#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 3.49 0.00 -3.43 2.96 -1.26 -4.47 118.68 115.97 1auz s LEU 2 Ca 0.00 -0.02 0.00 0.00 -0.22 0.00 0.00 54.13 53.89 1auz s LEU 2 Cb 0.00 -2.00 0.00 0.00 0.50 0.00 0.00 46.19 44.69 1auz s LEU 2 CO 0.00 0.28 0.00 0.61 -1.32 0.00 0.00 176.35 175.92 1auz n GLY 3 N 1.42 1.01 0.00 7.98 0.00 3.56 -4.91 105.19 114.26 1auz n GLY 3 Ca -0.15 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.14 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 -3.82 -0.61 0.00 -1.25 -4.28 119.36 109.39 1auz n ILE 4 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 62.75 62.63 1auz n ILE 4 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 39.64 39.52 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 -0.14 -0.02 9.51 -1.08 0.21 -4.95 116.67 120.20 1auz s ASP 5 Ca 0.00 0.23 0.01 0.00 -0.52 0.00 0.00 52.55 52.27 1auz s ASP 5 Cb 0.00 0.32 0.01 0.00 -1.46 0.00 0.00 42.92 41.79 1auz s ASP 5 CO 0.00 -0.12 -0.03 -0.04 0.52 0.00 0.00 175.17 175.50 1auz s MET 6 N -0.20 0.47 0.10 4.34 -1.94 -1.24 0.34 119.30 121.16 1auz s MET 6 Ca -0.03 -0.08 -0.00 0.00 -1.71 0.00 0.00 55.69 53.86 1auz s MET 6 Cb -0.02 -0.51 -0.04 0.00 2.01 0.00 0.00 34.83 36.26 1auz s MET 6 CO 0.00 -0.01 -0.01 -0.80 -0.01 0.00 0.00 175.02 174.20 1auz s ASN 7 N 0.46 0.61 0.01 3.03 -0.87 0.28 -4.91 114.94 113.55 1auz s ASN 7 Ca -0.05 -1.08 0.05 0.00 -1.57 0.00 0.00 52.86 50.20 1auz s ASN 7 Cb -0.08 0.21 -0.02 0.00 -0.02 0.00 0.00 41.25 41.34 1auz s ASN 7 CO -0.01 -0.62 -0.15 0.54 -2.57 0.00 0.00 177.10 174.30 1auz s VAL 8 N -3.89 1.16 -0.26 1.60 0.11 -1.24 0.21 120.40 118.10 1auz s VAL 8 Ca 0.15 -0.81 -0.02 0.00 -2.93 0.00 0.00 61.98 58.37 1auz s VAL 8 Cb 0.07 -1.00 0.13 0.00 -1.53 0.00 0.00 36.38 34.04 1auz s VAL 8 CO -0.04 0.18 0.30 -0.54 -3.33 0.00 0.00 175.10 171.68 1auz s LYS 9 N -0.72 0.30 0.00 1.54 -0.14 0.17 -4.88 119.74 116.01 1auz s LYS 9 Ca 0.04 0.13 0.00 0.00 -1.36 0.00 0.00 55.97 54.78 1auz s LYS 9 Cb -0.07 -0.73 0.00 0.00 -1.68 0.00 0.00 37.83 35.35 1auz s LYS 9 CO 0.00 -0.84 0.00 -1.91 -0.76 0.00 0.00 175.35 171.84 1auz n GLU 10 N 5.33 0.00 0.00 1.68 2.13 -1.26 0.55 120.64 129.07 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 -2.19 0.00 0.00 0.27 0.00 0.00 31.44 30.00 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 0.09 0.00 -4.69 4.31 3.41 -1.26 -5.01 113.62 110.47 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 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 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 4.93 -0.55 -3.33 0.11 0.19 0.33 120.40 122.08 1auz s VAL 12 Ca 0.00 1.62 -0.17 0.00 -2.93 0.00 0.00 61.98 60.50 1auz s VAL 12 Cb 0.00 -4.13 0.12 0.00 -1.53 0.00 0.00 36.38 30.85 1auz s VAL 12 CO 0.00 0.11 0.54 -1.48 -3.33 0.00 0.00 175.10 170.94 1auz s LEU 13 N 1.59 6.04 0.15 2.54 0.05 1.47 0.44 118.68 130.97 1auz s LEU 13 Ca 0.39 -1.72 -0.30 0.00 0.05 0.00 0.00 54.13 52.55 1auz s LEU 13 Cb -0.17 -2.23 -0.07 0.00 -2.05 0.00 0.00 46.19 41.67 1auz s LEU 13 CO 0.16 -0.91 1.19 0.00 -0.55 0.00 0.00 176.35 176.24 1auz s ILE 15 N 0.23 1.77 -0.53 0.00 1.09 0.21 0.10 121.20 124.07 1auz s ILE 15 Ca 0.54 -2.26 -0.20 0.00 -1.10 0.00 0.00 60.65 57.63 1auz s ILE 15 Cb -0.31 -2.29 0.06 0.00 -1.06 0.00 0.00 42.46 38.86 1auz s ILE 15 CO 0.34 -0.70 0.70 -0.60 -0.10 0.00 0.00 174.94 174.58 1auz s ARG 16 N 0.83 3.16 -0.18 2.79 6.06 0.15 -2.81 118.95 128.95 1auz s ARG 16 Ca 0.13 -0.79 -0.12 0.00 -2.50 0.00 0.00 55.73 52.45 1auz s ARG 16 Cb -0.21 -4.10 -0.05 0.00 0.06 0.00 0.00 34.95 30.65 1auz s ARG 16 CO -0.10 -1.31 0.22 -0.51 -2.50 0.00 0.00 175.30 171.09 1auz s LEU 17 N 2.94 4.22 -0.18 -0.88 2.01 -1.19 0.64 118.68 126.24 1auz s LEU 17 Ca 0.18 0.37 -0.00 0.00 0.01 0.00 0.00 54.13 54.69 1auz s LEU 17 Cb -0.18 -2.24 0.04 0.00 0.01 0.00 0.00 46.19 43.82 1auz s LEU 17 CO 0.13 0.12 -0.07 0.42 1.01 0.00 0.00 176.35 177.97 1auz s THR 18 N 0.49 1.29 0.00 5.49 -4.23 -1.26 -3.62 115.64 113.81 1auz s THR 18 Ca 0.12 -0.