#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 -3.79 -3.24 -3.43 7.94 -1.24 -4.94 117.00 108.30 1auz n LEU 2 Ca 0.00 1.62 -0.22 0.00 -1.11 0.00 0.00 56.01 56.30 1auz n LEU 2 Cb 0.00 -1.07 -0.07 0.00 0.53 0.00 0.00 43.42 42.81 1auz n LEU 2 CO 0.00 -0.23 -0.22 0.61 -1.11 0.00 0.00 177.39 176.45 1auz n GLY 3 N -0.15 1.52 3.78 -3.96 0.00 3.17 -4.83 105.19 104.72 1auz n GLY 3 Ca 0.00 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.77 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 0.21 3.29 0.21 -0.61 1.10 -1.26 0.80 121.20 124.94 1auz s ILE 4 Ca 0.32 0.74 -0.02 0.00 -0.51 0.00 0.00 60.65 61.18 1auz s ILE 4 Cb 0.04 -3.27 -0.03 0.00 0.15 0.00 0.00 42.46 39.34 1auz s ILE 4 CO -0.16 -0.24 0.18 -0.62 -2.11 0.00 0.00 174.94 171.99 1auz s ASP 5 N -2.06 0.18 -0.24 4.50 -1.08 0.44 -4.87 116.67 113.56 1auz s ASP 5 Ca 0.70 -1.35 -0.17 0.00 -0.52 0.00 0.00 52.55 51.22 1auz s ASP 5 Cb -0.22 0.41 0.07 0.00 -1.46 0.00 0.00 42.92 41.72 1auz s ASP 5 CO 0.30 -0.89 0.60 -0.04 0.52 0.00 0.00 175.17 175.66 1auz s MET 6 N -4.11 0.65 0.14 4.34 -1.94 -1.24 -2.84 119.30 114.30 1auz s MET 6 Ca 0.37 0.98 -0.05 0.00 -1.71 0.00 0.00 55.69 55.28 1auz s MET 6 Cb 0.06 0.19 -0.02 0.00 2.01 0.00 0.00 34.83 37.07 1auz s MET 6 CO 0.12 -0.12 0.15 -0.80 -0.01 0.00 0.00 175.02 174.36 1auz s ASN 7 N 1.03 0.20 0.01 3.03 -0.87 0.55 -4.91 114.94 113.98 1auz s ASN 7 Ca -0.06 -1.03 0.03 0.00 -1.57 0.00 0.00 52.86 50.24 1auz s ASN 7 Cb -0.05 0.35 -0.01 0.00 -0.02 0.00 0.00 41.25 41.52 1auz s ASN 7 CO -0.10 -0.79 -0.09 0.54 -2.57 0.00 0.00 177.10 174.09 1auz s VAL 8 N -4.00 0.71 -0.26 1.60 0.11 -1.24 0.21 120.40 117.53 1auz s VAL 8 Ca 0.19 -0.55 -0.02 0.00 -2.93 0.00 0.00 61.98 58.67 1auz s VAL 8 Cb 0.06 -0.63 0.12 0.00 -1.53 0.00 0.00 36.38 34.40 1auz s VAL 8 CO -0.00 0.08 0.28 -0.54 -3.33 0.00 0.00 175.10 171.59 1auz s LYS 9 N -0.52 0.28 0.00 1.54 -0.14 0.16 -4.88 119.74 116.18 1auz s LYS 9 Ca 0.01 0.07 0.00 0.00 -1.36 0.00 0.00 55.97 54.69 1auz s LYS 9 Cb -0.05 -0.81 0.00 0.00 -1.68 0.00 0.00 37.83 35.29 1auz s LYS 9 CO 0.00 -0.85 0.00 -1.91 -0.76 0.00 0.00 175.35 171.83 1auz n GLU 10 N 5.32 0.00 0.00 1.68 2.13 -1.26 0.41 120.64 128.92 1auz n GLU 10 Ca -0.03 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.79 1auz n GLU 10 Cb 0.48 -2.02 0.00 0.00 0.27 0.00 0.00 31.44 30.17 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 0.12 0.00 -4.64 4.31 3.41 -1.26 -5.01 113.62 110.56 1auz n SER 11 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 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 4.95 -0.56 -3.33 0.11 0.17 0.53 120.40 122.27 1auz s VAL 12 Ca 0.00 1.26 -0.20 0.00 -2.93 0.00 0.00 61.98 60.11 1auz s VAL 12 Cb 0.00 -3.99 0.07 0.00 -1.53 0.00 0.00 36.38 30.94 1auz s VAL 12 CO 0.00 0.02 0.72 -1.48 -3.33 0.00 0.00 175.10 171.03 1auz s LEU 13 N 2.46 4.98 0.06 2.54 0.05 1.82 0.37 118.68 130.96 1auz s LEU 13 Ca 0.29 -1.06 -0.30 0.00 0.05 0.00 0.00 54.13 53.11 1auz s LEU 13 Cb -0.16 -2.42 -0.05 0.00 -2.05 0.00 0.00 46.19 41.51 1auz s LEU 13 CO 0.09 -1.06 1.05 0.00 -0.55 0.00 0.00 176.35 175.88 1auz s ILE 15 N 0.69 2.51 -0.62 0.00 1.09 0.23 0.21 121.20 125.30 1auz s ILE 15 Ca 0.53 -3.21 -0.23 0.00 -1.10 0.00 0.00 60.65 56.64 1auz s ILE 15 Cb -0.25 -2.75 0.06 0.00 -1.06 0.00 0.00 42.46 38.46 1auz s ILE 15 CO 0.30 -0.79 0.93 -0.13 -0.10 0.00 0.00 174.94 175.15 1auz s ARG 16 N -0.17 3.16 -0.22 2.79 0.52 -1.13 -3.02 118.95 120.87 1auz s ARG 16 Ca 0.17 -0.72 -0.08 0.00 -0.52 0.00 0.00 55.73 54.57 1auz s ARG 16 Cb -0.25 -4.18 -0.04 0.00 0.52 0.00 0.00 34.95 31.00 1auz s ARG 16 CO -0.01 -1.70 0.10 -1.17 0.02 0.00 0.00 175.30 172.54 1auz s LEU 17 N 3.91 3.77 -0.22 2.53 1.98 -1.18 