#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qou n LYS 13 N 0.00 0.75 -1.78 2.89 5.02 -1.26 -5.09 118.16 118.69 2qou n LYS 13 Ca 0.00 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 2qou n LYS 13 Cb 0.00 -1.18 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 2qou n LYS 13 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2qou n GLN 14 N -1.87 -4.54 0.00 1.97 1.13 -1.14 -5.02 117.38 107.91 2qou n GLN 14 Ca -0.03 3.31 0.00 0.00 -1.94 0.00 0.00 57.00 58.34 2qou n GLN 14 Cb 0.31 -3.47 0.00 0.00 0.11 0.00 0.00 30.24 27.18 2qou n GLN 14 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2qou n VAL 15 N 1.55 0.00 0.00 5.09 0.31 -0.09 -4.95 118.33 120.24 2qou n VAL 15 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2qou n VAL 15 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2qou n VAL 15 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2qou n SER 16 N -0.35 0.00 -4.08 4.52 7.64 -0.05 -4.83 113.62 116.46 2qou n SER 16 Ca 0.00 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.73 2qou n SER 16 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 2qou n SER 16 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2qou s ASP 17 N 0.00 0.89 0.00 6.43 1.47 -1.21 0.64 116.67 124.90 2qou s ASP 17 Ca 0.00 -1.47 0.00 0.00 1.18 0.00 0.00 52.55 52.26 2qou s ASP 17 Cb 0.00 0.35 0.00 0.00 -0.34 0.00 0.00 42.92 42.93 2qou s ASP 17 CO 0.00 -0.85 0.00 0.61 0.68 0.00 0.00 175.17 175.61 2qou n GLY 18 N -0.43 -0.90 3.85 2.12 0.00 -1.25 -4.50 105.19 104.08 2qou n GLY 18 Ca 0.02 -1.31 -0.37 0.00 0.00 0.00 0.00 46.02 44.35 2qou n GLY 18 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qou s VAL 19 N -2.00 5.09 -0.84 1.61 -7.23 0.61 -1.88 120.40 115.75 2qou s VAL 19 Ca 0.00 0.72 0.01 0.00 -1.81 0.00 0.00 61.98 60.90 2qou s VAL 19 Cb 0.00 -3.67 0.32 0.00 0.56 0.00 0.00 36.38 33.59 2qou s VAL 19 CO 0.00 0.55 1.36 0.00 -0.31 0.00 0.00 175.10 176.70 2qou n ALA 20 N 1.72 5.26 -1.56 1.32 0.00 -1.20 0.00 120.51 126.06 2qou n ALA 20 Ca -0.14 -4.69 -0.48 0.00 0.00 0.00 0.00 53.44 48.12 2qou n ALA 20 Cb 0.53 -1.58 -0.04 0.00 0.00 0.00 0.00 19.45 18.36 2qou n ALA 20 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2qou n HIS 21 N 0.18 1.09 -3.96 0.00 8.25 -0.26 -3.28 115.22 117.24 2qou n HIS 21 Ca 0.37 0.73 -0.21 0.00 -0.26 0.00 0.00 57.72 58.34 2qou n HIS 21 Cb 0.33 -2.23 -0.17 0.00 1.12 0.00 0.00 29.99 29.04 2qou n HIS 21 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2qou s ILE 22 N -0.41 0.46 -0.48 1.59 1.01 0.30 -0.74 121.20 122.92 2qou s ILE 22 Ca 0.71 -0.00 -0.12 0.00 0.00 0.00 0.00 60.65 61.23 2qou s ILE 22 Cb -0.85 -0.55 0.11 0.00 0.01 0.00 0.00 42.46 41.18 2qou s ILE 22 CO 0.54 0.24 0.38 -2.28 0.00 0.00 0.00 174.94 173.82 2qou s HIS 23 N 1.42 3.34 -1.13 3.97 5.65 -0.65 -2.60 115.29 125.30 2qou s HIS 23 Ca -0.03 -1.53 -0.09 0.00 0.25 0.00 0.00 55.06 53.66 2qou s HIS 23 Cb -0.13 -3.44 0.27 0.00 -1.18 0.00 0.00 32.58 28.10 2qou s HIS 23 CO -0.03 -0.95 1.21 0.00 -0.65 0.00 0.00 174.74 174.33 2qou n ALA 24 N 5.04 4.35 -1.70 1.58 0.00 -1.16 -2.01 120.51 126.61 2qou n ALA 24 Ca -0.11 -4.64 -0.30 0.00 0.00 0.00 0.00 53.44 48.39 2qou n ALA 24 Cb 0.41 -2.52 0.06 0.00 0.00 0.00 0.00 19.45 17.41 2qou n ALA 24 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qou s SER 25 N 1.04 5.05 0.28 0.00 1.04 -0.36 -3.45 113.70 117.30 2qou s SER 25 Ca 0.32 1.27 0.24 0.00 0.48 0.00 0.00 55.95 58.26 2qou s SER 25 Cb -0.07 -2.06 1.03 0.00 0.10 0.00 0.00 66.02 65.02 2qou s SER 25 CO -0.05 -1.61 1.72 0.49 0.98 0.00 0.00 173.24 174.77 2qou n PHE 26 N -3.20 0.84 -0.33 5.02 3.72 -1.26 -3.10 117.46 119.14 2qou n PHE 26 Ca 0.07 0.34 0.00 0.00 -0.05 0.00 0.00 57.45 57.81 2qou n PHE 26 Cb 0.56 -1.