#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qe6 n GLN 8 N -2.60 0.66 -3.51 0.00 6.02 -1.26 -4.94 117.38 111.75 1qe6 n GLN 8 Ca 0.11 -0.19 -0.37 0.00 -0.01 0.00 0.00 57.00 56.54 1qe6 n GLN 8 Cb 0.52 -1.53 -0.06 0.00 1.02 0.00 0.00 30.24 30.19 1qe6 n GLN 8 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1qe6 n ILE 10 N 2.73 1.52 -4.07 0.00 5.41 -1.26 -5.02 119.36 118.66 1qe6 n ILE 10 Ca -0.12 -0.56 -0.08 0.00 1.00 0.00 0.00 62.75 62.99 1qe6 n ILE 10 Cb 0.52 -1.49 -0.10 0.00 -0.71 0.00 0.00 39.64 37.87 1qe6 n ILE 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 1qe6 s LYS 11 N -2.52 0.72 0.06 0.38 -2.85 -1.26 -5.17 119.74 109.10 1qe6 s LYS 11 Ca -0.34 -1.23 0.09 0.00 -1.00 0.00 0.00 55.97 53.49 1qe6 s LYS 11 Cb 0.09 0.24 -0.03 0.00 -2.06 0.00 0.00 37.83 36.07 1qe6 s LYS 11 CO 0.60 -0.17 -0.26 0.95 0.10 0.00 0.00 175.35 176.57 1qe6 s THR 12 N -3.94 2.20 0.04 3.79 -4.23 -1.26 -4.33 115.64 107.91 1qe6 s THR 12 Ca 0.11 -1.43 -0.27 0.00 -1.18 0.00 0.00 61.69 58.92 1qe6 s THR 12 Cb 0.07 -1.88 -0.05 0.00 1.34 0.00 0.00 72.50 71.99 1qe6 s THR 12 CO -0.07 0.32 0.85 -0.47 -0.54 0.00 0.00 174.62 174.71 1qe6 s TYR 13 N -0.85 3.72 -0.90 3.99 5.04 0.54 -4.98 117.35 123.92 1qe6 s TYR 13 Ca 0.12 1.56 0.09 0.00 -2.44 0.00 0.00 57.07 56.41 1qe6 s TYR 13 Cb -0.10 -2.93 0.01 0.00 0.35 0.00 0.00 41.96 39.29 1qe6 s TYR 13 CO 0.03 0.17 0.64 0.43 -1.34 0.00 0.00 175.55 175.48 1qe6 n SER 14 N 3.16 1.28 -4.49 4.32 7.64 -1.26 -4.66 113.62 119.61 1qe6 n SER 14 Ca 0.01 -1.14 -0.43 0.00 1.01 0.00 0.00 58.87 58.31 1qe6 n SER 14 Cb 0.50 0.37 -0.06 0.00 -1.01 0.00 0.00 64.21 64.01 1qe6 n SER 14 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1qe6 s LYS 15 N -1.16 3.24 0.26 1.43 2.47 -1.26 -5.02 119.74 119.70 1qe6 s LYS 15 Ca 0.08 -0.51 -0.28 0.00 -1.56 0.00 0.00 55.97 53.69 1qe6 s LYS 15 Cb 0.07 -4.03 -0.15 0.00 -1.46 0.00 0.00 37.83 32.27 1qe6 s LYS 15 CO 0.20 -1.21 0.91 -2.30 0.16 0.00 0.00 175.35 173.12 1qe6 n PRO 16 N 6.55 1.06 -4.04 4.03 -0.02 -1.26 -4.99 135.00 136.34 1qe6 n PRO 16 Ca -0.02 0.37 -0.10 0.00 -2.02 0.00 0.00 63.50 61.73 1qe6 n PRO 16 Cb 0.47 -1.67 -0.08 0.00 -0.02 0.00 0.00 33.50 32.20 1qe6 n PRO 16 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1qe6 s PHE 17 N -1.00 0.59 0.22 6.00 -0.12 -1.26 -5.16 117.98 117.25 1qe6 s PHE 17 Ca 0.60 -0.94 -0.30 0.00 -0.05 0.00 0.00 56.93 56.25 