#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1auz n LEU 2 N 0.00 -0.55 0.00 -3.43 0.00 -1.25 -4.72 117.00 107.05 1auz n LEU 2 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 56.01 56.71 1auz n LEU 2 Cb 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 43.42 42.84 1auz n LEU 2 CO 0.00 -1.64 0.00 0.61 0.00 0.00 0.00 177.39 176.36 1auz n GLY 3 N 1.14 5.30 0.00 -3.96 0.00 2.38 -4.89 105.19 105.16 1auz n GLY 3 Ca 0.11 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1auz n GLY 3 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1auz n ILE 4 N 0.00 0.00 -3.75 -0.61 0.00 -1.25 -4.15 119.36 109.61 1auz n ILE 4 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 62.75 62.62 1auz n ILE 4 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 39.64 39.54 1auz n ILE 4 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1auz s ASP 5 N 0.00 -0.33 -0.02 9.51 -1.08 0.88 -4.88 116.67 120.75 1auz s ASP 5 Ca 0.00 0.55 0.02 0.00 -0.52 0.00 0.00 52.55 52.60 1auz s ASP 5 Cb 0.00 0.61 0.00 0.00 -1.46 0.00 0.00 42.92 42.08 1auz s ASP 5 CO 0.00 -0.22 -0.07 -0.04 0.52 0.00 0.00 175.17 175.36 1auz s MET 6 N -0.26 0.70 0.14 4.34 -1.94 -1.25 0.11 119.30 121.14 1auz s MET 6 Ca -0.04 -0.23 -0.03 0.00 -1.71 0.00 0.00 55.69 53.68 1auz s MET 6 Cb -0.03 -0.68 -0.03 0.00 2.01 0.00 0.00 34.83 36.10 1auz s MET 6 CO 0.02 0.09 0.12 -0.80 -0.01 0.00 0.00 175.02 174.43 1auz s ASN 7 N 0.15 0.24 0.06 3.03 -0.87 0.28 -4.91 114.94 112.91 1auz s ASN 7 Ca -0.02 -1.10 0.04 0.00 -1.57 0.00 0.00 52.86 50.21 1auz s ASN 7 Cb -0.07 0.33 -0.03 0.00 -0.02 0.00 0.00 41.25 41.47 1auz s ASN 7 CO -0.00 -0.77 -0.12 -0.69 -2.57 0.00 0.00 177.10 172.96 1auz s VAL 8 N -4.02 0.88 -0.29 1.60 1.01 -1.24 0.22 120.40 118.56 1auz s VAL 8 Ca 0.21 -1.16 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1auz s VAL 8 Cb 0.06 -0.87 0.18 0.00 0.00 0.00 0.00 36.38 35.75 1auz s VAL 8 CO 0.01 -0.25 0.54 -0.54 0.00 0.00 0.00 175.10 174.85 1auz s LYS 9 N -1.58 0.52 0.00 2.72 3.01 0.88 -4.89 119.74 120.39 1auz s LYS 9 Ca -0.05 0.78 0.00 0.00 -1.01 0.00 0.00 55.97 55.69 1auz s LYS 9 Cb -0.10 0.25 0.00 0.00 -1.01 0.00 0.00 37.83 36.97 1auz s LYS 9 CO 0.01 -0.73 0.00 -1.91 0.51 0.00 0.00 175.35 173.23 1auz n GLU 10 N 5.41 0.00 0.00 1.68 2.13 -1.26 0.18 120.64 128.78 1auz n GLU 10 Ca -0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1auz n GLU 10 Cb 0.51 -1.74 0.00 0.00 0.27 0.00 0.00 31.44 30.49 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 0.20 0.00 -4.66 4.31 3.41 -1.26 -5.00 113.62 110.62 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 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 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 5.01 -0.53 -3.33 0.11 0.13 0.47 120.40 122.26 1auz s VAL 12 Ca 0.00 1.22 -0.18 0.00 -2.93 0.00 0.00 61.98 60.10 1auz s VAL 12 Cb 0.00 -3.96 0.09 0.00 -1.53 0.00 0.00 36.38 30.98 1auz s VAL 12 CO 0.00 0.11 0.58 -1.48 -3.33 0.00 0.00 175.10 170.98 1auz s LEU 13 N 1.86 5.51 0.17 2.54 0.05 1.50 -0.09 118.68 130.22 1auz s LEU 13 Ca 0.30 -1.36 -0.30 0.00 0.05 0.00 0.00 54.13 52.82 1auz s LEU 13 Cb -0.16 -2.29 -0.08 0.00 -2.05 0.00 0.00 46.19 41.61 1auz s LEU 13 CO 0.11 -0.91 1.15 0.00 -0.55 0.00 0.00 176.35 176.15 1auz s ILE 15 N -0.04 1.81 -0.47 0.00 1.09 0.41 0.98 121.20 124.97 1auz s ILE 15 Ca 0.52 -2.33 -0.18 0.00 -1.10 0.00 0.00 60.65 57.56 1auz s ILE 15 Cb -0.31 -2.31 0.05 0.00 -1.06 0.00 0.00 42.46 38.83 1auz s ILE 15 CO 0.35 -0.72 0.51 -0.13 -0.10 0.00 0.00 174.94 174.86 1auz s ARG 16 N 0.75 3.08 -0.11 2.79 0.52 0.30 -2.78 118.95 123.50 1auz s ARG 16 Ca 0.13 -0.96 -0.01 0.00 -0.52 0.00 0.00 55.73 54.37 1auz s ARG 16 Cb -0.21 -4.06 -0.03 0.00 0.52 0.00 0.00 34.95 31.17 1auz s ARG 16 CO -0.09 -1.06 -0.07 -0.48 