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.05 2qou n PHE 26 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2qou n ASN 27 N -2.28 1.13 -3.53 4.37 3.02 -1.26 -4.85 115.26 111.87 2qou n ASN 27 Ca 0.01 -1.46 -0.01 0.00 -0.03 0.00 0.00 54.58 53.09 2qou n ASN 27 Cb 0.20 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.39 2qou n ASN 27 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2qou s ASN 28 N -0.46 -0.01 -0.25 6.41 3.04 -1.18 -4.36 114.94 118.13 2qou s ASN 28 Ca 0.00 -0.49 -0.23 0.00 0.04 0.00 0.00 52.86 52.18 2qou s ASN 28 Cb 0.00 0.38 0.06 0.00 -1.54 0.00 0.00 41.25 40.15 2qou s ASN 28 CO 0.00 -0.75 0.66 -0.89 -3.04 0.00 0.00 177.10 173.08 2qou s THR 29 N -2.20 -0.00 -0.03 -5.21 2.01 -1.26 -1.22 115.64 107.73 2qou s THR 29 Ca 0.23 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.23 2qou s THR 29 Cb -0.01 -0.91 0.03 0.00 0.01 0.00 0.00 72.50 71.61 2qou s THR 29 CO 0.03 0.00 0.02 0.27 -0.69 0.00 0.00 174.62 174.24 2qou s ILE 30 N 0.36 0.08 -0.46 1.82 -5.25 -0.85 -0.21 121.20 116.68 2qou s ILE 30 Ca -0.00 0.16 -0.12 0.00 -0.99 0.00 0.00 60.65 59.70 2qou s ILE 30 Cb -0.05 -0.20 0.09 0.00 2.95 0.00 0.00 42.46 45.25 2qou s ILE 30 CO 0.01 0.13 0.34 -0.69 -1.79 0.00 0.00 174.94 172.94 2qou s VAL 31 N 1.16 4.63 -0.33 8.37 1.01 0.89 -1.63 120.40 134.49 2qou s VAL 31 Ca -0.08 -1.39 -0.10 0.00 0.00 0.00 0.00 61.98 60.41 2qou s VAL 31 Cb -0.13 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.38 2qou s VAL 31 CO -0.02 -0.63 0.17 -0.89 0.00 0.00 0.00 175.10 173.73 2qou s THR 32 N 1.49 4.57 -0.22 3.92 2.01 0.08 -0.79 115.64 126.71 2qou s THR 32 Ca 0.04 -0.60 -0.15 0.00 0.31 0.00 0.00 61.69 61.28 2qou s THR 32 Cb -0.25 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 68.80 2qou s THR 32 CO 0.03 -0.05 0.39 -0.63 -0.69 0.00 0.00 174.62 173.66 2qou s ILE 33 N 1.59 5.19 0.05 1.82 -1.09 0.23 -1.10 121.20 127.89 2qou s ILE 33 Ca 0.04 0.65 -0.06 0.00 -2.23 0.00 0.00 60.65 59.05 2qou s ILE 33 Cb -0.18 -3.71 -0.01 0.00 -1.58 0.00 0.00 42.46 36.98 2qou s ILE 33 CO 0.06 0.22 0.11 0.28 -1.23 0.00 0.00 174.94 174.39 2qou s THR 34 N 1.53 0.14 0.98 2.92 -1.32 0.10 -0.63 115.64 119.36 2qou s THR 34 Ca 0.18 -1.16 -0.11 0.00 -1.21 0.00 0.00 61.69 59.38 2qou s THR 34 Cb -0.15 -1.03 0.18 0.00 -1.51 0.00 0.00 72.50 69.98 2qou s THR 34 CO 0.08 -0.64 1.09 1.51 -2.21 0.00 0.00 174.62 174.45 2qou s ASP 35 N -2.32 2.63 0.47 8.08 -4.77 -1.02 0.22 116.67 119.95 2qou s ASP 35 Ca -0.02 1.67 0.24 0.00 -3.30 0.00 0.00 52.55 51.14 2qou s ASP 35 Cb 0.01 -2.31 1.27 0.00 -1.09 0.00 0.00 42.92 40.80 2qou s ASP 35 CO -0.06 -3.20 1.85 0.03 0.70 0.00 0.00 175.17 174.49 2qou h ARG 36 N -1.93 0.22 -0.75 2.11 3.08 -1.86 1.00 114.38 116.25 2qou h ARG 36 Ca -0.51 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.50 2qou h ARG 36 Cb 1.29 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.26 2qou h ARG 36 CO 0.50 0.15 0.36 1.96 -1.07 0.00 0.00 179.97 181.87 2qou h GLN 37 N 0.23 1.07 0.00 0.04 1.08 -1.98 -3.47 115.11 112.09 2qou h GLN 37 Ca 0.49 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 57.54 2qou h GLN 37 Cb 1.52 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 28.75 2qou h GLN 37 CO -0.13 0.82 0.00 0.41 -0.95 0.00 0.00 178.83 178.99 2qou n GLY 38 N -1.07 1.79 3.61 3.46 0.00 0.35 -5.10 105.19 108.22 2qou n GLY 38 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2qou n GLY 38 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qou s ASN 39 N -2.00 6.72 0.19 1.61 0.01 -1.25 -4.87 114.94 115.35 2qou s ASN 39 Ca 0.00 0.70 -0.33 0.00 -0.71 0.00 0.00 52.86 52.52 2qou s ASN 39 Cb 0.00 -2.45 -0.14 0.00 0.41 0.00 0.00 41.25 39.06 2qou s ASN 39 CO 0.00 -0.75 1.36 0.00 -1.51 0.00 0.00 177.10 176.19 2qou n ALA 40 N 6.53 0.39 -0.03 0.60 0.00 -1.26 -2.44 120.51 124.31 2qou n ALA 40 Ca 0.06 0.44 -0.04 0.00 0.00 0.00 0.00 53.44 53.91 2qou n ALA 40 Cb 0.48 -2.19 -0.02 0.00 0.00 0.00 0.00 19.45 17.71 2qou n ALA 40 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qou