1qe6 s PHE 17 Cb -0.76 -0.19 -0.08 0.00 -0.63 0.00 0.00 43.02 41.36 1qe6 s PHE 17 CO 0.59 -0.69 1.03 -1.58 -0.05 0.00 0.00 175.22 174.52 1qe6 s HIS 18 N -4.01 3.75 -1.18 3.49 5.65 -1.26 -4.95 115.29 116.78 1qe6 s HIS 18 Ca 0.22 1.76 0.10 0.00 0.25 0.00 0.00 55.06 57.39 1qe6 s HIS 18 Cb 0.04 -3.15 0.48 0.00 -1.18 0.00 0.00 32.58 28.77 1qe6 s HIS 18 CO 0.03 -0.12 1.29 -0.35 -0.65 0.00 0.00 174.74 174.93 1qe6 n PRO 19 N 1.79 0.06 0.28 2.88 -0.04 -1.26 -2.87 135.00 135.84 1qe6 n PRO 19 Ca -0.00 0.27 0.13 0.00 -0.04 0.00 0.00 63.50 63.86 1qe6 n PRO 19 Cb 0.46 -1.50 0.83 0.00 -0.04 0.00 0.00 33.50 33.25 1qe6 n PRO 19 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1qe6 h LYS 20 N 0.00 0.00 -0.00 0.54 2.10 -1.96 -2.33 116.57 114.92 1qe6 h LYS 20 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1qe6 h LYS 20 Cb 0.15 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.48 1qe6 h LYS 20 CO 0.00 0.04 -0.14 1.19 -2.00 0.00 0.00 179.45 178.54 1qe6 n PHE 21 N -3.87 0.00 -3.20 0.07 3.72 -1.14 -4.84 117.46 108.20 1qe6 n PHE 21 Ca -0.03 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 56.99 1qe6 n PHE 21 Cb 0.13 -0.34 -0.05 0.00 -0.94 0.00 0.00 39.48 38.28 1qe6 n PHE 21 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1qe6 s ILE 22 N -2.82 5.05 -0.12 4.37 1.01 -0.88 -1.19 121.20 126.63 1qe6 s ILE 22 Ca 0.19 1.19 0.03 0.00 0.00 0.00 0.00 60.65 62.06 1qe6 s ILE 22 Cb 0.19 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 1qe6 s ILE 22 CO 0.55 0.34 0.12 2.29 0.00 0.00 0.00 174.94 178.24 1qe6 n LYS 23 N 3.34 4.42 -3.73 2.79 2.85 -0.18 -4.91 118.16 122.75 1qe6 n LYS 23 Ca -0.05 -0.01 -0.13 0.00 -1.05 0.00 0.00 58.31 57.06 1qe6 n LYS 23 Cb 0.51 -0.76 -0.09 0.00 -0.65 0.00 0.00 35.03 34.03 1qe6 n LYS 23 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 1qe6 s GLU 24 N -1.55 0.56 0.03 -1.58 2.12 -1.13 -4.98 118.70 112.17 1qe6 s GLU 24 Ca 0.01 0.39 0.05 0.00 0.36 0.00 0.00 54.97 55.78 1qe6 s GLU 24 Cb 0.02 0.26 -0.02 0.00 0.26 0.00 0.00 34.13 34.66 1qe6 s GLU 24 CO 0.14 -0.10 -0.14 -1.17 -0.54 0.00 0.00 175.26 173.44 1qe6 s LEU 25 N -0.19 2.15 -0.03 2.70 2.96 -1.26 -1.16 118.68 123.84 1qe6 s LEU 25 Ca -0.04 -0.43 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 1qe6 s LEU 25 Cb -0.03 -0.63 0.03 0.00 0.50 0.00 0.00 46.19 46.06 1qe6 s LEU 25 CO 0.02 0.05 0.06 -0.13 -1.32 0.00 0.00 176.35 