#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qme n GLN 2 N 0.00 1.24 -4.27 2.12 -0.06 -1.25 -4.78 117.38 110.39 2qme n GLN 2 Ca 0.00 0.45 -0.18 0.00 -2.00 0.00 0.00 57.00 55.27 2qme n GLN 2 Cb 0.00 -2.02 -0.13 0.00 -4.06 0.00 0.00 30.24 24.03 2qme n GLN 2 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2qme s ALA 3 N -1.32 0.91 -0.05 1.69 0.00 -1.26 -0.54 121.76 121.19 2qme s ALA 3 Ca 0.64 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.93 2qme s ALA 3 Cb -0.54 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.46 2qme s ALA 3 CO 0.56 0.15 -0.12 0.42 0.00 0.00 0.00 175.76 176.77 2qme s ILE 4 N -0.82 1.10 -0.26 0.00 1.01 0.57 -4.93 121.20 117.88 2qme s ILE 4 Ca -0.01 -0.49 -0.09 0.00 0.00 0.00 0.00 60.65 60.07 2qme s ILE 4 Cb -0.07 -0.99 -0.04 0.00 0.01 0.00 0.00 42.46 41.37 2qme s ILE 4 CO 0.01 0.34 0.12 -0.75 0.00 0.00 0.00 174.94 174.65 2qme s LYS 5 N 0.47 3.79 -0.11 2.79 2.20 -1.26 -0.53 119.74 127.08 2qme s LYS 5 Ca -0.10 -0.41 0.02 0.00 -0.36 0.00 0.00 55.97 55.12 2qme s LYS 5 Cb -0.14 -3.45 0.01 0.00 -1.51 0.00 0.00 37.83 32.75 2qme s LYS 5 CO 0.03 -0.16 -0.17 0.00 -0.36 0.00 0.00 175.35 174.69 2qme s VAL 7 N 0.92 3.29 -0.17 0.00 1.01 -0.72 -0.66 120.40 124.07 2qme s VAL 7 Ca -0.07 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.29 2qme s VAL 7 Cb -0.15 -2.35 -0.00 0.00 0.00 0.00 0.00 36.38 33.87 2qme s VAL 7 CO -0.01 0.56 -0.12 -0.69 0.00 0.00 0.00 175.10 174.83 2qme s VAL 8 N -0.22 2.86 0.16 2.92 1.01 -0.34 -0.79 120.40 126.01 2qme s VAL 8 Ca 0.01 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.32 2qme s VAL 8 Cb -0.13 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 2qme s VAL 8 CO 0.03 0.50 -0.02 0.68 0.00 0.00 0.00 175.10 176.29 2qme s VAL 9 N 0.94 0.75 0.00 2.92 -7.23 0.06 -3.17 120.40 114.67 2qme s VAL 9 Ca -0.02 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.16 2qme s VAL 9 Cb -0.15 -2.05 0.00 0.00 0.56 0.00 0.00 36.38 34.74 2qme s VAL 9 CO -0.01 -0.55 0.00 0.61 -0.31 0.00 0.00 175.10 174.84 2qme n GLY 10 N -0.22 2.05 3.57 2.32 0.00 -1.26 -0.90 105.19 110.75 2qme n GLY 10 Ca -0.08 -1.50 -0.33 0.00 0.00 0.00 0.00 46.02 44.12 2qme n GLY 10 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qme n ASP 11 N 0.00 -0.38 -4.63 1.61 9.92 -1.26 -4.04 116.55 117.77 2qme n ASP 11 Ca 0.00 0.46 -0.40 0.00 -0.53 0.00 0.00 54.79 54.32 2qme n ASP 11 Cb 0.00 -1.37 0.03 0.00 -0.64 0.00 0.00 41.12 39.13 2qme n ASP 11 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2qme n GLY 12 N 0.88 -0.09 2.90 0.44 0.00 -1.24 -2.73 105.19 105.35 2qme n GLY 12 Ca 0.11 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2qme n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qme n ALA 13 N -0.86 0.00 0.15 4.61 0.00 -1.26 -4.90 120.51 118.24 2qme n ALA 13 Ca 0.10 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.56 2qme n ALA 13 Cb 0.42 -0.72 0.14 0.00 0.00 0.00 0.00 19.45 19.30 2qme n ALA 13 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2qme h VAL 14 N 0.00 1.05 0.00 0.00 -1.51 -1.87 -3.48 116.25 110.44 2qme h VAL 14 Ca 0.00 -2.11 0.00 0.00 -1.23 0.00 0.00 66.70 63.36 2qme h VAL 14 Cb 0.35 2.26 0.00 0.00 -2.13 0.00 0.00 31.29 31.77 2qme h VAL 14 CO 0.00 0.53 0.00 0.61 -1.23 0.00 0.00 177.57 177.48 2qme n GLY 15 N 0.75 1.86 0.08 5.19 0.00 -1.26 -4.53 105.19 107.29 2qme n GLY 15 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 2qme n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qme h LYS 16 N 0.00 -0.04 -0.25 1.61 1.57 -1.91 -0.29 116.57 117.25 2qme h LYS 16 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 2qme h LYS 16 Cb 0.00 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2qme h LYS 16 CO 0.00 -0.03 0.06 1.15 -0.57 0.00 0.00 179.45 180.06 2qme h THR 17 N -0.04 1.21 -0.86 -0.16 2.02 -1.96 -2.18 112.91 110.94 2qme h THR 17 Ca 0.03 -0.71 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 2qme h THR 17 Cb 0.09 1.19 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 2qme h THR 17 CO -0.08 0.23 0.53 0.00 0.37 0.00 0.00 175.52 176.57 2qme h LEU 19 N 1.18 -0.64 -0.53 0.00 5.85 -0.83 0.07 115.31 120.42 2qme h LEU 19 Ca 0.31 0.08 -0.08 0.00 0.84 0.00 0.00 57.88 59.03 2qme h LEU 19 Cb -0.07 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2qme h LEU 19 CO -0.06 -0.31 0.00 -0.07 -0.34 0.00 0.00 178.44 177.67 2qme h LEU 20 N -0.40 0.91 -0.11 2.25 3.38 -0.99 -2.01 115.31 118.34 2qme h LEU 20 Ca 0.04 -0.31 -0.20 0.00 0.09 0.00 0.00 57.88 57.50 2qme h LEU 20 Cb 0.44 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 40.95 2qme h LEU 20 CO -0.15 0.99 -0.71 0.40 0.09 0.00 0.00 178.44 179.07 2qme h ILE 21 N 0.80 1.32 -0.62 1.22 1.08 -0.91 -1.57 117.51 118.83 2qme h ILE 21 Ca 0.15 -1.96 -0.03 0.00 -0.39 0.00 0.00 64.86 62.63 2qme h ILE 21 Cb 0.53 2.14 -0.03 0.00 -3.07 0.00 0.00 36.82 36.39 2qme h ILE 21 CO 0.03 0.61 0.28 -1.28 -0.69 0.00 0.00 178.15 177.09 2qme h SER 22 N 0.34 0.83 -0.02 1.72 0.87 -1.00 -1.09 113.55 115.20 2qme h SER 22 Ca -0.06 -0.15 -0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2qme h SER 22 Cb 1.35 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2qme h SER 22 CO 0.14 0.75 0.01 0.22 -0.53 0.00 0.00 176.83 177.42 2qme h TYR 23 N 0.86 0.03 0.00 2.24 3.20 -1.32 -0.72 116.97 121.26 2qme h TYR 23 Ca 0.21 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.03 2qme h TYR 23 Cb 0.16 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 2qme h TYR 23 CO 0.01 0.23 -0.27 1.79 -1.64 0.00 0.00 178.16 178.27 2qme h THR 24 N -0.18 0.38 0.00 1.81 1.35 -1.18 -3.37 112.91 111.72 2qme h THR 24 Ca 0.01 -1.55 0.00 0.00 -0.55 0.00 0.00 66.41 64.32 2qme h THR 24 Cb 0.21 2.