0.17 118.68 129.65 1auz s LEU 17 Ca 0.23 -0.01 -0.00 0.00 -2.89 0.00 0.00 54.13 51.46 1auz s LEU 17 Cb -0.16 -1.99 0.06 0.00 0.66 0.00 0.00 46.19 44.75 1auz s LEU 17 CO 0.12 0.07 -0.03 0.42 -1.89 0.00 0.00 176.35 175.03 1auz s THR 18 N 1.03 1.27 0.00 3.68 -4.23 0.24 -3.25 115.64 114.38 1auz s THR 18 Ca 0.05 -1.03 0.00 0.00 -1.18 0.00 0.00 61.69 59.53 1auz s THR 18 Cb -0.14 -1.59 0.00 0.00 1.34 0.00 0.00 72.50 72.11 1auz s THR 18 CO 0.03 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 1auz n GLY 19 N 4.77 -0.52 3.45 3.99 0.00 -0.84 0.68 105.19 116.71 1auz n GLY 19 Ca -0.11 0.22 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 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 1.59 -0.49 1.61 8.01 -1.26 -4.02 118.70 124.15 1auz s GLU 20 Ca 0.00 -1.78 0.03 0.00 0.01 0.00 0.00 54.97 53.23 1auz s GLU 20 Cb 0.00 -1.38 0.14 0.00 -4.31 0.00 0.00 34.13 28.57 1auz s GLU 20 CO 0.00 0.14 0.27 -0.51 0.01 0.00 0.00 175.26 175.17 1auz s LEU 21 N -3.47 3.32 0.20 1.80 2.01 -1.26 -4.47 118.68 116.81 1auz s LEU 21 Ca 0.29 -2.87 -0.03 0.00 0.01 0.00 0.00 54.13 51.53 1auz s LEU 21 Cb 0.01 -1.25 -0.03 0.00 0.01 0.00 0.00 46.19 44.93 1auz s LEU 21 CO 0.12 -0.24 0.18 -1.81 1.01 0.00 0.00 176.35 175.62 1auz s ASP 22 N -0.01 0.13 0.45 2.29 1.01 -1.26 -0.91 116.67 118.37 1auz s ASP 22 Ca 0.19 -1.28 0.12 0.00 0.71 0.00 0.00 52.55 52.29 1auz s ASP 22 Cb -0.22 0.40 0.65 0.00 1.01 0.00 0.00 42.92 44.76 1auz s ASP 22 CO -0.02 -0.87 1.27 1.12 0.21 0.00 0.00 175.17 176.87 1auz h HIS 23 N 2.59 0.00 0.00 4.23 2.07 -1.94 8.67 115.15 130.78 1auz h HIS 23 Ca -0.34 0.00 -0.26 0.00 -2.85 0.00 0.00 60.37 56.91 1auz h HIS 23 Cb 1.24 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.18 1auz h HIS 23 CO 0.37 0.00 -1.67 0.72 -3.07 0.00 0.00 177.93 174.28 1auz n HIS 24 N -2.23 0.42 0.21 6.12 8.25 -1.26 -3.93 115.22 122.79 1auz n HIS 24 Ca -0.01 0.18 0.11 0.00 -0.26 0.00 0.00 57.72 57.74 1auz n HIS 24 Cb 0.53 -0.92 0.15 0.00 1.12 0.00 0.00 29.99 30.88 1auz n HIS 24 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1auz h THR 25 N -1.00 0.12 0.00 1.59 1.35 -0.82 -2.98 112.91 111.18 1auz h THR 25 Ca -0.40 -1.17 0.00 0.00 -0.55 0.00 0.00 66.41 64.29 1auz h THR 25 Cb 1.29 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 69.76 1auz h THR 25 CO -0.24 0.07 0.00 0.00 -0.25 0.00 0.00 175.52 175.10 1auz n ALA 26 N -2.12 2.11 -0.08 6.62 0.00 2.73 -3.29 120.51 126.49 1auz n ALA 26 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.38 1auz n ALA 26 Cb 0.56 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.53 1auz n ALA 26 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1auz h GLU 27 N 0.00 0.38 -0.88 0.00 4.57 -1.60 -1.33 114.58 115.72 1auz h GLU 27 Ca 0.00 -0.05 0.21 0.00 -1.18 0.00 0.00 59.36 58.33 1auz h GLU 27 Cb 0.62 -0.07 -0.16 0.00 -0.16 0.00 0.00 28.75 28.98 1auz h GLU 27 CO 0.00 0.37 -0.04 0.00 -1.18 0.00 0.00 179.01 178.15 1auz h THR 28 N 0.29 0.17 0.00 0.32 1.03 -1.73 1.65 112.91 114.64 1auz h THR 28 Ca 0.09 -0.02 -0.13 0.00 -0.01 0.00 0.00 66.41 66.34 1auz h THR 28 Cb 0.11 0.12 -0.02 0.00 -1.07 0.00 0.00 68.15 67.29 1auz h THR 28 CO -0.01 0.01 -0.63 0.25 -0.01 0.00 0.00 175.52 175.12 1auz h LEU 29 N 0.05 0.00 -0.80 0.00 5.85 -1.68 -2.61 115.31 116.11 1auz h LEU 29 Ca 0.48 0.00 0.14 0.00 0.84 0.00 0.00 57.88 59.35 1auz h LEU 29 Cb 0.89 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 41.82 1auz h LEU 29 CO -0.82 0.63 0.37 0.50 -0.34 0.00 0.00 178.44 178.78 1auz h LYS 30 N 0.00 0.52 0.04 1.25 3.11 0.36 0.10 116.57 121.95 1auz h LYS 30 Ca -0.01 -0.03 -0.22 0.00 -2.81 0.00 0.00 60.65 57.58 1auz h LYS 30 Cb 1.12 -0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 