175.03 1qe6 s ARG 26 N -1.04 -0.03 -0.16 1.98 0.52 -0.18 -5.00 118.95 115.06 1qe6 s ARG 26 Ca 0.02 0.27 0.00 0.00 -0.52 0.00 0.00 55.73 55.51 1qe6 s ARG 26 Cb -0.08 -0.29 0.03 0.00 0.52 0.00 0.00 34.95 35.13 1qe6 s ARG 26 CO 0.01 -0.21 -0.12 0.08 0.02 0.00 0.00 175.30 175.08 1qe6 s VAL 27 N 1.36 1.52 -0.30 3.52 1.01 -1.26 -0.76 120.40 125.48 1qe6 s VAL 27 Ca -0.06 -0.68 -0.00 0.00 0.00 0.00 0.00 61.98 61.24 1qe6 s VAL 27 Cb -0.13 -1.48 0.06 0.00 0.00 0.00 0.00 36.38 34.83 1qe6 s VAL 27 CO -0.04 0.37 -0.02 -0.63 0.00 0.00 0.00 175.10 174.79 1qe6 s ILE 28 N 1.50 2.72 0.65 2.22 1.01 0.12 -4.98 121.20 124.44 1qe6 s ILE 28 Ca 0.03 -1.55 -0.17 0.00 0.00 0.00 0.00 60.65 58.96 1qe6 s ILE 28 Cb -0.14 -2.61 -0.00 0.00 0.01 0.00 0.00 42.46 39.71 1qe6 s ILE 28 CO -0.10 -0.14 1.25 -0.70 0.00 0.00 0.00 174.94 175.24 1qe6 s GLU 29 N 1.18 2.56 0.75 2.79 2.12 -1.26 -0.82 118.70 126.01 1qe6 s GLU 29 Ca -0.05 1.92 -0.15 0.00 0.36 0.00 0.00 54.97 57.05 1qe6 s GLU 29 Cb -0.20 -1.86 0.05 0.00 0.26 0.00 0.00 34.13 32.38 1qe6 s GLU 29 CO -0.03 -1.55 1.24 -1.54 -0.54 0.00 0.00 175.26 172.83 1qe6 s SER 30 N -1.61 3.95 0.00 -1.70 1.04 -1.26 -4.78 113.70 109.34 1qe6 s SER 30 Ca 0.79 2.45 0.00 0.00 0.48 0.00 0.00 55.95 59.67 1qe6 s SER 30 Cb -0.33 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.19 1qe6 s SER 30 CO 0.39 -2.43 0.00 0.61 0.98 0.00 0.00 173.24 172.79 1qe6 n GLY 31 N 0.62 -0.62 0.33 7.32 0.00 0.96 -4.96 105.19 108.83 1qe6 n GLY 31 Ca 0.14 -0.55 0.22 0.00 0.00 0.00 0.00 46.02 45.83 1qe6 n GLY 31 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1qe6 h PRO 32 N 0.00 0.00 0.11 1.61 0.11 -2.00 -2.96 132.00 128.87 1qe6 h PRO 32 Ca 0.00 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.75 1qe6 h PRO 32 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 1qe6 h PRO 32 CO 0.00 0.00 -1.95 0.00 -0.21 0.00 0.00 178.00 175.84 1qe6 n ALA 35 N 3.82 1.74 -2.46 0.00 0.00 -1.26 -0.03 120.51 122.32 1qe6 n ALA 35 Ca -0.23 0.07 -0.26 0.00 0.00 0.00 0.00 53.44 53.02 1qe6 n ALA 35 Cb 0.53 -1.40 -0.13 0.00 0.00 0.00 0.00 19.45 18.45 1qe6 n ALA 35 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1qe6 s ASN 36 N -4.30 2.96 0.32 0.00 -0.87 -1.26 -4.72 114.94 107.07 1qe6 s ASN 36 Ca 0.05 -0.75 -0.28 0.00 -1.57 0.00 0.00 52.86 50.31 1qe6 s ASN 36 Cb 0.10 -0.19 -0.09 0.00 -0.02 0.00 0.00 41.25 41.05 1qe6 s ASN 36 CO 0.42 