0.02 0.00 0.00 175.30 173.62 1auz s LEU 17 N 2.23 3.11 -0.21 2.53 -0.00 -1.21 0.30 118.68 125.44 1auz s LEU 17 Ca 0.11 -0.12 0.00 0.00 -0.00 0.00 0.00 54.13 54.13 1auz s LEU 17 Cb -0.20 -1.71 0.05 0.00 -0.00 0.00 0.00 46.19 44.33 1auz s LEU 17 CO 0.11 0.25 -0.07 0.42 -0.00 0.00 0.00 176.35 177.07 1auz s THR 18 N -0.15 1.44 0.00 5.48 -4.23 -1.26 -3.74 115.64 113.18 1auz s THR 18 Ca 0.02 -0.99 0.00 0.00 -1.18 0.00 0.00 61.69 59.53 1auz s THR 18 Cb -0.13 -1.63 0.00 0.00 1.34 0.00 0.00 72.50 72.08 1auz s THR 18 CO 0.03 0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.76 1auz n GLY 19 N 4.73 -0.50 3.46 3.99 0.00 -1.08 0.58 105.19 116.38 1auz n GLY 19 Ca -0.13 0.32 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 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 1.64 -0.72 1.61 8.01 -1.26 -4.16 118.70 123.82 1auz s GLU 20 Ca 0.00 -1.83 0.05 0.00 0.01 0.00 0.00 54.97 53.19 1auz s GLU 20 Cb 0.00 -1.33 0.17 0.00 -4.31 0.00 0.00 34.13 28.66 1auz s GLU 20 CO 0.00 0.07 0.52 -0.51 0.01 0.00 0.00 175.26 175.35 1auz s LEU 21 N -3.50 4.89 0.21 1.80 2.01 -1.26 -4.55 118.68 118.28 1auz s LEU 21 Ca 0.30 -3.86 -0.00 0.00 0.01 0.00 0.00 54.13 50.58 1auz s LEU 21 Cb 0.03 -1.66 -0.04 0.00 0.01 0.00 0.00 46.19 44.53 1auz s LEU 21 CO 0.13 -0.09 0.11 -1.81 1.01 0.00 0.00 176.35 175.71 1auz s ASP 22 N -1.40 0.44 0.66 2.29 -0.00 -1.26 -1.52 116.67 115.87 1auz s ASP 22 Ca 0.25 -1.37 0.22 0.00 -0.00 0.00 0.00 52.55 51.65 1auz s ASP 22 Cb -0.04 0.31 1.17 0.00 -0.00 0.00 0.00 42.92 44.36 1auz s ASP 22 CO -0.17 -0.80 1.66 1.12 -0.00 0.00 0.00 175.17 176.98 1auz h HIS 23 N 2.58 0.00 0.08 4.23 2.07 -1.95 4.02 115.15 126.19 1auz h HIS 23 Ca -0.36 0.00 -0.21 0.00 -2.85 0.00 0.00 60.37 56.94 1auz h HIS 23 Cb 1.24 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.22 1auz h HIS 23 CO 0.39 0.00 -1.07 0.45 -3.07 0.00 0.00 177.93 174.63 1auz h HIS 24 N 0.00 0.32 0.08 6.12 -0.00 -1.96 -3.01 115.15 116.70 1auz h HIS 24 Ca 0.04 -0.24 -0.25 0.00 -0.00 0.00 0.00 60.37 59.92 1auz h HIS 24 Cb 1.14 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 28.52 1auz h HIS 24 CO 0.00 1.42 -1.17 1.79 -0.00 0.00 0.00 177.93 179.97 1auz h THR 25 N -0.53 1.56 0.00 2.45 1.35 0.03 -3.15 112.91 114.63 1auz h THR 25 Ca -0.24 -3.19 -0.01 0.00 -0.55 0.00 0.00 66.41 62.42 1auz h THR 25 Cb 1.55 2.89 -0.00 0.00 -1.73 0.00 0.00 68.15 70.86 1auz h THR 25 CO 0.02 0.92 -0.04 0.00 -0.25 0.00 0.00 175.52 176.17 1auz h ALA 26 N 0.75 1.02 0.24 6.62 0.00 0.72 -3.04 119.26 125.57 1auz h ALA 26 Ca -0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1auz h ALA 26 Cb 1.90 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.68 1auz h ALA 26 CO 0.17 0.06 -0.12 1.49 0.00 0.00 0.00 179.25 180.85 1auz h GLU 27 N 0.00 -0.31 -0.76 0.00 4.57 -1.48 -1.44 114.58 115.17 1auz h GLU 27 Ca -0.00 0.02 0.16 0.00 -1.18 0.00 0.00 59.36 58.36 1auz h GLU 27 Cb 0.52 0.07 -0.14 0.00 -0.16 0.00 0.00 28.75 29.04 1auz h GLU 27 CO 0.01 -0.01 -0.09 1.15 -1.18 0.00 0.00 179.01 178.88 1auz h THR 28 N -0.62 0.28 0.00 0.32 2.02 -1.61 1.51 112.91 114.81 1auz h THR 28 Ca -0.03 -0.01 -0.05 0.00 0.77 0.00 0.00 66.41 67.08 1auz h THR 28 Cb 0.44 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1auz h THR 28 CO 0.05 0.01 -0.26 0.25 0.37 0.00 0.00 175.52 175.95 1auz h LEU 29 N 0.04 0.00 -0.91 2.58 5.85 -1.59 -2.60 115.31 118.67 1auz h LEU 29 Ca 0.39 0.00 0.25 0.00 0.84 0.00 0.00 57.88 59.36 1auz h LEU 29 Cb 0.65 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.54 1auz h LEU 29 CO -0.73 0.26 0.36 0.50 -0.34 0.00 0.00 178.44 178.49 1auz h LYS 30 N 0.00 0.28 -0.01 1.25 3.11 0.33 1.45 116.57 122.98 1auz h LYS 30 Ca -0.00 -0.02 -0.14 0.00 -2.81 0.00 0.00 60.65 57.68 1auz h LYS 30 Cb 0.49 -0.06 -0.02 0.00 -1.00 0.00 0.00 32.23 31.64 1auz h LYS 30 CO 0.03 0.18 -0.67 -0.56 -2.81 0.00 0.00 179.45 175.63 1auz h GLN 31 N 0.29 0.04 0.00 1.90 3.07 -1.33 -2.48 115.11 116.60 1auz h GLN 31 Ca 0.60 -0.04 0.00 0.00 0.09 0.00 0.00 58.65 59.30 1auz h GLN 31 Cb 1.23 0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.80 1auz h GLN 31 CO -0.61 0.70 0.00 1.17 0.09 0.00 0.00 178.83 180.18 1auz n LYS 32 N -3.76 0.21 -0.07 0.06 0.00 0.46 -3.16 118.16 111.89 1auz n LYS 32 Ca -0.01 0.35 -0.11 0.00 0.00 0.00 0.00 58.31 58.53 1auz n LYS 32 Cb 0.66 -1.83 -0.08 0.00 0.00 0.00 0.00 35.03 33.78 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 0.96 -1.08 3.15 2.07 0.14 -3.31 116.25 118.18 1auz h VAL 33 Ca 0.00 -1.82 0.33 0.00 0.82 0.00 0.00 66.70 66.03 1auz h VAL 33 Cb 0.48 1.91 -0.13 0.00 -1.52 0.00 0.00 31.29 32.03 1auz h VAL 33 CO 0.00 0.33 0.65 0.00 0.02 0.00 0.00 177.57 178.57 1auz h THR 34 N -1.00 0.32 -0.83 2.57 1.03 -1.45 1.03 112.91 114.58 1auz h THR 34 Ca -0.07 -0.10 0.03 0.00 -0.01 0.00 0.00 66.41 66.26 1auz h THR 34 Cb 0.75 -0.01 -0.05 0.00 -1.07 0.00 0.00 68.15 67.77 1auz h THR 34 CO -0.04 0.06 0.53 0.06 -0.01 0.00 0.00 175.52 176.11 1auz h GLN 35 N 0.30 1.00 0.00 0.00 3.07 -1.66 -1.02 115.11 116.80 1auz h GLN 35 Ca 0.72 -0.06 -0.11 0.00 0.09 0.00 0.00 58.65 59.29 1auz h GLN 35 Cb 1.81 -0.22 -0.02 0.00 0.08 0.00 0.00 27.48 29.13 1auz h GLN 35 CO -0.49 0.66 -0.52 1.03 0.09 0.00 0.00 178.83 179.59 1auz h SER 36 N 1.03 0.00 -1.04 0.06 0.87 0.85 -2.16 113.55 113.16 1auz h SER 36 Ca 0.33 0.00 0.28 0.00 -1.23 0.00 0.00 61.79 61.17 1auz h SER 36 Cb 0.02 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 61.90 1auz h SER 36 CO -0.12 0.52 0.70 -0.07 -0.53 0.00 0.00 176.83 177.33 1auz h LEU 37 N 0.00 0.28 -5.00 2.23 -0.00 0.71 -3.29 115.31 110.23 1auz h LEU 37 Ca -0.01 0.05 -0.16 0.00 -0.00 0.00 0.00 57.88 57.76 1auz h LEU 37 Cb 1.22 0.00 -0.15 0.00 -0.00 0.00 0.00 40.66 41.74 1auz h LEU 37 CO 0.07 0.06 -0.41 -0.62 -0.00 0.00 0.00 178.44 177.54 1auz n GLU 38 N -4.46 0.57 -0.04 1.13 1.02 -1.18 -4.99 120.64 112.69 1auz n GLU 38 Ca 0.24 -1.63 -0.14 0.00 -0.02 0.00 0.00 57.16 55.61 1auz n GLU 38 Cb 0.96 -1.20 -0.09 0.00 -0.02 0.00 0.00 31.44 31.09 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 4.24 0.27 0.00 3.49 3.11 -1.47 -3.48 116.57 122.73 1auz h LYS 39 Ca -0.08 -0.18 0.00 0.00 -2.81 0.00 0.00 60.65 57.58 1auz h LYS 39 Cb 1.09 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 32.34 1auz h LYS 39 CO 0.13 0.76 0.00 -0.25 -2.81 0.00 0.00 179.45 177.29 1auz n ASP 40 N -4.57 0.00 0.00 4.20 8.00 -1.26 -5.09 116.55 117.83 1auz n ASP 40 Ca -0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.43 1auz n ASP 40 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 1auz n ASP 40 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1auz n ASP 41 N 0.00 0.00 -3.26 -2.24 2.03 -1.26 -5.01 116.55 106.81 1auz n ASP 41 Ca 0.00 0.00 -0.18 0.00 0.52 0.00 0.00 54.79 55.13 1auz n ASP 41 Cb 0.00 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.33 1auz n ASP 41 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1auz s ILE 42 N 0.00 -0.23 0.00 5.18 -1.09 -1.26 -5.02 121.20 118.78 1auz s ILE 42 Ca 0.00 -1.54 0.00 0.00 -2.23 0.00 0.00 60.65 56.88 1auz s ILE 42 Cb 0.00 -0.74 0.00 0.00 -1.58 0.00 0.00 42.46 40.14 1auz s ILE 42 CO 0.00 -0.70 0.00 0.54 -1.23 0.00 0.00 174.94 173.55 1auz n ARG 43 N 3.55 0.63 -4.24 2.79 1.74 -1.26 -4.96 116.66 114.91 1auz n ARG 43 Ca 0.18 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 57.12 1auz n ARG 43 Cb 0.48 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.81 1auz n ARG 43 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1auz s HIS 44 N -0.28 1.24 0.22 -1.55 3.76 1.71 -4.66 115.29 115.73 