#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2os6 s SER 2 N 0.00 6.49 -1.38 1.61 0.15 -1.26 -2.54 113.70 116.78 2os6 s SER 2 Ca 0.00 2.78 -0.09 0.00 0.70 0.00 0.00 55.95 59.34 2os6 s SER 2 Cb 0.00 -2.61 0.02 0.00 -1.71 0.00 0.00 66.02 61.71 2os6 s SER 2 CO 0.00 -0.85 1.16 1.57 1.20 0.00 0.00 173.24 176.32 2os6 n HIS 3 N 3.01 -2.81 -3.41 3.44 -0.00 -1.26 -5.00 115.22 109.19 2os6 n HIS 3 Ca 0.11 1.00 -0.28 0.00 -0.00 0.00 0.00 57.72 58.55 2os6 n HIS 3 Cb 0.38 -4.91 -0.03 0.00 -0.00 0.00 0.00 29.99 25.43 2os6 n HIS 3 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 2os6 s MET 4 N -6.34 3.61 0.00 1.57 1.00 -1.05 -5.09 119.30 113.00 2os6 s MET 4 Ca 0.59 -0.07 0.00 0.00 0.00 0.00 0.00 55.69 56.20 2os6 s MET 4 Cb -0.26 -2.69 0.00 0.00 0.00 0.00 0.00 34.83 31.88 2os6 s MET 4 CO 0.74 0.25 0.00 0.41 0.00 0.00 0.00 175.02 176.43 2os6 n GLY 5 N -0.89 3.67 3.42 -0.03 0.00 -1.26 -5.12 105.19 104.97 2os6 n GLY 5 Ca -0.02 -0.40 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 2os6 n GLY 5 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2os6 s LEU 6 N 0.00 -0.15 -0.03 0.99 -0.00 -1.26 -4.84 118.68 113.39 2os6 s LEU 6 Ca 0.00 0.41 0.03 0.00 -0.00 0.00 0.00 54.13 54.57 2os6 s LEU 6 Cb 0.00 2.14 -0.00 0.00 -0.00 0.00 0.00 46.19 48.33 2os6 s LEU 6 CO 0.00 -0.61 -0.13 -0.69 -0.00 0.00 0.00 176.35 174.92 2os6 s VAL 7 N -1.64 1.07 -0.13 1.48 1.01 -0.73 -5.01 120.40 116.44 2os6 s VAL 7 Ca -0.10 -0.52 -0.09 0.00 0.00 0.00 0.00 61.98 61.27 2os6 s VAL 7 Cb -0.01 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 2os6 s VAL 7 CO 0.05 0.32 0.18 -1.58 0.00 0.00 0.00 175.10 174.06 2os6 s GLN 8 N 0.08 3.76 0.05 2.72 0.74 -1.26 -1.38 119.66 124.37 2os6 s GLN 8 Ca -0.03 -0.08 -0.13 0.00 0.05 0.00 0.00 55.36 55.17 2os6 s GLN 8 Cb -0.09 -3.28 0.02 0.00 1.10 0.00 0.00 33.01 30.76 2os6 s GLN 8 CO 0.01 0.59 0.30 -0.98 -0.55 0.00 0.00 175.29 174.66 2os6 s ARG 9 N -0.52 0.81 -0.14 1.67 1.70 0.21 -4.97 118.95 117.70 2os6 s ARG 9 Ca 0.14 -0.52 -0.07 0.00 -0.47 0.00 0.00 55.73 54.80 2os6 s ARG 9 Cb -0.12 0.35 -0.04 0.00 -0.57 0.00 0.00 34.95 34.56 2os6 s ARG 9 CO 0.03 -0.26 0.12 0.00 -1.08 0.00 0.00 175.30 174.11 2os6 s VAL 11 N -0.55 1.43 -0.31 0.00 -7.23 0.98 -4.93 120.40 109.79 2os6 s VAL 11 Ca 0.12 -0.67 -0.16 0.00 -1.81 0.00 0.00 61.98 59.46 2os6 s VAL 11 Cb -0.12 -1.26 -0.02 0.00 0.56 0.00 0.00 36.38 35.55 2os6 s VAL 11 CO 0.02 0.42 0.43 -0.63 -0.31 0.00 0.00 175.10 175.02 2os6 s ILE 12 N 0.38 5.11 -0.13 -0.62 1.09 -1.26 0.20 121.20 125.97 2os6 s ILE 12 Ca -0.12 0.39 -0.01 0.00 -1.10 0.00 0.00 60.65 59.81 2os6 s ILE 12 Cb -0.15 -3.83 -0.02 0.00 -1.06 0.00 0.00 42.46 37.41 2os6 s ILE 12 CO 0.04 -0.03 -0.09 -0.63 -0.10 