0.11 1.16 -0.89 -2.57 0.00 0.00 177.10 175.33 1qe6 s THR 37 N -1.25 3.24 -0.04 1.60 2.01 -1.26 -4.20 115.64 115.74 1qe6 s THR 37 Ca 0.12 1.19 0.06 0.00 0.31 0.00 0.00 61.69 63.38 1qe6 s THR 37 Cb -0.09 -3.74 -0.02 0.00 0.01 0.00 0.00 72.50 68.66 1qe6 s THR 37 CO 0.06 0.24 -0.24 -1.61 -0.69 0.00 0.00 174.62 172.37 1qe6 s GLU 38 N -1.76 2.40 -0.22 4.92 2.02 -0.00 -4.72 118.70 121.33 1qe6 s GLU 38 Ca 0.49 -0.89 0.02 0.00 0.02 0.00 0.00 54.97 54.60 1qe6 s GLU 38 Cb -0.33 -2.14 0.05 0.00 0.10 0.00 0.00 34.13 31.80 1qe6 s GLU 38 CO 0.43 0.46 -0.12 0.42 0.02 0.00 0.00 175.26 176.47 1qe6 s ILE 39 N -0.36 1.93 -0.18 -1.63 1.01 -1.25 -0.70 121.20 120.01 1qe6 s ILE 39 Ca 0.03 -1.25 -0.00 0.00 0.00 0.00 0.00 60.65 59.42 1qe6 s ILE 39 Cb -0.12 -1.97 0.01 0.00 0.01 0.00 0.00 42.46 40.39 1qe6 s ILE 39 CO 0.02 0.16 -0.15 -0.63 0.00 0.00 0.00 174.94 174.33 1qe6 s ILE 40 N 1.26 2.48 0.06 2.92 1.09 0.06 -0.52 121.20 128.54 1qe6 s ILE 40 Ca -0.03 -0.81 0.06 0.00 -1.10 0.00 0.00 60.65 58.78 1qe6 s ILE 40 Cb -0.17 -2.07 -0.04 0.00 -1.06 0.00 0.00 42.46 39.13 1qe6 s ILE 40 CO -0.08 0.51 -0.14 0.68 -0.10 0.00 0.00 174.94 175.81 1qe6 s VAL 41 N 1.23 3.13 -0.24 2.92 -7.23 0.22 -1.01 120.40 119.42 1qe6 s VAL 41 Ca 0.03 -1.15 -0.07 0.00 -1.81 0.00 0.00 61.98 58.98 1qe6 s VAL 41 Cb -0.14 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.39 1qe6 s VAL 41 CO -0.08 0.27 0.06 -0.54 -0.31 0.00 0.00 175.10 174.51 1qe6 s LYS 42 N -1.70 3.70 0.46 4.82 1.02 -0.31 -0.61 119.74 127.11 1qe6 s LYS 42 Ca 0.17 -0.46 -0.03 0.00 0.02 0.00 0.00 55.97 55.67 1qe6 s LYS 42 Cb -0.11 -3.29 -0.02 0.00 -0.52 0.00 0.00 37.83 33.89 1qe6 s LYS 42 CO 0.08 -0.11 0.72 -0.51 -0.92 0.00 0.00 175.35 174.61 1qe6 s LEU 43 N 1.39 3.68 0.50 3.17 1.43 0.18 -1.01 118.68 128.02 1qe6 s LEU 43 Ca 0.05 0.63 0.26 0.00 -1.03 0.00 0.00 54.13 54.04 1qe6 s LEU 43 Cb -0.15 -3.53 1.34 0.00 0.03 0.00 0.00 46.19 43.89 1qe6 s LEU 43 CO 0.03 -0.60 2.03 0.77 0.23 0.00 0.00 176.35 178.81 1qe6 h SER 44 N 0.34 0.00 -0.06 2.29 4.64 -1.48 -2.11 113.55 117.18 1qe6 h SER 44 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1qe6 h SER 44 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1qe6 h SER 44 CO 0.60 0.14 0.00 -0.90 -0.87 0.00 0.00 176.83 175.81 1qe6 n ASP 45 N -3.65 0.45 0.00 4.97 5.68 -1.26 -4.91 116.55 117.83 1qe6 n ASP 45 Ca -0.02 -1.67 0.00 0.00 -0.50 0.00 0.00 54.79 