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 1auz s THR 18 Cb -0.12 -1.45 0.00 0.00 1.34 0.00 0.00 72.50 72.26 1auz s THR 18 CO 0.02 0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 1auz n GLY 19 N 4.80 -0.14 3.37 3.99 0.00 -1.09 0.72 105.19 116.85 1auz n GLY 19 Ca -0.13 -0.12 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 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 1.40 -0.44 1.61 8.01 -1.26 -4.05 118.70 123.97 1auz s GLU 20 Ca 0.00 -1.52 -0.00 0.00 0.01 0.00 0.00 54.97 53.45 1auz s GLU 20 Cb 0.00 -1.46 0.12 0.00 -4.31 0.00 0.00 34.13 28.47 1auz s GLU 20 CO 0.00 0.29 0.21 -0.51 0.01 0.00 0.00 175.26 175.26 1auz s LEU 21 N -2.93 5.04 0.24 1.80 1.02 -1.26 -4.53 118.68 118.05 1auz s LEU 21 Ca 0.20 -2.30 -0.15 0.00 0.02 0.00 0.00 54.13 51.91 1auz s LEU 21 Cb -0.05 -1.76 0.00 0.00 0.02 0.00 0.00 46.19 44.40 1auz s LEU 21 CO 0.09 -0.44 0.51 1.51 0.02 0.00 0.00 176.35 178.04 1auz s ASP 22 N 1.20 -0.14 0.61 2.29 -4.77 -1.26 0.24 116.67 114.84 1auz s ASP 22 Ca 0.11 -0.80 0.27 0.00 -3.30 0.00 0.00 52.55 48.83 1auz s ASP 22 Cb -0.22 0.60 1.10 0.00 -1.09 0.00 0.00 42.92 43.32 1auz s ASP 22 CO -0.05 -1.14 1.51 1.12 0.70 0.00 0.00 175.17 177.31 1auz h HIS 23 N 2.22 0.00 0.03 2.11 2.07 -1.92 5.33 115.15 124.99 1auz h HIS 23 Ca -0.26 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.26 1auz h HIS 23 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1auz h HIS 23 CO 0.39 0.00 -0.02 0.45 -3.07 0.00 0.00 177.93 175.69 1auz h HIS 24 N 0.00 -0.04 0.00 6.12 3.86 -1.96 -3.15 115.15 119.99 1auz h HIS 24 Ca 0.37 -0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 59.35 1auz h HIS 24 Cb 2.24 0.01 -0.03 0.00 1.06 0.00 0.00 27.41 30.69 1auz h HIS 24 CO 0.00 0.65 -1.10 1.79 0.86 0.00 0.00 177.93 180.12 1auz h THR 25 N -0.85 1.55 0.00 2.45 1.35 0.54 -3.14 112.91 114.80 1auz h THR 25 Ca -0.00 -3.27 0.00 0.00 -0.55 0.00 0.00 66.41 62.58 1auz h THR 25 Cb 0.71 2.76 0.00 0.00 -1.73 0.00 0.00 68.15 69.89 1auz h THR 25 CO 0.01 0.88 0.00 0.00 -0.25 0.00 0.00 175.52 176.16 1auz n ALA 26 N -2.38 1.23 0.06 6.62 0.00 1.66 -2.06 120.51 125.64 1auz n ALA 26 Ca -0.03 0.15 -0.13 0.00 0.00 0.00 0.00 53.44 53.44 1auz n ALA 26 Cb 0.95 -1.31 -0.08 0.00 0.00 0.00 0.00 19.45 19.01 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 -0.10 -0.79 0.00 4.57 -1.49 -0.64 114.58 116.13 1auz h GLU 27 Ca 0.00 0.01 0.16 0.00 -1.18 0.00 0.00 59.36 58.34 1auz h GLU 27 Cb 0.11 0.02 -0.15 0.00 -0.16 0.00 0.00 28.75 28.57 1auz h GLU 27 CO 0.00 0.08 -0.20 0.00 -1.18 0.00 0.00 179.01 177.71 1auz h THR 28 N -0.27 0.21 0.00 0.32 1.03 -1.62 1.72 112.91 114.30 1auz h THR 28 Ca -0.01 0.00 -0.06 0.00 -0.01 0.00 0.00 66.41 66.33 1auz h THR 28 Cb 0.23 0.21 -0.01 0.00 -1.07 0.00 0.00 68.15 67.51 1auz h THR 28 CO 0.02 0.00 -0.29 0.25 -0.01 0.00 0.00 175.52 175.49 1auz h LEU 29 N -0.00 0.00 -0.63 0.00 5.85 -1.65 -2.46 115.31 116.42 1auz h LEU 29 Ca 0.38 0.00 0.08 0.00 0.84 0.00 0.00 57.88 59.18 1auz h LEU 29 Cb 0.58 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.54 1auz h LEU 29 CO -0.81 0.29 0.28 0.50 -0.34 0.00 0.00 178.44 178.36 1auz h LYS 30 N 0.00 0.49 0.01 1.25 3.11 0.42 -0.59 116.57 121.26 1auz h LYS 30 Ca -0.00 -0.03 -0.24 0.00 -2.81 0.00 0.00 60.65 57.57 1auz h LYS 30 Cb 0.70 -0.11 0.01 0.00 -1.00 0.00 0.00 32.23 31.83 1auz h LYS 30 CO 0.04 0.33 -0.99 -0.56 -2.81 0.00 0.00 179.45 175.45 1auz h GLN 31 N 0.51 0.47 0.00 1.90 3.07 -1.10 -2.93 115.11 117.03 1auz h GLN 31 Ca 0.31 -0.53 0.00 0.00 0.09 0.00 0.00 58.65 58.52 1auz h GLN 31 Cb 0.32 0.15 0.00 0.00 0.08 0.00 0.00 27.48 28.04 1auz h GLN 31 CO -0.26 1.17 0.00 1.17 0.09 0.00 0.00 178.83 181.00 1auz n LYS 32 N -3.76 0.11 0.16 0.06 3.00 -0.60 -1.75 118.16 115.37 1auz n LYS 32 Ca -0.08 0.60 -0.12 0.00 -0.00 0.00 0.00 58.31 58.72 1auz n LYS 32 Cb 0.86 -1.85 -0.07 0.00 0.00 0.00 0.00 35.03 33.98 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 0.49 -0.98 3.15 2.07 -0.95 -1.92 116.25 118.11 1auz h VAL 33 Ca 0.00 -0.72 0.10 0.00 0.82 0.00 0.00 66.70 66.90 1auz h VAL 33 Cb 0.01 0.77 -0.08 0.00 -1.52 0.00 0.00 31.29 30.47 1auz h VAL 33 CO 0.00 0.11 0.62 0.00 0.02 0.00 0.00 177.57 178.31 1auz h THR 34 N -0.94 0.98 -0.67 2.57 1.03 -1.48 0.66 112.91 115.06 1auz h THR 34 Ca -0.05 -0.36 0.01 0.00 -0.01 0.00 0.00 66.41 66.01 1auz h THR 34 Cb 0.52 -0.15 -0.03 0.00 -1.07 0.00 0.00 68.15 67.42 1auz h THR 34 CO 0.08 0.19 0.44 1.56 -0.01 0.00 0.00 175.52 177.77 1auz h GLN 35 N 1.04 0.86 0.00 0.00 4.20 -1.50 -1.44 115.11 118.27 1auz h GLN 35 Ca 0.46 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 59.05 1auz h GLN 35 Cb 0.36 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1auz h GLN 35 CO -0.23 0.57 -0.34 1.03 -0.67 0.00 0.00 178.83 179.19 1auz h SER 36 N 0.89 0.00 -0.86 1.46 0.87 -0.33 -1.92 113.55 113.65 1auz h SER 36 Ca 0.25 0.00 0.19 0.00 -1.23 0.00 0.00 61.79 61.00 1auz h SER 36 Cb -0.09 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 61.81 1auz h SER 36 CO -0.06 0.34 0.57 -0.07 -0.53 0.00 0.00 176.83 177.09 1auz h LEU 37 N 0.00 0.38 -5.00 2.23 -0.00 0.14 -3.35 115.31 109.71 1auz h LEU 37 Ca -0.00 0.04 -0.10 0.00 -0.00 0.00 0.00 57.88 57.81 1auz h LEU 37 Cb 1.10 -0.04 -0.15 0.00 -0.00 0.00 0.00 40.66 41.57 1auz h LEU 37 CO 0.04 0.16 -0.32 -0.62 -0.00 0.00 0.00 178.44 177.71 1auz n GLU 38 N -4.49 0.39 -0.05 1.13 1.02 -1.18 -4.93 120.64 112.53 1auz n GLU 38 Ca 0.18 -1.43 -0.13 0.00 -0.02 0.00 0.00 57.16 55.76 1auz n GLU 38 Cb 0.67 -0.82 -0.07 0.00 -0.02 0.00 0.00 31.44 31.20 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 4.35 0.33 0.00 3.49 3.64 -1.49 -3.48 116.57 123.42 1auz h LYS 39 Ca -0.03 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 1auz h LYS 39 Cb 1.13 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1auz h LYS 39 CO 0.00 0.69 0.00 -0.25 -2.27 0.00 0.00 179.45 177.62 1auz n ASP 40 N -4.60 0.00 0.00 4.20 10.43 -1.26 -5.09 116.55 120.22 1auz n ASP 40 Ca -0.06 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.30 1auz n ASP 40 Cb 0.33 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.29 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 -3.37 -2.24 2.03 -1.26 -5.02 116.55 106.69 1auz n ASP 41 Ca 0.00 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.14 1auz n ASP 41 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 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 -0.33 0.00 5.18 -1.09 -1.26 -5.00 121.20 118.70 1auz s ILE 42 Ca 0.00 -0.95 0.00 0.00 -2.23 0.00 0.00 60.65 57.47 1auz s ILE 42 Cb 0.00 -0.73 0.00 0.00 -1.58 0.00 0.00 42.46 40.15 1auz s ILE 42 CO 0.00 -0.58 0.00 0.54 -1.23 0.00 0.00 174.94 173.67 1auz n ARG 43 N 4.37 1.26 -4.17 2.79 1.74 -1.26 -4.97 116.66 116.41 1auz n ARG 43 Ca 0.10 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 57.06 1auz n ARG 43 Cb 0.45 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.79 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 0.51 0.96 0.23 -1.55 3.76 1.00 -4.51 115.29 115.69 1auz s HIS 44 Ca 0.00 -0.81 0.06 0.00 -0.15 0.00 