#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1auz s LEU 2 N 0.00 0.51 0.00 -3.43 2.96 -1.26 -3.56 118.68 113.89 1auz s LEU 2 Ca 0.00 0.68 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 1auz s LEU 2 Cb 0.00 1.39 0.00 0.00 0.50 0.00 0.00 46.19 48.08 1auz s LEU 2 CO 0.00 -0.21 0.00 0.61 -1.32 0.00 0.00 176.35 175.43 1auz n GLY 3 N 2.53 1.19 3.65 7.98 0.00 3.40 -4.90 105.19 119.03 1auz n GLY 3 Ca -0.15 -1.96 0.02 0.00 0.00 0.00 0.00 46.02 43.93 1auz n GLY 3 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1auz s ILE 4 N 1.09 0.00 0.05 -0.61 -1.16 -1.25 -4.06 121.20 115.26 1auz s ILE 4 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.14 1auz s ILE 4 Cb 0.00 -1.00 -0.03 0.00 0.61 0.00 0.00 42.46 42.04 1auz s ILE 4 CO 0.00 0.00 -0.05 -0.62 -2.81 0.00 0.00 174.94 171.46 1auz s ASP 5 N 0.93 0.66 -0.12 4.50 2.15 0.13 -4.93 116.67 119.98 1auz s ASP 5 Ca -0.07 -0.83 -0.08 0.00 0.43 0.00 0.00 52.55 52.00 1auz s ASP 5 Cb -0.02 0.13 0.04 0.00 -0.30 0.00 0.00 42.92 42.77 1auz s ASP 5 CO -0.10 -0.44 0.31 -0.04 -0.17 0.00 0.00 175.17 174.73 1auz s MET 6 N -3.03 0.31 -0.05 4.34 -1.94 -1.23 -1.57 119.30 116.13 1auz s MET 6 Ca 0.01 0.55 -0.05 0.00 -1.71 0.00 0.00 55.69 54.49 1auz s MET 6 Cb 0.01 0.01 0.01 0.00 2.01 0.00 0.00 34.83 36.87 1auz s MET 6 CO -0.05 -0.12 0.14 1.21 -0.01 0.00 0.00 175.02 176.19 1auz s ASN 7 N 0.88 -0.13 0.01 3.03 2.47 0.31 -4.91 114.94 116.60 1auz s ASN 7 Ca -0.06 0.25 0.03 0.00 0.42 0.00 0.00 52.86 53.50 1auz s ASN 7 Cb -0.07 0.29 -0.03 0.00 -1.45 0.00 0.00 41.25 39.98 1auz s ASN 7 CO -0.06 -0.08 -0.06 0.54 -3.72 0.00 0.00 177.10 173.72 1auz s VAL 8 N -0.05 3.68 -0.27 -5.21 0.11 -1.24 0.41 120.40 117.83 1auz s VAL 8 Ca -0.01 -0.81 -0.01 0.00 -2.93 0.00 0.00 61.98 58.22 1auz s VAL 8 Cb -0.02 -2.62 0.16 0.00 -1.53 0.00 0.00 36.38 32.37 1auz s VAL 8 CO 0.00 0.36 0.46 -0.54 -3.33 0.00 0.00 175.10 172.05 1auz s LYS 9 N -1.53 0.43 0.00 1.54 3.01 0.89 -4.89 119.74 119.19 1auz s LYS 9 Ca 0.18 0.60 0.00 0.00 -1.01 0.00 0.00 55.97 55.74 1auz s LYS 9 Cb -0.11 -0.13 0.00 0.00 -1.01 0.00 0.00 37.83 36.58 1auz s LYS 9 CO 0.09 -0.72 0.00 -1.91 0.51 0.00 0.00 175.35 173.32 1auz n GLU 10 N 5.38 0.00 0.00 1.68 2.13 -1.26 -0.03 120.64 128.54 1auz n GLU 10 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 1auz n GLU 10 Cb 0.50 -1.97 0.00 0.00 0.27 0.00 0.00 31.44 30.25 1auz n GLU 10 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1auz n SER 11 N 0.17 0.00 -4.68 4.31 3.41 -1.26 -4.99 113.62 110.59 1auz n SER 11 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.21 1auz n SER 11 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1auz n SER 11 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1auz s VAL 12 N 0.00 4.98 -0.60 -3.33 0.11 0.95 0.39 120.40 122.90 1auz s VAL 12 Ca 0.00 1.40 -0.16 0.00 -2.93 0.00 0.00 61.98 60.29 1auz s VAL 12 Cb 0.00 -4.03 0.15 0.00 -1.53 0.00 0.00 36.38 30.96 1auz s VAL 12 CO 0.00 0.11 0.57 -1.48 -3.33 0.00 0.00 175.10 170.97 1auz s LEU 13 N 1.77 6.25 0.08 2.54 0.05 1.33 -0.08 118.68 130.62 1auz s LEU 13 Ca 0.34 -1.95 -0.31 0.00 0.05 0.00 0.00 54.13 52.27 1auz s LEU 13 Cb -0.16 -2.22 -0.06 0.00 -2.05 0.00 0.00 46.19 41.70 1auz s LEU 13 CO 0.13 -0.82 1.21 0.00 -0.55 0.00 0.00 176.35 176.32 1auz s ILE 15 N 0.94 2.02 -0.56 0.00 1.09 0.21 0.11 121.20 125.02 1auz s ILE 15 Ca 0.58 -2.06 -0.19 0.00 -1.10 0.00 0.00 60.65 57.89 1auz s ILE 15 Cb -0.30 -2.44 0.09 0.00 -1.06 0.00 0.00 42.46 38.75 1auz s ILE 15 CO 0.30 -0.51 0.65 -0.13 -0.10 0.00 0.00 174.94 175.16 1auz s ARG 16 N 1.06 3.06 -0.16 2.79 0.52 -0.61 -2.63 118.95 122.98 1auz s ARG 16 Ca 0.07 -1.21 -0.14 0.00 -0.52 0.00 0.00 55.73 53.94 1auz s ARG 16 Cb -0.19 -4.21 -0.05 0.00 0.52 0.00 0.00 34.95 31.02 1auz s ARG 16 CO -0.10 -1.41 0.29 -0.51 0.02 0.00 0.00 175.30 173.59 1auz s LEU 17 N 2.56 