52.60 1qe6 n ASP 45 Cb 0.27 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 1qe6 n ASP 45 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qe6 n GLY 46 N 0.80 2.87 3.77 6.12 0.00 -0.79 -5.07 105.19 112.88 1qe6 n GLY 46 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1qe6 n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qe6 s ARG 47 N -0.02 3.68 -0.36 1.61 0.52 -1.26 -4.74 118.95 118.39 1qe6 s ARG 47 Ca 0.00 1.96 -0.05 0.00 -0.52 0.00 0.00 55.73 57.12 1qe6 s ARG 47 Cb 0.00 -2.46 0.07 0.00 0.52 0.00 0.00 34.95 33.08 1qe6 s ARG 47 CO 0.00 -0.66 0.13 -1.21 0.02 0.00 0.00 175.30 173.57 1qe6 s GLU 48 N -2.62 2.39 0.01 3.54 2.02 -1.26 -0.65 118.70 122.13 1qe6 s GLU 48 Ca 0.63 -1.43 0.02 0.00 0.02 0.00 0.00 54.97 54.22 1qe6 s GLU 48 Cb -0.33 -3.46 -0.04 0.00 0.10 0.00 0.00 34.13 30.40 1qe6 s GLU 48 CO 0.41 -0.81 -0.01 -0.51 0.02 0.00 0.00 175.26 174.36 1qe6 s LEU 49 N 1.29 3.47 -0.20 1.80 1.43 0.22 -4.93 118.68 121.76 1qe6 s LEU 49 Ca 0.01 -0.04 -0.09 0.00 -1.03 0.00 0.00 54.13 52.98 1qe6 s LEU 49 Cb -0.21 -2.01 -0.05 0.00 0.03 0.00 0.00 46.19 43.95 1qe6 s LEU 49 CO -0.00 0.27 0.11 0.00 0.23 0.00 0.00 176.35 176.95 1qe6 s LEU 51 N 0.42 2.84 -0.53 0.00 1.43 0.32 -0.33 118.68 122.83 1qe6 s LEU 51 Ca 0.06 -0.62 -0.28 0.00 -1.03 0.00 0.00 54.13 52.27 1qe6 s LEU 51 Cb -0.12 -1.56 0.03 0.00 0.03 0.00 0.00 46.19 44.57 1qe6 s LEU 51 CO -0.01 0.12 1.11 -0.62 0.23 0.00 0.00 176.35 177.19 1qe6 s ASP 52 N -2.67 6.51 0.16 2.29 -1.08 -1.26 -3.91 116.67 116.71 1qe6 s ASP 52 Ca 0.23 0.19 0.11 0.00 -0.52 0.00 0.00 52.55 52.56 1qe6 s ASP 52 Cb -0.09 -2.53 0.59 0.00 -1.46 0.00 0.00 42.92 39.44 1qe6 s ASP 52 CO 0.13 -1.32 1.34 -0.81 0.52 0.00 0.00 175.17 175.04 1qe6 n PRO 53 N 7.97 0.07 0.02 4.34 -0.04 -1.26 -1.87 135.00 144.23 1qe6 n PRO 53 Ca 0.09 0.55 0.12 0.00 -0.04 0.00 0.00 63.50 64.21 1qe6 n PRO 53 Cb 0.49 -1.72 0.15 0.00 -0.04 0.00 0.00 33.50 32.37 1qe6 n PRO 53 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1qe6 n LYS 54 N -1.87 0.15 -2.69 0.54 4.76 -1.26 -4.72 118.16 113.07 1qe6 n LYS 54 Ca -0.00 0.02 -0.41 0.00 -2.87 0.00 0.00 58.31 55.05 1qe6 n LYS 54 Cb 0.03 -1.57 -0.04 0.00 -1.84 0.00 0.00 35.03 31.60 1qe6 n LYS 54 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1qe6 s GLU 55 N -3.10 4.70 0.17 1.97 0.41 -0.78 -4.96 118.70 117.12 1qe6 s GLU 55 Ca 0.08 1.51 -0.14 0.00 -0.41 0.00 