32.22 1auz h LYS 30 CO 0.08 0.35 -1.00 -0.56 -2.81 0.00 0.00 179.45 175.51 1auz h GLN 31 N 0.54 0.22 0.00 1.90 3.07 -1.15 -2.97 115.11 116.72 1auz h GLN 31 Ca 0.44 -0.28 0.00 0.00 0.09 0.00 0.00 58.65 58.90 1auz h GLN 31 Cb 0.63 0.09 0.00 0.00 0.08 0.00 0.00 27.48 28.28 1auz h GLN 31 CO -0.38 1.05 0.00 1.17 0.09 0.00 0.00 178.83 180.76 1auz n LYS 32 N -3.59 0.07 0.01 0.06 3.00 0.18 -2.08 118.16 115.81 1auz n LYS 32 Ca -0.05 0.47 -0.09 0.00 -0.00 0.00 0.00 58.31 58.64 1auz n LYS 32 Cb 0.89 -1.69 -0.07 0.00 0.00 0.00 0.00 35.03 34.15 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 0.87 -0.97 3.15 2.07 -0.88 -2.50 116.25 117.99 1auz h VAL 33 Ca 0.00 -1.34 0.14 0.00 0.82 0.00 0.00 66.70 66.32 1auz h VAL 33 Cb 0.11 1.55 -0.08 0.00 -1.52 0.00 0.00 31.29 31.35 1auz h VAL 33 CO 0.00 0.26 0.61 0.00 0.02 0.00 0.00 177.57 178.46 1auz h THR 34 N -0.92 0.87 -0.21 2.57 1.03 -1.53 1.76 112.91 116.47 1auz h THR 34 Ca -0.01 -0.30 -0.01 0.00 -0.01 0.00 0.00 66.41 66.08 1auz h THR 34 Cb 0.53 -0.08 -0.01 0.00 -1.07 0.00 0.00 68.15 67.52 1auz h THR 34 CO 0.02 0.16 0.10 1.56 -0.01 0.00 0.00 175.52 177.35 1auz h GLN 35 N 0.87 0.31 0.00 0.00 4.20 -1.57 -2.48 115.11 116.44 1auz h GLN 35 Ca 0.49 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 59.09 1auz h GLN 35 Cb 0.62 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1auz h GLN 35 CO -0.26 0.34 -0.28 1.03 -0.67 0.00 0.00 178.83 178.99 1auz h SER 36 N 0.20 0.00 -0.92 1.46 0.87 -0.70 -2.33 113.55 112.14 1auz h SER 36 Ca 0.07 0.00 0.22 0.00 -1.23 0.00 0.00 61.79 60.86 1auz h SER 36 Cb 0.14 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.04 1auz h SER 36 CO -0.01 0.28 0.62 -0.07 -0.53 0.00 0.00 176.83 177.12 1auz h LEU 37 N 0.00 0.33 -5.00 2.23 -0.00 0.31 -3.33 115.31 109.84 1auz h LEU 37 Ca -0.00 0.04 -0.13 0.00 -0.00 0.00 0.00 57.88 57.79 1auz h LEU 37 Cb 1.02 -0.02 -0.15 0.00 -0.00 0.00 0.00 40.66 41.51 1auz h LEU 37 CO 0.04 0.12 -0.36 -0.62 -0.00 0.00 0.00 178.44 177.61 1auz n GLU 38 N -4.48 0.47 -0.04 1.13 -0.58 -1.17 -4.81 120.64 111.16 1auz n GLU 38 Ca 0.20 -1.55 -0.13 0.00 -0.42 0.00 0.00 57.16 55.26 1auz n GLU 38 Cb 0.78 -1.00 -0.08 0.00 -0.57 0.00 0.00 31.44 30.57 1auz n GLU 38 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1auz h LYS 39 N 4.36 0.27 0.00 3.49 3.64 -1.53 -3.48 116.57 123.32 1auz h LYS 39 Ca -0.04 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 1auz h LYS 39 Cb 1.11 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1auz h LYS 39 CO 0.05 0.69 0.00 -0.25 -2.27 0.00 0.00 179.45 177.66 1auz n ASP 40 N -4.62 0.00 -0.11 4.20 8.00 -1.26 -5.09 116.55 117.66 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 0.34 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 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 -3.76 -2.24 4.64 -1.26 -5.00 116.55 108.92 1auz n ASP 41 Ca 0.00 0.00 -0.28 0.00 -1.38 0.00 0.00 54.79 53.13 1auz n ASP 41 Cb 0.00 0.00 -0.12 0.00 -1.04 0.00 0.00 41.12 39.96 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 2.06 0.00 5.18 -1.09 -1.26 -4.96 121.20 121.13 1auz s ILE 42 Ca 0.00 -3.54 0.00 0.00 -2.23 0.00 0.00 60.65 54.88 1auz s ILE 42 Cb 0.00 -2.38 0.00 0.00 -1.58 0.00 0.00 42.46 38.50 1auz s ILE 42 CO 0.00 -1.01 0.00 0.54 -1.23 0.00 0.00 174.94 173.24 1auz n ARG 43 N 2.54 0.54 -4.32 2.79 3.00 -1.26 -4.85 116.66 115.10 1auz n ARG 43 Ca 0.18 0.00 -0.17 0.00 -0.01 0.00 0.00 57.85 57.85 1auz n ARG 43 Cb 0.37 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.73 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 -0.37 1.60 0.21 -1.55 3.76 2.04 -3.45 115.29 117.52 1auz s HIS 44 Ca 0.00 -0.62 0.05 0.00 -0.15 0.00 0.00 55.06 54.34 1auz s HIS 44 