4.25 -0.18 2.53 1.43 -1.19 0.19 118.68 128.26 1auz s LEU 17 Ca 0.12 0.51 -0.00 0.00 -1.03 0.00 0.00 54.13 53.72 1auz s LEU 17 Cb -0.23 -2.36 0.05 0.00 0.03 0.00 0.00 46.19 43.67 1auz s LEU 17 CO 0.08 0.11 -0.05 0.42 0.23 0.00 0.00 176.35 177.14 1auz s THR 18 N 0.40 1.17 0.00 5.49 -4.23 -1.26 -3.43 115.64 113.78 1auz s THR 18 Ca 0.16 -0.76 0.00 0.00 -1.18 0.00 0.00 61.69 59.92 1auz s THR 18 Cb -0.13 -1.39 0.00 0.00 1.34 0.00 0.00 72.50 72.33 1auz s THR 18 CO 0.04 0.06 0.00 0.61 -0.54 0.00 0.00 174.62 174.79 1auz n GLY 19 N 4.84 -0.47 3.40 3.99 0.00 -1.06 0.71 105.19 116.60 1auz n GLY 19 Ca -0.12 0.10 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 1auz n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1auz s GLU 20 N 0.00 1.49 -0.68 1.61 8.01 -1.23 -4.06 118.70 123.84 1auz s GLU 20 Ca 0.00 -1.68 0.05 0.00 0.01 0.00 0.00 54.97 53.35 1auz s GLU 20 Cb 0.00 -1.40 0.17 0.00 -4.31 0.00 0.00 34.13 28.59 1auz s GLU 20 CO 0.00 0.24 0.48 -0.51 0.01 0.00 0.00 175.26 175.48 1auz s LEU 21 N -3.41 4.57 0.31 1.80 2.01 -1.26 -4.53 118.68 118.18 1auz s LEU 21 Ca 0.26 -3.80 0.06 0.00 0.01 0.00 0.00 54.13 50.66 1auz s LEU 21 Cb -0.02 -1.55 -0.03 0.00 0.01 0.00 0.00 46.19 44.60 1auz s LEU 21 CO 0.11 -0.09 0.25 1.51 1.01 0.00 0.00 176.35 179.14 1auz s ASP 22 N -1.34 1.44 0.55 2.29 1.47 -1.26 0.31 116.67 120.14 1auz s ASP 22 Ca 0.25 -1.70 0.36 0.00 1.18 0.00 0.00 52.55 52.65 1auz s ASP 22 Cb -0.04 0.53 1.52 0.00 -0.34 0.00 0.00 42.92 44.59 1auz s ASP 22 CO -0.17 -1.03 1.76 1.12 0.68 0.00 0.00 175.17 177.54 1auz h HIS 23 N 2.21 0.00 0.19 2.11 2.07 -1.91 5.48 115.15 125.30 1auz h HIS 23 Ca -0.27 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.24 1auz h HIS 23 Cb 1.23 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.22 1auz h HIS 23 CO 1.50 0.00 -0.09 0.45 -3.07 0.00 0.00 177.93 176.72 1auz h HIS 24 N 0.00 -0.23 0.00 6.12 3.86 -1.95 -2.65 115.15 120.29 1auz h HIS 24 Ca 0.55 -0.01 -0.17 0.00 -1.16 0.00 0.00 60.37 59.59 1auz h HIS 24 Cb 2.32 0.08 -0.02 0.00 1.06 0.00 0.00 27.41 30.85 1auz h HIS 24 CO 0.00 0.18 -0.80 1.79 0.86 0.00 0.00 177.93 179.96 1auz h THR 25 N -0.80 1.46 0.00 2.45 1.35 -0.58 -2.98 112.91 113.81 1auz h THR 25 Ca -0.03 -2.86 0.00 0.00 -0.55 0.00 0.00 66.41 62.98 1auz h THR 25 Cb 0.52 2.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.53 1auz h THR 25 CO 0.04 0.79 0.00 0.00 -0.25 0.00 0.00 175.52 176.10 1auz h ALA 26 N 1.20 1.00 -0.06 6.62 0.00 1.08 -2.45 119.26 126.65 1auz h ALA 26 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1auz h ALA 26 Cb 1.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1auz h ALA 26 CO 0.10 0.00 -0.23 0.93 0.00 0.00 0.00 179.25 180.05 1auz h GLU 27 N 0.00 0.27 -0.74 0.00 3.07 -1.30 -2.59 114.58 113.29 1auz h GLU 27 Ca 0.00 -0.21 0.16 0.00 -0.50 0.00 0.00 59.36 58.81 1auz h GLU 27 Cb 0.25 0.04 -0.13 0.00 -0.84 0.00 0.00 28.75 28.07 1auz h GLU 27 CO 0.00 0.84 -0.06 1.15 -1.40 0.00 0.00 179.01 179.54 1auz h THR 28 N -0.24 0.32 0.00 1.13 2.02 -1.56 1.24 112.91 115.82 1auz h THR 28 Ca -0.01 -0.02 -0.07 0.00 0.77 0.00 0.00 66.41 67.08 1auz h THR 28 Cb 0.87 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 1auz h THR 28 CO 0.05 0.01 -0.34 0.25 0.37 0.00 0.00 175.52 175.86 1auz h LEU 29 N 0.06 0.00 -0.90 2.58 7.12 -1.63 -2.74 115.31 119.80 1auz h LEU 29 Ca 0.39 0.00 0.21 0.00 0.13 0.00 0.00 57.88 58.61 1auz h LEU 29 Cb 0.65 0.00 -0.12 0.00 -0.53 0.00 0.00 40.66 40.66 1auz h LEU 29 CO -0.69 0.34 0.41 0.50 -0.13 0.00 0.00 178.44 178.88 1auz h LYS 30 N 0.00 0.43 -0.01 1.25 3.64 0.20 0.70 116.57 122.78 1auz h LYS 30 Ca -0.00 -0.03 -0.18 0.00 -1.27 0.00 0.00 60.65 59.18 1auz h LYS 30 Cb 0.68 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 1auz h LYS 30 CO 0.04 0.28 -0.80 -0.56 -2.27 0.00 0.00 179.45 176.15 1auz h GLN 31 N 0.44 0.11 0.00 1.90 