0.00 54.97 56.00 1qe6 s GLU 55 Cb 0.16 -3.35 0.09 0.00 -1.78 0.00 0.00 34.13 29.24 1qe6 s GLU 55 CO 0.74 0.22 1.82 -0.91 -0.49 0.00 0.00 175.26 176.64 1qe6 h ASN 56 N 5.35 0.51 -0.42 -0.19 -0.26 -1.90 -2.00 115.58 116.68 1qe6 h ASN 56 Ca -0.43 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.28 1qe6 h ASN 56 Cb 1.21 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 38.34 1qe6 h ASN 56 CO 0.72 0.36 0.16 4.11 -1.06 0.00 0.00 177.43 181.72 1qe6 h TRP 57 N 0.62 0.69 -0.21 1.19 5.08 -1.95 -1.66 115.95 119.72 1qe6 h TRP 57 Ca 0.20 -0.04 -0.03 0.00 1.08 0.00 0.00 58.89 60.11 1qe6 h TRP 57 Cb -0.00 -0.21 -0.01 0.00 -3.00 0.00 0.00 29.16 25.94 1qe6 h TRP 57 CO -0.06 0.55 0.02 0.28 -1.28 0.00 0.00 178.44 177.96 1qe6 h VAL 58 N 0.67 1.24 -0.45 0.12 2.07 -1.74 -0.90 116.25 117.26 1qe6 h VAL 58 Ca 0.16 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 66.91 1qe6 h VAL 58 Cb 0.17 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1qe6 h VAL 58 CO -0.01 0.24 0.30 1.56 0.02 0.00 0.00 177.57 179.68 1qe6 h GLN 59 N 0.13 0.56 -0.14 1.57 4.20 -0.93 -0.52 115.11 119.98 1qe6 h GLN 59 Ca 0.06 -0.03 -0.21 0.00 0.06 0.00 0.00 58.65 58.53 1qe6 h GLN 59 Cb 0.34 -0.13 0.01 0.00 0.30 0.00 0.00 27.48 28.01 1qe6 h GLN 59 CO 0.01 0.37 -0.73 0.00 -0.67 0.00 0.00 178.83 177.81 1qe6 h ARG 60 N 0.58 0.73 -0.52 1.46 3.08 -1.09 -2.34 114.38 116.29 1qe6 h ARG 60 Ca 0.17 -0.61 -0.04 0.00 0.07 0.00 0.00 59.98 59.57 1qe6 h ARG 60 Cb -0.02 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1qe6 h ARG 60 CO -0.04 1.22 0.16 0.28 -1.07 0.00 0.00 179.97 180.52 1qe6 h VAL 61 N 0.44 1.23 -0.52 2.04 2.07 -0.35 -1.69 116.25 119.48 1qe6 h VAL 61 Ca -0.05 -0.78 -0.11 0.00 0.82 0.00 0.00 66.70 66.57 1qe6 h VAL 61 Cb 1.37 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1qe6 h VAL 61 CO 0.15 0.29 -0.12 0.58 0.02 0.00 0.00 177.57 178.49 1qe6 h VAL 62 N 0.71 1.27 -0.52 2.57 2.07 -1.17 -2.44 116.25 118.73 1qe6 h VAL 62 Ca 0.17 -1.27 -0.07 0.00 0.82 0.00 0.00 66.70 66.35 1qe6 h VAL 62 Cb 0.28 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1qe6 h VAL 62 CO -0.00 0.44 0.07 -0.08 0.02 0.00 0.00 177.57 178.02 1qe6 h GLU 63 N 0.87 0.87 -0.58 1.57 4.57 -1.24 -1.83 114.58 118.81 1qe6 h GLU 63 Ca 0.13 -0.24 -0.10 0.00 -1.18 0.00 0.00 59.36 57.97 1qe6 h GLU 63 Cb 0.68 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.15 1qe6 h