0.00 0.00 174.94 174.12 2os6 s ILE 13 N 2.18 3.38 -0.33 2.92 1.01 0.11 -4.72 121.20 125.75 2os6 s ILE 13 Ca 0.16 -0.55 -0.10 0.00 0.00 0.00 0.00 60.65 60.16 2os6 s ILE 13 Cb -0.16 -2.44 -0.00 0.00 0.01 0.00 0.00 42.46 39.87 2os6 s ILE 13 CO 0.11 0.52 0.18 -1.58 0.00 0.00 0.00 174.94 174.17 2os6 s GLN 14 N 0.28 3.27 0.38 2.79 0.74 -1.26 0.01 119.66 125.87 2os6 s GLN 14 Ca -0.07 -0.77 -0.27 0.00 0.05 0.00 0.00 55.36 54.29 2os6 s GLN 14 Cb -0.15 -3.63 -0.10 0.00 1.10 0.00 0.00 33.01 30.23 2os6 s GLN 14 CO 0.04 -0.47 1.38 0.21 -0.55 0.00 0.00 175.29 175.90 2os6 s LYS 15 N 1.62 4.08 0.32 1.67 2.20 0.16 -4.78 119.74 125.00 2os6 s LYS 15 Ca 0.04 2.34 0.02 0.00 -0.36 0.00 0.00 55.97 58.00 2os6 s LYS 15 Cb -0.17 -2.90 0.02 0.00 -1.51 0.00 0.00 37.83 33.26 2os6 s LYS 15 CO 0.07 -0.46 0.13 -3.47 -0.36 0.00 0.00 175.35 171.25 2os6 n ASP 16 N 0.37 2.43 -0.13 1.43 2.03 -1.08 -4.85 116.55 116.75 2os6 n ASP 16 Ca 0.02 -2.22 0.10 0.00 0.52 0.00 0.00 54.79 53.21 2os6 n ASP 16 Cb 0.41 0.09 0.45 0.00 -0.72 0.00 0.00 41.12 41.35 2os6 n ASP 16 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2os6 h ASP 17 N 0.55 0.48 -0.53 1.67 3.58 -2.02 0.48 116.42 120.63 2os6 h ASP 17 Ca -0.23 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.23 2os6 h ASP 17 Cb 0.76 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.72 2os6 h ASP 17 CO 0.37 0.29 0.00 -0.46 -2.88 0.00 0.00 179.24 176.56 2os6 n ASN 18 N -4.48 3.78 0.00 2.28 0.23 -1.26 -5.06 115.26 110.75 2os6 n ASN 18 Ca 0.11 -2.30 0.00 0.00 -0.53 0.00 0.00 54.58 51.86 2os6 n ASN 18 Cb 0.34 -0.50 0.00 0.00 -2.08 0.00 0.00 39.78 37.54 2os6 n ASN 18 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2os6 n GLY 19 N 1.05 -1.73 0.14 4.83 0.00 0.16 -4.47 105.19 105.17 2os6 n GLY 19 Ca 0.21 -1.52 -0.23 0.00 0.00 0.00 0.00 46.02 44.47 2os6 n GLY 19 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2os6 h PHE 20 N 0.00 0.83 -0.52 1.61 0.04 -1.90 -2.86 116.94 114.14 2os6 h PHE 20 Ca 0.00 -0.61 0.00 0.00 2.80 0.00 0.00 57.97 60.16 2os6 h PHE 20 Cb 0.00 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.12 2os6 h PHE 20 CO 0.00 1.52 0.00 0.41 -0.60 0.00 0.00 178.31 179.64 2os6 n GLY 21 N 1.73 0.86 3.02 -1.45 0.00 -1.26 -2.76 105.19 105.33 2os6 n GLY 21 Ca -0.18 -0.61 -0.11 0.00 0.00 0.00 0.00 46.02 45.13 2os6 n GLY 21 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2os6 s LEU 22 N -0.52 2.26 -0.11 0.99 0.05 -1.26 -0.55 118.68 119.54 2os6 s LEU 22 Ca 0.00 -0.55 0.01 0.00 0.05 0.00 0.00 54.13 53.64 2os6 s LEU 22 Cb 0.00 -0.01 -0.02 0.00 -2.05 0.00 0.00 46.19 44.12 2os6 s LEU 22 CO 0.00 -0.28 -0.14 -0.89 -0.55 0.00 0.00 176.35 174.49 2os6 s THR 23 N -1.58 3.01 0.00 5.48 2.01 0.13 -4.98 