0.00 55.06 54.16 1auz s HIS 44 Cb 0.00 -0.54 -0.03 0.00 1.11 0.00 0.00 32.58 33.12 1auz s HIS 44 CO 0.00 -0.08 0.23 0.96 -0.85 0.00 0.00 174.74 175.00 1auz s ILE 45 N -3.18 4.72 -0.50 0.60 -5.25 -1.21 0.43 121.20 116.81 1auz s ILE 45 Ca 0.10 -1.20 0.07 0.00 -0.99 0.00 0.00 60.65 58.63 1auz s ILE 45 Cb 0.02 -3.53 0.19 0.00 2.95 0.00 0.00 42.46 42.09 1auz s ILE 45 CO -0.03 -0.29 0.70 -0.69 -1.79 0.00 0.00 174.94 172.85 1auz s VAL 46 N -2.01 -0.98 0.42 8.37 1.01 -0.83 -4.26 120.40 122.11 1auz s VAL 46 Ca 0.33 -0.82 -0.15 0.00 0.00 0.00 0.00 61.98 61.33 1auz s VAL 46 Cb -0.09 -0.02 -0.08 0.00 0.00 0.00 0.00 36.38 36.19 1auz s VAL 46 CO 0.26 -0.02 0.85 -0.76 0.00 0.00 0.00 175.10 175.44 1auz s LEU 47 N 1.06 3.86 -0.30 3.92 1.02 -1.22 0.66 118.68 127.67 1auz s LEU 47 Ca 0.27 1.40 -0.17 0.00 0.02 0.00 0.00 54.13 55.65 1auz s LEU 47 Cb -0.01 -4.27 0.17 0.00 0.02 0.00 0.00 46.19 42.11 1auz s LEU 47 CO -0.06 -0.39 1.20 0.21 0.02 0.00 0.00 176.35 177.34 1auz s ASN 48 N -2.70 -0.12 -0.24 2.29 3.04 -1.12 -3.26 114.94 112.82 1auz s ASN 48 Ca 0.56 0.06 -0.06 0.00 0.04 0.00 0.00 52.86 53.47 1auz s ASN 48 Cb -0.10 1.10 -0.02 0.00 -1.54 0.00 0.00 41.25 40.69 1auz s ASN 48 CO 0.24 -0.02 0.03 -1.48 -3.04 0.00 0.00 177.10 172.83 1auz s LEU 49 N 2.99 3.28 0.02 3.21 2.34 -1.26 -3.17 118.68 126.09 1auz s LEU 49 Ca -0.02 -0.32 0.22 0.00 0.06 0.00 0.00 54.13 54.07 1auz s LEU 49 Cb -0.07 -1.85 -0.24 0.00 -0.56 0.00 0.00 46.19 43.47 1auz s LEU 49 CO -0.10 -0.04 0.60 1.21 -1.06 0.00 0.00 176.35 176.96 1auz n GLU 50 N 4.87 0.65 -3.00 1.48 2.13 -1.24 -4.49 120.64 121.04 1auz n GLU 50 Ca -0.17 -0.09 -0.40 0.00 0.66 0.00 0.00 57.16 57.17 1auz n GLU 50 Cb 0.51 -1.61 -0.00 0.00 0.27 0.00 0.00 31.44 30.61 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 -2.43 6.15 -4.65 4.31 4.64 -1.26 -5.00 116.55 118.31 1auz n ASP 51 Ca -0.06 -3.48 -0.38 0.00 -1.38 0.00 0.00 54.79 49.49 1auz n ASP 51 Cb 0.63 -1.14 -0.08 0.00 -1.04 0.00 0.00 41.12 39.49 1auz n ASP 51 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 1auz s LEU 52 N -3.06 4.12 0.00 -2.67 1.98 -1.26 -2.69 118.68 115.11 1auz s LEU 52 Ca 0.34 0.47 0.00 0.00 -2.89 0.00 0.00 54.13 52.06 1auz s LEU 52 Cb 0.10 -2.51 0.00 0.00 0.66 0.00 0.00 46.19 44.44 1auz s LEU 52 CO 0.04 -0.11 0.00 -0.24 -1.89 0.00 0.00 176.35 174.15 1auz n SER 53 N 4.72 0.00 0.34 3.68 2.88 -1.26 -5.00 113.62 118.99 1auz n SER 53 Ca -0.08 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.32 1auz n SER 53 Cb 0.51 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.90 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 -0.82 -6.12 0.66 3.57 -1.90 -3.49 116.94 108.84 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 0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1auz h PHE 54 CO 0.00 -0.51 -0.35 -0.12 -2.23 0.00 0.00 178.31 175.10 1auz n MET 55 N -4.84 -1.30 -4.00 1.11 0.00 -1.16 -4.88 117.12 102.05 1auz n MET 55 Ca -0.11 1.30 -0.25 0.00 -0.00 0.00 0.00 57.70 58.64 1auz n MET 55 Cb 0.35 -1.20 -0.05 0.00 0.00 0.00 0.00 33.22 32.31 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 -0.31 4.57 0.00 6.12 -1.08 0.68 -4.92 116.67 121.73 1auz s ASP 56 Ca -0.02 -1.07 0.14 0.00 -0.52 0.00 0.00 52.55 51.08 1auz s ASP 56 Cb 0.00 -0.30 0.73 0.00 -1.46 0.00 0.00 42.92 41.90 1auz s ASP 56 CO 0.06 -0.68 1.32 -0.24 0.52 0.00 0.00 175.17 176.15 1auz n SER 57 N -1.39 0.00 -0.22 -0.34 2.88 -1.26 -2.87 113.62 110.42 1auz n SER 57 Ca -0.01 -0.09 -0.02 0.00 -1.33 0.00 0.00 58.87 57.41 1auz n SER 57 Cb 0.64 -0.18 0.09 0.00 -0.75 0.00 0.00 64.21 64.00 1auz n SER 57 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1auz h SER 58 N 0.00 0.51 0.51 -3.46 0.02 -1.93 -0.39 113.55 108.82 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 0.08 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1auz h SER 58 CO 0.00 0.34 -0.30 0.61 -1.14 0.00 0.00 176.83 176.34 1auz n GLY 59 N -1.28 -1.12 0.30 -3.77 0.00 -1.14 -3.97 105.19 94.21 1auz n GLY 59 Ca 0.07 -0.30 0.09 0.00 0.00 0.00 0.00 46.02 45.88 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 0.32 0.36 0.09 0.99 7.12 -1.17 0.65 115.31 123.68 1auz h LEU 60 Ca 0.00 0.12 -0.26 0.00 0.13 0.00 0.00 57.88 57.87 1auz h LEU 60 Cb 0.47 0.09 -0.01 0.00 -0.53 0.00 0.00 40.66 40.68 1auz h LEU 60 CO 0.00 0.10 -1.20 1.23 -0.13 0.00 0.00 178.44 178.43 1auz h GLY 61 N 0.48 0.21 2.00 3.75 0.00 -1.69 -2.16 103.07 105.66 1auz h GLY 61 Ca 0.48 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 1auz h GLY 61 CO -0.44 0.48 -0.13 -0.24 0.00 0.00 0.00 176.54 176.21 1auz h VAL 62 N 0.05 0.59 0.07 4.60 3.04 -1.05 0.01 116.25 123.56 1auz h VAL 62 Ca -0.11 -0.58 -0.32 0.00 -1.01 0.00 0.00 66.70 64.68 1auz h VAL 62 Cb 1.92 1.38 -0.03 0.00 -2.01 0.00 0.00 31.29 32.55 1auz h VAL 62 CO 0.18 0.13 -1.75 0.40 -1.01 0.00 0.00 177.57 175.51 1auz h ILE 63 N 0.00 0.86 -0.62 3.17 5.03 0.20 -3.34 117.51 122.81 1auz h ILE 63 Ca -0.00 -2.61 -0.04 0.00 -0.12 0.00 0.00 64.86 62.09 1auz h ILE 63 Cb 0.37 2.55 -0.03 0.00 -3.03 0.00 0.00 36.82 36.67 1auz h ILE 63 CO 0.02 0.73 0.24 0.25 -0.68 0.00 0.00 178.15 178.71 1auz h LEU 64 N 0.04 0.87 -1.62 1.44 5.85 -0.72 -2.03 115.31 119.14 1auz h LEU 64 Ca -0.32 -0.18 0.14 0.00 0.84 0.00 0.00 57.88 58.36 1auz h LEU 64 Cb 2.02 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 42.78 1auz h LEU 64 CO 0.10 0.81 0.47 1.23 -0.34 0.00 0.00 178.44 180.72 1auz h GLY 65 N 0.88 0.62 0.95 3.75 0.00 -1.15 -0.39 103.07 107.73 1auz h GLY 65 Ca 0.21 -0.16 -0.12 0.00 0.00 0.00 0.00 47.33 47.25 1auz h GLY 65 CO -0.02 0.07 -0.32 -0.09 0.00 0.00 0.00 176.54 176.18 1auz h ARG 66 N 0.39 0.66 -0.59 4.80 1.12 -1.49 -2.76 114.38 116.49 1auz h ARG 66 Ca 0.34 -0.37 0.09 0.00 -1.11 0.00 0.00 59.98 58.93 1auz h ARG 66 Cb 0.78 0.03 -0.07 0.00 -0.01 0.00 0.00 29.97 30.69 1auz h ARG 66 CO -0.10 0.99 0.20 -0.92 -3.11 0.00 0.00 179.97 177.03 1auz h TYR 67 N 0.37 0.35 -0.38 2.20 3.20 -0.70 0.39 116.97 122.41 1auz h TYR 67 Ca 0.03 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.82 1auz h TYR 67 Cb 0.90 -0.07 -0.07 0.00 1.54 0.00 0.00 36.73 39.03 1auz h TYR 67 CO 0.08 0.08 0.15 1.63 -1.64 0.00 0.00 178.16 178.45 1auz n LYS 68 N -5.02 2.33 -0.01 1.82 4.76 -0.91 -2.61 118.16 118.53 1auz n LYS 68 Ca 0.08 -1.52 -0.01 0.00 -2.87 0.00 0.00 58.31 53.99 1auz n LYS 68 Cb 0.27 -1.74 -0.01 0.00 -1.84 0.00 0.00 35.03 31.71 1auz n LYS 68 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1auz n GLN 69 N 0.03 0.08 0.01 1.97 3.00 0.12 -4.03 117.38 118.56 1auz n GLN 69 Ca 0.21 0.01 -0.04 0.00 -0.01 0.00 0.00 57.00 57.17 1auz n GLN 69 Cb 0.88 -1.04 -0.11 0.00 0.00 0.00 0.00 30.24 29.98 1auz n GLN 69 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.06 178.03 1auz h ILE 70 N 0.00 0.69 0.16 5.09 6.09 -1.19 -2.96 117.51 125.39 1auz h ILE 70 Ca -0.05 -2.35 -0.34 0.00 -1.37 0.00 0.00 64.86 60.75 1auz h ILE 70 Cb 1.07 2.23 0.00 0.00 0.47 0.00 0.00 36.82 40.60 1auz h ILE 70 CO -0.01 0.39 -1.75 0.11 -3.07 0.00 0.00 178.15 173.83 1auz h LYS 71 N 0.00 0.34 0.00 2.19 1.57 -1.72 0.49 116.57 119.45 1auz h LYS 71 Ca -0.21 -0.59 0.00 0.00 -1.87 0.00 0.00 60.65 57.98 1auz h LYS 71 Cb 1.78 0.22 0.00 0.00 0.08 0.00 0.00 32.23 34.30 1auz h LYS 71 CO 0.06 1.28 0.00 -0.56 -0.57 0.00 0.00 179.45 179.66 1auz h GLN 72 N 0.03 0.00 0.16 3.15 3.07 -1.72 -2.76 115.11 117.04 1auz h GLN 72 Ca -0.36 