3.07 -1.22 -2.77 115.11 116.65 1auz h GLN 31 Ca 0.56 -0.11 0.00 0.00 0.09 0.00 0.00 58.65 59.18 1auz h GLN 31 Cb 1.03 0.03 0.00 0.00 0.08 0.00 0.00 27.48 28.62 1auz h GLN 31 CO -0.51 0.85 0.00 1.17 0.09 0.00 0.00 178.83 180.43 1auz n LYS 32 N -3.67 0.10 0.02 0.06 0.00 0.23 -2.43 118.16 112.46 1auz n LYS 32 Ca -0.02 0.43 -0.09 0.00 0.00 0.00 0.00 58.31 58.63 1auz n LYS 32 Cb 0.76 -1.73 -0.07 0.00 0.00 0.00 0.00 35.03 33.99 1auz n LYS 32 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1auz h VAL 33 N 0.00 0.81 -0.96 3.15 2.07 -0.75 -2.68 116.25 117.89 1auz h VAL 33 Ca 0.00 -1.30 0.17 0.00 0.82 0.00 0.00 66.70 66.39 1auz h VAL 33 Cb 0.20 1.43 -0.09 0.00 -1.52 0.00 0.00 31.29 31.32 1auz h VAL 33 CO 0.00 0.24 0.61 0.00 0.02 0.00 0.00 177.57 178.43 1auz h THR 34 N -0.93 0.77 -0.32 2.57 1.03 -1.57 1.46 112.91 115.92 1auz h THR 34 Ca -0.02 -0.25 -0.02 0.00 -0.01 0.00 0.00 66.41 66.12 1auz h THR 34 Cb 0.50 -0.01 -0.01 0.00 -1.07 0.00 0.00 68.15 67.56 1auz h THR 34 CO 0.03 0.13 0.14 1.56 -0.01 0.00 0.00 175.52 177.36 1auz h GLN 35 N 0.72 0.47 0.00 0.00 4.20 -1.57 -2.44 115.11 116.48 1auz h GLN 35 Ca 0.51 -0.08 -0.07 0.00 0.06 0.00 0.00 58.65 59.08 1auz h GLN 35 Cb 0.84 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 1auz h GLN 35 CO -0.28 0.46 -0.32 1.03 -0.67 0.00 0.00 178.83 179.05 1auz h SER 36 N 0.37 0.00 -1.00 1.46 0.87 -0.62 -1.62 113.55 113.01 1auz h SER 36 Ca 0.11 0.00 0.19 0.00 -1.23 0.00 0.00 61.79 60.85 1auz h SER 36 Cb 0.16 0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 62.01 1auz h SER 36 CO -0.01 0.32 0.61 -0.07 -0.53 0.00 0.00 176.83 177.15 1auz h LEU 37 N 0.00 0.76 -5.00 2.23 4.07 0.24 -3.34 115.31 114.27 1auz h LEU 37 Ca -0.00 0.09 -0.18 0.00 0.08 0.00 0.00 57.88 57.86 1auz h LEU 37 Cb 1.07 -0.05 -0.14 0.00 1.08 0.00 0.00 40.66 42.62 1auz h LEU 37 CO 0.04 0.29 -0.44 -0.62 -1.08 0.00 0.00 178.44 176.63 1auz n GLU 38 N -4.72 0.64 -0.04 1.13 1.02 -1.18 -4.80 120.64 112.68 1auz n GLU 38 Ca 0.23 -1.69 -0.14 0.00 -0.02 0.00 0.00 57.16 55.54 1auz n GLU 38 Cb 0.57 -1.31 -0.09 0.00 -0.02 0.00 0.00 31.44 30.59 1auz n GLU 38 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1auz h LYS 39 N 4.19 0.24 0.00 3.49 3.64 -1.42 -3.48 116.57 123.23 1auz h LYS 39 Ca -0.10 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1auz h LYS 39 Cb 1.07 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1auz h LYS 39 CO 0.19 0.74 0.00 -0.25 -2.27 0.00 0.00 179.45 177.86 1auz n ASP 40 N -4.60 0.00 0.00 4.20 10.43 -1.26 -5.10 116.55 120.23 1auz n ASP 40 Ca -0.08 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.28 1auz n ASP 40 Cb 0.38 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.34 1auz n ASP 40 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 1auz n ASP 41 N 0.00 0.00 -3.24 -2.24 4.64 -1.26 -5.03 116.55 109.42 1auz n ASP 41 Ca 0.00 0.00 -0.15 0.00 -1.38 0.00 0.00 54.79 53.26 1auz n ASP 41 Cb 0.00 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.02 1auz n ASP 41 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1auz s ILE 42 N 0.00 -0.38 0.00 5.18 -1.09 -1.26 -4.97 121.20 118.68 1auz s ILE 42 Ca 0.00 -1.24 0.00 0.00 -2.23 0.00 0.00 60.65 57.18 1auz s ILE 42 Cb 0.00 -0.59 0.00 0.00 -1.58 0.00 0.00 42.46 40.29 1auz s ILE 42 CO 0.00 -0.55 0.00 0.54 -1.23 0.00 0.00 174.94 173.70 1auz n ARG 43 N 3.72 0.71 -4.22 2.79 3.00 -1.26 -4.96 116.66 116.45 1auz n ARG 43 Ca 0.16 0.00 -0.13 0.00 -0.01 0.00 0.00 57.85 57.87 1auz n ARG 43 Cb 0.49 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.85 1auz n ARG 43 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1auz s HIS 44 N -0.20 1.14 0.28 -1.55 3.76 1.29 -4.64 115.29 115.37 1auz s HIS 44 Ca 0.00 -0.78 0.08 0.00 -0.15 0.00 0.00 55.06 54.21 1auz s HIS 44 Cb 0.00 -0.60 -0.04 0.00 1.11 0.00 0.00 32.58 33.05 1auz s HIS 44 CO 