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 2qme h THR 24 CO -0.00 0.22 -0.33 0.35 -0.25 0.00 0.00 175.52 175.51 2qme n THR 25 N -3.14 0.00 -1.06 6.82 -2.24 -0.42 -5.02 114.28 109.22 2qme n THR 25 Ca 0.03 -0.24 -0.02 0.00 -2.27 0.00 0.00 64.05 61.55 2qme n THR 25 Cb 0.63 0.75 -0.01 0.00 -2.10 0.00 0.00 70.33 69.60 2qme n THR 25 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2qme n ASN 26 N -0.97 -5.36 -4.40 3.42 3.02 -0.28 -4.98 115.26 105.71 2qme n ASN 26 Ca 0.00 0.05 -0.33 0.00 -0.03 0.00 0.00 54.58 54.28 2qme n ASN 26 Cb 0.00 -3.05 -0.14 0.00 -0.61 0.00 0.00 39.78 35.98 2qme n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qme s ALA 27 N -1.39 2.66 -0.22 5.41 0.00 -1.26 -4.97 121.76 121.99 2qme s ALA 27 Ca 0.00 -0.90 -0.14 0.00 0.00 0.00 0.00 51.96 50.92 2qme s ALA 27 Cb 0.00 -1.19 -0.04 0.00 0.00 0.00 0.00 23.12 21.89 2qme s ALA 27 CO 0.00 0.31 0.31 0.12 0.00 0.00 0.00 175.76 176.50 2qme s PHE 28 N 0.12 3.33 0.20 0.00 5.36 -1.26 -3.48 117.98 122.24 2qme s PHE 28 Ca -0.06 0.45 -0.32 0.00 -0.96 0.00 0.00 56.93 56.04 2qme s PHE 28 Cb -0.15 -2.44 -0.15 0.00 -0.34 0.00 0.00 43.02 39.94 2qme s PHE 28 CO 0.04 -0.02 1.27 -2.30 -1.46 0.00 0.00 175.22 172.76 2qme n PRO 29 N 4.54 1.53 0.09 10.12 -0.02 -1.26 -4.92 135.00 145.07 2qme n PRO 29 Ca -0.11 0.55 -0.04 0.00 -2.02 0.00 0.00 63.50 61.88 2qme n PRO 29 Cb 0.51 -2.12 -0.05 0.00 -0.02 0.00 0.00 33.50 31.82 2qme n PRO 29 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2qme h GLY 30 N 3.78 0.00 -2.87 -1.23 0.00 -2.05 -3.47 103.07 97.24 2qme h GLY 30 Ca -0.44 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.37 2qme h GLY 30 CO 0.73 0.00 -0.55 -1.83 0.00 0.00 0.00 176.54 174.88 2qme s GLU 31 N -2.86 2.79 -0.48 4.80 1.03 -1.26 -5.08 118.70 117.64 2qme s GLU 31 Ca 0.01 -1.12 -0.11 0.00 0.03 0.00 0.00 54.97 53.78 2qme s GLU 31 Cb 0.10 -2.48 0.11 0.00 -0.80 0.00 0.00 34.13 31.06 2qme s GLU 31 CO 0.80 0.40 0.37 -0.47 -1.33 0.00 0.00 175.26 175.02 2qme s TYR 32 N -2.15 3.37 -0.33 4.83 5.04 -1.26 -5.03 117.35 121.81 2qme s TYR 32 Ca 0.32 -1.67 0.01 0.00 -2.44 0.00 0.00 57.07 53.29 2qme s TYR 32 Cb -0.08 -3.46 0.08 0.00 0.35 0.00 0.00 41.96 38.85 2qme s TYR 32 CO 0.24 -0.97 0.05 0.42 -1.34 0.00 0.00 175.55 173.95 2qme s ILE 33 N 1.43 2.70 0.34 3.14 1.01 -1.26 -5.10 121.20 123.46 2qme s ILE 33 Ca 0.05 -1.91 -0.28 0.00 0.00 0.00 0.00 60.65 58.50 2qme s ILE 33 Cb -0.26 -2.77 -0.12 0.00 0.01 0.00 0.00 42.46 39.31 2qme s ILE 33 CO 0.01 -0.40 1.31 -2.65 0.00 0.00 0.00 174.94 173.21 2qme n PRO 34 N 4.46 2.18 -3.19 2.79 -0.02 -1.26 -4.94 135.00 135.01 2qme n PRO 34 Ca -0.05 0.76 -0.34 0.00 -2.02 0.00 0.00 63.50 61.85 2qme n PRO 34 Cb 0.42 -2.36 -0.06 0.00 -0.02 0.00 0.00 33.50 31.48 2qme n PRO 34 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2qme s THR 35 N -1.07 4.70 -0.07 3.45 2.01 -1.26 -5.00 115.64 118.39 2qme s THR 35 Ca 0.55 1.00 -0.07 0.00 0.31 0.00 0.00 61.69 63.49 2qme s THR 35 Cb -0.56 -3.73 -0.02 0.00 0.01 0.00 0.00 72.50 68.20 2qme s THR 35 CO 0.62 0.06 -0.14 0.52 -0.69 0.00 0.00 174.62 174.99 2qme n VAL 36 N 0.29 0.62 -3.66 3.82 0.31 -1.26 -4.15 118.33 114.30 2qme n VAL 36 Ca -0.01 0.34 -0.07 0.00 -0.01 0.00 0.00 64.34 64.60 2qme n VAL 36 Cb 0.52 -1.82 -0.08 0.00 -0.91 0.00 0.00 33.84 31.55 2qme n VAL 36 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 2qme s PHE 37 N -1.78 -0.99 0.01 3.52 5.36 -1.26 -3.32 117.98 119.52 2qme s PHE 37 Ca -0.11 1.93 0.00 0.00 -0.96 0.00 0.00 56.93 57.79 2qme s PHE 37 Cb 0.02 0.56 -0.01 0.00 -0.34 0.00 0.00 43.02 43.25 2qme s PHE 37 CO 0.17 -0.51 -0.01 -0.51 -1.46 0.00 0.00 175.22 172.90 2qme s ASP 38 N 1.84 0.11 -0.09 6.13 1.01 -1.02 -5.03 116.67 119.61 2qme s ASP 38 Ca -0.09 -0.16 0.04 0.00 0.71 0.00 0.00 52.55 53.06 2qme s ASP 38 Cb -0.07 0.03 -0.00 0.00 1.01 0.00 0.00 42.92 43.88 2qme s ASP 38 CO -0.18 -0.09 -0.24 0.21 0.21 0.00 0.00 175.17 175.08 2qme s ASN 39 N -0.47 3.09 0.22 0.27 3.04 -1.26 0.03 114.94 119.87 2qme s ASN 39 Ca -0.05 -0.55 0.12 0.00 0.04 0.00 0.00 52.86 52.42 2qme s ASN 39 Cb -0.03 -1.28 -0.05 0.00 -1.54 0.00 0.00 41.25 38.35 2qme s ASN 39 CO -0.00 0.18 -0.23 -0.31 -3.04 0.00 0.00 177.10 173.70 2qme s TYR 40 N 0.23 2.31 0.03 0.43 2.02 0.26 -4.98 117.35 117.63 2qme s TYR 40 Ca -0.15 -0.35 0.05 0.00 -0.37 0.00 0.00 57.07 56.25 2qme s TYR 40 Cb -0.17 -1.10 -0.02 0.00 -0.40 0.00 0.00 41.96 40.27 2qme s TYR 40 CO 0.08 0.56 -0.15 0.45 -1.57 0.00 0.00 175.55 174.92 2qme s SER 41 N -2.90 1.73 0.07 2.29 0.15 -1.26 -0.25 113.70 113.53 2qme s SER 41 Ca 0.23 -0.41 -0.19 0.00 0.70 0.00 0.00 55.95 56.28 2qme s SER 41 Cb -0.07 -0.13 0.04 0.00 -1.71 0.00 0.00 66.02 64.15 2qme s SER 41 CO 0.11 0.08 0.45 0.00 1.20 0.00 0.00 173.24 175.08 2qme s ALA 42 N -0.71 -1.10 0.03 5.45 0.00 -0.76 -5.00 121.76 119.66 2qme s ALA 42 Ca 0.03 0.31 0.04 0.00 0.00 0.00 0.00 51.96 52.34 2qme s ALA 42 Cb -0.07 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 23.47 2qme s ALA 42 CO 0.01 -0.52 -0.07 -0.80 0.00 0.00 0.00 175.76 174.37 2qme s ASN 43 N -2.21 4.61 0.08 0.00 0.01 -1.26 0.32 114.94 116.49 2qme s ASN 43 Ca -0.03 -0.19 0.04 0.00 -0.71 0.00 0.00 52.86 51.97 2qme s ASN 43 Cb -0.00 -1.04 -0.03 0.00 0.41 0.00 0.00 41.25 40.59 2qme s ASN 43 CO -0.05 0.26 -0.12 0.68 -1.51 0.00 0.00 177.10 176.36 2qme s VAL 44 N -1.06 1.02 -0.16 1.60 -7.23 -0.38 -4.97 120.40 109.23 2qme s VAL 44 Ca 0.18 -1.45 -0.19 0.00 -1.81 0.00 0.00 61.98 58.72 2qme s VAL 44 Cb -0.11 -1.18 -0.04 0.00 0.56 0.00 0.00 36.38 35.61 2qme s VAL 44 CO 0.09 -0.38 0.52 -0.04 -0.31 0.00 0.00 175.10 174.98 2qme s MET 45 N -2.21 4.27 -0.26 4.82 -1.94 -1.26 -0.36 119.30 122.36 2qme s MET 45 Ca 0.01 0.47 0.02 0.00 -1.71 0.00 0.00 55.69 54.49 2qme s MET 45 Cb -0.07 -3.50 0.06 0.00 2.01 0.00 0.00 34.83 33.33 2qme s MET 45 CO 0.01 -0.02 -0.08 0.08 -0.01 0.00 0.00 175.02 175.01 2qme s VAL 46 N 1.19 1.97 -1.50 -6.03 1.01 0.13 -4.74 120.40 112.43 2qme s VAL 46 Ca 0.26 -1.57 -0.11 0.00 0.00 0.00 0.00 61.98 60.56 2qme s VAL 46 Cb -0.15 -2.16 0.07 0.00 0.00 0.00 0.00 36.38 34.14 2qme s VAL 46 CO 0.10 -0.11 0.86 0.47 0.00 0.00 0.00 175.10 176.43 2qme n ASP 47 N 4.49 -3.57 0.00 3.32 8.00 -1.26 -1.83 116.55 125.70 2qme n ASP 47 Ca -0.12 -0.83 0.00 0.00 0.71 0.00 0.00 54.79 54.55 2qme n ASP 47 Cb 0.43 -3.71 0.00 