n LEU 41 N 2.35 2.75 -3.64 0.00 4.77 0.19 -4.91 117.00 118.51 2qou n LEU 41 Ca 0.14 -0.02 -0.03 0.00 -0.03 0.00 0.00 56.01 56.07 2qou n LEU 41 Cb 0.28 -0.18 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 2qou n LEU 41 CO 0.62 0.54 1.10 -0.83 -1.33 0.00 0.00 177.39 177.50 2qou s GLY 42 N -4.57 0.08 0.14 -0.72 0.00 -0.66 -4.80 107.32 96.78 2qou s GLY 42 Ca -0.07 2.85 -0.06 0.00 0.00 0.00 0.00 44.72 47.44 2qou s GLY 42 CO 0.12 1.26 0.18 0.66 0.00 0.00 0.00 173.10 175.32 2qou s TRP 43 N -0.81 0.50 0.05 1.90 1.48 -1.26 0.75 118.94 121.55 2qou s TRP 43 Ca 0.07 -0.89 0.01 0.00 -1.06 0.00 0.00 56.10 54.23 2qou s TRP 43 Cb -0.02 -0.20 -0.03 0.00 -1.16 0.00 0.00 33.47 32.06 2qou s TRP 43 CO -0.08 -0.61 -0.06 0.00 -4.06 0.00 0.00 176.95 172.13 2qou s ALA 44 N -3.97 0.60 -0.08 2.67 0.00 0.03 -4.75 121.76 116.26 2qou s ALA 44 Ca 0.17 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 51.18 2qou s ALA 44 Cb 0.05 0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.31 2qou s ALA 44 CO -0.02 -0.13 0.04 -0.08 0.00 0.00 0.00 175.76 175.57 2qou s THR 45 N -2.18 0.14 0.12 0.00 -1.32 -1.26 -0.08 115.64 111.06 2qou s THR 45 Ca -0.04 0.18 -0.17 0.00 -1.21 0.00 0.00 61.69 60.45 2qou s THR 45 Cb -0.05 -0.41 0.02 0.00 -1.51 0.00 0.00 72.50 70.56 2qou s THR 45 CO -0.02 0.15 0.99 0.00 -2.21 0.00 0.00 174.62 173.52 2qou n ALA 46 N 5.22 -0.30 0.06 11.08 0.00 0.70 0.15 120.51 137.42 2qou n ALA 46 Ca -0.05 0.58 -0.06 0.00 0.00 0.00 0.00 53.44 53.90 2qou n ALA 46 Cb 0.50 -0.16 -0.03 0.00 0.00 0.00 0.00 19.45 19.76 2qou n ALA 46 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2qou h GLY 47 N 0.00 -1.09 2.00 0.00 0.00 -1.79 -1.88 103.07 100.32 2qou h GLY 47 Ca 0.14 0.50 -0.00 0.00 0.00 0.00 0.00 47.33 47.98 2qou h GLY 47 CO -0.61 -0.36 -0.00 -1.33 0.00 0.00 0.00 176.54 174.23 2qou h GLY 48 N -0.29 0.00 0.73 4.60 0.00 -1.39 -2.02 103.07 104.70 2qou h GLY 48 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2qou h GLY 48 CO -0.07 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.91 2qou n SER 49 N -3.09 0.00 0.00 0.19 7.64 0.40 -4.85 113.62 113.91 2qou n SER 49 Ca -0.03 -0.32 0.00 0.00 1.01 0.00 0.00 58.87 59.53 2qou n SER 49 Cb 0.09 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2qou n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qou n GLY 50 N -0.42 1.21 3.79 0.23 0.00 -0.76 -4.95 105.19 104.29 2qou n GLY 50 Ca 0.04 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 2qou n GLY 50 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qou s PHE 51 N 0.00 2.89 0.23 1.61 -0.12 -1.25 -5.00 117.98 116.35 2qou s PHE 51 Ca 0.00 1.54 0.02 0.00 -0.05 0.00 0.00 56.93 58.44 2qou s PHE 51 Cb 0.00 -3.09 -0.01 0.00 -0.63 0.00 0.00 43.02 39.29 2qou s PHE 51 CO 0.00 -1.18 0.06 0.54 -0.05 0.00 0.00 175.22 174.59 2qou n ARG 52 N -1.67 0.86 0.00 1.99 5.12 -1.26 -4.16 116.66 117.53 2qou n ARG 52 Ca 0.10 -1.88 0.00 0.00 -1.93 0.00 0.00 57.85 54.14 2qou n ARG 52 Cb 0.52 0.92 0.00 0.00 -1.16 0.00 0.00 32.46 32.75 2qou n ARG 52 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qou n GLY 53 N 0.86 3.59 0.11 -0.13 0.00 -1.26 -3.38 105.19 104.97 2qou n GLY 53 Ca -0.05 0.02 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 2qou n GLY 53 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qou h SER 54 N 0.00 -0.43 -0.02 1.61 4.64 -1.99 -2.18 113.55 115.18 2qou h SER 54 Ca 0.00 0.06 0.01 0.00 -0.47 0.00 0.00 61.79 61.38 2qou h SER 54 Cb 0.00 0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2qou h SER 54 CO 0.00 -0.09 0.02 0.03 -0.87 0.00 0.00 176.83 175.92 2qou h ARG 55 N -0.10 0.00 -1.30 4.77 3.08 -1.94 -2.81 114.38 116.09 2qou h ARG 55 Ca 0.02 0.00 0.38 0.00 0.07 0.00 0.00 59.98 60.44 2qou h ARG 55 Cb 0.14 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.13 2qou h ARG 55 CO -0.14 0.00 0.93 -0.22 -1.07 0.00 