0.00 0.01 0.10 0.96 -0.85 0.00 0.00 174.74 174.96 1auz s ILE 45 N -3.28 3.60 -0.46 0.60 -5.25 -1.25 0.40 121.20 115.56 1auz s ILE 45 Ca 0.14 -1.70 0.07 0.00 -0.99 0.00 0.00 60.65 58.17 1auz s ILE 45 Cb 0.02 -3.04 0.18 0.00 2.95 0.00 0.00 42.46 42.58 1auz s ILE 45 CO -0.01 -0.31 0.64 -0.69 -1.79 0.00 0.00 174.94 172.78 1auz s VAL 46 N -2.30 -0.88 0.43 8.37 1.01 -0.68 -4.14 120.40 122.21 1auz s VAL 46 Ca 0.34 -0.69 -0.17 0.00 0.00 0.00 0.00 61.98 61.45 1auz s VAL 46 Cb -0.06 -0.11 -0.09 0.00 0.00 0.00 0.00 36.38 36.11 1auz s VAL 46 CO 0.22 -0.11 0.90 -0.76 0.00 0.00 0.00 175.10 175.35 1auz s LEU 47 N 1.25 3.87 -0.30 3.92 2.01 -1.14 0.67 118.68 128.97 1auz s LEU 47 Ca 0.24 1.51 -0.16 0.00 0.01 0.00 0.00 54.13 55.73 1auz s LEU 47 Cb -0.03 -4.38 0.17 0.00 0.01 0.00 0.00 46.19 41.97 1auz s LEU 47 CO -0.06 -0.39 1.16 0.54 1.01 0.00 0.00 176.35 178.60 1auz s ASN 48 N -2.53 -0.22 -0.21 2.29 2.20 -1.08 -3.24 114.94 112.14 1auz s ASN 48 Ca 0.58 0.11 -0.08 0.00 -0.94 0.00 0.00 52.86 52.54 1auz s ASN 48 Cb -0.10 1.17 -0.04 0.00 -2.00 0.00 0.00 41.25 40.29 1auz s ASN 48 CO 0.21 -0.04 0.08 -1.48 -2.94 0.00 0.00 177.10 172.92 1auz s LEU 49 N 2.98 3.71 -0.07 3.54 2.34 -1.25 -3.17 118.68 126.77 1auz s LEU 49 Ca -0.00 -0.02 0.18 0.00 0.06 0.00 0.00 54.13 54.35 1auz s LEU 49 Cb -0.08 -1.97 -0.27 0.00 -0.56 0.00 0.00 46.19 43.31 1auz s LEU 49 CO -0.11 0.08 0.31 1.21 -1.06 0.00 0.00 176.35 176.78 1auz n GLU 50 N 4.16 0.73 -2.97 1.48 0.00 -1.22 -4.58 120.64 118.24 1auz n GLU 50 Ca -0.16 -0.13 -0.39 0.00 0.00 0.00 0.00 57.16 56.49 1auz n GLU 50 Cb 0.52 -1.45 -0.01 0.00 0.00 0.00 0.00 31.44 30.50 1auz n GLU 50 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1auz n ASP 51 N -2.30 6.10 -4.67 4.31 -0.08 -1.26 -5.00 116.55 113.64 1auz n ASP 51 Ca -0.11 -3.51 -0.39 0.00 -1.51 0.00 0.00 54.79 49.27 1auz n ASP 51 Cb 0.66 -1.10 -0.06 0.00 2.34 0.00 0.00 41.12 42.96 1auz n ASP 51 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 1auz s LEU 52 N -3.19 4.17 0.00 -2.67 1.98 -1.26 -2.57 118.68 115.14 1auz s LEU 52 Ca 0.36 0.72 0.00 0.00 -2.89 0.00 0.00 54.13 52.31 1auz s LEU 52 Cb 0.12 -2.73 0.00 0.00 0.66 0.00 0.00 46.19 44.24 1auz s LEU 52 CO 0.01 -0.16 0.00 -0.24 -1.89 0.00 0.00 176.35 174.07 1auz n SER 53 N 4.62 0.00 0.43 3.68 2.88 -1.26 -4.99 113.62 118.98 1auz n SER 53 Ca -0.05 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.32 1auz n SER 53 Cb 0.51 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.88 1auz n SER 53 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1auz h PHE 54 N 0.00 -1.02 -5.70 0.66 3.57 -1.91 -3.48 116.94 109.05 1auz h PHE 54 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1auz h PHE 54 Cb 0.00 0.34 0.00 0.00 2.79 0.00 0.00 35.95 39.08 1auz h PHE 54 CO 0.00 -0.64 -0.59 -0.12 -2.23 0.00 0.00 178.31 174.73 1auz n MET 55 N -5.27 -0.55 -3.69 1.11 0.00 -1.22 -4.86 117.12 102.64 1auz n MET 55 Ca -0.14 0.83 -0.22 0.00 -0.00 0.00 0.00 57.70 58.17 1auz n MET 55 Cb 0.44 -0.82 -0.03 0.00 0.00 0.00 0.00 33.22 32.80 1auz n MET 55 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1auz s ASP 56 N -0.59 4.89 0.00 6.12 -1.08 0.93 -4.91 116.67 122.03 1auz s ASP 56 Ca 0.00 -0.86 0.15 0.00 -0.52 0.00 0.00 52.55 51.32 1auz s ASP 56 Cb 0.00 -0.44 0.78 0.00 -1.46 0.00 0.00 42.92 41.81 1auz s ASP 56 CO 0.00 -0.69 1.38 -1.54 0.52 0.00 0.00 175.17 174.84 1auz n SER 57 N -1.52 0.00 -0.30 -0.34 3.41 -1.26 -2.88 113.62 110.73 1auz n SER 57 Ca 0.02 -0.07 0.09 0.00 -0.26 0.00 0.00 58.87 58.65 1auz n SER 57 Cb 0.63 -0.21 0.31 0.00 -0.26 0.00 0.00 64.21 64.67 1auz n SER 57 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1auz h SER 58 N 0.00 0.78 0.31 4.04 0.02 -1.92 0.72 113.55 117.51 1auz h SER 58 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1auz h SER 58 Cb 0.10 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.52 