0.00 -0.02 0.00 0.00 41.12 37.82 2qme n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qme n GLY 48 N -1.66 0.72 3.06 0.44 0.00 -1.26 -5.04 105.19 101.45 2qme n GLY 48 Ca -0.05 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.77 2qme n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qme s LYS 49 N -0.33 0.89 0.31 1.61 1.02 -0.76 -5.11 119.74 117.35 2qme s LYS 49 Ca 0.00 -0.40 -0.27 0.00 0.02 0.00 0.00 55.97 55.31 2qme s LYS 49 Cb 0.00 -0.86 -0.09 0.00 -0.52 0.00 0.00 37.83 36.36 2qme s LYS 49 CO 0.00 0.23 0.98 -1.25 -0.92 0.00 0.00 175.35 174.39 2qme s PRO 50 N -0.29 4.61 -0.06 -1.68 0.04 -1.26 0.18 135.00 136.54 2qme s PRO 50 Ca 0.04 1.46 0.03 0.00 0.04 0.00 0.00 61.00 62.57 2qme s PRO 50 Cb -0.04 -2.94 0.00 0.00 0.04 0.00 0.00 34.50 31.56 2qme s PRO 50 CO -0.00 0.28 -0.15 0.08 0.04 0.00 0.00 177.00 177.24 2qme s VAL 51 N -1.45 1.31 -0.17 -0.36 1.01 0.51 -3.93 120.40 117.32 2qme s VAL 51 Ca 0.48 -0.62 -0.20 0.00 0.00 0.00 0.00 61.98 61.64 2qme s VAL 51 Cb -0.23 -1.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 2qme s VAL 51 CO 0.29 0.39 0.59 0.21 0.00 0.00 0.00 175.10 176.58 2qme s ASN 52 N 0.34 6.70 -0.31 3.32 3.84 0.29 -1.24 114.94 127.89 2qme s ASN 52 Ca -0.10 0.85 -0.15 0.00 0.21 0.00 0.00 52.86 53.67 2qme s ASN 52 Cb -0.14 -2.34 -0.02 0.00 -0.55 0.00 0.00 41.25 38.20 2qme s ASN 52 CO 0.03 -0.19 0.37 -0.76 -2.79 0.00 0.00 177.10 173.76 2qme s LEU 53 N 1.52 4.23 -0.40 3.21 1.43 0.15 -0.31 118.68 128.51 2qme s LEU 53 Ca 0.29 0.02 -0.14 0.00 -1.03 0.00 0.00 54.13 53.27 2qme s LEU 53 Cb -0.16 -2.38 0.02 0.00 0.03 0.00 0.00 46.19 43.70 2qme s LEU 53 CO 0.11 -0.26 0.28 -0.83 0.23 0.00 0.00 176.35 175.88 2qme s GLY 54 N 1.70 1.99 -0.22 -3.19 0.00 0.31 -1.83 107.32 106.08 2qme s GLY 54 Ca 0.13 -1.68 -0.05 0.00 0.00 0.00 0.00 44.72 43.12 2qme s GLY 54 CO 0.11 0.89 0.00 1.08 0.00 0.00 0.00 173.10 175.19 2qme s LEU 55 N 1.67 3.17 -0.30 0.66 1.43 0.65 -1.06 118.68 124.90 2qme s LEU 55 Ca 0.05 -0.27 -0.04 0.00 -1.03 0.00 0.00 54.13 52.84 2qme s LEU 55 Cb -0.19 -1.82 0.04 0.00 0.03 0.00 0.00 46.19 44.25 2qme s LEU 55 CO 0.10 0.01 0.03 0.26 0.23 0.00 0.00 176.35 176.98 2qme s TRP 56 N 1.34 3.21 -0.13 0.29 0.52 0.17 -0.58 118.94 123.76 2qme s TRP 56 Ca 0.04 -1.55 -0.16 0.00 0.02 0.00 0.00 56.10 54.45 2qme s TRP 56 Cb -0.15 -2.17 -0.04 0.00 -1.15 0.00 0.00 33.47 29.96 2qme s TRP 56 CO 0.01 -0.74 0.40 0.34 0.02 0.00 0.00 176.95 176.98 2qme s ASP 57 N 1.35 6.58 0.38 2.95 2.15 0.10 -1.20 116.67 128.98 2qme s ASP 57 Ca -0.02 0.69 0.07 0.00 0.43 0.00 0.00 52.55 53.72 2qme s ASP 57 Cb -0.19 -2.24 -0.07 0.00 -0.30 0.00 0.00 42.92 40.12 2qme s ASP 57 CO 0.00 0.04 -0.01 0.42 -0.17 0.00 0.00 175.17 175.45 2qme s THR 58 N 0.54 1.93 -0.09 1.71 -4.23 -1.19 -2.44 115.64 111.87 2qme s THR 58 Ca 0.22 -2.05 -0.25 0.00 -1.18 0.00 0.00 61.69 58.42 2qme s THR 58 Cb -0.14 -2.86 -0.03 0.00 1.34 0.00 0.00 72.50 70.81 2qme s THR 58 CO 0.08 -0.06 0.80 0.00 -0.54 0.00 0.00 174.62 174.90 2qme s ALA 59 N -2.78 3.37 0.10 3.99 0.00 -1.21 -4.80 121.76 120.43 2qme s ALA 59 Ca 0.34 0.17 0.25 0.00 0.00 0.00 0.00 51.96 52.72 2qme s ALA 59 Cb 0.08 -3.14 0.91 0.00 0.00 0.00 0.00 23.12 20.97 2qme s ALA 59 CO 0.17 -0.34 1.82 0.78 0.00 0.00 0.00 175.76 178.19 2qme h GLY 60 N 7.39 0.00 -4.24 0.00 0.00 -1.81 -3.46 103.07 100.94 2qme h GLY 60 Ca -0.36 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.44 2qme h GLY 60 CO 0.79 0.00 0.79 1.20 0.00 0.00 0.00 176.54 179.32 2qme s GLN 61 N -3.61 4.22 0.62 4.80 -0.21 -1.26 -3.68 119.66 120.55 2qme s GLN 61 Ca 0.01 2.38 0.35 0.00 0.02 0.00 0.00 55.36 58.12 2qme s GLN 61 Cb 0.10 -3.08 2.00 0.00 1.00 0.00 0.00 33.01 33.02 2qme s GLN 61 CO 0.63 -0.48 2.26 1.05 -2.12 0.00 0.00 175.29 176.63 2qme h GLU 62 N 4.90 0.00 -0.89 2.91 4.11 -2.00 -2.39 114.58 121.22 2qme h GLU 62 Ca -0.46 0.00 0.26 0.00 0.07 0.00 0.00 59.36 59.22 2qme h GLU 62 Cb 1.22 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.43 2qme h GLU 62 CO 0.78 0.00 0.64 -0.44 0.07 0.00 0.00 179.01 180.06 2qme h ASP 63 N 0.00 0.00 -0.60 3.06 3.45 -1.97 -1.07 116.42 119.30 2qme h ASP 63 Ca 0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.47 2qme h ASP 63 Cb 0.10 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.87 2qme h ASP 63 CO -0.00 0.00 0.00 -1.22 -1.57 0.00 0.00 179.24 176.45 2qme n TYR 64 N -4.26 1.61 -0.12 4.55 4.02 -0.90 -4.57 117.16 117.49 2qme n TYR 64 Ca 0.18 -0.66 0.06 0.00 -0.01 0.00 0.00 57.90 57.47 2qme n TYR 64 Cb 0.96 -0.32 0.38 0.00 -0.02 0.00 0.00 39.34 40.34 2qme n TYR 64 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 2qme h ASP 65 N 3.88 0.59 0.77 7.72 3.32 -1.36 0.69 116.42 132.04 2qme h ASP 65 Ca 0.00 -0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 2qme h ASP 65 Cb 1.60 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.99 2qme h ASP 65 CO 0.30 0.40 -0.88 0.03 -1.72 0.00 0.00 179.24 177.38 2qme h ARG 66 N 0.69 0.07 0.08 3.56 3.08 -1.84 -3.33 114.38 116.69 2qme h ARG 66 Ca 0.26 -0.08 -0.28 0.00 0.07 0.00 0.00 59.98 59.95 2qme h ARG 66 Cb 0.16 0.02 0.02 0.00 0.08 0.00 0.00 29.97 30.25 2qme h ARG 66 CO -0.07 0.90 -1.16 1.25 -1.07 0.00 0.00 179.97 179.81 2qme h LEU 67 N 0.03 0.76 -0.85 3.04 5.85 -1.68 -3.39 115.31 119.07 2qme h LEU 67 Ca -0.02 -0.68 0.17 0.00 0.84 0.00 0.00 57.88 58.19 2qme h LEU 67 Cb 1.53 -0.24 -0.11 0.00 0.37 0.00 0.00 40.66 42.22 2qme h LEU 67 CO 0.12 1.49 0.40 -0.09 -0.34 0.00 0.00 178.44 180.02 2qme h ARG 68 N 0.26 0.49 0.00 1.25 2.43 -1.00 0.14 114.38 117.95 2qme h ARG 68 Ca -0.15 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 2qme h ARG 68 Cb 1.83 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 31.27 2qme h ARG 68 CO 0.22 0.33 0.00 -2.30 -1.51 0.00 0.00 179.97 176.70 2qme n PRO 69 N -4.96 0.06 -0.12 0.20 -0.02 -1.26 -1.49 135.00 127.40 2qme n PRO 69 Ca 0.19 0.29 0.21 0.00 -2.02 0.00 0.00 63.50 62.16 2qme n PRO 69 Cb 0.52 -1.50 0.62 0.00 -0.02 0.00 0.00 33.50 33.12 2qme n PRO 69 