Cb 0.00 -0.76 -0.04 0.00 1.11 0.00 0.00 32.58 32.90 1auz s HIS 44 CO 0.00 0.29 0.23 0.96 -0.85 0.00 0.00 174.74 175.37 1auz s ILE 45 N -3.06 4.78 -0.47 0.60 -0.00 -1.21 0.49 121.20 122.33 1auz s ILE 45 Ca 0.21 -1.10 0.07 0.00 -0.00 0.00 0.00 60.65 59.83 1auz s ILE 45 Cb 0.00 -3.53 0.18 0.00 -0.00 0.00 0.00 42.46 39.12 1auz s ILE 45 CO 0.05 -0.23 0.67 -0.69 -0.00 0.00 0.00 174.94 174.74 1auz s VAL 46 N -1.92 -0.94 0.42 8.37 1.01 -0.48 -4.34 120.40 122.52 1auz s VAL 46 Ca 0.33 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.51 1auz s VAL 46 Cb -0.09 -0.06 -0.08 0.00 0.00 0.00 0.00 36.38 36.15 1auz s VAL 46 CO 0.26 -0.06 0.85 -0.76 0.00 0.00 0.00 175.10 175.39 1auz s LEU 47 N 1.25 3.83 -0.30 3.92 2.01 -1.18 0.78 118.68 128.99 1auz s LEU 47 Ca 0.24 1.37 -0.15 0.00 0.01 0.00 0.00 54.13 55.59 1auz s LEU 47 Cb -0.02 -4.24 0.18 0.00 0.01 0.00 0.00 46.19 42.11 1auz s LEU 47 CO -0.06 -0.41 1.14 0.21 1.01 0.00 0.00 176.35 178.24 1auz s ASN 48 N -2.83 -0.24 -0.25 2.29 2.47 -1.17 -3.15 114.94 112.06 1auz s ASN 48 Ca 0.55 0.11 -0.12 0.00 0.42 0.00 0.00 52.86 53.83 1auz s ASN 48 Cb -0.10 1.19 -0.05 0.00 -1.45 0.00 0.00 41.25 40.84 1auz s ASN 48 CO 0.26 -0.04 0.23 -0.76 -3.72 0.00 0.00 177.10 173.07 1auz s LEU 49 N 2.98 4.07 -0.04 3.21 1.43 -1.18 -3.07 118.68 126.08 1auz s LEU 49 Ca 0.03 0.15 0.21 0.00 -1.03 0.00 0.00 54.13 53.48 1auz s LEU 49 Cb -0.07 -2.21 -0.26 0.00 0.03 0.00 0.00 46.19 43.68 1auz s LEU 49 CO -0.12 -0.03 0.48 1.21 0.23 0.00 0.00 176.35 178.11 1auz n GLU 50 N 4.75 0.66 -3.23 1.70 0.00 -1.20 -4.51 120.64 118.80 1auz n GLU 50 Ca -0.13 -0.08 -0.27 0.00 0.00 0.00 0.00 57.16 56.69 1auz n GLU 50 Cb 0.52 -1.58 -0.06 0.00 0.00 0.00 0.00 31.44 30.31 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 -2.48 3.80 -4.53 4.31 -0.08 -1.26 -5.00 116.55 111.30 1auz n ASP 51 Ca -0.11 -3.49 -0.42 0.00 -1.51 0.00 0.00 54.79 49.26 1auz n ASP 51 Cb 0.74 -0.63 -0.09 0.00 2.34 0.00 0.00 41.12 43.48 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 -2.79 4.54 0.00 -2.67 1.98 -1.26 -1.99 118.68 116.49 1auz s LEU 52 Ca 0.43 -0.31 0.00 0.00 -2.89 0.00 0.00 54.13 51.36 1auz s LEU 52 Cb 0.20 -2.41 0.00 0.00 0.66 0.00 0.00 46.19 44.64 1auz s LEU 52 CO -0.06 -0.45 0.00 -0.24 -1.89 0.00 0.00 176.35 173.71 1auz n SER 53 N 5.54 0.00 0.00 3.68 2.88 -1.26 -4.99 113.62 119.48 1auz n SER 53 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1auz n SER 53 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 1auz n SER 53 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1auz n PHE 54 N -0.14 0.00 -2.53 0.66 7.35 -1.26 -4.88 117.46 116.66 1auz n PHE 54 Ca 0.00 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 56.62 1auz n PHE 54 Cb 0.00 -0.29 0.01 0.00 0.35 0.00 0.00 39.48 39.54 1auz n PHE 54 CO 0.00 0.00 0.00 -0.12 -0.76 0.00 0.00 176.76 175.88 1auz n MET 55 N -1.88 -0.45 0.00 -4.13 0.00 -1.20 -4.87 117.12 104.59 1auz n MET 55 Ca 0.00 0.66 0.00 0.00 -0.00 0.00 0.00 57.70 58.36 1auz n MET 55 Cb 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 33.22 32.35 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 1.08 0.00 -1.15 6.12 -0.08 -0.08 -4.94 116.55 117.48 1auz n ASP 56 Ca -0.01 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 53.35 1auz n ASP 56 Cb 0.39 0.00 0.26 0.00 2.34 0.00 0.00 41.12 44.11 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 3.36 -0.02 1.67 3.41 -1.26 -3.77 113.62 117.02 1auz n SER 57 Ca 0.00 -2.17 -0.01 0.00 -0.26 0.00 0.00 58.87 56.43 1auz n SER 57 Cb 0.00 -0.44 -0.00 0.00 -0.26 0.00 0.00 64.21 63.51 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 3.18 -0.05 1.79 4.04 0.02 -1.92 -3.36 113.55 117.25 1auz h SER 58 