1auz h SER 58 CO 0.00 0.43 -0.75 0.61 -1.14 0.00 0.00 176.83 175.98 1auz n GLY 59 N -1.40 -1.15 0.26 -3.77 0.00 -1.14 -4.11 105.19 93.88 1auz n GLY 59 Ca 0.17 -0.45 0.04 0.00 0.00 0.00 0.00 46.02 45.78 1auz n GLY 59 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1auz h LEU 60 N 0.00 0.17 0.04 0.99 7.12 -0.96 0.57 115.31 123.24 1auz h LEU 60 Ca 0.00 0.11 -0.25 0.00 0.13 0.00 0.00 57.88 57.87 1auz h LEU 60 Cb 0.53 0.12 -0.00 0.00 -0.53 0.00 0.00 40.66 40.77 1auz h LEU 60 CO 0.00 0.06 -1.14 1.23 -0.13 0.00 0.00 178.44 178.46 1auz h GLY 61 N 0.37 0.27 2.00 3.75 0.00 -1.72 -0.74 103.07 107.00 1auz h GLY 61 Ca 0.39 -0.65 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 1auz h GLY 61 CO -0.41 0.57 -0.08 -0.24 0.00 0.00 0.00 176.54 176.37 1auz h VAL 62 N 0.08 0.43 0.07 4.60 3.04 -1.25 0.81 116.25 124.02 1auz h VAL 62 Ca -0.10 -0.42 -0.36 0.00 -1.01 0.00 0.00 66.70 64.81 1auz h VAL 62 Cb 1.86 1.29 -0.04 0.00 -2.01 0.00 0.00 31.29 32.39 1auz h VAL 62 CO 0.18 0.08 -2.13 -0.38 -1.01 0.00 0.00 177.57 174.31 1auz n ILE 63 N -3.52 1.65 -0.01 3.17 5.41 0.18 -3.69 119.36 122.55 1auz n ILE 63 Ca -0.02 -0.66 -0.13 0.00 1.00 0.00 0.00 62.75 62.95 1auz n ILE 63 Cb 0.21 -1.48 -0.09 0.00 -0.71 0.00 0.00 39.64 37.57 1auz n ILE 63 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 1auz h LEU 64 N 0.04 0.07 -2.34 1.39 5.85 -0.64 -1.60 115.31 118.07 1auz h LEU 64 Ca -0.46 -0.36 0.03 0.00 0.84 0.00 0.00 57.88 57.93 1auz h LEU 64 Cb 2.01 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 43.02 1auz h LEU 64 CO 0.03 0.41 0.14 1.23 -0.34 0.00 0.00 178.44 179.91 1auz h GLY 65 N -0.28 0.00 1.77 3.75 0.00 0.44 0.14 103.07 108.88 1auz h GLY 65 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.11 1auz h GLY 65 CO 0.00 0.00 -1.16 3.21 0.00 0.00 0.00 176.54 178.59 1auz h ARG 66 N 0.00 0.02 -0.65 4.80 2.47 -1.55 -2.91 114.38 116.57 1auz h ARG 66 Ca 0.05 -0.04 -0.02 0.00 -1.26 0.00 0.00 59.98 58.71 1auz h ARG 66 Cb 0.33 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.64 1auz h ARG 66 CO -0.00 0.93 0.32 -0.92 0.56 0.00 0.00 179.97 180.86 1auz h TYR 67 N 0.01 0.92 -0.02 3.04 5.03 0.26 2.04 116.97 128.25 1auz h TYR 67 Ca -0.08 -0.04 -0.15 0.00 2.58 0.00 0.00 58.73 61.04 1auz h TYR 67 Cb 1.83 -0.29 -0.02 0.00 1.55 0.00 0.00 36.73 39.81 1auz h TYR 67 CO 0.01 0.68 -0.70 0.87 -1.32 0.00 0.00 178.16 177.70 1auz h LYS 68 N 0.89 0.09 0.01 1.82 6.56 -1.57 -2.01 116.57 122.36 1auz h LYS 68 Ca 0.22 -0.08 -0.00 0.00 -1.06 0.00 0.00 60.65 59.73 1auz h LYS 68 Cb 0.10 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.78 1auz h LYS 68 CO -0.03 0.75 -0.00 1.96 -2.06 0.00 0.00 179.45 180.07 1auz h GLN 69 N 0.06 -0.01 -0.75 3.15 1.08 -1.20 -1.78 115.11 115.67 1auz h GLN 69 Ca -0.01 0.00 0.11 0.00 -1.45 0.00 0.00 58.65 57.29 1auz h GLN 69 Cb 1.24 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.62 1auz h GLN 69 CO 0.10 0.80 0.49 0.97 -0.95 0.00 0.00 178.83 180.24 1auz h ILE 70 N -0.87 0.91 0.00 2.54 6.09 0.32 0.40 117.51 126.90 1auz h ILE 70 Ca -0.00 -0.21 -0.13 0.00 -1.37 0.00 0.00 64.86 63.15 1auz h ILE 70 Cb 0.82 0.24 -0.02 0.00 0.47 0.00 0.00 36.82 38.33 1auz h ILE 70 CO 0.00 0.11 -0.61 0.11 -3.07 0.00 0.00 178.15 174.69 1auz h LYS 71 N 0.61 0.00 0.00 2.19 1.57 -1.40 -2.69 116.57 116.85 1auz h LYS 71 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1auz h LYS 71 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1auz h LYS 71 CO -0.13 0.61 0.00 0.00 -0.57 0.00 0.00 179.45 179.37 1auz n GLN 72 N -3.54 0.10 0.08 3.15 10.64 0.13 -2.24 117.38 125.71 1auz n GLN 72 Ca -0.00 0.27 -0.12 0.00 -1.83 0.00 0.00 57.00 55.33 1auz n GLN 72 Cb 0.67 -1.67 -0.13 0.00 -0.86 0.00 0.00 30.24 28.26 1auz n GLN 72 CO 0.00 0.00 0.00 0.82 -1.83 0.00 0.00 177.06 176.05 1auz h ILE 73 N 0.00 1.60 0.00 -0.39 