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2qme h LEU 70 N 0.00 0.17 -0.57 2.45 3.38 -1.00 -1.65 115.31 118.08 2qme h LEU 70 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2qme h LEU 70 Cb 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2qme h LEU 70 CO 0.00 0.08 0.00 0.28 0.09 0.00 0.00 178.44 178.89 2qme h SER 71 N 0.18 0.00 0.22 -0.43 0.02 -1.47 -3.40 113.55 108.66 2qme h SER 71 Ca 0.36 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.96 2qme h SER 71 Cb 1.15 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.71 2qme h SER 71 CO -0.06 0.00 -1.63 1.88 -1.14 0.00 0.00 176.83 175.87 2qme h TYR 72 N 0.00 0.85 -2.79 3.45 0.05 -1.48 -3.44 116.97 113.61 2qme h TYR 72 Ca 0.00 -0.62 -0.58 0.00 0.05 0.00 0.00 58.73 57.57 2qme h TYR 72 Cb 0.57 -0.03 0.09 0.00 1.01 0.00 0.00 36.73 38.37 2qme h TYR 72 CO 0.00 1.63 0.54 -2.30 -1.05 0.00 0.00 178.16 176.98 2qme n PRO 73 N -3.65 1.98 -1.13 4.88 -0.02 -1.26 -1.95 135.00 133.84 2qme n PRO 73 Ca -0.21 0.70 -0.04 0.00 -2.02 0.00 0.00 63.50 61.92 2qme n PRO 73 Cb 1.09 -2.31 -0.02 0.00 -0.02 0.00 0.00 33.50 32.24 2qme n PRO 73 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2qme n GLN 74 N 1.56 -0.73 -2.12 -0.52 6.02 -1.26 -4.99 117.38 115.34 2qme n GLN 74 Ca 0.10 0.51 -0.41 0.00 -0.01 0.00 0.00 57.00 57.19 2qme n GLN 74 Cb 0.32 -4.26 -0.03 0.00 1.02 0.00 0.00 30.24 27.30 2qme n GLN 74 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2qme s THR 75 N -1.95 2.88 -0.09 5.09 2.01 -0.83 -4.74 115.64 118.02 2qme s THR 75 Ca 0.00 0.77 0.14 0.00 0.31 0.00 0.00 61.69 62.92 2qme s THR 75 Cb 0.00 -3.49 -0.22 0.00 0.01 0.00 0.00 72.50 68.79 2qme s THR 75 CO 0.00 0.14 0.57 0.47 -0.69 0.00 0.00 174.62 175.11 2qme n ASP 76 N 2.00 0.69 -3.62 3.53 8.00 0.20 -4.93 116.55 122.43 2qme n ASP 76 Ca 0.05 0.32 -0.14 0.00 0.71 0.00 0.00 54.79 55.72 2qme n ASP 76 Cb 0.42 0.21 -0.07 0.00 -0.02 0.00 0.00 41.12 41.66 2qme n ASP 76 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2qme s VAL 77 N -2.64 0.00 -0.02 2.53 0.11 -0.96 -4.18 120.40 115.23 2qme s VAL 77 Ca -0.05 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.00 2qme s VAL 77 Cb 0.08 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.89 2qme s VAL 77 CO 0.83 0.00 0.02 -0.36 -3.33 0.00 0.00 175.10 172.26 2qme s PHE 78 N 0.21 3.15 -0.32 1.54 0.08 -0.66 -1.76 117.98 120.21 2qme s PHE 78 Ca -0.01 0.14 -0.05 0.00 0.12 0.00 0.00 56.93 57.12 2qme s PHE 78 Cb -0.04 -1.71 0.03 0.00 -0.57 0.00 0.00 43.02 40.73 2qme s PHE 78 CO 0.02 0.49 0.07 -0.51 -0.10 0.00 0.00 175.22 175.19 2qme s LEU 79 N -1.45 4.08 -0.21 -0.37 1.43 0.03 -0.75 118.68 121.43 2qme s LEU 79 Ca 0.19 -1.06 -0.17 0.00 -1.03 0.00 0.00 54.13 52.06 2qme s LEU 79 Cb -0.12 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2qme s LEU 79 CO 0.09 -0.28 0.44 -0.63 0.23 0.00 0.00 176.35 176.21 2qme s ILE 80 N 1.39 5.16 0.00 -0.59 1.01 -0.57 -0.76 121.20 126.84 2qme s ILE 80 Ca -0.01 0.79 0.06 0.00 0.00 0.00 0.00 60.65 61.48 2qme s ILE 80 Cb -0.19 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.48 2qme s ILE 80 CO 0.02 0.21 -0.18 0.00 0.00 0.00 0.00 174.94 174.99 2qme s PHE 82 N -0.82 0.19 -0.01 0.00 -0.71 -0.57 -4.04 117.98 112.01 2qme s PHE 82 Ca 0.13 -0.48 -0.25 0.00 -1.04 0.00 0.00 56.93 55.29 2qme s PHE 82 Cb -0.10 -0.13 -0.04 0.00 -1.21 0.00 0.00 43.02 41.53 2qme s PHE 82 CO 0.03 -0.36 0.77 0.45 -1.34 0.00 0.00 175.22 174.76 2qme s SER 83 N -2.08 7.13 0.22 1.98 0.15 -1.26 -0.46 113.70 119.39 2qme s SER 83 Ca -0.06 1.36 0.18 0.00 0.70 0.00 0.00 55.95 58.14 2qme s SER 83 Cb -0.02 -2.46 0.88 0.00 -1.71 0.00 0.00 66.02 62.72 2qme s SER 83 CO -0.04 -0.08 1.56 0.18 1.20 0.00 0.00 173.24 176.05 2qme n LEU 84 N 3.40 0.46 -0.66 3.45 4.77 -0.40 -1.54 117.00 126.48 2qme n LEU 84 Ca -0.01 0.67 0.08 0.00 -0.03 0.00 0.00 56.01 56.72 2qme n LEU 84 Cb 0.51 -0.67 0.22 0.00 -2.33 0.00 0.00 43.42 41.15 2qme n LEU 84 CO 0.48 -0.69 0.66 1.33 -1.33 0.00 0.00 177.39 177.84 2qme n VAL 85 N -2.06 2.19 -3.59 4.08 0.24 -1.26 -0.53 118.33 117.39 2qme n VAL 85 Ca 0.00 -2.11 -0.29 0.00 -2.04 0.00 0.00 64.34 59.91 2qme n VAL 85 Cb 0.11 -0.26 -0.12 0.00 -1.47 0.00 0.00 33.84 32.10 2qme n VAL 85 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2qme s SER 86 N -2.31 3.21 0.44 -1.34 0.15 -0.59 -4.96 113.70 108.30 2qme s SER 86 Ca 0.39 -2.55 0.22 0.00 0.70 0.00 0.00 55.95 54.72 2qme s SER 86 Cb 0.33 -0.75 1.20 0.00 -1.71 0.00 0.00 66.02 65.09 2qme s SER 86 CO 0.06 -0.27 1.82 -0.65 1.20 0.00 0.00 173.24 175.40 2qme h PRO 87 N 6.68 0.29 -0.66 5.44 0.11 -1.87 -0.84 132.00 141.14 2qme h PRO 87 Ca 0.05 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.15 2qme h PRO 87 Cb 0.94 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.95 2qme h PRO 87 CO 0.40 0.19 0.43 0.00 -0.21 0.00 0.00 178.00 178.80 2qme h ALA 88 N 1.58 0.84 -0.19 -0.75 0.00 -1.94 -1.11 119.26 117.69 2qme h ALA 88 Ca 0.53 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.30 2qme h ALA 88 Cb 1.52 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2qme h ALA 88 CO -0.19 0.29 -0.25 0.66 0.00 0.00 0.00 179.25 179.76 2qme h SER 89 N 0.90 0.36 -0.19 0.00 4.64 -1.51 -2.43 113.55 115.33 2qme h SER 89 Ca 0.24 -0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 61.42 2qme h SER 89 Cb -0.08 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 2qme h SER 89 CO -0.05 0.62 0.01 0.15 -0.87 0.00 0.00 176.83 176.69 2qme h PHE 90 N 0.32 0.35 -0.68 4.77 3.57 -1.03 -2.87 116.94 121.36 2qme h PHE 90 Ca 0.05 -0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.52 2qme h PHE 90 Cb 0.62 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.23 2qme h PHE 90 CO 0.02 0.50 0.45 1.49 -2.23 0.00 0.00 178.31 178.54 2qme h GLU 91 N 0.09 0.81 0.00 1.11 4.57 -0.95 -1.74 114.58 118.48 2qme h GLU 91 Ca 0.05 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 2qme h GLU 91 Cb 0.35 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 2qme h GLU 91 CO 0.01 0.54 0.00 -0.91 -1.18 0.00 0.00 179.01 