0.00 -0.33 0.00 0.09 0.00 0.00 58.65 58.06 1auz h GLN 72 Cb 2.03 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.59 1auz h GLN 72 CO 0.14 0.00 -1.61 0.97 0.09 0.00 0.00 178.83 178.42 1auz h ILE 73 N 0.00 1.08 0.00 1.86 2.10 -1.60 -3.48 117.51 117.47 1auz h ILE 73 Ca 0.00 -2.68 0.00 0.00 1.08 0.00 0.00 64.86 63.26 1auz h ILE 73 Cb 0.48 2.79 0.00 0.00 -1.09 0.00 0.00 36.82 38.99 1auz h ILE 73 CO 0.00 0.83 0.00 0.61 -1.08 0.00 0.00 178.15 178.51 1auz n GLY 74 N 1.74 0.77 0.00 8.18 0.00 -1.04 -5.02 105.19 109.83 1auz n GLY 74 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 5.49 2.97 -0.02 0.00 0.17 -4.93 105.19 108.87 1auz n GLY 75 Ca 0.00 -1.01 -0.11 0.00 0.00 0.00 0.00 46.02 44.90 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 4.91 0.30 -0.16 1.61 0.41 -1.21 -4.50 118.70 120.06 1auz s GLU 76 Ca 0.00 -0.47 0.02 0.00 -0.41 0.00 0.00 54.97 54.10 1auz s GLU 76 Cb 0.00 -0.05 0.01 0.00 -1.78 0.00 0.00 34.13 32.32 1auz s GLU 76 CO 0.00 -0.00 -0.21 0.00 -0.49 0.00 0.00 175.26 174.56 1auz s MET 77 N -1.05 3.00 0.11 1.61 0.23 -1.26 -3.31 119.30 118.61 1auz s MET 77 Ca -0.10 -0.84 0.04 0.00 -1.03 0.00 0.00 55.69 53.76 1auz s MET 77 Cb -0.07 -2.48 -0.04 0.00 -1.53 0.00 0.00 34.83 30.71 1auz s MET 77 CO -0.00 -0.09 -0.10 0.08 -2.03 0.00 0.00 175.02 172.87 1auz s VAL 78 N 1.01 0.97 -0.25 5.16 1.01 -1.26 -4.91 120.40 122.13 1auz s VAL 78 Ca -0.02 -1.73 -0.15 0.00 0.00 0.00 0.00 61.98 60.07 1auz s VAL 78 Cb -0.14 -1.47 0.07 0.00 0.00 0.00 0.00 36.38 34.84 1auz s VAL 78 CO -0.06 -0.61 0.62 0.54 0.00 0.00 0.00 175.10 175.59 1auz s VAL 79 N -2.66 -0.01 0.06 2.92 0.11 -1.24 -3.44 120.40 116.15 1auz s VAL 79 Ca 0.08 0.02 0.01 0.00 -2.93 0.00 0.00 61.98 59.16 1auz s VAL 79 Cb -0.01 -0.90 -0.00 0.00 -1.53 0.00 0.00 36.38 33.94 1auz s VAL 79 CO -0.00 0.01 0.02 0.00 -3.33 0.00 0.00 175.10 171.80 1auz n ALA 81 N -2.73 -2.37 -2.68 0.00 0.00 -1.26 -4.01 120.51 107.46 1auz n ALA 81 Ca -0.02 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1auz n ALA 81 Cb 0.09 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.53 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 -0.93 0.00 0.00 0.00 0.13 -1.26 -4.56 119.36 112.74 1auz n ILE 82 Ca 0.02 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.67 1auz n ILE 82 Cb 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 39.17 1auz n ILE 82 CO 0.00 0.00 0.00 -0.24 2.80 0.00 0.00 176.55 179.11 1auz n SER 83 N 0.00 0.00 0.00 9.51 2.88 -1.26 -4.92 113.62 119.83 1auz n SER 83 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 1auz n SER 83 Cb 0.00 0.00 0.64 0.00 -0.75 0.00 0.00 64.21 64.10 1auz n SER 83 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1auz n PRO 84 N -0.29 0.74 -0.64 -1.46 -0.04 -1.26 -1.27 135.00 130.79 1auz n PRO 84 Ca 0.00 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.49 1auz n PRO 84 Cb 0.00 -1.45 0.05 0.00 -0.04 0.00 0.00 33.50 32.06 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 -0.95 2.29 0.00 0.55 0.00 -1.26 -4.73 120.51 116.41 1auz n ALA 85 Ca 0.16 -1.84 0.00 0.00 0.00 0.00 0.00 53.44 51.76 1auz n ALA 85 Cb 0.07 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.01 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 -0.29 0.00 0.70 0.00 0.31 -0.96 -4.74 118.33 113.36 1auz n VAL 86 Ca 0.06 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.49 1auz n VAL 86 Cb 0.78 -0.16 0.43 0.00 -0.91 0.00 0.00 33.84 33.98 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 -1.42 0.02 0.20 5.55 2.85 -0.39 -2.38 118.16 122.59 1auz n LYS 87 Ca 0.00 0.15 0.07 0.00 -1.05 0.00 0.00 58.31 57.48 1auz n LYS 87 Cb 0.12 -1.50 0.40 0.00 -0.65 0.00 0.00 35.03 33.40 