0.00 179.97 179.47 2qou h LYS 56 N 0.00 0.02 -2.30 0.04 3.64 -1.40 -2.12 116.57 114.46 2qou h LYS 56 Ca 0.01 -0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.75 2qou h LYS 56 Cb 0.06 -0.00 -0.39 0.00 -0.41 0.00 0.00 32.23 31.49 2qou h LYS 56 CO -0.00 0.01 -0.29 0.45 -2.27 0.00 0.00 179.45 177.36 2qou n SER 57 N -4.17 4.91 -4.35 4.20 2.88 -1.06 -4.49 113.62 111.54 2qou n SER 57 Ca 0.28 -3.63 -0.18 0.00 -1.33 0.00 0.00 58.87 54.02 2qou n SER 57 Cb 1.34 -0.72 -0.10 0.00 -0.75 0.00 0.00 64.21 63.98 2qou n SER 57 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2qou s THR 58 N -3.97 1.00 0.30 2.46 -4.23 -0.80 -4.80 115.64 105.60 2qou s THR 58 Ca 0.45 -2.02 -0.01 0.00 -1.18 0.00 0.00 61.69 58.93 2qou s THR 58 Cb 0.23 -2.45 0.19 0.00 1.34 0.00 0.00 72.50 71.81 2qou s THR 58 CO -0.10 -0.24 1.88 1.55 -0.54 0.00 0.00 174.62 177.17 2qou h PRO 59 N 2.41 0.85 -1.01 3.99 0.13 -1.89 -2.50 132.00 133.99 2qou h PRO 59 Ca -0.39 -0.13 0.11 0.00 -0.87 0.00 0.00 66.00 64.72 2qou h PRO 59 Cb 1.23 -0.15 -0.08 0.00 0.13 0.00 0.00 31.00 32.13 2qou h PRO 59 CO 0.65 0.70 0.64 0.35 -0.23 0.00 0.00 178.00 180.11 2qou h PHE 60 N 0.84 1.16 -0.26 1.56 -0.00 -1.97 -2.82 116.94 115.46 2qou h PHE 60 Ca 0.20 0.03 0.03 0.00 -0.00 0.00 0.00 57.97 58.24 2qou h PHE 60 Cb 0.18 -0.37 -0.06 0.00 -0.00 0.00 0.00 35.95 35.69 2qou h PHE 60 CO 0.01 0.49 -0.46 0.00 -0.00 0.00 0.00 178.31 178.35 2qou h ALA 61 N 1.52 -0.74 -0.73 2.41 0.00 -1.72 -1.66 119.26 118.34 2qou h ALA 61 Ca 0.49 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.50 2qou h ALA 61 Cb 0.43 1.01 -0.13 0.00 0.00 0.00 0.00 17.79 19.10 2qou h ALA 61 CO -0.25 -0.94 -0.31 0.00 0.00 0.00 0.00 179.25 177.75 2qou h ALA 62 N -0.35 0.14 0.16 0.00 0.00 -1.61 0.60 119.26 118.20 2qou h ALA 62 Ca 0.05 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2qou h ALA 62 Cb 0.52 0.79 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2qou h ALA 62 CO -0.45 -0.60 -0.18 0.37 0.00 0.00 0.00 179.25 178.39 2qou h GLN 63 N -0.09 -0.33 -0.64 0.00 4.15 -1.44 0.18 115.11 116.94 2qou h GLN 63 Ca 0.29 0.02 0.17 0.00 0.77 0.00 0.00 58.65 59.91 2qou h GLN 63 Cb 0.57 0.08 -0.03 0.00 0.21 0.00 0.00 27.48 28.30 2qou h GLN 63 CO -0.78 -0.22 0.45 -0.24 -1.93 0.00 0.00 178.83 176.11 2qou h VAL 64 N -0.35 0.72 0.00 2.39 3.04 -0.89 -1.49 116.25 119.67 2qou h VAL 64 Ca -0.02 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 2qou h VAL 64 Cb 0.31 0.61 0.00 0.00 -2.01 0.00 0.00 31.29 30.20 2qou h VAL 64 CO -0.03 0.02 0.00 0.00 -1.01 0.00 0.00 177.57 176.54 2qou n ALA 65 N -2.63 -0.25 -0.24 3.17 0.00 0.21 -2.25 120.51 118.53 2qou n ALA 65 Ca 0.12 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.58 2qou n ALA 65 Cb 0.65 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.20 2qou n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qou h ALA 66 N -2.00 0.59 -0.16 0.00 0.00 -0.55 0.81 119.26 117.95 2qou h ALA 66 Ca 0.00 0.24 0.05 0.00 0.00 0.00 0.00 54.91 55.20 2qou h ALA 66 Cb 0.00 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2qou h ALA 66 CO 0.00 -0.42 0.12 1.05 0.00 0.00 0.00 179.25 180.00 2qou h GLU 67 N 0.05 0.00 0.00 0.00 4.11 -1.40 0.53 114.58 117.87 2qou h GLU 67 Ca 0.36 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.68 2qou h GLU 67 Cb 0.58 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 2qou h GLU 67 CO -0.66 0.00 -0.52 -0.09 0.07 0.00 0.00 179.01 177.81 2qou h ARG 68 N 0.00 0.00 0.12 1.06 2.43 0.10 -3.28 114.38 114.81 2qou h ARG 68 Ca 0.07 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 58.99 2qou h ARG 68 Cb 0.31 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 29.89 2qou h ARG 68 CO -0.00 0.52 -1.06 0.00 -1.51 0.00 0.00 179.97 177.92 2qou h ALA 70 N 0.23 2.14 0.00 0.00 0.00 -1.37 0.16 119.26 120.42 2qou h ALA 70 Ca -0.17 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qou