GLU 63 CO 0.05 0.87 -0.04 0.87 -1.18 0.00 0.00 179.01 179.58 1qe6 h LYS 64 N 0.75 1.04 -0.16 1.92 1.57 -1.25 -2.24 116.57 118.20 1qe6 h LYS 64 Ca 0.16 -0.34 -0.02 0.00 -1.87 0.00 0.00 60.65 58.57 1qe6 h LYS 64 Cb 0.43 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1qe6 h LYS 64 CO 0.01 1.04 0.02 0.35 -0.57 0.00 0.00 179.45 180.31 1qe6 h PHE 65 N 0.94 0.28 -0.41 -1.35 3.57 -1.34 -2.06 116.94 116.57 1qe6 h PHE 65 Ca 0.16 -0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.69 1qe6 h PHE 65 Cb 0.59 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 39.19 1qe6 h PHE 65 CO 0.04 0.43 0.03 1.25 -2.23 0.00 0.00 178.31 177.83 1qe6 h LEU 66 N 0.04 -0.11 -0.87 0.59 6.46 -1.25 0.12 115.31 120.30 1qe6 h LEU 66 Ca 0.05 0.09 -0.05 0.00 -0.12 0.00 0.00 57.88 57.84 1qe6 h LEU 66 Cb 0.31 0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.35 1qe6 h LEU 66 CO 0.00 -0.02 0.22 0.11 -0.62 0.00 0.00 178.44 178.13 1qe6 h LYS 67 N 0.14 1.06 -0.07 1.25 1.79 -1.36 -1.44 116.57 117.93 1qe6 h LYS 67 Ca 0.20 -0.21 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 1qe6 h LYS 67 Cb 0.28 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 30.76 1qe6 h LYS 67 CO -0.31 0.90 0.01 -0.09 -1.08 0.00 0.00 179.45 178.87 1qe6 h ARG 68 N 1.02 0.13 -0.96 3.15 2.43 -0.61 -2.95 114.38 116.59 1qe6 h ARG 68 Ca 0.23 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.38 1qe6 h ARG 68 Cb 0.28 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.77 1qe6 h ARG 68 CO -0.01 0.37 0.63 0.00 -1.51 0.00 0.00 179.97 179.45 1qe6 h ALA 69 N 0.75 1.34 0.00 2.80 0.00 -0.67 -0.69 119.26 122.80 1qe6 h ALA 69 Ca 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1qe6 h ALA 69 Cb 0.31 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1qe6 h ALA 69 CO 0.00 0.60 0.00 0.39 0.00 0.00 0.00 179.25 180.24 1qe6 n GLU 70 N -4.41 0.00 -0.03 0.00 1.02 -0.55 -0.89 120.64 115.78 1qe6 n GLU 70 Ca 0.12 0.30 0.13 0.00 -0.02 0.00 0.00 57.16 57.68 1qe6 n GLU 70 Cb 0.04 -1.51 0.42 0.00 -0.02 0.00 0.00 31.44 30.37 1qe6 n GLU 70 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1qe6 n ASN 71 N -1.52 1.82 0.00 1.62 3.02 -0.27 -5.09 115.26 114.86 1qe6 n ASN 71 Ca 0.03 -1.64 0.00 0.00 -0.03 0.00 0.00 54.58 52.94 1qe6 n ASN 71 Cb 0.14 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1qe6 n ASN 71 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44