115.64 119.71 2os6 s THR 23 Ca -0.12 -0.69 0.03 0.00 0.31 0.00 0.00 61.69 61.22 2os6 s THR 23 Cb -0.09 -2.24 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 2os6 s THR 23 CO -0.01 0.54 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.67 2os6 s VAL 24 N 0.10 0.78 0.08 3.82 1.01 -1.26 0.67 120.40 125.61 2os6 s VAL 24 Ca -0.06 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 2os6 s VAL 24 Cb -0.15 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2os6 s VAL 24 CO 0.05 0.14 0.00 -0.44 0.00 0.00 0.00 175.10 174.85 2os6 s SER 25 N -0.45 0.42 0.00 3.32 0.01 -0.07 -4.89 113.70 112.04 2os6 s SER 25 Ca 0.02 -1.08 0.00 0.00 1.31 0.00 0.00 55.95 56.21 2os6 s SER 25 Cb -0.05 0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.42 2os6 s SER 25 CO -0.00 -0.65 0.00 0.61 0.41 0.00 0.00 173.24 173.61 2os6 n GLY 26 N 0.03 0.49 1.78 3.44 0.00 -1.26 -1.02 105.19 108.65 2os6 n GLY 26 Ca -0.11 -1.67 -0.10 0.00 0.00 0.00 0.00 46.02 44.14 2os6 n GLY 26 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2os6 n ASP 27 N -0.62 1.34 0.00 1.61 -0.08 -1.26 -4.41 116.55 113.13 2os6 n ASP 27 Ca 0.00 -1.78 0.00 0.00 -1.51 0.00 0.00 54.79 51.50 2os6 n ASP 27 Cb 0.00 -0.12 0.00 0.00 2.34 0.00 0.00 41.12 43.34 2os6 n ASP 27 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2os6 n ASN 28 N -2.36 0.00 -3.42 1.67 3.02 -1.22 -1.64 115.26 111.31 2os6 n ASN 28 Ca 0.04 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.21 2os6 n ASN 28 Cb 0.28 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.43 2os6 n ASN 28 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2os6 n PRO 29 N 0.00 3.07 -1.52 3.52 -0.04 -1.26 -4.68 135.00 134.09 2os6 n PRO 29 Ca 0.00 -2.16 -0.39 0.00 -0.04 0.00 0.00 63.50 60.91 2os6 n PRO 29 Cb 0.00 -2.88 0.04 0.00 -0.04 0.00 0.00 33.50 30.62 2os6 n PRO 29 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2os6 n VAL 30 N 4.24 2.63 -4.24 0.52 0.31 -0.38 -4.75 118.33 116.66 2os6 n VAL 30 Ca 0.65 -0.50 -0.18 0.00 -0.01 0.00 0.00 64.34 64.29 2os6 n VAL 30 Cb 0.27 -0.84 -0.15 0.00 -0.91 0.00 0.00 33.84 32.20 2os6 n VAL 30 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 2os6 s PHE 31 N -1.60 0.70 -0.05 3.52 -0.71 -0.19 0.87 117.98 120.52 2os6 s PHE 31 Ca 0.70 -0.16 -0.30 0.00 -1.04 0.00 0.00 56.93 56.13 2os6 s PHE 31 Cb -0.46 -0.52 -0.02 0.00 -1.21 0.00 0.00 43.02 40.80 2os6 s PHE 31 CO 0.53 -0.08 1.00 0.08 -1.34 0.00 0.00 175.22 175.41 2os6 s VAL 32 N 0.26 4.81 -0.02 -2.49 1.01 -0.14 -0.90 120.40 122.93 2os6 s VAL 32 Ca -0.03 2.04 -0.01 0.00 0.00 0.00 0.00 61.98 63.98 2os6 s VAL 32 Cb -0.08 -4.31 -0.00 0.00 0.00 0.00 0.00 36.38 31.99 2os6 s VAL 32 CO 0.00 0.08 -0.02 -0.61 0.00 0.00 0.00 175.10 