h ALA 70 Cb 1.77 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.62 2qou h ALA 70 CO 0.20 -0.61 0.00 -3.47 0.00 0.00 0.00 179.25 175.37 2qou n ASP 71 N -4.76 1.30 0.00 0.00 -0.08 -1.23 -1.11 116.55 110.68 2qou n ASP 71 Ca 0.28 -0.87 0.00 0.00 -1.51 0.00 0.00 54.79 52.69 2qou n ASP 71 Cb 0.92 -0.22 0.00 0.00 2.34 0.00 0.00 41.12 44.16 2qou n ASP 71 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qou n ALA 72 N 0.82 0.00 -0.03 -1.67 0.00 0.56 -4.95 120.51 115.24 2qou n ALA 72 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2qou n ALA 72 Cb 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.62 2qou n ALA 72 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2qou n VAL 73 N 0.00 0.36 0.27 0.00 0.24 -0.27 -4.58 118.33 114.36 2qou n VAL 73 Ca 0.00 -0.20 0.13 0.00 -2.04 0.00 0.00 64.34 62.23 2qou n VAL 73 Cb 0.00 -0.83 0.82 0.00 -1.47 0.00 0.00 33.84 32.37 2qou n VAL 73 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2qou h LYS 74 N 0.00 0.00 0.00 7.34 1.57 -1.57 0.17 116.57 124.08 2qou h LYS 74 Ca -0.14 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.59 2qou h LYS 74 Cb 1.29 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.60 2qou h LYS 74 CO -0.00 0.00 -0.21 1.05 -0.57 0.00 0.00 179.45 179.72 2qou h GLU 75 N 0.00 0.00 -0.99 3.15 9.09 -1.81 -2.32 114.58 121.71 2qou h GLU 75 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.42 2qou h GLU 75 Cb 0.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.17 2qou h GLU 75 CO -0.00 0.21 0.00 0.66 0.05 0.00 0.00 179.01 179.93 2qou n TYR 76 N -3.55 0.00 -2.13 2.06 4.02 0.60 -3.37 117.16 114.79 2qou n TYR 76 Ca -0.01 -0.20 -0.17 0.00 -0.01 0.00 0.00 57.90 57.51 2qou n TYR 76 Cb 0.36 -0.16 -0.02 0.00 -0.02 0.00 0.00 39.34 39.50 2qou n TYR 76 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qou n GLY 77 N 0.24 0.14 3.70 2.72 0.00 -0.88 -0.91 105.19 110.21 2qou n GLY 77 Ca 0.00 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 2qou n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qou s ILE 78 N -2.81 4.88 0.00 -0.61 -1.09 -1.19 -0.88 121.20 119.50 2qou s ILE 78 Ca 0.00 1.95 0.00 0.00 -2.23 0.00 0.00 60.65 60.37 2qou s ILE 78 Cb 0.00 -4.27 0.00 0.00 -1.58 0.00 0.00 42.46 36.61 2qou s ILE 78 CO 0.00 0.13 0.00 0.29 -1.23 0.00 0.00 174.94 174.13 2qou n LYS 79 N 4.21 2.21 -4.27 2.79 4.76 0.95 -4.71 118.16 124.11 2qou n LYS 79 Ca 0.06 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.35 2qou n LYS 79 Cb 0.50 -0.81 -0.10 0.00 -1.84 0.00 0.00 35.03 32.78 2qou n LYS 79 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2qou s ASN 80 N -2.39 1.75 0.01 4.39 2.20 0.21 -1.46 114.94 119.64 2qou s ASN 80 Ca 0.00 -1.07 -0.29 0.00 -0.94 0.00 0.00 52.86 50.55 2qou s ASN 80 Cb 0.00 0.01 0.11 0.00 -2.00 0.00 0.00 41.25 39.37 2qou s ASN 80 CO 0.00 -0.39 1.25 -1.48 -2.94 0.00 0.00 177.10 173.54 2qou s LEU 81 N -3.20 -0.06 0.00 3.54 2.34 -1.01 -3.29 118.68 117.01 2qou s LEU 81 Ca 0.20 -0.19 0.03 0.00 0.06 0.00 0.00 54.13 54.24 2qou s LEU 81 Cb 0.04 1.47 0.03 0.00 -0.56 0.00 0.00 46.19 47.17 2qou s LEU 81 CO 0.03 -0.38 0.29 -0.62 -1.06 0.00 0.00 176.35 174.60 2qou n GLU 82 N -0.55 0.97 -4.14 1.48 1.02 -0.79 -2.20 120.64 116.44 2qou n GLU 82 Ca -0.07 -1.91 -0.25 0.00 -0.02 0.00 0.00 57.16 54.91 2qou n GLU 82 Cb 0.62 0.13 -0.17 0.00 -0.02 0.00 0.00 31.44 32.00 2qou n GLU 82 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2qou s VAL 83 N -1.43 1.00 -0.48 2.62 1.01 0.27 -3.23 120.40 120.17 2qou s VAL 83 Ca 0.22 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 61.91 2qou s VAL 83 Cb -0.02 -0.99 0.13 0.00 0.00 0.00 0.00 36.38 35.50 2qou s VAL 83 CO 0.14 0.35 0.23 -0.32 0.00 0.00 0.00 175.10 175.49 2qou s MET 84 N 1.33 1.77 0.12 2.72 1.75 -1.21 -1.94 119.30 123.84 2qou s MET 84 Ca -0.02 -2.39 0.07 0.00 -1.25 0.00 0.00 55.69 52.09 2qou s MET 