1auz s HIS 44 Ca 0.00 -0.73 0.06 0.00 -0.15 0.00 0.00 55.06 54.24 1auz s HIS 44 Cb 0.00 -0.64 -0.04 0.00 1.11 0.00 0.00 32.58 33.01 1auz s HIS 44 CO 0.00 0.07 0.19 0.96 -0.85 0.00 0.00 174.74 175.11 1auz s ILE 45 N -3.13 4.53 -0.42 0.60 -5.25 -1.24 0.44 121.20 116.72 1auz s ILE 45 Ca 0.15 -1.26 0.07 0.00 -0.99 0.00 0.00 60.65 58.61 1auz s ILE 45 Cb 0.01 -3.40 0.18 0.00 2.95 0.00 0.00 42.46 42.20 1auz s ILE 45 CO 0.01 -0.27 0.60 -0.69 -1.79 0.00 0.00 174.94 172.80 1auz s VAL 46 N -1.99 -0.86 0.41 8.37 1.01 -0.60 -4.17 120.40 122.57 1auz s VAL 46 Ca 0.32 -0.38 -0.12 0.00 0.00 0.00 0.00 61.98 61.81 1auz s VAL 46 Cb -0.09 -0.13 -0.07 0.00 0.00 0.00 0.00 36.38 36.09 1auz s VAL 46 CO 0.25 -0.12 0.79 -0.76 0.00 0.00 0.00 175.10 175.25 1auz s LEU 47 N 1.58 3.83 -0.30 3.92 1.02 -1.24 0.15 118.68 127.65 1auz s LEU 47 Ca 0.19 1.19 -0.17 0.00 0.02 0.00 0.00 54.13 55.37 1auz s LEU 47 Cb -0.05 -4.07 0.17 0.00 0.02 0.00 0.00 46.19 42.26 1auz s LEU 47 CO -0.06 -0.40 1.19 0.21 0.02 0.00 0.00 176.35 177.31 1auz s ASN 48 N -3.05 -0.14 -0.19 2.29 2.47 -1.12 -3.13 114.94 112.07 1auz s ASN 48 Ca 0.52 0.07 -0.05 0.00 0.42 0.00 0.00 52.86 53.83 1auz s ASN 48 Cb -0.10 1.11 -0.02 0.00 -1.45 0.00 0.00 41.25 40.79 1auz s ASN 48 CO 0.30 -0.03 -0.01 -1.48 -3.72 0.00 0.00 177.10 172.16 1auz s LEU 49 N 2.99 3.22 -0.06 3.21 2.34 -1.26 -3.31 118.68 125.81 1auz s LEU 49 Ca 0.02 -0.20 0.20 0.00 0.06 0.00 0.00 54.13 54.20 1auz s LEU 49 Cb -0.06 -1.81 -0.30 0.00 -0.56 0.00 0.00 46.19 43.46 1auz s LEU 49 CO -0.11 0.08 0.36 1.21 -1.06 0.00 0.00 176.35 176.83 1auz n GLU 50 N 4.14 0.68 -3.02 1.48 2.13 -1.25 -4.57 120.64 120.23 1auz n GLU 50 Ca -0.17 -0.15 -0.39 0.00 0.66 0.00 0.00 57.16 57.11 1auz n GLU 50 Cb 0.52 -1.49 -0.01 0.00 0.27 0.00 0.00 31.44 30.73 1auz n GLU 50 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1auz n ASP 51 N -2.32 5.96 -4.68 4.31 -0.08 -1.26 -5.00 116.55 113.47 1auz n ASP 51 Ca -0.10 -3.48 -0.38 0.00 -1.51 0.00 0.00 54.79 49.32 1auz n ASP 51 Cb 0.66 -1.09 -0.08 0.00 2.34 0.00 0.00 41.12 42.95 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 -3.03 4.17 0.00 -2.67 1.98 -1.26 -2.62 118.68 115.24 1auz s LEU 52 Ca 0.35 0.46 0.00 0.00 -2.89 0.00 0.00 54.13 52.05 1auz s LEU 52 Cb 0.11 -2.43 0.00 0.00 0.66 0.00 0.00 46.19 44.53 1auz s LEU 52 CO 0.03 -0.02 0.00 -0.24 -1.89 0.00 0.00 176.35 174.23 1auz n SER 53 N 4.26 0.00 0.00 3.68 2.88 -1.26 -5.01 113.62 118.18 1auz n SER 53 Ca -0.10 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1auz n SER 53 Cb 0.51 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.97 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 -0.02 -5.22 0.66 3.57 -1.91 -3.48 116.94 110.54 1auz h PHE 54 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1auz h PHE 54 Cb 0.00 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.75 1auz h PHE 54 CO 0.00 -0.01 -0.54 -0.12 -2.23 0.00 0.00 178.31 175.41 1auz n MET 55 N -2.31 -0.48 0.00 1.11 0.00 -1.20 -4.88 117.12 109.36 1auz n MET 55 Ca -0.00 0.74 0.00 0.00 -0.00 0.00 0.00 57.70 58.44 1auz n MET 55 Cb 0.01 -0.74 0.00 0.00 0.00 0.00 0.00 33.22 32.48 1auz n MET 55 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1auz n ASP 56 N 1.63 0.00 -1.83 6.12 -0.08 -0.58 -4.95 116.55 116.85 1auz n ASP 56 Ca 0.00 0.00 -0.16 0.00 -1.51 0.00 0.00 54.79 53.12 1auz n ASP 56 Cb 0.27 0.00 0.13 0.00 2.34 0.00 0.00 41.12 43.86 1auz n ASP 56 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1auz n SER 57 N 0.00 3.52 -0.08 1.67 3.41 -1.26 -3.85 113.62 117.03 1auz n SER 57 Ca 0.00 -3.09 -0.08 0.00 -0.26 0.00 0.00 58.87 55.44 1auz n SER 57 Cb 0.00 -0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 63.19 1auz n SER 57 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1auz