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1auz h SER 58 Cb 0.96 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.51 1auz h SER 58 CO 0.09 0.39 0.00 1.23 -1.14 0.00 0.00 176.83 177.40 1auz h GLY 59 N -0.91 0.00 0.02 -3.77 0.00 -1.75 -3.25 103.07 93.41 1auz h GLY 59 Ca -0.01 0.00 0.16 0.00 0.00 0.00 0.00 47.33 47.48 1auz h GLY 59 CO 0.01 0.00 0.28 -2.00 0.00 0.00 0.00 176.54 174.83 1auz h LEU 60 N 0.00 0.21 -0.01 3.11 7.12 -1.71 0.53 115.31 124.56 1auz h LEU 60 Ca 0.00 0.13 -0.23 0.00 0.13 0.00 0.00 57.88 57.91 1auz h LEU 60 Cb 0.89 0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 41.14 1auz h LEU 60 CO 0.00 0.05 -1.06 1.23 -0.13 0.00 0.00 178.44 178.52 1auz h GLY 61 N 0.39 0.15 2.00 3.75 0.00 -1.70 -2.25 103.07 105.42 1auz h GLY 61 Ca 0.44 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 1auz h GLY 61 CO -0.46 0.32 -0.12 -0.24 0.00 0.00 0.00 176.54 176.04 1auz h VAL 62 N 0.05 0.50 0.07 4.60 3.04 -0.89 0.24 116.25 123.86 1auz h VAL 62 Ca -0.06 -0.56 -0.32 0.00 -1.01 0.00 0.00 66.70 64.75 1auz h VAL 62 Cb 1.79 1.38 -0.03 0.00 -2.01 0.00 0.00 31.29 32.42 1auz h VAL 62 CO 0.16 0.11 -1.77 0.40 -1.01 0.00 0.00 177.57 175.47 1auz h ILE 63 N 0.00 0.84 -0.20 3.17 5.03 -0.02 -3.28 117.51 123.05 1auz h ILE 63 Ca -0.00 -2.60 -0.05 0.00 -0.12 0.00 0.00 64.86 62.09 1auz h ILE 63 Cb 0.37 2.52 -0.01 0.00 -3.03 0.00 0.00 36.82 36.67 1auz h ILE 63 CO 0.02 0.71 -0.06 0.25 -0.68 0.00 0.00 178.15 178.39 1auz h LEU 64 N 0.04 0.39 0.00 1.44 5.85 -0.76 0.82 115.31 123.10 1auz h LEU 64 Ca -0.32 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.02 1auz h LEU 64 Cb 2.02 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.94 1auz h LEU 64 CO 0.10 0.68 0.00 0.61 -0.34 0.00 0.00 178.44 179.49 1auz n GLY 65 N -0.11 -0.74 0.11 3.75 0.00 0.79 -1.72 105.19 107.27 1auz n GLY 65 Ca -0.05 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.82 1auz n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1auz n ARG 66 N -1.49 0.70 -0.18 1.61 1.74 -0.86 -3.54 116.66 114.64 1auz n ARG 66 Ca 0.02 0.05 0.13 0.00 -0.77 0.00 0.00 57.85 57.28 1auz n ARG 66 Cb 0.08 -1.51 0.45 0.00 -1.02 0.00 0.00 32.46 30.46 1auz n ARG 66 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 1auz h TYR 67 N 0.00 0.60 0.00 -1.55 3.20 0.02 7.40 116.97 126.65 1auz h TYR 67 Ca -0.55 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 61.17 1auz h TYR 67 Cb 2.09 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 40.14 1auz h TYR 67 CO 0.01 0.25 -1.29 0.87 -1.64 0.00 0.00 178.16 176.35 1auz h LYS 68 N 0.53 0.00 -0.00 1.82 1.79 -1.74 -2.35 116.57 116.62 1auz h LYS 68 Ca 0.37 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.84 1auz h LYS 68 Cb 0.70 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 1auz h LYS 68 CO -0.13 0.33 -0.68 1.04 -1.08 0.00 0.00 179.45 178.92 1auz n GLN 69 N -2.94 0.08 -0.10 3.15 3.00 0.22 -3.34 117.38 117.45 1auz n GLN 69 Ca -0.08 -0.06 -0.16 0.00 -0.01 0.00 0.00 57.00 56.69 1auz n GLN 69 Cb 0.83 -1.50 -0.13 0.00 0.00 0.00 0.00 30.24 29.44 1auz n GLN 69 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.06 178.57 1auz n ILE 70 N -1.41 1.50 0.23 5.09 0.13 2.35 -3.90 119.36 123.36 1auz n ILE 70 Ca 0.05 -0.67 0.11 0.00 -1.10 0.00 0.00 62.75 61.14 1auz n ILE 70 Cb 0.34 -1.17 0.45 0.00 -0.84 0.00 0.00 39.64 38.42 1auz n ILE 70 CO 0.00 0.00 0.00 0.11 2.80 0.00 0.00 176.55 179.46 1auz h LYS 71 N 0.01 0.00 -0.04 9.51 1.57 -1.54 2.95 116.57 129.03 1auz h LYS 71 Ca -0.54 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.06 1auz h LYS 71 Cb 2.