174.55 2os6 h GLN 33 N 6.96 0.00 -6.86 2.72 4.15 -0.08 0.27 115.11 122.27 2os6 h GLN 33 Ca -0.36 0.00 -0.69 0.00 0.77 0.00 0.00 58.65 58.38 2os6 h GLN 33 Cb 1.18 0.00 -0.22 0.00 0.21 0.00 0.00 27.48 28.65 2os6 h GLN 33 CO 0.81 0.00 -0.86 0.45 -1.93 0.00 0.00 178.83 177.30 2os6 s SER 34 N -3.69 3.42 -0.02 -0.69 0.15 -1.10 -3.15 113.70 108.62 2os6 s SER 34 Ca -0.01 -0.70 0.01 0.00 0.70 0.00 0.00 55.95 55.95 2os6 s SER 34 Cb 0.00 -0.29 0.01 0.00 -1.71 0.00 0.00 66.02 64.04 2os6 s SER 34 CO 0.02 0.19 -0.02 -0.69 1.20 0.00 0.00 173.24 173.93 2os6 s VAL 35 N -1.06 0.29 -0.51 4.45 1.01 -1.26 0.17 120.40 123.49 2os6 s VAL 35 Ca 0.15 -0.06 -0.27 0.00 0.00 0.00 0.00 61.98 61.79 2os6 s VAL 35 Cb -0.10 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.95 2os6 s VAL 35 CO 0.06 0.13 1.86 -0.54 0.00 0.00 0.00 175.10 176.62 2os6 s LYS 36 N 0.48 2.84 0.45 2.72 1.02 0.28 -4.85 119.74 122.68 2os6 s LYS 36 Ca -0.05 0.92 0.19 0.00 0.02 0.00 0.00 55.97 57.05 2os6 s LYS 36 Cb -0.08 -4.33 1.14 0.00 -0.52 0.00 0.00 37.83 34.04 2os6 s LYS 36 CO -0.01 -2.47 1.91 1.05 -0.92 0.00 0.00 175.35 174.91 2os6 h GLU 37 N 14.49 0.31 -0.68 1.68 4.11 -1.95 0.15 114.58 132.70 2os6 h GLU 37 Ca -0.28 -0.02 -0.38 0.00 0.07 0.00 0.00 59.36 58.75 2os6 h GLU 37 Cb 1.17 -0.07 -0.22 0.00 0.50 0.00 0.00 28.75 30.13 2os6 h GLU 37 CO 1.15 0.21 0.24 -0.40 0.07 0.00 0.00 179.01 180.28 2os6 n ASP 38 N -4.46 3.57 -4.35 3.06 5.68 -1.26 -4.52 116.55 114.27 2os6 n ASP 38 Ca 0.16 -3.73 -0.20 0.00 -0.50 0.00 0.00 54.79 50.52 2os6 n ASP 38 Cb 0.63 -0.73 -0.10 0.00 -1.14 0.00 0.00 41.12 39.77 2os6 n ASP 38 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 2os6 s GLY 39 N -2.08 1.97 0.48 6.12 0.00 0.03 -5.01 107.32 108.83 2os6 s GLY 39 Ca 0.52 -1.91 0.24 0.00 0.00 0.00 0.00 44.72 43.57 2os6 s GLY 39 CO 0.04 -1.71 1.89 0.00 0.00 0.00 0.00 173.10 173.32 2os6 h ALA 40 N 2.21 2.49 0.51 3.20 0.00 -1.82 0.23 119.26 126.08 2os6 h ALA 40 Ca -0.39 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 2os6 h ALA 40 Cb 1.25 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2os6 h ALA 40 CO 0.64 -0.75 -0.31 0.00 0.00 0.00 0.00 179.25 178.84 2os6 h ALA 41 N 1.61 -1.14 -0.33 0.00 0.00 -1.75 0.36 119.26 118.00 2os6 h ALA 41 Ca 0.42 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 55.04 2os6 h ALA 41 Cb 1.35 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 19.54 2os6 h ALA 41 CO -0.09 -1.11 -0.33 1.98 0.00 0.00 0.00 179.25 179.70 2os6 h MET 42 N -0.77 0.73 -0.35 0.00 -1.53 -1.34 -1.65 114.93 110.03 2os6 h MET 42 Ca -0.07 -0.35 -0.01 0.00 -3.44 0.00 0.00 59.70 55.83 2os6 h MET 42 Cb 0.61 -0.01 -0.02 0.00 -0.55 0.00 0.00 31.60 31.64 2os6 h MET 42 CO 0.07 0.96 0.16 -0.09 0.14 0.00 0.00 176.91 178.16 2os6 h ARG 43 N 0.62 0.49 0.00 0.39 1.12 -0.51 -1.24 114.38 115.24 2os6 h ARG 43 Ca 0.07 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 58.88 2os6 h ARG 43 Cb 0.86 -0.10 0.00 0.00 -0.01 0.00 0.00 29.97 30.72 2os6 h ARG 43 CO 0.08 0.39 0.00 0.00 -3.11 0.00 0.00 179.97 177.33 2os6 n ALA 44 N -2.48 1.99 0.00 2.80 0.00 0.13 -4.87 120.51 118.08 2os6 n ALA 44 Ca 0.02 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2os6 n ALA 44 Cb 0.12 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.16 2os6 n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2os6 n GLY 45 N 0.70 1.70 3.83 0.00 0.00 -0.47 -4.46 105.19 106.49 2os6 n GLY 45 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 2os6 n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2os6 s VAL 46 N -2.00 5.16 0.13 1.61 1.01 -0.64 -5.00 120.40 120.68 2os6 s VAL 46 Ca 0.00 0.68 0.08 0.00 0.00 0.00 0.00 61.98 62.74 2os6 s VAL 46 Cb 0.00 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 2os6 s VAL 46 CO 0.00 0.56 -0.19 -1.10 0.00 0.00 0.00 175.10 174.37 2os6 s GLN 47 N -0.87 1.19 0.32 2.72 -0.21 -1.26 -4.01 119.66 117.54 2os6 s GLN 47 Ca 0.21 -1.28 -0.29 0.00 0.02 0.00 0.00 55.36 54.02 2os6 s GLN 47 Cb -0.15 -1.34 -0.10 0.00 1.00 0.00 0.00 33.01 32.41 2os6 s GLN 47 CO 0.10 0.29 1.42 -0.08 -2.12 0.00 0.00 175.29 174.90 2os6 s THR 48 N -1.62 2.47 -0.12 -0.19 -1.32 -1.26 -2.90 115.64 110.69 2os6 s THR 48 Ca 0.11 0.44 0.00 0.00 -1.21 0.00 0.00 61.69 61.03 2os6 s THR 48 Cb -0.08 -3.28 0.00 0.00 -1.51 0.00 0.00 72.50 67.63 2os6 s THR 48 CO 0.05 0.09 0.00 0.61 -2.21 0.00 0.00 174.62 173.17 2os6 n GLY 49 N 1.23 0.33 3.92 6.08 0.00 0.91 -5.01 105.19 112.65 2os6 n GLY 49 Ca 0.03 -0.85 -0.28 0.00 0.00 0.00 0.00 46.02 44.91 2os6 n GLY 49 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2os6 s ASP 50 N -2.94 4.03 -0.60 1.61 -1.08 -0.98 -4.81 116.67 111.90 2os6 s ASP 50 Ca 0.00 0.47 0.04 0.00 -0.52 0.00 0.00 52.55 52.54 2os6 s ASP 50 Cb 0.00 -0.81 0.17 0.00 -1.46 0.00 0.00 42.92 40.81 2os6 s ASP 50 CO 0.00 -2.16 0.43 -0.13 0.52 0.00 0.00 175.17 173.83 2os6 s ARG 51 N -5.61 1.93 -0.01 4.34 1.81 0.89 -0.97 118.95 121.33 2os6 s ARG 51 Ca 0.66 -2.88 -0.30 0.00 -1.72 0.00 0.00 55.73 51.49 2os6 s ARG 51 Cb -0.08 -2.78 -0.05 0.00 -0.45 0.00 0.00 34.95 31.59 2os6 s ARG 51 CO 0.49 -1.30 1.40 -1.50 -0.68 0.00 0.00 175.30 173.72 2os6 s ILE 52 N -0.87 3.72 -0.18 1.52 -1.16 0.25 0.68 121.20 125.17 2os6 s ILE 52 Ca 0.26 1.10 0.06 0.00 -0.51 0.00 0.00 60.65 61.56 2os6 s ILE 52 Cb -0.04 -3.70 -0.15 0.00 0.61 0.00 0.00 42.46 39.17 2os6 s ILE 52 CO -0.16 -0.01 -0.08 -0.38 -2.81 0.00 0.00 174.94 171.50 2os6 n ILE 53 N 4.70 1.11 -4.09 2.00 