1.08 -0.97 -3.48 117.51 115.36 1auz h ILE 73 Ca 0.00 -3.22 0.00 0.00 -0.39 0.00 0.00 64.86 61.25 1auz h ILE 73 Cb 0.38 2.89 0.00 0.00 -3.07 0.00 0.00 36.82 37.02 1auz h ILE 73 CO 0.00 0.93 0.00 0.61 -0.69 0.00 0.00 178.15 179.00 1auz n GLY 74 N 1.43 1.81 0.00 5.37 0.00 -0.95 -4.92 105.19 107.94 1auz n GLY 74 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1auz n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1auz n GLY 75 N -0.40 3.85 3.38 -0.02 0.00 -1.24 -4.99 105.19 105.77 1auz n GLY 75 Ca 0.00 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 1auz n GLY 75 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1auz s GLU 76 N 4.34 1.11 -0.08 1.61 0.41 -1.26 -4.67 118.70 120.15 1auz s GLU 76 Ca 0.00 -0.43 0.04 0.00 -0.41 0.00 0.00 54.97 54.17 1auz s GLU 76 Cb 0.00 0.50 0.00 0.00 -1.78 0.00 0.00 34.13 32.85 1auz s GLU 76 CO 0.00 -0.43 -0.21 1.41 -0.49 0.00 0.00 175.26 175.54 1auz s MET 77 N -3.17 2.58 0.11 1.61 -2.45 -1.26 -3.88 119.30 112.85 1auz s MET 77 Ca -0.01 -0.76 0.08 0.00 -1.25 0.00 0.00 55.69 53.74 1auz s MET 77 Cb 0.00 -2.02 -0.04 0.00 1.25 0.00 0.00 34.83 34.02 1auz s MET 77 CO -0.08 0.18 -0.19 0.08 1.05 0.00 0.00 175.02 176.07 1auz s VAL 78 N 0.31 1.64 -0.15 10.11 1.01 -1.26 -4.88 120.40 127.18 1auz s VAL 78 Ca -0.15 -1.61 -0.09 0.00 0.00 0.00 0.00 61.98 60.13 1auz s VAL 78 Cb -0.16 -1.56 0.05 0.00 0.00 0.00 0.00 36.38 34.71 1auz s VAL 78 CO 0.07 -0.16 0.37 0.54 0.00 0.00 0.00 175.10 175.91 1auz s VAL 79 N -1.44 -0.02 0.00 2.92 0.11 -1.26 -2.87 120.40 117.84 1auz s VAL 79 Ca 0.08 0.08 0.00 0.00 -2.93 0.00 0.00 61.98 59.21 1auz s VAL 79 Cb -0.09 -0.54 0.00 0.00 -1.53 0.00 0.00 36.38 34.22 1auz s VAL 79 CO 0.04 0.03 0.00 0.00 -3.33 0.00 0.00 175.10 171.85 1auz n ALA 81 N -3.00 -0.09 -1.00 0.00 0.00 -1.26 -3.79 120.51 111.37 1auz n ALA 81 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1auz n ALA 81 Cb 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1auz n ALA 81 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1auz n ILE 82 N -3.91 0.00 -3.57 0.00 0.13 -1.26 -4.62 119.36 106.13 1auz n ILE 82 Ca -0.04 0.00 0.03 0.00 -1.10 0.00 0.00 62.75 61.65 1auz n ILE 82 Cb 0.49 0.00 -0.00 0.00 -0.84 0.00 0.00 39.64 39.29 1auz n ILE 82 CO 0.00 0.00 0.00 -0.44 2.80 0.00 0.00 176.55 178.91 1auz s SER 83 N -1.63 -0.01 0.02 9.51 0.01 -1.26 -4.94 113.70 115.39 1auz s SER 83 Ca 0.00 -0.02 0.22 0.00 1.31 0.00 0.00 55.95 57.46 1auz s SER 83 Cb 0.00 0.03 0.93 0.00 0.21 0.00 0.00 66.02 67.19 1auz s SER 83 CO 0.00 -0.06 1.70 -0.81 0.41 0.00 0.00 173.24 174.49 1auz n PRO 84 N -0.48 0.02 -1.00 12.44 -0.04 -1.26 -1.01 135.00 143.67 1auz n PRO 84 Ca -0.09 0.14 0.03 0.00 -0.04 0.00 0.00 63.50 63.54 1auz n PRO 84 Cb 0.64 -1.53 0.14 0.00 -0.04 0.00 0.00 33.50 32.71 1auz n PRO 84 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1auz n ALA 85 N -1.53 3.36 0.00 0.55 0.00 -1.26 -4.62 120.51 117.02 1auz n ALA 85 Ca 0.05 -3.06 0.00 0.00 0.00 0.00 0.00 53.44 50.43 1auz n ALA 85 Cb 0.26 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.24 1auz n ALA 85 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1auz n VAL 86 N -0.63 0.00 0.80 0.00 0.31 -1.09 -4.80 118.33 112.92 1auz n VAL 86 Ca 0.17 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.60 1auz n VAL 86 Cb 0.84 0.00 0.48 0.00 -0.91 0.00 0.00 33.84 34.25 1auz n VAL 86 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 1auz n LYS 87 N -1.20 0.06 0.19 5.55 2.85 -0.18 -2.32 118.16 123.10 1auz n LYS 87 Ca 0.00 0.12 0.14 0.00 -1.05 0.00 0.00 58.31 57.52 1auz n LYS 87 Cb 0.00 -1.50 0.45 0.00 -0.65 0.00 0.00 35.03 33.33 1auz n LYS 87 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 177.40 177.42 1auz h ARG 88 N 0.00 0.00 -0.17 -1.58 -0.00 -1.82 -0.38 114.38 110.43 1auz h ARG 88 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 