n SER 58 N -0.61 1.87 0.02 4.04 7.64 -1.26 -4.48 113.62 120.83 1auz n SER 58 Ca 0.41 0.49 0.13 0.00 1.01 0.00 0.00 58.87 60.91 1auz n SER 58 Cb 1.30 -0.82 0.35 0.00 -1.01 0.00 0.00 64.21 64.03 1auz n SER 58 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1auz n GLY 59 N 1.53 -1.38 0.31 0.23 0.00 -1.26 -3.90 105.19 100.72 1auz n GLY 59 Ca -0.13 -0.24 0.10 0.00 0.00 0.00 0.00 46.02 45.75 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 0.44 0.09 0.99 7.12 -1.79 0.41 115.31 122.58 1auz h LEU 60 Ca 0.00 0.12 -0.27 0.00 0.13 0.00 0.00 57.88 57.86 1auz h LEU 60 Cb 0.56 0.06 0.00 0.00 -0.53 0.00 0.00 40.66 40.75 1auz h LEU 60 CO 0.00 0.13 -1.20 1.23 -0.13 0.00 0.00 178.44 178.47 1auz h GLY 61 N 0.53 0.30 2.00 3.75 0.00 -1.82 -1.57 103.07 106.25 1auz h GLY 61 Ca 0.50 -0.73 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 1auz h GLY 61 CO -0.43 0.64 -0.07 -0.24 0.00 0.00 0.00 176.54 176.45 1auz h VAL 62 N 0.08 0.47 0.10 4.60 3.04 -1.04 1.36 116.25 124.86 1auz h VAL 62 Ca -0.12 -0.32 -0.36 0.00 -1.01 0.00 0.00 66.70 64.89 1auz h VAL 62 Cb 1.92 1.21 -0.03 0.00 -2.01 0.00 0.00 31.29 32.39 1auz h VAL 62 CO 0.20 0.06 -2.03 -0.38 -1.01 0.00 0.00 177.57 174.41 1auz n ILE 63 N -3.62 1.73 0.14 3.17 -0.00 0.12 -3.83 119.36 117.07 1auz n ILE 63 Ca -0.02 -0.67 -0.01 0.00 -0.00 0.00 0.00 62.75 62.06 1auz n ILE 63 Cb 0.18 -1.60 0.20 0.00 -0.00 0.00 0.00 39.64 38.41 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 0.06 0.00 -0.54 1.39 7.12 -0.63 -2.41 115.31 120.29 1auz h LEU 64 Ca -0.43 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.58 1auz h LEU 64 Cb 2.02 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 42.15 1auz h LEU 64 CO 0.07 0.58 0.00 0.61 -0.13 0.00 0.00 178.44 179.57 1auz n GLY 65 N 0.17 -1.27 0.13 3.75 0.00 0.46 -2.72 105.19 105.71 1auz n GLY 65 Ca -0.01 0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 1auz n GLY 65 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1auz h ARG 66 N 0.00 0.28 -0.50 1.61 -0.00 -1.54 -3.22 114.38 111.01 1auz h ARG 66 Ca 0.00 -0.48 0.08 0.00 -0.50 0.00 0.00 59.98 59.08 1auz h ARG 66 Cb 0.37 0.18 -0.07 0.00 0.00 0.00 0.00 29.97 30.46 1auz h ARG 66 CO 0.00 1.23 0.13 -0.92 0.00 0.00 0.00 179.97 180.41 1auz h TYR 67 N -0.23 0.23 0.00 3.04 5.03 -1.43 1.10 116.97 124.70 1auz h TYR 67 Ca -0.30 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.04 1auz h TYR 67 Cb 1.82 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 40.07 1auz h TYR 67 CO 0.13 0.04 0.00 1.63 -1.32 0.00 0.00 178.16 178.63 1auz n LYS 68 N -5.07 0.82 -0.11 1.82 5.02 -1.19 -1.74 118.16 117.72 1auz n LYS 68 Ca 0.06 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.12 1auz n LYS 68 Cb 0.23 -1.44 -0.08 0.00 -0.02 0.00 0.00 35.03 33.72 1auz n LYS 68 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1auz n GLN 69 N -0.94 0.49 0.07 1.97 -0.06 0.22 -3.77 117.38 115.35 1auz n GLN 69 Ca 0.17 0.20 -0.02 0.00 -2.00 0.00 0.00 57.00 55.35 1auz n GLN 69 Cb 0.08 -1.32 0.24 0.00 -4.06 0.00 0.00 30.24 25.18 1auz n GLN 69 CO 0.00 0.00 0.00 0.97 -0.20 0.00 0.00 177.06 177.83 1auz h ILE 70 N -0.68 1.27 0.00 1.69 6.09 0.91 -1.43 117.51 125.36 1auz h ILE 70 Ca -0.56 -1.29 -0.04 0.00 -1.37 0.00 0.00 64.86 61.60 1auz h ILE 70 Cb 1.54 1.46 -0.01 0.00 0.47 0.00 0.00 36.82 40.29 1auz h ILE 70 CO -0.30 0.40 -0.21 0.11 -3.07 0.00 0.00 178.15 175.07 1auz h LYS 71 N 0.30 0.00 0.00 2.19 1.57 -1.54 0.12 116.57 119.21 1auz h LYS 71 Ca 0.04 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 1auz h LYS 71 Cb 0.68 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.98 1auz h LYS 71 CO 0.05 0.21 -0.45 -0.56 -0.57 0.00 0.00 179.45 178.13 1auz h GLN 72 N 0.00 0.00 0.24 3.15 3.07 -1.42 -3.27 115.11 116.88 1auz h GLN 