177.46 2qme h ASN 92 N 0.83 0.00 -0.35 1.04 2.35 -1.22 -1.85 115.58 116.38 2qme h ASN 92 Ca 0.27 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 56.08 2qme h ASN 92 Cb 0.04 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.35 2qme h ASN 92 CO -0.07 0.00 0.01 0.58 -1.65 0.00 0.00 177.43 176.30 2qme h VAL 93 N 0.00 0.75 0.07 2.81 2.07 -1.21 0.52 116.25 121.26 2qme h VAL 93 Ca 0.00 -0.04 -0.14 0.00 0.82 0.00 0.00 66.70 67.34 2qme h VAL 93 Cb 0.43 0.63 0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2qme h VAL 93 CO 0.00 0.02 -0.61 -0.09 0.02 0.00 0.00 177.57 176.91 2qme h ARG 94 N 0.11 0.29 -0.07 1.57 2.43 -1.60 -0.55 114.38 116.56 2qme h ARG 94 Ca 0.17 -0.40 -0.16 0.00 -0.81 0.00 0.00 59.98 58.77 2qme h ARG 94 Cb 0.23 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2qme h ARG 94 CO -0.28 1.14 -0.67 0.00 -1.51 0.00 0.00 179.97 178.65 2qme h ALA 95 N 0.17 0.72 0.00 2.80 0.00 -1.31 -3.41 119.26 118.23 2qme h ALA 95 Ca -0.10 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2qme h ALA 95 Cb 1.41 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2qme h ALA 95 CO 0.12 0.76 -0.23 1.17 0.00 0.00 0.00 179.25 181.06 2qme n LYS 96 N -3.84 0.00 -0.04 0.00 4.81 0.07 -4.85 118.16 114.31 2qme n LYS 96 Ca -0.03 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.27 2qme n LYS 96 Cb 0.67 -0.40 -0.09 0.00 0.02 0.00 0.00 35.03 35.22 2qme n LYS 96 CO 0.00 0.00 0.00 -1.49 1.17 0.00 0.00 177.40 177.08 2qme h TRP 97 N 0.00 0.26 0.14 5.64 4.06 -1.21 -1.93 115.95 122.91 2qme h TRP 97 Ca 0.00 -0.10 0.01 0.00 2.06 0.00 0.00 58.89 60.87 2qme h TRP 97 Cb 0.23 -0.05 -0.03 0.00 -1.00 0.00 0.00 29.16 28.32 2qme h TRP 97 CO 0.00 0.74 -0.25 -0.92 -3.56 0.00 0.00 178.44 174.45 2qme h TYR 98 N -0.29 -0.66 -0.38 0.49 3.20 -1.35 -1.30 116.97 116.67 2qme h TYR 98 Ca 0.00 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 2qme h TYR 98 Cb 0.73 0.27 -0.02 0.00 1.54 0.00 0.00 36.73 39.26 2qme h TYR 98 CO 0.12 -0.35 0.14 -1.35 -1.64 0.00 0.00 178.16 175.07 2qme h PRO 99 N -0.47 0.55 0.51 1.82 0.11 -1.79 -1.48 132.00 131.26 2qme h PRO 99 Ca 0.02 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 66.04 2qme h PRO 99 Cb 0.48 -0.10 0.01 0.00 0.11 0.00 0.00 31.00 31.49 2qme h PRO 99 CO -0.13 0.47 -0.25 1.49 -0.21 0.00 0.00 178.00 179.37 2qme h GLU 100 N 0.54 -0.66 -0.60 1.05 4.81 -1.09 -2.57 114.58 116.06 2qme h GLU 100 Ca 0.13 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.42 2qme h GLU 100 Cb 0.13 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.63 2qme h GLU 100 CO -0.01 -0.38 0.39 0.28 -0.73 0.00 0.00 179.01 178.56 2qme h VAL 101 N -0.83 1.14 -0.28 0.32 2.07 -1.10 -2.83 116.25 114.74 2qme h VAL 101 Ca -0.07 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 2qme h VAL 101 Cb 0.59 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 2qme h VAL 101 CO 0.12 0.15 -0.05 0.03 0.02 0.00 0.00 177.57 177.83 2qme h ARG 102 N 0.80 0.43 -0.59 1.57 2.47 -1.32 0.82 114.38 118.56 2qme h ARG 102 Ca 0.23 -0.10 -0.00 0.00 -1.26 0.00 0.00 59.98 58.85 2qme h ARG 102 Cb -0.07 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.16 2qme h ARG 102 CO -0.06 0.50 0.37 1.25 0.56 0.00 0.00 179.97 182.59 2qme h HIS 103 N 0.41 0.77 0.01 3.04 2.76 -1.20 -3.04 115.15 117.89 2qme h HIS 103 Ca 0.09 0.00 -0.24 0.00 -2.20 0.00 0.00 60.37 58.02 2qme h HIS 103 Cb 0.35 -0.25 -0.04 0.00 1.55 0.00 0.00 27.41 29.02 2qme h HIS 103 CO 0.01 0.51 -1.28 0.45 -1.30 0.00 0.00 177.93 176.32 2qme h HIS 104 N 0.80 0.03 -2.66 5.26 3.86 -1.43 -3.42 115.15 117.59 2qme h HIS 104 Ca 0.21 -0.02 -0.60 0.00 -1.16 0.00 0.00 60.37 58.81 2qme h HIS 104 Cb -0.04 -0.00 -0.39 0.00 1.06 0.00 0.00 27.41 28.04 2qme h HIS 104 CO -0.02 1.02 -0.84 0.00 0.86 0.00 0.00 177.93 178.95 2qme h PRO 106 N 6.25 0.00 -0.00 0.00 0.13 -1.78 -3.24 132.00 133.36 2qme h PRO 106 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2qme h PRO 106 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 2qme h PRO 106 CO 0.41 0.25 -0.02 0.72 -0.23 0.00 0.00 178.00 179.13 2qme n HIS 107 N -3.97 0.00 -2.38 1.56 8.25 -1.26 -5.00 115.22 112.42 2qme n HIS 107 Ca -0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.03 2qme n HIS 107 Cb 0.33 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.40 2qme n HIS 107 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2qme s THR 108 N -0.44 3.67 0.40 1.59 2.01 -1.22 -4.96 115.64 116.69 2qme s THR 108 Ca 0.04 1.35 -0.27 0.00 0.31 0.00 0.00 61.69 63.12 2qme s THR 108 Cb 0.03 -3.86 -0.10 0.00 0.01 0.00 0.00 72.50 68.58 2qme s THR 108 CO 0.06 0.19 1.45 -0.81 -0.69 0.00 0.00 174.62 174.82 2qme n PRO 109 N 2.86 2.49 -4.88 4.92 -0.04 -1.26 -4.87 135.00 134.23 2qme n PRO 109 Ca 0.06 0.88 -0.32 0.00 -0.04 0.00 0.00 63.50 64.07 2qme n PRO 109 Cb 0.45 -2.63 -0.16 0.00 -0.04 0.00 0.00 33.50 31.12 2qme n PRO 109 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2qme s ILE 110 N -1.14 2.23 -0.16 0.52 1.01 -1.26 -1.66 121.20 120.74 2qme s ILE 110 Ca 0.56 -0.94 -0.08 0.00 0.00 0.00 0.00 60.65 60.19 2qme s ILE 110 Cb -0.48 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 2qme s ILE 110 CO 0.62 0.55 0.12 -0.76 0.00 0.00 0.00 174.94 175.46 2qme s LEU 111 N 0.59 4.18 -0.21 2.97 1.02 0.07 -0.56 118.68 126.73 2qme s LEU 111 Ca -0.12 0.30 -0.15 0.00 0.02 0.00 0.00 54.13 54.18 2qme s LEU 111 Cb -0.17 -2.04 -0.04 0.00 0.02 0.00 0.00 46.19 43.96 2qme s LEU 111 CO 0.03 0.29 0.38 -0.22 0.02 0.00 0.00 176.35 176.85 2qme s LEU 112 N -0.31 4.14 -0.20 1.79 2.96 -0.44 -1.51 118.68 125.11 2qme s LEU 112 Ca 0.11 0.47 0.02 0.00 -0.22 0.00 0.00 54.13 54.50 2qme s LEU 112 Cb -0.12 -2.47 0.03 0.00 0.50 0.00 0.00 46.19 44.13 2qme s LEU 112 CO 0.01 -0.07 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.11 2qme s VAL 113 N 1.33 2.11 -0.24 1.68 1.01 0.43 -0.98 120.40 125.74 2qme s VAL 113 Ca 0.18 -1.14 -0.23 0.00 0.00 0.00 0.00 61.98 60.79 2qme s VAL 113 Cb -0.15 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 2qme s