59.98 59.89 1auz h ARG 88 Cb 0.34 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 30.31 1auz h ARG 88 CO 0.00 0.00 -0.23 -0.07 -0.00 0.00 0.00 179.97 179.67 1auz h LEU 89 N 0.00 0.50 0.00 0.08 3.38 -1.82 -2.07 115.31 115.39 1auz h LEU 89 Ca 0.00 -0.51 -0.05 0.00 0.09 0.00 0.00 57.88 57.41 1auz h LEU 89 Cb 0.63 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1auz h LEU 89 CO 0.00 0.91 -0.68 -0.26 0.09 0.00 0.00 178.44 178.51 1auz h PHE 90 N 0.11 0.00 -0.15 1.13 -1.00 -1.71 -2.18 116.94 113.13 1auz h PHE 90 Ca 0.02 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.67 1auz h PHE 90 Cb 0.80 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.35 1auz h PHE 90 CO 0.09 0.19 -0.47 0.22 -1.61 0.00 0.00 178.31 176.72 1auz h ASP 91 N 0.00 0.42 0.64 2.17 3.58 -1.04 -2.27 116.42 119.92 1auz h ASP 91 Ca -0.03 -0.20 -0.19 0.00 0.42 0.00 0.00 57.03 57.03 1auz h ASP 91 Cb 1.17 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 42.06 1auz h ASP 91 CO 0.02 0.83 -1.49 0.80 -2.88 0.00 0.00 179.24 176.52 1auz n MET 92 N -3.98 0.62 0.11 0.28 1.56 -0.78 -3.93 117.12 111.00 1auz n MET 92 Ca -0.02 0.23 0.00 0.00 -0.27 0.00 0.00 57.70 57.64 1auz n MET 92 Cb 0.54 -1.80 0.30 0.00 2.15 0.00 0.00 33.22 34.42 1auz n MET 92 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 1auz h SER 93 N 0.00 0.23 -0.30 6.12 0.87 -1.29 -3.46 113.55 115.71 1auz h SER 93 Ca -0.19 -0.07 -0.13 0.00 -1.23 0.00 0.00 61.79 60.16 1auz h SER 93 Cb 1.68 -0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 63.52 1auz h SER 93 CO 0.05 0.52 -0.12 0.61 -0.53 0.00 0.00 176.83 177.36 1auz n GLY 94 N -0.50 0.86 0.00 5.77 0.00 -0.86 -4.84 105.19 105.61 1auz n GLY 94 Ca -0.01 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1auz n GLY 94 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1auz n LEU 95 N -0.72 1.62 -0.28 0.99 7.94 -1.24 -4.73 117.00 120.57 1auz n LEU 95 Ca -0.06 -1.62 0.26 0.00 -1.11 0.00 0.00 56.01 53.48 1auz n LEU 95 Cb 0.24 0.00 0.61 0.00 0.53 0.00 0.00 43.42 44.79 1auz n LEU 95 CO 0.10 0.40 1.25 0.15 -1.11 0.00 0.00 177.39 178.18 1auz h PHE 96 N 0.00 0.36 0.00 1.96 3.04 -1.87 1.50 116.94 121.92 1auz h PHE 96 Ca 0.00 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 1auz h PHE 96 Cb 0.54 -0.11 -0.00 0.00 2.56 0.00 0.00 35.95 38.94 1auz h PHE 96 CO 0.00 0.05 -0.04 0.87 -2.02 0.00 0.00 178.31 177.17 1auz h LYS 97 N 0.23 0.00 0.00 1.11 1.79 -1.89 1.84 116.57 119.65 1auz h LYS 97 Ca 0.54 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.01 1auz h LYS 97 Cb 1.68 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.33 1auz h LYS 97 CO -0.15 0.04 -0.16 1.51 -1.08 0.00 0.00 179.45 179.60 1auz n ILE 98 N -3.55 0.06 0.10 1.86 0.00 0.51 -3.34 119.36 115.01 1auz n ILE 98 Ca -0.02 -0.03 0.02 0.00 0.00 0.00 0.00 62.75 62.71 1auz n ILE 98 Cb 0.14 -0.29 -0.03 0.00 0.00 0.00 0.00 39.64 39.47 1auz n ILE 98 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 1auz n ILE 99 N -1.58 0.00 -2.39 9.51 2.08 0.15 -4.85 119.36 122.28 1auz n ILE 99 Ca 0.06 -0.27 -0.11 0.00 0.56 0.00 0.00 62.75 62.99 1auz n ILE 99 Cb 0.35 0.74 0.01 0.00 -0.75 0.00 0.00 39.64 39.99 1auz n ILE 99 CO 0.00 0.00 0.00 -1.14 0.56 0.00 0.00 176.55 175.97 1auz n ARG 100 N -1.33 -0.63 -3.38 0.38 0.63 0.58 -4.46 116.66 108.44 1auz n ARG 100 Ca 0.00 0.67 -0.21 0.00 -0.92 0.00 0.00 57.85 57.39 1auz n ARG 100 Cb 0.08 -0.91 0.00 0.00 0.45 0.00 0.00 32.46 32.09 1auz n ARG 100 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 1auz s PHE 101 N -0.76 2.21 0.00 -0.14 2.19 -1.26 -4.09 117.98 116.13 1auz s PHE 101 Ca 0.11 -0.60 0.00 0.00 0.33 0.00 0.00 56.93 56.77 1auz s PHE 101 Cb -0.01 -2.18 0.00 0.00 -1.31 0.00 0.00 43.02 39.52 1auz s PHE 101 CO 0.25 -0.50 0.00 -1.91 1.83 0.00 0.00 175.22 174.89 1auz n GLU 102 N -1.82 0.00 -3.26 10.12 0.00 -1.22 -5.04 