72 Ca -0.00 0.00 -0.33 0.00 0.09 0.00 0.00 58.65 58.40 1auz h GLN 72 Cb 0.95 0.00 0.03 0.00 0.08 0.00 0.00 27.48 28.54 1auz h GLN 72 CO 0.03 0.36 -1.50 0.82 0.09 0.00 0.00 178.83 178.63 1auz h ILE 73 N 0.00 1.23 0.00 1.86 2.04 -1.05 -3.48 117.51 118.11 1auz h ILE 73 Ca -0.01 -2.65 0.00 0.00 1.00 0.00 0.00 64.86 63.19 1auz h ILE 73 Cb 1.30 3.00 0.00 0.00 -0.74 0.00 0.00 36.82 40.38 1auz h ILE 73 CO 0.05 0.81 0.00 0.61 0.00 0.00 0.00 178.15 179.62 1auz n GLY 74 N 1.74 1.05 0.00 5.37 0.00 -0.90 -5.01 105.19 107.44 1auz n GLY 74 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 0.00 5.33 3.04 -0.02 0.00 -0.02 -4.97 105.19 108.55 1auz n GLY 75 Ca 0.00 -1.40 -0.11 0.00 0.00 0.00 0.00 46.02 44.52 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 3.22 0.35 -0.18 1.61 0.41 -1.26 -4.42 118.70 118.44 1auz s GLU 76 Ca 0.00 -0.32 -0.07 0.00 -0.41 0.00 0.00 54.97 54.17 1auz s GLU 76 Cb 0.00 0.14 -0.04 0.00 -1.78 0.00 0.00 34.13 32.45 1auz s GLU 76 CO 0.00 -0.07 0.07 1.41 -0.49 0.00 0.00 175.26 176.17 1auz s MET 77 N -1.04 3.96 0.22 1.61 1.75 -1.26 -3.62 119.30 120.91 1auz s MET 77 Ca -0.11 -0.33 0.10 0.00 -1.25 0.00 0.00 55.69 54.10 1auz s MET 77 Cb -0.07 -3.22 -0.05 0.00 2.84 0.00 0.00 34.83 34.34 1auz s MET 77 CO 0.01 0.30 -0.20 0.08 -0.65 0.00 0.00 175.02 174.56 1auz s VAL 78 N 0.30 2.19 -0.30 10.11 1.01 -1.26 -4.91 120.40 127.54 1auz s VAL 78 Ca 0.04 -2.17 -0.14 0.00 0.00 0.00 0.00 61.98 59.71 1auz s VAL 78 Cb -0.12 -2.11 0.15 0.00 0.00 0.00 0.00 36.38 34.29 1auz s VAL 78 CO 0.00 -0.33 0.88 0.54 0.00 0.00 0.00 175.10 176.19 1auz s VAL 79 N -2.25 -0.53 0.00 2.92 0.11 -1.26 -3.60 120.40 115.79 1auz s VAL 79 Ca 0.23 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 1auz s VAL 79 Cb -0.05 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.80 1auz s VAL 79 CO 0.11 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 171.88 1auz n ALA 81 N -3.00 -0.40 -0.70 0.00 0.00 -1.26 -4.12 120.51 111.03 1auz n ALA 81 Ca 0.00 0.12 -0.30 0.00 0.00 0.00 0.00 53.44 53.26 1auz n ALA 81 Cb 0.00 -1.97 0.27 0.00 0.00 0.00 0.00 19.45 17.75 1auz n ALA 81 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1auz s ILE 82 N -2.91 1.37 0.09 0.00 1.10 -1.26 -4.75 121.20 114.84 1auz s ILE 82 Ca 0.15 0.00 -0.25 0.00 -0.51 0.00 0.00 60.65 60.04 1auz s ILE 82 Cb -0.07 -2.27 0.08 0.00 0.15 0.00 0.00 42.46 40.36 1auz s ILE 82 CO 0.19 0.00 0.69 -0.55 -2.11 0.00 0.00 174.94 173.16 1auz s SER 83 N -3.51 -0.52 0.00 4.50 0.15 -1.26 -4.98 113.70 108.08 1auz s SER 83 Ca 0.70 0.09 0.19 0.00 0.70 0.00 0.00 55.95 57.63 1auz s SER 83 Cb -0.11 0.53 1.16 0.00 -1.71 0.00 0.00 66.02 65.89 1auz s SER 83 CO 0.57 -0.83 1.60 -0.81 1.20 0.00 0.00 173.24 174.97 1auz n PRO 84 N -0.18 0.75 -0.87 5.44 -0.04 -1.26 -1.78 135.00 137.06 1auz n PRO 84 Ca -0.15 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.35 1auz n PRO 84 Cb 0.63 -1.41 0.05 0.00 -0.04 0.00 0.00 33.50 32.74 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 -0.91 2.40 0.00 0.55 0.00 -1.26 -4.73 120.51 116.57 1auz n ALA 85 Ca 0.15 -2.04 0.00 0.00 0.00 0.00 0.00 53.44 51.54 1auz n ALA 85 Cb 0.07 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 18.95 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 -0.12 0.00 0.69 0.00 0.31 -0.97 -4.74 118.33 113.51 1auz n VAL 86 Ca 0.07 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.50 1auz n VAL 86 Cb 0.87 -0.15 0.44 0.00 -0.91 0.00 0.00 33.84 34.09 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 -1.62 0.01 0.18 5.55 2.85 -0.74 -2.57 118.16 121.82 1auz n LYS 87 Ca 0.00 0.16 0.03 0.00 -1.05 0.00 0.00 58.31 57.44 1auz n LYS 87 Cb 0.13 -1.51 0.37 0.00 -0.65 0.00 0.00 35.03 33.37 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 0.01 -0.51 -1.58 -0.00 -1.85 0.37 114.38 110.82 1auz h ARG 88 Ca 0.00 -0.00 -0.12 0.00 -0.00 0.00 0.00 59.98 59.86 1auz h ARG 88 Cb 0.36 -0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 30.31 1auz h ARG 88 CO 0.00 0.36 -0.15 -0.07 -0.00 0.00 0.00 179.97 180.11 1auz h LEU 89 N 0.01 1.00 0.00 0.08 3.38 -1.84 -2.58 115.31 115.36 1auz h LEU 89 Ca -0.00 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.54 1auz h LEU 89 Cb 0.63 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1auz h LEU 89 CO 0.05 1.13 -0.61 -0.26 0.09 0.00 0.00 178.44 178.83 1auz h PHE 90 N 0.87 0.00 -0.40 1.13 0.04 -1.60 -2.62 116.94 114.36 1auz h PHE 90 Ca 0.13 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.84 1auz h PHE 90 Cb 0.71 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.84 1auz h PHE 90 CO 0.05 0.35 -0.01 0.22 -0.60 0.00 0.00 178.31 178.32 1auz h ASP 91 N 0.00 0.62 1.01 2.17 3.58 -0.03 -2.25 116.42 121.51 1auz h ASP 91 Ca -0.03 -0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.27 1auz h ASP 91 Cb 1.29 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 42.18 1auz h ASP 91 CO 0.04 0.69 -1.00 -0.03 -2.88 0.00 0.00 179.24 176.06 1auz h MET 92 N 0.61 0.00 -0.46 0.28 4.05 -1.51 -3.33 114.93 114.57 1auz h MET 92 Ca 0.12 0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 59.45 1auz h MET 92 Cb 0.40 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.18 1auz h MET 92 CO 0.02 0.03 -0.11 1.03 0.23 0.00 0.00 176.91 178.11 1auz h SER 93 N 0.00 0.84 0.00 1.39 0.87 -1.04 -3.46 113.55 112.15 1auz h SER 93 Ca -0.01 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 1auz h SER 93 Cb 1.05 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 1auz h SER 93 CO 0.00 0.96 0.00 0.61 -0.53 0.00 0.00 176.83 177.88 1auz n GLY 94 N -0.40 0.54 0.40 5.77 0.00 -0.89 -4.80 105.19 105.81 1auz n GLY 94 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 2.62 -0.35 0.99 7.94 -1.26 -4.66 117.00 122.28 1auz n LEU 95 Ca 0.00 -2.10 0.26 0.00 -1.11 0.00 0.00 56.01 53.07 1auz n LEU 95 Cb 0.07 -0.17 0.55 0.00 0.53 0.00 0.00 43.42 44.40 1auz n LEU 95 CO 0.00 0.64 1.22 0.15 -1.11 0.00 0.00 177.39 178.30 1auz h PHE 96 N 1.19 0.60 0.00 1.96 3.04 -1.87 1.98 116.94 123.84 1auz h PHE 96 Ca 0.00 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.97 1auz h PHE 96 Cb 0.70 -0.17 -0.00 0.00 2.56 0.00 0.00 35.95 39.04 1auz h PHE 96 CO 0.15 -0.00 -0.00 0.87 -2.02 0.00 0.00 178.31 177.31 1auz h LYS 97 N 0.31 0.00 0.01 1.11 1.79 -1.92 1.38 116.57 119.24 1auz h LYS 97 Ca 0.64 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.90 1auz h LYS 97 Cb 1.77 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 32.39 1auz h LYS 97 CO -0.31 0.00 -1.05 0.97 -1.08 0.00 0.00 179.45 177.98 1auz h ILE 98 N 0.00 1.67 0.00 1.86 -0.00 0.28 -3.19 117.51 118.12 1auz h ILE 98 Ca -0.00 -3.38 0.00 0.00 -0.00 0.00 0.00 64.86 61.48 1auz h ILE 98 Cb 0.02 2.83 0.00 0.00 -0.00 0.00 0.00 36.82 39.67 1auz h ILE 98 CO 0.00 0.95 -0.96 -0.38 -0.00 0.00 0.00 178.15 177.77 1auz n ILE 99 N -3.34 0.17 -1.87 2.19 -0.00 0.76 -4.86 119.36 112.41 1auz n ILE 99 Ca -0.01 -0.22 -0.04 0.00 -0.00 0.00 0.00 62.75 62.47 1auz n ILE 99 Cb 0.95 0.21 0.00 0.00 -0.00 0.00 0.00 39.64 40.80 1auz n ILE 99 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.55 175.41 1auz n ARG 100 N -1.93 -0.30 -3.48 0.38 0.00 0.44 -4.64 116.66 107.13 1auz n ARG 100 Ca 0.02 0.43 -0.20 0.00 -0.00 0.00 0.00 57.85 58.11 1auz n ARG 100 Cb 0.43 -0.57 -0.02 0.00 0.00 0.00 0.00 32.46 32.30 1auz n ARG 100 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 1auz s PHE 101 N -0.52 2.88 0.00 -0.14 2.19 -1.26 -4.39 117.98 116.74 1auz s PHE 101 Ca 0.04 -0.35 0.00 0.00 0.33 0.00 0.00 56.93 56.95 1auz s PHE 101 Cb -0.00 -2.07 0.00 0.00 -1.31 