84 Cb -0.14 -3.10 -0.04 0.00 2.84 0.00 0.00 34.83 34.39 2qou s MET 84 CO -0.04 -1.09 -0.04 0.08 -0.65 0.00 0.00 175.02 173.28 2qou s VAL 85 N 0.01 3.66 -0.11 10.11 1.01 -0.82 0.11 120.40 134.36 2qou s VAL 85 Ca 0.16 -1.24 -0.21 0.00 0.00 0.00 0.00 61.98 60.69 2qou s VAL 85 Cb -0.25 -2.76 0.05 0.00 0.00 0.00 0.00 36.38 33.42 2qou s VAL 85 CO -0.01 0.04 0.51 -1.59 0.00 0.00 0.00 175.10 174.05 2qou s LYS 86 N -2.47 0.75 0.00 2.72 -2.85 -1.07 -0.92 119.74 115.90 2qou s LYS 86 Ca 0.25 0.34 0.00 0.00 -1.00 0.00 0.00 55.97 55.56 2qou s LYS 86 Cb -0.11 0.35 0.00 0.00 -2.06 0.00 0.00 37.83 36.02 2qou s LYS 86 CO 0.17 -0.17 0.00 0.41 0.10 0.00 0.00 175.35 175.85 2qou n GLY 87 N 1.85 -0.54 0.00 0.59 0.00 -1.26 -2.96 105.19 102.86 2qou n GLY 87 Ca -0.17 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.26 2qou n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qou n PRO 88 N -0.14 0.00 -1.20 1.61 -0.04 -1.22 -4.66 135.00 129.35 2qou n PRO 88 Ca 0.00 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.61 2qou n PRO 88 Cb 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.39 2qou n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qou n GLY 89 N 5.00 -2.82 3.75 0.55 0.00 -1.25 -4.35 105.19 106.06 2qou n GLY 89 Ca 0.00 -1.15 -0.31 0.00 0.00 0.00 0.00 46.02 44.56 2qou n GLY 89 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qou s PRO 90 N -3.46 2.09 0.00 1.61 0.04 -1.26 -3.00 135.00 131.03 2qou s PRO 90 Ca 0.00 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.33 2qou s PRO 90 Cb 0.00 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.67 2qou s PRO 90 CO 0.00 -1.78 0.00 0.41 0.04 0.00 0.00 177.00 175.67 2qou n GLY 91 N -0.79 2.58 0.54 0.56 0.00 -1.26 -4.79 105.19 102.03 2qou n GLY 91 Ca 0.10 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.43 2qou n GLY 91 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2qou h ARG 92 N 1.04 0.00 0.00 1.61 2.43 -1.73 -1.00 114.38 116.72 2qou h ARG 92 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2qou h ARG 92 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2qou h ARG 92 CO 0.00 0.00 -0.87 0.39 -1.51 0.00 0.00 179.97 177.98 2qou n GLU 93 N -3.42 0.00 -0.28 0.20 1.02 -1.26 -4.78 120.64 112.12 2qou n GLU 93 Ca 0.24 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.46 2qou n GLU 93 Cb 1.47 -0.83 0.20 0.00 -0.02 0.00 0.00 31.44 32.26 2qou n GLU 93 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2qou h SER 94 N 0.00 -0.33 -0.32 1.62 0.87 -1.71 -0.59 113.55 113.09 2qou h SER 94 Ca 0.00 0.21 0.07 0.00 -1.23 0.00 0.00 61.79 60.84 2qou h SER 94 Cb 0.87 0.36 -0.08 0.00 -0.44 0.00 0.00 62.40 63.11 2qou h SER 94 CO 0.00 -0.21 -0.19 0.00 -0.53 0.00 0.00 176.83 175.90 2qou h THR 95 N 0.10 0.45 -0.09 2.23 1.03 -1.48 -1.40 112.91 113.76 2qou h THR 95 Ca 0.47 0.00 0.04 0.00 -0.01 0.00 0.00 66.41 66.90 2qou h THR 95 Cb 0.87 0.45 -0.05 0.00 -1.07 0.00 0.00 68.15 68.35 2qou h THR 95 CO -0.71 0.00 -0.18 0.40 -0.01 0.00 0.00 175.52 175.01 2qou h ILE 96 N -0.16 0.54 0.09 0.00 2.04 -1.34 0.42 117.51 119.10 2qou h ILE 96 Ca 0.16 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.05 2qou h ILE 96 Cb 0.41 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 2qou h ILE 96 CO -0.41 0.00 -0.44 0.03 0.00 0.00 0.00 178.15 177.32 2qou h ARG 97 N -0.26 -0.63 -0.59 2.37 3.08 -1.06 -1.84 114.38 115.46 2qou h ARG 97 Ca 0.08 0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 2qou h ARG 97 Cb 0.37 0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 2qou h ARG 97 CO -0.23 -0.42 0.29 0.00 -1.07 0.00 0.00 179.97 178.53 2qou h ALA 98 N -0.22 1.41 0.21 0.04 0.00 -1.06 -2.44 119.26 117.21 2qou h ALA 98 Ca 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2qou h ALA 98 Cb 0.69 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2qou h ALA 98 CO -0.28 0.47 -0.21 1.25 0.00 0.00 