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.32 1auz h LYS 71 CO -0.03 0.18 -0.79 0.37 -0.57 0.00 0.00 179.45 178.62 1auz h GLN 72 N 0.00 0.31 -0.19 3.15 4.15 -1.72 -3.13 115.11 117.68 1auz h GLN 72 Ca -0.00 -0.28 -0.19 0.00 0.77 0.00 0.00 58.65 58.95 1auz h GLN 72 Cb 0.76 0.07 -0.30 0.00 0.21 0.00 0.00 27.48 28.22 1auz h GLN 72 CO 0.02 0.95 -0.89 -0.89 -1.93 0.00 0.00 178.83 176.09 1auz n ILE 73 N -3.77 1.17 -1.14 2.39 -0.00 -1.05 -4.69 119.36 112.26 1auz n ILE 73 Ca -0.04 -2.40 0.00 0.00 -0.00 0.00 0.00 62.75 60.31 1auz n ILE 73 Cb 0.74 0.46 0.00 0.00 -0.00 0.00 0.00 39.64 40.84 1auz n ILE 73 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1auz n GLY 74 N -0.31 -0.62 5.00 7.39 0.00 0.98 -4.32 105.19 113.32 1auz n GLY 74 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 0.49 3.08 -0.02 0.00 -1.18 -3.51 105.19 104.04 1auz n GLY 75 Ca 0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 0.40 -0.19 1.61 0.41 -1.26 -4.87 118.70 114.79 1auz s GLU 76 Ca 0.00 -0.25 -0.05 0.00 -0.41 0.00 0.00 54.97 54.26 1auz s GLU 76 Cb 0.00 0.17 -0.03 0.00 -1.78 0.00 0.00 34.13 32.49 1auz s GLU 76 CO 0.00 -0.09 0.00 1.41 -0.49 0.00 0.00 175.26 176.10 1auz s MET 77 N -1.01 3.67 0.20 1.61 1.75 -1.26 -3.36 119.30 120.89 1auz s MET 77 Ca -0.11 -0.50 0.09 0.00 -1.25 0.00 0.00 55.69 53.92 1auz s MET 77 Cb -0.06 -3.08 -0.05 0.00 2.84 0.00 0.00 34.83 34.49 1auz s MET 77 CO 0.01 0.07 -0.17 0.08 -0.65 0.00 0.00 175.02 174.36 1auz s VAL 78 N 0.86 1.87 -0.30 10.11 1.01 -1.26 -4.92 120.40 127.77 1auz s VAL 78 Ca 0.01 -2.14 -0.09 0.00 0.00 0.00 0.00 61.98 59.77 1auz s VAL 78 Cb -0.14 -2.01 0.18 0.00 0.00 0.00 0.00 36.38 34.40 1auz s VAL 78 CO 0.02 -0.47 0.84 0.54 0.00 0.00 0.00 175.10 176.03 1auz s VAL 79 N -2.58 -0.66 0.00 2.92 0.11 -1.26 -3.12 120.40 115.81 1auz s VAL 79 Ca 0.21 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.26 1auz s VAL 79 Cb -0.03 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.82 1auz s VAL 79 CO 0.08 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 171.85 1auz n ALA 81 N -3.00 -0.51 -1.00 0.00 0.00 -1.26 -3.10 120.51 111.65 1auz n ALA 81 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1auz n ALA 81 Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.16 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 -3.34 0.00 -3.62 0.00 0.13 -1.26 -4.25 119.36 107.02 1auz n ILE 82 Ca -0.00 0.00 -0.02 0.00 -1.10 0.00 0.00 62.75 61.63 1auz n ILE 82 Cb 0.53 0.00 -0.02 0.00 -0.84 0.00 0.00 39.64 39.31 1auz n ILE 82 CO 0.00 0.00 0.00 -0.94 2.80 0.00 0.00 176.55 178.41 1auz s SER 83 N -1.18 -0.05 0.00 9.51 1.04 -1.26 -4.96 113.70 116.80 1auz s SER 83 Ca 0.00 -0.01 0.24 0.00 0.48 0.00 0.00 55.95 56.65 1auz s SER 83 Cb 0.00 0.07 1.35 0.00 0.10 0.00 0.00 66.02 67.53 1auz s SER 83 CO 0.00 -0.11 1.78 -0.81 0.98 0.00 0.00 173.24 175.08 1auz n PRO 84 N -0.13 0.62 -0.95 4.02 -0.04 -1.26 -1.28 135.00 135.98 1auz n PRO 84 Ca 0.01 0.02 0.04 0.00 -0.04 0.00 0.00 63.50 63.53 1auz n PRO 84 Cb 0.58 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.61 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 -1.08 2.59 0.00 0.55 0.00 -1.26 -4.75 120.51 116.55 1auz n ALA 85 Ca 0.16 -2.34 0.00 0.00 0.00 0.00 0.00 53.44 51.26 1auz n ALA 85 Cb 0.11 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 -0.16 0.00 0.58 0.00 0.31 -1.01 -4.77 118.33 113.28 1auz n VAL 86 Ca 0.09 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.50 1auz n VAL 86 Cb 0.90 -0.02 0.35 0.00 -0.91 0.00 0.00 33.84 34.17 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 -1.14 0.02 0.24 5.55 0.00 -0.40 -2.03 118.16 120.40 1auz n LYS 87 Ca 0.00 0.21 0.12 0.00 -0.00 0.00 0.00 58.31 58.64 1auz n LYS 87 Cb 0.01 -1.50 0.51 0.00 -0.00 0.00 0.00 35.03 34.06 1auz n LYS 87 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.40 