.31 116.70 3ilu h LEU 236 Ca 0.16 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3ilu h LEU 236 Cb 0.20 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3ilu h LEU 236 CO -0.01 0.78 0.18 0.00 0.09 0.00 0.00 178.44 179.47 3ilu h ALA 237 N 1.29 0.60 -0.73 1.53 0.00 -0.51 -1.00 119.26 120.45 3ilu h ALA 237 Ca 0.12 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3ilu h ALA 237 Cb 0.48 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3ilu h ALA 237 CO 0.03 0.22 0.38 0.28 0.00 0.00 0.00 179.25 180.16 3ilu h VAL 238 N 0.61 1.23 -0.72 0.00 2.07 -0.98 0.29 116.25 118.75 3ilu h VAL 238 Ca 0.15 -0.60 -0.07 0.00 0.82 0.00 0.00 66.70 67.01 3ilu h VAL 238 Cb 0.21 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 3ilu h VAL 238 CO -0.01 0.26 0.17 -0.07 0.02 0.00 0.00 177.57 177.94 3ilu h LEU 239 N 1.01 1.09 -0.33 2.57 3.38 -1.24 -0.62 115.31 121.17 3ilu h LEU 239 Ca 0.25 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3ilu h LEU 239 Cb 0.07 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3ilu h LEU 239 CO -0.04 1.04 0.15 0.50 0.09 0.00 0.00 178.44 180.18 3ilu h LYS 240 N 1.09 0.48 -0.90 1.13 1.63 -0.74 -1.97 116.57 117.29 3ilu h LYS 240 Ca 0.22 -0.08 -0.02 0.00 -0.85 0.00 0.00 60.65 59.93 3ilu h LYS 240 Cb 0.38 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 31.88 3ilu h LYS 240 CO 0.00 0.46 0.49 -0.07 -3.45 0.00 0.00 179.45 176.88 3ilu h LEU 241 N 0.39 1.12 -0.03 5.20 3.38 -0.68 -0.90 115.31 123.79 3ilu h LEU 241 Ca 0.11 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3ilu h LEU 241 Cb 0.15 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3ilu h LEU 241 CO -0.01 0.90 -0.04 -1.28 0.09 0.00 0.00 178.44 178.10 3ilu h SER 242 N 1.26 -0.11 1.06 -0.43 0.87 -0.99 -1.81 113.55 113.40 3ilu h SER 242 Ca 0.32 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.83 3ilu h SER 242 Cb 0.03 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 3ilu h SER 242 CO -0.05 -0.05 -0.30 -0.33 -0.53 0.00 0.00 176.83 175.57 3ilu h GLU 243 N -0.05 0.00 -0.03 2.24 5.08 -1.04 -2.41 114.58 118.37 3ilu h GLU 243 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3ilu h GLU 243 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3ilu h GLU 243 CO -0.06 0.30 0.00 1.04 -1.00 0.00 0.00 179.01 179.29 3ilu n GLN 244 N -3.37 1.30 -0.96 2.33 6.02 -0.37 -4.91 117.38 117.42 3ilu n GLN 244 Ca 0.01 -0.44 0.00 0.00 -0.01 0.00 0.00 57.00 56.56 3ilu n GLN 244 Cb 0.51 -1.43 0.00 0.00 1.02 0.00 0.00 30.24 30.34 3ilu n GLN 244 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ilu n GLY 245 N 1.02 0.55 0.31 1.08 0.00 -0.91 -4.91 105.19 102.33 3ilu n GLY 245 Ca 0.19 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.15 3ilu n GLY 245 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3ilu h LEU 246 N 0.00 0.96 -0.92 0.99 5.85 -1.56 -1.91 115.31 118.72 3ilu h LEU 246 Ca 0.00 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 3ilu h LEU 246 Cb 0.13 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 3ilu h LEU 246 CO 0.00 0.97 0.56 -0.07 -0.34 0.00 0.00 178.44 179.56 3ilu h LEU 247 N 0.94 1.11 -0.60 2.25 3.38 -1.83 -0.36 115.31 120.19 3ilu h LEU 247 Ca 0.19 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 3ilu h LEU 247 Cb 0.44 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3ilu h LEU 247 CO 0.01 0.85 0.00 0.44 0.09 0.00 0.00 178.44 179.84 3ilu h ASP 248 N 1.27 1.03 -0.21 -0.43 3.32 -1.83 -1.08 116.42 118.49 3ilu h ASP 248 Ca 0.33 -0.31 0.01 0.00 0.02 0.00 0.00 57.03 57.09 