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 -0.35 -1.58 -0.00 -1.85 0.23 114.38 110.83 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 0.33 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 30.29 1auz h ARG 88 CO 0.00 0.33 0.14 -0.07 -0.00 0.00 0.00 179.97 180.37 1auz h LEU 89 N 0.00 0.49 0.00 0.08 3.38 -1.81 0.72 115.31 118.16 1auz h LEU 89 Ca -0.00 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 1auz h LEU 89 Cb 0.79 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1auz h LEU 89 CO 0.04 0.51 -0.72 -0.26 0.09 0.00 0.00 178.44 178.10 1auz h PHE 90 N 0.43 0.00 -0.14 1.13 -1.00 -1.69 -2.48 116.94 113.18 1auz h PHE 90 Ca 0.12 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.75 1auz h PHE 90 Cb 0.18 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.73 1auz h PHE 90 CO -0.00 0.20 -0.56 0.22 -1.61 0.00 0.00 178.31 176.55 1auz h ASP 91 N 0.00 0.47 0.62 2.17 1.82 -0.28 -1.63 116.42 119.60 1auz h ASP 91 Ca -0.03 -0.26 -0.27 0.00 -0.39 0.00 0.00 57.03 56.08 1auz h ASP 91 Cb 1.18 -0.14 -0.03 0.00 0.68 0.00 0.00 39.33 41.02 1auz h ASP 91 CO 0.02 0.94 -1.46 -0.03 -1.61 0.00 0.00 179.24 177.10 1auz h MET 92 N 0.32 0.07 -0.57 0.28 4.05 -0.93 -3.32 114.93 114.84 1auz h MET 92 Ca 0.00 -0.12 -0.10 0.00 -0.28 0.00 0.00 59.70 59.20 1auz h MET 92 Cb 1.09 0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.91 1auz h MET 92 CO 0.10 0.83 -0.03 1.03 0.23 0.00 0.00 176.91 179.07 1auz h SER 93 N 0.02 0.99 0.00 1.39 0.87 -1.39 -3.47 113.55 111.96 1auz h SER 93 Ca -0.19 -0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 1auz h SER 93 Cb 1.94 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 63.63 1auz h SER 93 CO 0.12 1.06 0.00 0.61 -0.53 0.00 0.00 176.83 178.09 1auz n GLY 94 N -0.42 0.52 0.55 5.77 0.00 -0.62 -4.87 105.19 106.13 1auz n GLY 94 Ca 0.03 -0.05 0.05 0.00 0.00 0.00 0.00 46.02 46.04 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 2.77 -0.34 0.99 7.94 -1.24 -4.62 117.00 122.50 1auz n LEU 95 Ca 0.00 -1.96 0.27 0.00 -1.11 0.00 0.00 56.01 53.22 1auz n LEU 95 Cb 0.00 -0.19 0.58 0.00 0.53 0.00 0.00 43.42 44.34 1auz n LEU 95 CO 0.00 0.69 1.25 0.15 -1.11 0.00 0.00 177.39 178.36 1auz h PHE 96 N 1.79 0.48 0.00 1.96 3.04 -1.88 1.85 116.94 124.17 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 0.69 -0.14 -0.00 0.00 2.56 0.00 0.00 35.95 39.06 1auz h PHE 96 CO 0.19 0.01 -0.01 0.87 -2.02 0.00 0.00 178.31 177.36 1auz h LYS 97 N 0.26 0.00 -0.00 1.11 6.56 -1.90 1.71 116.57 124.31 1auz h LYS 97 Ca 0.61 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.20 1auz h LYS 97 Cb 1.82 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.48 1auz h LYS 97 CO -0.24 0.01 -0.29 1.51 -2.06 0.00 0.00 179.45 178.38 1auz n ILE 98 N -3.50 0.00 0.13 1.86 0.00 0.63 -3.50 119.36 114.98 1auz n ILE 98 Ca -0.03 -0.02 0.03 0.00 0.00 0.00 0.00 62.75 62.73 1auz n ILE 98 Cb 0.09 -0.00 -0.04 0.00 0.00 0.00 0.00 39.64 39.69 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 -1.37 0.00 -1.94 9.51 -0.00 0.23 -4.88 119.36 120.92 1auz n ILE 99 Ca 0.08 -0.25 0.00 0.00 -0.00 0.00 0.00 62.75 62.57 1auz n ILE 99 Cb 0.33 0.69 0.00 0.00 -0.00 0.00 0.00 39.64 40.66 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 -1.41 -0.14 -4.17 0.38 0.63 0.52 -4.48 116.66 107.99 1auz n ARG 100 Ca 0.00 0.41 -0.26 0.00 -0.92 0.00 0.00 57.85 57.08 1auz n ARG 100 Cb 0.12 -0.52 -0.07 0.00 0.45 0.00 0.00 32.46 32.44 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 -0.53 2.40 0.00 -0.14 2.19 -1.26 -3.61 117.98 117.03 1auz s PHE 101 Ca 0.00 -0.66 0.00 0.00 0.33 0.00 0.00 56.93 56.60 1auz s PHE 101 Cb 0.00 -1.92 0.00 0.00 -1.31 0.00 0.00 43.02 39.79 1auz s