0.00 179.25 180.49 2qou h LEU 99 N 0.82 -0.57 -1.50 0.00 5.85 0.59 -2.52 115.31 117.99 2qou h LEU 99 Ca 0.21 0.05 0.11 0.00 0.84 0.00 0.00 57.88 59.08 2qou h LEU 99 Cb 0.07 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 2qou h LEU 99 CO -0.03 -0.28 0.47 -0.55 -0.34 0.00 0.00 178.44 177.72 2qou h ASN 100 N -0.42 0.50 0.13 1.25 -1.07 -1.37 0.20 115.58 114.81 2qou h ASN 100 Ca -0.03 0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.36 2qou h ASN 100 Cb 0.36 -0.09 0.00 0.00 -2.07 0.00 0.00 38.32 36.52 2qou h ASN 100 CO -0.02 0.29 0.00 0.00 0.07 0.00 0.00 177.43 177.77 2qou n ALA 101 N -2.49 1.15 1.93 4.14 0.00 -0.92 -0.82 120.51 123.51 2qou n ALA 101 Ca 0.12 0.16 0.15 0.00 0.00 0.00 0.00 53.44 53.87 2qou n ALA 101 Cb 0.38 -1.30 0.82 0.00 0.00 0.00 0.00 19.45 19.36 2qou n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qou n ALA 102 N -1.75 2.66 0.00 0.00 0.00 0.71 -4.85 120.51 117.29 2qou n ALA 102 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2qou n ALA 102 Cb 0.07 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.08 2qou n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qou n GLY 103 N 0.99 1.93 3.85 0.00 0.00 0.00 -5.10 105.19 106.86 2qou n GLY 103 Ca 0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 2qou n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qou s PHE 104 N -2.00 3.53 -1.28 1.61 0.08 -0.86 -4.96 117.98 114.10 2qou s PHE 104 Ca 0.00 0.47 -0.18 0.00 0.12 0.00 0.00 56.93 57.33 2qou s PHE 104 Cb 0.00 -1.91 0.03 0.00 -0.57 0.00 0.00 43.02 40.57 2qou s PHE 104 CO 0.00 0.69 1.85 -2.13 -0.10 0.00 0.00 175.22 175.53 2qou n ARG 105 N 1.93 2.80 -1.70 0.44 3.00 -0.54 -4.74 116.66 117.86 2qou n ARG 105 Ca -0.19 -2.99 -0.39 0.00 -0.00 0.00 0.00 57.85 54.28 2qou n ARG 105 Cb 0.55 -3.49 0.03 0.00 0.00 0.00 0.00 32.46 29.55 2qou n ARG 105 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.63 179.14 2qou n ILE 106 N 6.46 3.34 0.00 5.15 3.06 -1.26 -2.39 119.36 133.72 2qou n ILE 106 Ca 0.49 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 60.24 2qou n ILE 106 Cb 0.45 -1.51 0.00 0.00 0.54 0.00 0.00 39.64 39.11 2qou n ILE 106 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2qou n THR 107 N -0.88 0.00 -2.66 9.51 -2.24 -0.93 -4.90 114.28 112.18 2qou n THR 107 Ca 0.10 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.45 2qou n THR 107 Cb 0.43 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.64 2qou n THR 107 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2qou s ASN 108 N 1.00 6.77 -0.13 3.42 -0.87 -1.26 -4.90 114.94 118.97 2qou s ASN 108 Ca 0.00 0.73 -0.04 0.00 -1.57 0.00 0.00 52.86 51.98 2qou s ASN 108 Cb 0.00 -2.53 -0.03 0.00 -0.02 0.00 0.00 41.25 38.67 2qou s ASN 108 CO 0.00 -1.02 0.01 -0.63 -2.57 0.00 0.00 177.10 172.89 2qou s ILE 109 N 3.93 4.34 -0.14 0.60 1.01 -1.26 -0.56 121.20 129.13 2qou s ILE 109 Ca 0.45 -0.21 -0.09 0.00 0.00 0.00 0.00 60.65 60.80 2qou s ILE 109 Cb -0.10 -2.88 0.05 0.00 0.01 0.00 0.00 42.46 39.53 2qou s ILE 109 CO 0.22 0.54 0.34 0.42 0.00 0.00 0.00 174.94 176.46 2qou s THR 110 N -0.25 -0.02 -1.10 2.92 -4.23 -0.82 -4.97 115.64 107.18 2qou s THR 110 Ca 0.06 0.07 -0.04 0.00 -1.18 0.00 0.00 61.69 60.60 2qou s THR 110 Cb -0.12 -0.49 0.30 0.00 1.34 0.00 0.00 72.50 73.52 2qou s THR 110 CO 0.02 0.03 1.56 -0.67 -0.54 0.00 0.00 174.62 175.02 2qou n ASP 111 N 3.76 6.39 -3.50 3.99 2.03 -1.25 -1.95 116.55 126.03 2qou n ASP 111 Ca -0.20 -3.41 -0.37 0.00 0.52 0.00 0.00 54.79 51.33 2qou n ASP 111 Cb 0.55 -1.28 -0.04 0.00 -0.72 0.00 0.00 41.12 39.63 2qou n ASP 111 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2qou n VAL 112 N 1.40 2.00 -3.10 5.18 0.24 -0.09 -4.81 118.33 119.16 2qou n VAL 112 Ca 0.29 -1.57 -0.39 0.00 -2.04 0.00 0.00 64.34 60.63 2qou n VAL 112 Cb 0.33 -2.27 -0.06 0.00 -1.47 0.00 0.00 33.84 30.37 2qou n VAL 112 