VAL 113 CO 0.08 0.37 0.73 -0.83 0.00 0.00 0.00 175.10 175.45 2qme s GLY 114 N 1.24 1.81 0.42 4.51 0.00 0.06 -1.52 107.32 113.84 2qme s GLY 114 Ca 0.01 -0.27 0.08 0.00 0.00 0.00 0.00 44.72 44.54 2qme s GLY 114 CO -0.11 1.62 0.49 -0.51 0.00 0.00 0.00 173.10 174.59 2qme s THR 115 N 2.61 2.90 -1.29 0.90 -4.23 0.40 -1.02 115.64 115.90 2qme s THR 115 Ca 0.31 -1.14 -0.06 0.00 -1.18 0.00 0.00 61.69 59.62 2qme s THR 115 Cb -0.15 -3.01 0.01 0.00 1.34 0.00 0.00 72.50 70.68 2qme s THR 115 CO 0.08 -0.01 0.75 0.29 -0.54 0.00 0.00 174.62 175.19 2qme n LYS 116 N -1.72 -5.45 -0.17 3.99 5.02 -0.98 -1.27 118.16 117.57 2qme n LYS 116 Ca 0.06 0.77 0.19 0.00 -2.02 0.00 0.00 58.31 57.30 2qme n LYS 116 Cb 0.60 -5.44 0.55 0.00 -0.02 0.00 0.00 35.03 30.72 2qme n LYS 116 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2qme h LEU 117 N -1.71 0.31 -2.09 -0.35 5.85 -1.53 0.14 115.31 115.92 2qme h LEU 117 Ca -0.48 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.25 2qme h LEU 117 Cb 1.32 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 2qme h LEU 117 CO 0.50 0.14 -0.06 -2.24 -0.34 0.00 0.00 178.44 176.44 2qme h ASP 118 N 0.32 0.00 1.41 1.25 2.03 -1.90 -2.41 116.42 117.11 2qme h ASP 118 Ca 0.39 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.69 2qme h ASP 118 Cb 1.06 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.56 2qme h ASP 118 CO -0.11 0.06 -0.12 -0.07 -1.03 0.00 0.00 179.24 177.96 2qme h LEU 119 N 0.00 0.00 -1.63 0.15 3.38 -1.34 -3.28 115.31 112.59 2qme h LEU 119 Ca -0.00 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2qme h LEU 119 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2qme h LEU 119 CO 0.01 0.02 -0.08 -0.09 0.09 0.00 0.00 178.44 178.39 2qme h ARG 120 N 0.00 0.14 -0.38 1.13 2.43 -1.50 -2.26 114.38 113.94 2qme h ARG 120 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2qme h ARG 120 Cb 0.77 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 2qme h ARG 120 CO 0.00 0.23 0.00 -0.25 -1.51 0.00 0.00 179.97 178.44 2qme n ASP 121 N -4.37 3.33 -4.66 -3.80 8.00 -1.25 -4.83 116.55 108.98 2qme n ASP 121 Ca -0.01 -1.95 -0.43 0.00 0.71 0.00 0.00 54.79 53.11 2qme n ASP 121 Cb 0.20 -0.25 -0.02 0.00 -0.02 0.00 0.00 41.12 41.03 2qme n ASP 121 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2qme s ASP 122 N -1.34 6.98 0.18 -2.24 2.15 -0.85 -4.95 116.67 116.60 2qme s ASP 122 Ca 0.36 1.45 -0.14 0.00 0.43 0.00 0.00 52.55 54.65 2qme s ASP 122 Cb 0.21 -2.54 0.16 0.00 -0.30 0.00 0.00 42.92 40.44 2qme s ASP 122 CO 0.29 -0.77 1.72 0.50 -0.17 0.00 0.00 175.17 176.74 2qme h LYS 123 N 7.98 0.21 -0.86 4.34 3.11 -1.92 -0.55 116.57 128.87 2qme h LYS 123 Ca -0.23 -0.01 -0.03 0.00 -2.81 0.00 0.00 60.65 57.57 2qme h LYS 123 Cb 1.08 -0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 32.22 2qme h LYS 123 CO 0.99 0.14 0.42 -0.44 -2.81 0.00 0.00 179.45 177.74 2qme h ASP 124 N 0.21 1.12 -0.20 4.20 3.32 -1.95 0.01 116.42 123.13 2qme h ASP 124 Ca 0.23 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 2qme h ASP 124 Cb 0.29 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 2qme h ASP 124 CO -0.30 0.93 -0.01 0.74 -1.72 0.00 0.00 179.24 178.88 2qme h THR 125 N 1.22 1.26 -0.73 0.35 2.02 -1.71 0.25 112.91 115.58 2qme h THR 125 Ca 0.30 -0.91 0.07 0.00 0.77 0.00 0.00 66.41 66.64 2qme h THR 125 Cb 0.11 1.46 -0.06 0.00 -1.74 0.00 0.00 68.15 67.92 2qme h THR 125 CO -0.04 0.28 0.41 0.40 0.37 0.00 0.00 175.52 176.93 2qme h ILE 126 N 0.11 0.94 -0.35 3.11 2.04 -0.82 -1.89 117.51 120.66 2qme h ILE 126 Ca 0.06 -0.25 -0.11 0.00 1.00 0.00 0.00 64.86 65.56 2qme h ILE 126 Cb 0.42 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 2qme h ILE 126 CO 0.01 0.13 -0.20 -0.33 0.00 0.00 0.00 178.15 177.76 2qme h GLU 127 N 0.72 0.75 -0.82 2.37 4.39 -0.83 0.80 114.58 121.96 2qme h GLU 127 Ca 0.34 -0.34 0.07 0.00 0.34 0.00 0.00 59.36 59.77 2qme h GLU 127 Cb 0.25 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.82 2qme h GLU 127 CO -0.21 0.96 0.49 -0.09 -1.16 0.00 0.00 179.01 179.00 2qme h ARG 128 N 0.53 0.84 -0.20 2.33 2.43 -0.57 0.17 114.38 119.91 2qme h ARG 128 Ca 0.07 -0.05 -0.18 0.00 -0.81 0.00 0.00 59.98 59.01 2qme h ARG 128 Cb 0.75 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2qme h ARG 128 CO 0.06 0.56 -0.58 -0.07 -1.51 0.00 0.00 179.97 178.42 2qme h LEU 129 N 0.87 0.86 -1.56 3.80 3.38 -1.20 -3.26 115.31 118.20 2qme h LEU 129 Ca 0.38 -0.58 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 2qme h LEU 129 Cb 0.25 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2qme h LEU 129 CO -0.20 1.29 -0.23 -0.09 0.09 0.00 0.00 178.44 179.30 2qme h ARG 130 N 0.47 0.00 0.00 1.13 2.43 -0.26 0.81 114.38 118.97 2qme h ARG 130 Ca -0.02 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2qme h ARG 130 Cb 1.20 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.75 2qme h ARG 130 CO 0.13 0.23 -0.00 -0.44 -1.51 0.00 0.00 179.97 178.37 2qme h ASP 131 N 0.00 0.00 -0.34 -3.80 3.32 -1.02 -1.89 116.42 112.69 2qme h ASP 131 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 2qme h ASP 131 Cb 0.41 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 2qme h ASP 131 CO 0.03 0.00 0.01 0.29 -1.72 0.00 0.00 179.24 177.85 2qme n LYS 132 N -4.36 3.28 -1.97 3.56 4.76 -0.04 -4.95 118.16 118.45 2qme n LYS 132 Ca -0.03 -2.93 -0.15 0.00 -2.87 0.00 0.00 58.31 52.33 2qme n LYS 132 Cb 0.09 -1.94 -0.03 0.00 -1.84 0.00 0.00 35.03 31.31 2qme n LYS 132 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2qme n LYS 133 N -0.31 -1.17 -4.34 1.97 5.02 -0.71 -4.99 118.16 113.62 2qme n LYS 133 Ca 0.24 0.86 -0.24 0.00 -2.02 0.00 0.00 58.31 57.15 2qme n LYS 133 Cb 0.97 -5.14 -0.08 0.00 -0.02 0.00 0.00 35.03 30.76 2qme n LYS 133 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qme s LEU 134 N -4.07 2.98 0.06 -0.35 1.43 0.08 -4.98 118.68 113.82 2qme s LEU 134 Ca 0.00 -0.91 -0.01 0.00 -1.03 0.00 0.00 54.13 52.18 2qme s LEU 134 Cb 0.00 -1.41 -0.04 0.00 0.03 0.00 0.00 46.19 44.77 2qme s LEU 134 