3ilu h ASP 248 Cb -0.06 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.20 3ilu h ASP 248 CO -0.06 1.08 0.11 0.50 -1.72 0.00 0.00 179.24 179.15 3ilu h LYS 249 N 0.95 0.22 -0.86 3.56 3.64 -0.92 -1.22 116.57 121.93 3ilu h LYS 249 Ca 0.17 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 3ilu h LYS 249 Cb 0.55 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 3ilu h LYS 249 CO 0.03 0.14 0.50 -0.07 -2.27 0.00 0.00 179.45 177.78 3ilu h LEU 250 N 0.23 1.05 -0.27 5.20 4.07 -0.98 -1.12 115.31 123.49 3ilu h LEU 250 Ca 0.08 -0.08 -0.02 0.00 0.08 0.00 0.00 57.88 57.95 3ilu h LEU 250 Cb 0.02 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.48 3ilu h LEU 250 CO -0.06 0.82 0.11 0.50 -1.08 0.00 0.00 178.44 178.73 3ilu h LYS 251 N 1.19 0.40 -0.76 1.13 3.64 -0.62 -1.99 116.57 119.56 3ilu h LYS 251 Ca 0.31 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 3ilu h LYS 251 Cb -0.01 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 3ilu h LYS 251 CO -0.05 0.43 0.48 -0.91 -2.27 0.00 0.00 179.45 177.13 3ilu h ASN 252 N 0.28 0.89 -0.40 4.20 2.35 -1.07 -0.71 115.58 121.12 3ilu h ASN 252 Ca 0.09 -0.04 0.02 0.00 -0.55 0.00 0.00 56.30 55.81 3ilu h ASN 252 Cb 0.18 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 3ilu h ASN 252 CO -0.01 0.67 0.24 0.50 -1.65 0.00 0.00 177.43 177.18 3ilu h LYS 253 N 1.03 0.46 0.00 0.81 3.64 -0.98 0.24 116.57 121.78 3ilu h LYS 253 Ca 0.27 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 3ilu h LYS 253 Cb -0.08 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 3ilu h LYS 253 CO -0.06 0.31 -1.37 0.91 -2.27 0.00 0.00 179.45 176.97 3ilu n TRP 254 N -4.86 0.22 -0.07 1.91 7.02 -0.77 -3.95 117.44 116.95 3ilu n TRP 254 Ca 0.01 0.06 -0.07 0.00 -1.02 0.00 0.00 57.50 56.49 3ilu n TRP 254 Cb 0.06 -0.46 -0.02 0.00 -2.42 0.00 0.00 31.31 28.47 3ilu n TRP 254 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 3ilu n TRP 255 N -2.09 0.00 -0.04 -5.99 8.01 -0.29 -4.73 117.44 112.31 3ilu n TRP 255 Ca -0.00 0.00 -0.17 0.00 -1.31 0.00 0.00 57.50 56.01 3ilu n TRP 255 Cb 0.48 -0.37 -0.14 0.00 -2.01 0.00 0.00 31.31 29.27 3ilu n TRP 255 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 3ilu n TYR 256 N -3.98 0.77 0.23 -5.99 4.01 -0.89 -2.83 117.16 108.47 3ilu n TYR 256 Ca -0.10 0.19 0.14 0.00 -0.16 0.00 0.00 57.90 57.96 3ilu n TYR 256 Cb 0.39 -1.11 0.72 0.00 -0.31 0.00 0.00 39.34 39.03 3ilu n TYR 256 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3ilu h ASP 257 N 0.04 0.00 -0.01 7.72 3.32 -0.70 -2.48 116.42 124.31 3ilu h ASP 257 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 3ilu h ASP 257 Cb 2.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.57 3ilu h ASP 257 CO 0.03 0.00 -0.58 0.29 -1.72 0.00 0.00 179.24 177.27 3ilu n LYS 258 N -2.46 1.64 -1.45 3.56 5.02 -1.23 -5.02 118.16 118.22 3ilu n LYS 258 Ca -0.01 -0.39 -0.49 0.00 -2.02 0.00 0.00 58.31 55.40 3ilu n LYS 258 Cb 0.07 -1.28 -0.04 0.00 -0.02 0.00 0.00 35.03 33.76 3ilu n LYS 258 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ilu n GLY 259 N 1.29 -1.18 0.00 0.72 0.00 -0.94 -4.91 105.19 100.17 3ilu n GLY 259 Ca 0.05 0.42 0.01 0.00 0.00 0.00 0.00 46.02 46.50 3ilu n GLY 259 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ilu n GLU 260 N 1.10 3.58 0.00 1.61 1.02 0.10 -5.04 120.64 123.01 3ilu n GLU 260 Ca 0.17 -0.01 0.09 0.00 -0.02 0.00 0.00 57.16 57.39 3ilu n GLU 260 Cb 0.23 -0.82 0.07 0.00 -0.02 0.00 0.00 31.44 30.91 3ilu n GLU 260 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31