0.00 0.00 43.02 39.63 1auz s PHE 101 CO 0.10 -0.08 0.00 -1.91 1.83 0.00 0.00 175.22 175.16 1auz n GLU 102 N -1.59 0.00 -3.31 10.12 0.00 -1.20 -5.07 120.64 119.59 1auz n GLU 102 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 57.16 57.07 1auz n GLU 102 Cb 0.60 0.00 -0.06 0.00 0.00 0.00 0.00 31.44 31.98 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 2.57 0.56 0.00 5.31 -0.21 -1.26 -4.22 119.66 122.41 1auz s GLN 103 Ca 0.00 -0.33 0.00 0.00 0.02 0.00 0.00 55.36 55.05 1auz s GLN 103 Cb 0.00 -0.42 0.00 0.00 1.00 0.00 0.00 33.01 33.59 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 4.77 0.00 -0.56 5.90 2.88 -1.26 -3.71 113.62 121.65 1auz n SER 104 Ca 0.06 0.00 0.42 0.00 -1.33 0.00 0.00 58.87 58.03 1auz n SER 104 Cb 0.49 0.00 0.66 0.00 -0.75 0.00 0.00 64.21 64.60 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 -0.00 0.02 -1.46 2.13 -1.26 0.47 120.64 120.53 1auz n GLU 105 Ca 0.00 0.90 0.02 0.00 0.66 0.00 0.00 57.16 58.75 1auz n GLU 105 Cb 0.00 -2.04 0.11 0.00 0.27 0.00 0.00 31.44 29.78 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 -3.67 0.02 -0.45 5.31 7.27 -1.24 -3.17 117.38 121.44 1auz n GLN 106 Ca 0.36 0.47 0.35 0.00 0.07 0.00 0.00 57.00 58.25 1auz n GLN 106 Cb 1.60 -1.55 0.55 0.00 2.41 0.00 0.00 30.24 33.25 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 -1.58 -0.01 -0.08 3.69 7.27 1.68 0.40 117.38 128.75 1auz n GLN 107 Ca 0.00 0.79 -0.10 0.00 0.07 0.00 0.00 57.00 57.77 1auz n GLN 107 Cb 0.03 -1.75 -0.06 0.00 2.41 0.00 0.00 30.24 30.88 1auz n GLN 107 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1auz h ALA 108 N 0.82 0.07 0.00 1.69 0.00 -1.78 -3.33 119.26 116.73 1auz h ALA 108 Ca 0.65 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1auz h ALA 108 Cb 2.46 0.40 0.00 0.00 0.00 0.00 0.00 17.79 20.65 1auz h ALA 108 CO -0.10 0.39 0.00 -0.07 0.00 0.00 0.00 179.25 179.47 1auz h LEU 109 N -1.00 0.00 -0.95 0.00 -0.00 0.13 -1.68 115.31 111.81 1auz h LEU 109 Ca -0.10 0.00 0.07 0.00 -0.00 0.00 0.00 57.88 57.85 1auz h LEU 109 Cb 0.69 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 41.29 1auz h LEU 109 CO -0.06 0.00 0.61 0.25 -0.00 0.00 0.00 178.44 179.24 1auz h LEU 110 N 0.00 0.96 0.00 1.67 5.85 0.76 0.40 115.31 124.95 1auz h LEU 110 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1auz h LEU 110 Cb 0.12 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1auz h LEU 110 CO 0.00 0.61 0.06 0.41 -0.34 0.00 0.00 178.44 179.18 1auz n THR 111 N -4.55 1.07 0.00 1.05 -1.04 -0.63 -4.31 114.28 105.88 1auz n THR 111 Ca 0.15 0.33 0.00 0.00 -2.04 0.00 0.00 64.05 62.48 1auz n THR 111 Cb 0.19 -1.33 0.00 0.00 -1.82 0.00 0.00 70.33 67.37 1auz n THR 111 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1auz n LEU 112 N -1.24 0.00 -4.10 -4.42 -0.00 0.10 -4.55 117.00 102.78 1auz n LEU 112 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 56.01 55.73 1auz n LEU 112 Cb 0.06 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.43 1auz n LEU 112 CO 0.00 0.00 -0.33 0.61 -0.00 0.00 0.00 177.39 177.67 1auz n GLY 113 N -1.19 -0.19 2.65 1.47 0.00 0.95 -4.85 105.19 104.04 1auz n GLY 113 Ca 0.00 0.16 -0.04 0.00 0.00 0.00 0.00 46.02 46.14 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 -4.47 0.00 0.00 1.61 0.31 -1.26 -5.06 118.33 109.46 1auz n VAL 114 Ca -0.31 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 1auz n VAL 114 Cb 0.69 0.84 0.00 0.00 -0.91 0.00 0.00 33.84 34.45 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 1.87 0.00 -0.21 3.52 0.00 -1.26 -5.07 120.51 119.35 1auz n ALA 115 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1auz n ALA 115 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.15 1auz n ALA 115 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95