CO 0.00 -0.14 -0.03 0.00 0.23 0.00 0.00 176.35 176.42 2qme s ALA 135 N -2.47 0.56 0.75 4.21 0.00 -1.26 -2.73 121.76 120.82 2qme s ALA 135 Ca 0.33 -1.23 -0.16 0.00 0.00 0.00 0.00 51.96 50.90 2qme s ALA 135 Cb -0.02 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.38 2qme s ALA 135 CO 0.19 -0.37 0.71 -2.30 0.00 0.00 0.00 175.76 173.99 2qme n PRO 136 N 0.09 0.30 -2.19 0.00 -0.02 -1.26 -4.87 135.00 127.04 2qme n PRO 136 Ca -0.13 0.15 -0.42 0.00 -2.02 0.00 0.00 63.50 61.08 2qme n PRO 136 Cb 0.61 -2.00 -0.03 0.00 -0.02 0.00 0.00 33.50 32.06 2qme n PRO 136 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2qme s ILE 137 N -1.94 3.21 0.51 4.25 -1.09 0.31 -5.02 121.20 121.42 2qme s ILE 137 Ca 0.68 0.95 -0.01 0.00 -2.23 0.00 0.00 60.65 60.03 2qme s ILE 137 Cb -0.33 -3.61 0.01 0.00 -1.58 0.00 0.00 42.46 36.95 2qme s ILE 137 CO 0.56 0.12 0.76 0.42 -1.23 0.00 0.00 174.94 175.57 2qme s THR 138 N 0.45 3.67 0.06 2.92 -4.23 -1.26 -4.92 115.64 112.32 2qme s THR 138 Ca 0.60 -0.37 -0.24 0.00 -1.18 0.00 0.00 61.69 60.49 2qme s THR 138 Cb -0.37 -3.39 -0.16 0.00 1.34 0.00 0.00 72.50 69.92 2qme s THR 138 CO 0.36 -0.31 1.62 0.22 -0.54 0.00 0.00 174.62 175.96 2qme h TYR 139 N 0.16 -0.03 -0.66 3.99 5.03 -1.99 -0.59 116.97 122.89 2qme h TYR 139 Ca -0.45 -0.00 0.09 0.00 2.58 0.00 0.00 58.73 60.95 2qme h TYR 139 Cb 1.26 0.01 -0.04 0.00 1.55 0.00 0.00 36.73 39.51 2qme h TYR 139 CO 0.44 0.10 0.44 -1.35 -1.32 0.00 0.00 178.16 176.47 2qme h PRO 140 N -0.15 0.52 -0.48 1.82 0.11 -1.99 -0.21 132.00 131.61 2qme h PRO 140 Ca -0.00 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.96 2qme h PRO 140 Cb 0.14 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 2qme h PRO 140 CO 0.01 0.34 -0.14 1.96 -0.21 0.00 0.00 178.00 179.96 2qme h GLN 141 N 0.53 0.94 -0.57 1.05 4.20 -1.84 -1.36 115.11 118.06 2qme h GLN 141 Ca 0.30 -0.37 -0.06 0.00 0.06 0.00 0.00 58.65 58.58 2qme h GLN 141 Cb 0.47 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 2qme h GLN 141 CO -0.09 1.03 0.10 0.78 -0.67 0.00 0.00 178.83 179.98 2qme h GLY 142 N 0.79 1.01 1.04 3.46 0.00 -0.43 -2.06 103.07 106.87 2qme h GLY 142 Ca 0.12 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.75 2qme h GLY 142 CO 0.05 0.61 0.38 -2.00 0.00 0.00 0.00 176.54 175.58 2qme h LEU 143 N 0.83 1.10 -0.81 3.11 5.85 -0.92 0.50 115.31 124.98 2qme h LEU 143 Ca 0.17 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2qme h LEU 143 Cb 0.40 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2qme h LEU 143 CO 0.01 0.94 0.45 0.00 -0.34 0.00 0.00 178.44 179.50 2qme h ALA 144 N 1.20 1.03 -0.53 1.25 0.00 -0.94 -0.66 119.26 120.63 2qme h ALA 144 Ca 0.28 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 2qme h ALA 144 Cb 0.15 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2qme h ALA 144 CO -0.03 0.54 0.16 1.98 0.00 0.00 0.00 179.25 181.90 2qme h MET 145 N 1.12 0.82 -0.76 0.00 1.85 -0.70 -1.09 114.93 116.18 2qme h MET 145 Ca 0.28 -0.18 0.08 0.00 -0.61 0.00 0.00 59.70 59.28 2qme h MET 145 Cb 0.02 -0.12 -0.07 0.00 0.43 0.00 0.00 31.60 31.87 2qme h MET 145 CO -0.05 0.76 0.42 0.00 -0.40 0.00 0.00 176.91 177.65 2qme h ALA 146 N 1.03 1.05 -0.53 0.39 0.00 -0.20 -1.51 119.26 119.49 2qme h ALA 146 Ca 0.17 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 2qme h ALA 146 Cb 0.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2qme h ALA 146 CO -0.00 0.07 0.11 0.07 0.00 0.00 0.00 179.25 179.50 2qme h ARG 147 N 0.74 0.86 -0.81 0.00 -0.00 -0.93 0.16 114.38 114.41 2qme h ARG 147 Ca 0.35 -0.22 -0.00 0.00 -0.00 0.00 0.00 59.98 60.11 2qme h ARG 147 Cb 0.29 -0.11 -0.04 0.00 -0.00 0.00 0.00 29.97 30.11 2qme h ARG 147 CO -0.22 0.83 0.49 1.49 -0.00 0.00 0.00 179.97 182.56 2qme h GLU 148 N 0.75 1.10 -0.15 0.08 4.81 -0.54 -2.49 114.58 118.15 2qme h GLU 148 Ca 0.16 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2qme h GLU 148 Cb 0.37 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.52 2qme h GLU 148 CO 0.01 0.77 0.00 0.44 -0.73 0.00 0.00 179.01 179.49 2qme n ILE 149 N -4.38 0.18 -2.91 2.32 -5.35 -0.63 -4.96 119.36 103.63 2qme n ILE 149 Ca 0.09 -0.47 -0.14 0.00 -0.27 0.00 0.00 62.75 61.96 2qme n ILE 149 Cb 0.06 0.86 0.03 0.00 -1.74 0.00 0.00 39.64 38.86 2qme n ILE 149 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qme n GLY 150 N 1.30 0.02 3.77 3.28 0.00 -0.54 -5.00 105.19 108.00 2qme n GLY 150 Ca 0.17 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2qme n GLY 150 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qme s SER 151 N -3.00 6.47 0.44 1.61 0.15 0.45 -4.72 113.70 115.10 2qme s SER 151 Ca 0.26 2.42 0.27 0.00 0.70 0.00 0.00 55.95 59.60 2qme s SER 151 Cb -0.11 -2.62 0.77 0.00 -1.71 0.00 0.00 66.02 62.34 2qme s SER 151 CO 0.32 -0.72 1.76 -0.37 1.20 0.00 0.00 173.24 175.43 2qme h VAL 152 N 2.36 0.00 -1.94 4.45 -1.51 -1.16 -3.44 116.25 115.01 2qme h VAL 152 Ca -0.49 -0.74 -0.03 0.00 -1.23 0.00 0.00 66.70 64.21 2qme h VAL 152 Cb 1.24 1.72 -0.21 0.00 -2.13 0.00 0.00 31.29 31.91 2qme h VAL 152 CO 0.63 0.00 0.20 -0.75 -1.23 0.00 0.00 177.57 176.41 2qme s LYS 153 N -3.35 0.86 -0.15 5.19 2.47 -1.25 -5.06 119.74 118.44 2qme s LYS 153 Ca 0.05 0.72 -0.03 0.00 -1.56 0.00 0.00 55.97 55.15 2qme s LYS 153 Cb 0.07 0.41 -0.03 0.00 -1.46 0.00 0.00 37.83 36.83 2qme s LYS 153 CO 0.60 -0.16 -0.05 -0.47 0.16 0.00 0.00 175.35 175.43 2qme s TYR 154 N -0.13 3.00 0.04 4.03 5.04 -1.26 -1.33 117.35 126.75 2qme s TYR 154 Ca -0.03 -0.33 0.02 0.00 -2.44 0.00 0.00 57.07 54.30 2qme s TYR 154 Cb -0.03 -1.94 -0.02 0.00 0.35 0.00 0.00 41.96 40.32 2qme s TYR 154 CO 0.03 -0.04 -0.08 -0.51 -1.34 0.00 0.00 175.55 173.61 2qme s LEU 155 N 0.32 2.26 0.05 6.97 1.43 -0.15 -4.98 118.68 124.58 2qme s LEU 155 Ca -0.05 -0.55 0.08 0.00 -1.03 0.00 0.00 54.13 52.59 2qme s LEU 155 Cb -0.14 -0.15 -0.03 0.00 0.03 0.00 0.00 46.19 45.90 2qme s LEU 155 CO 0.03 -0.21 -0.24 -1.61 0.23 0.00 0.00 176.35 174.55 2qme s GLU 156 N -1.59 1.58 0.20 1.70 2.02 -1.26 -0.76 118.70 120.58 2qme s GLU 