PHE 101 CO 0.00 0.11 0.00 -1.91 1.83 0.00 0.00 175.22 175.25 1auz n GLU 102 N -1.30 0.00 -3.37 10.12 0.00 -1.17 -5.02 120.64 119.90 1auz n GLU 102 Ca -0.03 0.00 -0.16 0.00 0.00 0.00 0.00 57.16 56.97 1auz n GLU 102 Cb 0.65 0.00 -0.08 0.00 0.00 0.00 0.00 31.44 32.01 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 2.37 0.52 0.00 5.31 -0.21 -1.26 -4.18 119.66 122.21 1auz s GLN 103 Ca 0.00 -0.54 0.00 0.00 0.02 0.00 0.00 55.36 54.84 1auz s GLN 103 Cb 0.00 -0.66 0.00 0.00 1.00 0.00 0.00 33.01 33.35 1auz s GLN 103 CO 0.00 -1.13 0.00 0.45 -2.12 0.00 0.00 175.29 172.49 1auz n SER 104 N 4.68 0.00 -0.52 5.90 2.88 -1.26 -3.91 113.62 121.39 1auz n SER 104 Ca 0.06 0.00 0.43 0.00 -1.33 0.00 0.00 58.87 58.03 1auz n SER 104 Cb 0.46 0.00 0.66 0.00 -0.75 0.00 0.00 64.21 64.58 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 0.21 -1.46 2.13 -1.26 0.62 120.64 120.88 1auz n GLU 105 Ca 0.00 1.01 0.14 0.00 0.66 0.00 0.00 57.16 58.98 1auz n GLU 105 Cb 0.00 -2.40 0.46 0.00 0.27 0.00 0.00 31.44 29.77 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 -1.20 5.31 4.15 -1.94 -3.28 115.11 118.16 1auz h GLN 106 Ca 0.76 0.00 0.37 0.00 0.77 0.00 0.00 58.65 60.54 1auz h GLN 106 Cb 3.35 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 30.97 1auz h GLN 106 CO -0.01 0.00 0.83 0.94 -1.93 0.00 0.00 178.83 178.67 1auz n GLN 107 N -2.79 -0.01 -0.06 1.69 -0.06 2.66 0.27 117.38 119.09 1auz n GLN 107 Ca 0.03 0.77 -0.04 0.00 -2.00 0.00 0.00 57.00 55.75 1auz n GLN 107 Cb 0.37 -1.68 -0.04 0.00 -4.06 0.00 0.00 30.24 24.83 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 0.81 0.01 -0.01 1.69 0.00 -1.74 -3.31 119.26 116.71 1auz h ALA 108 Ca 0.62 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1auz h ALA 108 Cb 2.33 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 20.16 1auz h ALA 108 CO -0.12 0.04 0.01 1.25 0.00 0.00 0.00 179.25 180.43 1auz h LEU 109 N -1.00 0.00 -1.00 0.00 6.46 0.21 -0.74 115.31 119.24 1auz h LEU 109 Ca -0.01 0.00 0.13 0.00 -0.12 0.00 0.00 57.88 57.88 1auz h LEU 109 Cb 0.32 0.00 -0.09 0.00 -0.73 0.00 0.00 40.66 40.16 1auz h LEU 109 CO -0.00 0.00 0.62 0.25 -0.62 0.00 0.00 178.44 178.69 1auz h LEU 110 N 0.00 0.89 0.00 2.25 5.85 0.38 0.78 115.31 125.46 1auz h LEU 110 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1auz h LEU 110 Cb 0.01 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 40.93 1auz h LEU 110 CO -0.00 0.45 0.00 0.41 -0.34 0.00 0.00 178.44 178.96 1auz n THR 111 N -4.65 0.41 0.00 1.05 -1.04 -0.28 -4.20 114.28 105.57 1auz n THR 111 Ca 0.19 0.11 0.00 0.00 -2.04 0.00 0.00 64.05 62.31 1auz n THR 111 Cb 0.39 -1.11 0.00 0.00 -1.82 0.00 0.00 70.33 67.79 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 -1.09 0.00 -1.82 -4.42 -0.00 0.23 -4.08 117.00 105.81 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 0.06 0.61 -0.00 0.00 0.00 177.39 178.06 1auz n GLY 113 N -1.40 -0.55 4.24 1.47 0.00 0.12 -3.90 105.19 105.17 1auz n GLY 113 Ca 0.00 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 1auz n GLY 113 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1auz n VAL 114 N -1.04 -1.52 -3.57 1.61 3.14 -1.25 0.15 118.33 115.85 1auz n VAL 114 Ca 0.00 -0.52 -0.29 0.00 -2.96 0.00 0.00 64.34 60.57 1auz n VAL 114 Cb 0.43 -1.39 -0.05 0.00 -1.06 0.00 0.00 33.84 31.76 1auz n VAL 114 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1auz n ALA 115 N -4.67 -0.84 -0.74 1.55 0.00 -1.26 -5.15 120.51 109.41 1auz n ALA 115 Ca -0.28 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1auz n ALA 115 Cb 0.67 -1.71 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1auz n ALA 115 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95