177.47 1auz h ARG 88 N 0.00 0.00 -0.29 -1.58 -0.00 -1.86 0.11 114.38 110.76 1auz h ARG 88 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.96 1auz h ARG 88 Cb 0.27 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.22 1auz h ARG 88 CO 0.00 0.17 0.09 -0.07 -0.00 0.00 0.00 179.97 180.16 1auz h LEU 89 N 0.00 0.42 0.00 0.08 3.38 -1.76 0.13 115.31 117.56 1auz h LEU 89 Ca -0.00 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 1auz h LEU 89 Cb 0.68 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1auz h LEU 89 CO 0.02 0.52 -0.71 -0.26 0.09 0.00 0.00 178.44 178.10 1auz h PHE 90 N 0.31 0.00 -0.12 1.13 -1.00 -1.70 -2.68 116.94 112.88 1auz h PHE 90 Ca 0.09 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.72 1auz h PHE 90 Cb 0.25 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.80 1auz h PHE 90 CO 0.01 0.16 -0.56 0.22 -1.61 0.00 0.00 178.31 176.53 1auz h ASP 91 N 0.00 0.42 0.49 2.17 3.58 -0.58 -1.01 116.42 121.49 1auz h ASP 91 Ca -0.03 -0.23 -0.30 0.00 0.42 0.00 0.00 57.03 56.90 1auz h ASP 91 Cb 1.15 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 42.07 1auz h ASP 91 CO 0.02 0.89 -1.49 -0.03 -2.88 0.00 0.00 179.24 175.75 1auz h MET 92 N 0.29 0.23 -0.25 0.28 4.05 -1.04 -3.34 114.93 115.15 1auz h MET 92 Ca 0.00 -0.40 -0.03 0.00 -0.28 0.00 0.00 59.70 58.99 1auz h MET 92 Cb 1.08 0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 32.01 1auz h MET 92 CO 0.10 1.10 0.03 1.03 0.23 0.00 0.00 176.91 179.39 1auz h SER 93 N 0.06 0.41 0.00 1.39 0.87 -1.44 -3.47 113.55 111.38 1auz h SER 93 Ca -0.22 -0.27 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 1auz h SER 93 Cb 2.00 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.85 1auz h SER 93 CO 0.16 0.58 0.00 0.61 -0.53 0.00 0.00 176.83 177.65 1auz n GLY 94 N -0.42 0.97 1.00 5.77 0.00 -0.39 -4.87 105.19 107.26 1auz n GLY 94 Ca -0.03 0.00 0.08 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 2.91 -0.30 0.99 7.94 -1.25 -4.33 117.00 122.96 1auz n LEU 95 Ca 0.00 -1.46 0.29 0.00 -1.11 0.00 0.00 56.01 53.73 1auz n LEU 95 Cb 0.00 -0.37 0.65 0.00 0.53 0.00 0.00 43.42 44.23 1auz n LEU 95 CO 0.00 0.69 1.27 0.15 -1.11 0.00 0.00 177.39 178.39 1auz h PHE 96 N 3.06 0.28 0.00 1.96 3.04 -1.89 1.77 116.94 125.16 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 0.76 -0.08 -0.00 0.00 2.56 0.00 0.00 35.95 39.19 1auz h PHE 96 CO 0.38 0.02 -0.03 0.87 -2.02 0.00 0.00 178.31 177.53 1auz h LYS 97 N 0.16 0.00 0.00 1.11 1.57 -1.90 1.61 116.57 119.12 1auz h LYS 97 Ca 0.56 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.34 1auz h LYS 97 Cb 1.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.19 1auz h LYS 97 CO -0.13 0.03 -0.18 1.51 -0.57 0.00 0.00 179.45 180.11 1auz n ILE 98 N -3.39 0.17 0.13 1.86 0.00 0.60 -3.36 119.36 115.38 1auz n ILE 98 Ca -0.02 -0.10 0.02 0.00 0.00 0.00 0.00 62.75 62.66 1auz n ILE 98 Cb 0.15 -0.31 -0.03 0.00 0.00 0.00 0.00 39.64 39.44 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 -1.74 0.00 -2.19 9.51 2.08 0.13 -4.87 119.36 122.27 1auz n ILE 99 Ca 0.06 -0.27 -0.04 0.00 0.56 0.00 0.00 62.75 63.06 1auz n ILE 99 Cb 0.37 0.73 0.00 0.00 -0.75 0.00 0.00 39.64 40.00 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 -1.36 -0.31 -3.56 0.38 0.63 0.51 -4.55 116.66 108.40 1auz n ARG 100 Ca 0.00 0.52 -0.21 0.00 -0.92 0.00 0.00 57.85 57.24 1auz n ARG 100 Cb 0.10 -0.68 -0.02 0.00 0.45 0.00 0.00 32.46 32.31 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 -0.65 2.51 0.00 -0.14 2.19 -1.26 -4.09 117.98 116.55 1auz s PHE 101 Ca 0.04 -0.54 0.00 0.00 0.33 0.00 0.00 56.93 56.75 1auz s PHE 101 Cb -0.00 -2.15 0.00 0.00 -1.31 0.00 0.00 43.02 39.56 1auz s PHE 101 CO 0.08 -0.23 0.00 -1.91 1.83 0.00 0.00 175.22 174.99 1auz n GLU 102 N -1.62 0.00 -3.20 10.12 0.00 -1.20 -5.04 120.64 119.70 1auz n GLU 102 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.20 1auz n GLU 102 Cb 0.62 0.00 -0.02 0.00 0.00 0.00 0.00 31.44 32.04 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 3.40 0.52 0.00 5.31 -0.21 -1.26 -4.43 119.66 122.99 1auz s GLN 103 Ca 0.00 0.41 0.00 0.00 0.02 0.00 0.00 55.36 55.79 1auz s GLN 103 Cb 0.00 0.08 0.00 0.00 1.00 0.00 0.00 33.01 34.09 1auz s GLN 103 CO 0.00 -1.05 0.00 0.45 -2.12 0.00 0.00 175.29 172.57 1auz n SER 104 N 5.38 0.00 -0.58 5.90 2.88 -1.26 -3.75 113.62 122.20 1auz n SER 104 Ca 0.04 0.00 0.45 0.00 -1.33 0.00 0.00 58.87 58.03 1auz n SER 104 Cb 0.53 0.00 0.69 0.00 -0.75 0.00 0.00 64.21 64.68 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 0.23 -1.46 2.13 -1.26 0.60 120.64 120.87 1auz n GLU 105 Ca 0.00 0.98 0.11 0.00 0.66 0.00 0.00 57.16 58.91 1auz n GLU 105 Cb 0.00 -2.29 0.44 0.00 0.27 0.00 0.00 31.44 29.86 1auz n GLU 105 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 1auz h GLN 106 N 0.00 0.00 -1.17 5.31 4.15 -1.94 -3.24 115.11 118.22 1auz h GLN 106 Ca 0.79 0.00 0.36 0.00 0.77 0.00 0.00 58.65 60.57 1auz h GLN 106 Cb 3.34 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 30.96 1auz h GLN 106 CO -0.01 0.19 0.81 0.94 -1.93 0.00 0.00 178.83 178.83 1auz n GLN 107 N -3.30 -0.01 -0.04 1.69 -0.06 2.52 0.42 117.38 118.59 1auz n GLN 107 Ca 0.01 0.78 -0.01 0.00 -2.00 0.00 0.00 57.00 55.77 1auz n GLN 107 Cb 0.44 -1.68 -0.00 0.00 -4.06 0.00 0.00 30.24 24.94 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 0.83 0.00 0.00 1.69 0.00 -1.72 -3.33 119.26 116.73 1auz h ALA 108 Ca 0.62 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1auz h ALA 108 Cb 2.29 0.14 0.00 0.00 0.00 0.00 0.00 17.79 20.22 1auz h ALA 108 CO -0.13 0.14 0.02 -0.07 0.00 0.00 0.00 179.25 179.21 1auz h LEU 109 N -0.73 0.00 -1.27 0.00 3.38 0.18 -0.20 115.31 116.67 1auz h LEU 109 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1auz h LEU 109 Cb 0.14 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1auz h LEU 109 CO 0.00 0.00 0.51 0.25 0.09 0.00 0.00 178.44 179.29 1auz h LEU 110 N 0.00 0.82 0.00 1.67 6.46 0.82 0.58 115.31 125.66 1auz h LEU 110 Ca 0.00 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1auz h LEU 110 Cb 0.05 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 39.78 1auz h LEU 110 CO 0.00 0.57 0.00 0.41 -0.62 0.00 0.00 178.44 178.80 1auz n THR 111 N -4.45 0.19 0.00 1.05 -1.04 -0.09 -4.41 114.28 105.53 1auz n THR 111 Ca 0.10 0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 1auz n THR 111 Cb 0.11 -1.05 0.00 0.00 -1.82 0.00 0.00 70.33 67.57 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 -1.05 0.00 0.00 -4.42 -0.00 0.56 -4.27 117.00 107.82 1auz n LEU 112 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1auz n LEU 112 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1auz n LEU 112 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.00 1auz n GLY 113 N -1.44 1.51 0.00 1.47 0.00 0.17 -4.88 105.19 102.02 1auz n GLY 113 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.00 0.00 -3.72 1.61 0.31 -1.26 -4.83 118.33 108.44 1auz n VAL 114 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.02 1auz n VAL 114 Cb 0.00 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 32.87 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 -3.00 -0.92 -0.48 3.52 0.00 -1.26 -4.80 120.51 113.57 1auz n ALA 115 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1auz n ALA 115 Cb 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1auz n ALA 115 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95