156 Ca -0.10 -1.05 -0.19 0.00 0.02 0.00 0.00 54.97 53.65 2qme s GLU 156 Cb -0.10 -1.75 0.03 0.00 0.10 0.00 0.00 34.13 32.42 2qme s GLU 156 CO 0.00 0.45 0.56 0.00 0.02 0.00 0.00 175.26 176.29 2qme s SER 158 N -2.86 2.95 0.45 0.00 0.15 -0.07 -1.50 113.70 112.83 2qme s SER 158 Ca 0.08 -0.62 0.13 0.00 0.70 0.00 0.00 55.95 56.24 2qme s SER 158 Cb -0.02 -1.24 1.03 0.00 -1.71 0.00 0.00 66.02 64.08 2qme s SER 158 CO -0.04 -0.07 2.03 0.00 1.20 0.00 0.00 173.24 176.36 2qme h ALA 159 N 8.01 1.75 0.08 5.45 0.00 -1.89 0.22 119.26 132.88 2qme h ALA 159 Ca -0.37 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2qme h ALA 159 Cb 1.13 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2qme h ALA 159 CO 0.53 0.19 -0.04 1.25 0.00 0.00 0.00 179.25 181.18 2qme h LEU 160 N 0.08 -0.09 0.00 0.00 5.85 -1.94 -3.30 115.31 115.91 2qme h LEU 160 Ca 0.02 -0.50 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2qme h LEU 160 Cb 0.21 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.26 2qme h LEU 160 CO 0.01 0.50 -0.79 0.71 -0.34 0.00 0.00 178.44 178.53 2qme h THR 161 N -0.73 0.00 0.00 1.05 1.35 -1.99 -3.48 112.91 109.10 2qme h THR 161 Ca -0.01 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.92 2qme h THR 161 Cb 0.58 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 2qme h THR 161 CO 0.02 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.29 2qme n GLN 162 N -2.67 -0.14 -1.68 4.72 6.02 0.78 -5.01 117.38 119.41 2qme n GLN 162 Ca 0.01 0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.61 2qme n GLN 162 Cb 0.53 -3.10 -0.03 0.00 1.02 0.00 0.00 30.24 28.66 2qme n GLN 162 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2qme n ARG 163 N -2.03 2.82 -0.78 -1.09 3.00 -1.20 -2.02 116.66 115.35 2qme n ARG 163 Ca 0.00 1.03 0.00 0.00 -0.00 0.00 0.00 57.85 58.88 2qme n ARG 163 Cb 0.03 -2.95 0.00 0.00 0.00 0.00 0.00 32.46 29.54 2qme n ARG 163 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qme n GLY 164 N 4.37 1.31 0.13 5.14 0.00 -1.26 -0.89 105.19 113.99 2qme n GLY 164 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 2qme n GLY 164 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qme h LEU 165 N 0.00 -0.17 -0.76 0.99 5.85 -1.67 -2.58 115.31 116.97 2qme h LEU 165 Ca 0.00 -0.36 0.12 0.00 0.84 0.00 0.00 57.88 58.48 2qme h LEU 165 Cb 0.00 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 40.99 2qme h LEU 165 CO 0.00 0.32 0.37 0.50 -0.34 0.00 0.00 178.44 179.30 2qme h LYS 166 N -0.72 0.57 -0.35 1.25 3.64 -1.91 -2.12 116.57 116.92 2qme h LYS 166 Ca -0.02 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2qme h LYS 166 Cb 0.52 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 2qme h LYS 166 CO 0.03 0.38 0.19 1.15 -2.27 0.00 0.00 179.45 178.93 2qme h THR 167 N 0.59 1.12 -0.23 1.00 2.02 -1.91 0.31 112.91 115.81 2qme h THR 167 Ca 0.39 -0.30 0.03 0.00 0.77 0.00 0.00 66.41 67.31 2qme h THR 167 Cb 0.49 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 2qme h THR 167 CO -0.32 0.13 0.04 0.58 0.37 0.00 0.00 175.52 176.32 2qme h VAL 168 N 0.48 0.89 -0.01 3.16 2.07 -0.97 -0.37 116.25 121.49 2qme h VAL 168 Ca 0.13 -0.04 -0.21 0.00 0.82 0.00 0.00 66.70 67.39 2qme h VAL 168 Cb 0.02 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2qme h VAL 168 CO -0.02 0.02 -0.89 -0.26 0.02 0.00 0.00 177.57 176.44 2qme h PHE 169 N 0.12 0.53 -0.41 1.57 0.04 -1.42 -1.28 116.94 116.09 2qme h PHE 169 Ca 0.10 -0.28 0.05 0.00 2.80 0.00 0.00 57.97 60.64 2qme h PHE 169 Cb 0.11 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.15 2qme h PHE 169 CO -0.16 1.09 0.15 -0.44 -0.60 0.00 0.00 178.31 178.35 2qme h ASP 170 N 0.21 0.18 0.34 2.17 3.32 -0.74 -0.11 116.42 121.78 2qme h ASP 170 Ca -0.06 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 56.90 2qme h ASP 170 Cb 1.52 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 41.07 2qme h ASP 170 CO 0.15 0.14 -0.54 -0.33 -1.72 0.00 0.00 179.24 176.94 2qme h GLU 171 N 0.32 0.21 -0.42 3.56 4.39 -0.93 -0.48 114.58 121.23 2qme h GLU 171 Ca 0.19 -0.13 -0.02 0.00 0.34 0.00 0.00 59.36 59.74 2qme h GLU 171 Cb 0.16 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 2qme h GLU 171 CO -0.18 0.70 0.19 0.00 -1.16 0.00 0.00 179.01 178.55 2qme h ALA 172 N 1.28 0.54 0.10 3.43 0.00 -0.86 0.64 119.26 124.38 2qme h ALA 172 Ca 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2qme h ALA 172 Cb 1.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2qme h ALA 172 CO 0.08 0.12 -0.05 0.82 0.00 0.00 0.00 179.25 180.23 2qme h ILE 173 N 0.54 0.96 -0.17 0.00 2.04 -0.72 -2.96 117.51 117.19 2qme h ILE 173 Ca 0.14 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 2qme h ILE 173 Cb 0.15 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 2qme h ILE 173 CO -0.02 0.05 -0.09 0.03 0.00 0.00 0.00 178.15 178.13 2qme h ARG 174 N -0.22 0.26 -0.14 2.37 2.47 -0.98 0.76 114.38 118.90 2qme h ARG 174 Ca -0.01 -0.05 0.04 0.00 -1.26 0.00 0.00 59.98 58.69 2qme h ARG 174 Cb 0.18 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.45 2qme h ARG 174 CO 0.02 0.37 0.11 0.00 0.56 0.00 0.00 179.97 181.02 2qme h ALA 175 N 1.66 2.09 0.01 0.04 0.00 -0.71 0.12 119.26 122.47 2qme h ALA 175 Ca 0.05 -0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.58 2qme h ALA 175 Cb 0.32 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 2qme h ALA 175 CO 0.02 -0.18 -2.16 0.28 0.00 0.00 0.00 179.25 177.21 2qme n VAL 176 N -4.42 1.55 0.68 0.00 0.31 -0.48 -4.68 118.33 111.29 2qme n VAL 176 Ca 0.00 -0.37 0.10 0.00 -0.01 0.00 0.00 64.34 64.07 2qme n VAL 176 Cb 0.23 -1.81 -0.13 0.00 -0.91 0.00 0.00 33.84 31.21 2qme n VAL 176 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2qme n LEU 177 N -4.02 0.68 0.00 7.52 4.77 0.14 -5.13 117.00 120.97 2qme n LEU 177 Ca -0.45 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.18 2qme n LEU 177 Cb 0.88 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.97 2qme n LEU 177 CO 0.16 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.00