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2qou s THR 113 N 4.53 4.52 0.41 3.34 2.01 -1.26 -4.62 115.64 124.58 2qou s THR 113 Ca 0.52 1.51 -0.26 0.00 0.31 0.00 0.00 61.69 63.77 2qou s THR 113 Cb 0.13 -4.04 -0.08 0.00 0.01 0.00 0.00 72.50 68.51 2qou s THR 113 CO 0.07 0.53 1.26 -2.16 -0.69 0.00 0.00 174.62 173.64 2qou s PRO 114 N -1.10 3.95 -0.44 4.92 0.04 -1.26 -4.94 135.00 136.17 2qou s PRO 114 Ca 0.33 2.06 0.07 0.00 0.04 0.00 0.00 61.00 63.50 2qou s PRO 114 Cb -0.22 -2.71 0.18 0.00 0.04 0.00 0.00 34.50 31.80 2qou s PRO 114 CO 0.23 -0.47 0.67 0.96 0.04 0.00 0.00 177.00 178.43 2qou s ILE 115 N -1.31 -0.99 0.43 0.56 -5.25 -1.26 -5.00 121.20 108.37 2qou s ILE 115 Ca 0.58 -0.30 -0.25 0.00 -0.99 0.00 0.00 60.65 59.68 2qou s ILE 115 Cb -0.36 0.00 -0.08 0.00 2.95 0.00 0.00 42.46 44.97 2qou s ILE 115 CO 0.46 0.00 1.29 -2.16 -1.79 0.00 0.00 174.94 172.74 2qou s PRO 116 N 1.55 3.86 -0.64 0.37 0.04 -1.26 -4.86 135.00 134.06 2qou s PRO 116 Ca 0.20 2.12 -0.06 0.00 0.04 0.00 0.00 61.00 63.30 2qou s PRO 116 Cb -0.03 -2.66 -0.11 0.00 0.04 0.00 0.00 34.50 31.74 2qou s PRO 116 CO -0.07 -0.57 2.45 0.72 0.04 0.00 0.00 177.00 179.58 2qou n HIS 117 N -0.06 0.95 -3.50 0.56 8.25 -1.26 -4.40 115.22 115.77 2qou n HIS 117 Ca 0.05 -1.74 -0.20 0.00 -0.26 0.00 0.00 57.72 55.57 2qou n HIS 117 Cb 0.44 -1.60 0.06 0.00 1.12 0.00 0.00 29.99 30.01 2qou n HIS 117 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2qou n ASN 118 N 3.46 -3.77 -0.07 0.41 4.05 -1.26 -4.96 115.26 113.12 2qou n ASN 118 Ca 0.43 -0.77 -0.06 0.00 0.45 0.00 0.00 54.58 54.63 2qou n ASN 118 Cb 0.35 -4.55 -0.02 0.00 1.23 0.00 0.00 39.78 36.79 2qou n ASN 118 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2qou n GLY 119 N -1.38 -0.80 3.94 8.20 0.00 -1.26 -5.00 105.19 108.89 2qou n GLY 119 Ca -0.19 -0.22 -0.25 0.00 0.00 0.00 0.00 46.02 45.36 2qou n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qou s ARG 121 N -5.16 2.48 0.67 0.00 3.52 -1.26 -5.09 118.95 114.11 2qou s ARG 121 Ca 0.60 -1.41 -0.17 0.00 -0.13 0.00 0.00 55.73 54.62 2qou s ARG 121 Cb -0.11 -3.56 0.01 0.00 -1.56 0.00 0.00 34.95 29.73 2qou s ARG 121 CO 0.44 -0.84 1.24 -1.25 -0.81 0.00 0.00 175.30 174.08 2qou s PRO 122 N 1.35 2.46 0.72 5.12 0.04 -1.26 -4.99 135.00 138.43 2qou s PRO 122 Ca 0.01 1.89 -0.12 0.00 0.04 0.00 0.00 61.00 62.82 2qou s PRO 122 Cb -0.21 -1.86 0.03 0.00 0.04 0.00 0.00 34.50 32.50 2qou s PRO 122 CO 0.01 -1.62 1.09 -1.25 0.04 0.00 0.00 177.00 175.27 2qou s PRO 123 N -3.59 2.59 0.00 0.56 0.04 -1.26 -5.03 135.00 128.30 2qou s PRO 123 Ca 0.78 1.20 0.00 0.00 0.04 0.00 0.00 61.00 63.02 2qou s PRO 123 Cb -0.32 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2qou s PRO 123 CO 0.41 -1.39 0.24 1.63 0.04 0.00 0.00 177.00 177.92 2qou n LYS 124 N -3.04 0.00 0.00 4.56 4.76 -1.26 -4.99 118.16 118.19 2qou n LYS 124 Ca 0.09 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 2qou n LYS 124 Cb 0.53 -0.72 0.00 0.00 -1.84 0.00 0.00 35.03 32.99 2qou n LYS 124 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2qou n LYS 125 N -0.48 0.00 -2.92 1.97 5.02 -1.26 -4.86 118.16 115.64 2qou n LYS 125 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 2qou n LYS 125 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2qou n LYS 125 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qou n ARG 126 N -1.07 -0.72 -3.32 1.97 5.12 -1.26 -4.89 116.66 112.50 2qou n ARG 126 Ca 0.00 0.38 -0.26 0.00 -1.93 0.00 0.00 57.85 56.04 2qou n ARG 126 Cb 0.00 -0.96 -0.07 0.00 -1.16 0.00 0.00 32.46 30.26 2qou n ARG 126 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 2qou n ARG 127 N -1.22 2.37 0.00 5.56 0.63 -1.26 -5.30 116.66 117.45 2qou n ARG 127 Ca -0.13 -4.49 0.00 0.00 -0.92 0.00 0.00 57.85 52.31 2qou n ARG 127 Cb 0.31 -2.11 0.00 0.00 0.45 0.00 0.00 32.46 31.11 2qou n ARG 127 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45