120.64 119.43 1auz n GLU 102 Ca 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 57.16 57.17 1auz n GLU 102 Cb 0.62 0.00 -0.04 0.00 0.00 0.00 0.00 31.44 32.02 1auz n GLU 102 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.13 176.48 1auz s GLN 103 N 3.08 0.62 0.00 5.31 -0.21 -1.26 -4.40 119.66 122.79 1auz s GLN 103 Ca 0.00 -0.15 0.00 0.00 0.02 0.00 0.00 55.36 55.23 1auz s GLN 103 Cb 0.00 -0.18 0.00 0.00 1.00 0.00 0.00 33.01 33.83 1auz s GLN 103 CO 0.00 -1.12 0.00 0.45 -2.12 0.00 0.00 175.29 172.50 1auz n SER 104 N 4.82 0.00 -0.46 5.90 2.88 -1.26 -3.65 113.62 121.85 1auz n SER 104 Ca 0.07 0.00 0.36 0.00 -1.33 0.00 0.00 58.87 57.97 1auz n SER 104 Cb 0.52 0.00 0.57 0.00 -0.75 0.00 0.00 64.21 64.55 1auz n SER 104 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1auz n GLU 105 N 0.00 -0.01 0.00 -1.46 2.13 -1.26 0.59 120.64 120.63 1auz n GLU 105 Ca 0.00 0.85 0.03 0.00 0.66 0.00 0.00 57.16 58.70 1auz n GLU 105 Cb 0.00 -1.85 0.15 0.00 0.27 0.00 0.00 31.44 30.02 1auz n GLU 105 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1auz n GLN 106 N -3.71 0.01 -0.46 5.31 7.27 -1.24 -3.35 117.38 121.22 1auz n GLN 106 Ca 0.32 0.36 0.35 0.00 0.07 0.00 0.00 57.00 58.10 1auz n GLN 106 Cb 1.37 -1.50 0.55 0.00 2.41 0.00 0.00 30.24 33.07 1auz n GLN 106 CO 0.00 0.00 0.00 0.94 0.07 0.00 0.00 177.06 178.07 1auz n GLN 107 N -1.47 -0.00 -0.08 3.69 -0.06 2.45 0.35 117.38 122.26 1auz n GLN 107 Ca 0.02 0.77 -0.12 0.00 -2.00 0.00 0.00 57.00 55.67 1auz n GLN 107 Cb 0.08 -1.71 -0.08 0.00 -4.06 0.00 0.00 30.24 24.47 1auz n GLN 107 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1auz h ALA 108 N 0.76 0.08 0.00 1.69 0.00 -1.78 -3.32 119.26 116.69 1auz h ALA 108 Ca 0.64 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1auz h ALA 108 Cb 2.48 0.31 0.00 0.00 0.00 0.00 0.00 17.79 20.57 1auz h ALA 108 CO -0.07 0.30 0.00 1.25 0.00 0.00 0.00 179.25 180.73 1auz h LEU 109 N -1.00 0.00 -0.80 0.00 6.46 0.26 -2.23 115.31 118.00 1auz h LEU 109 Ca -0.10 0.00 0.09 0.00 -0.12 0.00 0.00 57.88 57.75 1auz h LEU 109 Cb 0.78 0.00 -0.07 0.00 -0.73 0.00 0.00 40.66 40.64 1auz h LEU 109 CO -0.06 0.00 0.45 0.25 -0.62 0.00 0.00 178.44 178.46 1auz h LEU 110 N 0.00 0.65 0.00 2.25 6.46 0.60 0.46 115.31 125.74 1auz h LEU 110 Ca 0.00 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 1auz h LEU 110 Cb 0.23 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.08 1auz h LEU 110 CO 0.00 0.38 0.05 0.41 -0.62 0.00 0.00 178.44 178.65 1auz n THR 111 N -4.75 0.76 -0.26 1.05 -1.04 -0.84 -4.28 114.28 104.92 1auz n THR 111 Ca 0.13 0.24 0.00 0.00 -2.04 0.00 0.00 64.05 62.37 1auz n THR 111 Cb 0.26 -1.24 0.00 0.00 -1.82 0.00 0.00 70.33 67.54 1auz n THR 111 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1auz n LEU 112 N -1.14 -0.10 -1.85 -4.42 0.00 0.15 -4.22 117.00 105.42 1auz n LEU 112 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 56.01 55.99 1auz n LEU 112 Cb 0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 43.42 43.38 1auz n LEU 112 CO 0.00 0.00 -0.02 0.61 0.00 0.00 0.00 177.39 177.98 1auz n GLY 113 N -1.42 -0.21 2.48 -3.96 0.00 -0.25 -4.74 105.19 97.10 1auz n GLY 113 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1auz n GLY 113 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1auz n VAL 114 N -1.94 -0.57 0.00 1.61 0.31 -1.26 -5.03 118.33 111.45 1auz n VAL 114 Ca -0.02 -2.69 0.00 0.00 -0.01 0.00 0.00 64.34 61.63 1auz n VAL 114 Cb 0.31 -0.54 0.00 0.00 -0.91 0.00 0.00 33.84 32.70 1auz n VAL 114 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1auz n ALA 115 N 2.21 0.00 -0.69 3.52 0.00 -1.26 -4.98 120.51 119.31 1auz n ALA 115 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1auz n ALA 115 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1auz n ALA 115 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95