5.41 0.20 -1.25 119.36 127.44 2os6 n ILE 53 Ca 0.13 -0.52 -0.12 0.00 1.00 0.00 0.00 62.75 63.24 2os6 n ILE 53 Cb 0.44 -0.96 -0.11 0.00 -0.71 0.00 0.00 39.64 38.30 2os6 n ILE 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2os6 s LYS 54 N -2.39 0.60 -0.21 0.38 1.02 0.52 -3.40 119.74 116.24 2os6 s LYS 54 Ca -0.19 -0.91 0.01 0.00 0.02 0.00 0.00 55.97 54.90 2os6 s LYS 54 Cb 0.06 -0.24 0.05 0.00 -0.52 0.00 0.00 37.83 37.18 2os6 s LYS 54 CO 0.53 0.02 -0.10 0.14 -0.92 0.00 0.00 175.35 175.02 2os6 s VAL 55 N -2.02 1.75 -1.45 3.17 -7.23 -0.57 0.04 120.40 114.09 2os6 s VAL 55 Ca -0.04 -1.16 -0.09 0.00 -1.81 0.00 0.00 61.98 58.88 2os6 s VAL 55 Cb -0.06 -1.84 0.03 0.00 0.56 0.00 0.00 36.38 35.07 2os6 s VAL 55 CO -0.01 0.11 0.91 -3.20 -0.31 0.00 0.00 175.10 172.59 2os6 n ASN 56 N 4.63 -5.83 0.00 4.85 5.15 0.29 -1.88 115.26 122.47 2os6 n ASN 56 Ca -0.14 -0.49 0.00 0.00 -0.60 0.00 0.00 54.58 53.35 2os6 n ASN 56 Cb 0.45 -4.65 0.00 0.00 -0.53 0.00 0.00 39.78 35.06 2os6 n ASN 56 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2os6 n GLY 57 N -1.73 2.36 3.74 8.20 0.00 -1.13 -4.84 105.19 111.79 2os6 n GLY 57 Ca -0.03 -0.26 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 2os6 n GLY 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2os6 s THR 58 N -0.93 2.50 -0.16 2.61 -4.23 -0.79 -5.00 115.64 109.64 2os6 s THR 58 Ca 0.00 0.28 -0.16 0.00 -1.18 0.00 0.00 61.69 60.63 2os6 s THR 58 Cb 0.00 -2.98 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 2os6 s THR 58 CO 0.00 -0.10 0.37 -0.76 -0.54 0.00 0.00 174.62 173.59 2os6 s LEU 59 N -4.57 4.23 -0.27 4.79 1.02 -1.26 -1.50 118.68 121.12 2os6 s LEU 59 Ca 0.76 0.60 0.04 0.00 0.02 0.00 0.00 54.13 55.55 2os6 s LEU 59 Cb -0.30 -2.50 0.46 0.00 0.02 0.00 0.00 46.19 43.87 2os6 s LEU 59 CO 0.39 0.03 1.56 0.55 0.02 0.00 0.00 176.35 178.90 2os6 n VAL 60 N 3.76 2.35 -0.00 -1.59 3.14 -1.22 -4.11 118.33 120.66 2os6 n VAL 60 Ca -0.10 -1.21 -0.16 0.00 -2.96 0.00 0.00 64.34 59.92 2os6 n VAL 60 Cb 0.52 -0.60 -0.14 0.00 -1.06 0.00 0.00 33.84 32.55 2os6 n VAL 60 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 2os6 h THR 61 N 0.98 0.75 -0.44 1.55 2.02 -1.85 -3.22 112.91 112.71 2os6 h THR 61 Ca 0.35 -2.52 -0.32 0.00 0.77 0.00 0.00 66.41 64.69 2os6 h THR 61 Cb 2.12 2.48 -0.35 0.00 -1.74 0.00 0.00 68.15 70.66 2os6 h THR 61 CO 0.67 0.71 -0.90 1.57 0.37 0.00 0.00 175.52 177.94 2os6 n HIS 62 N -3.29 1.50 -4.33 3.16 -0.00 -1.26 -4.80 115.22 106.21 2os6 n HIS 62 Ca -0.24 -1.87 -0.24 0.00 -0.00 0.00 0.00 57.72 55.36 2os6 n HIS 62 Cb 1.05 -0.27 -0.08 0.00 -0.00 0.00 0.00 29.99 30.69 2os6 n HIS 62 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 2os6 s SER 63 N -3.42 4.29 0.68 0.26 0.01 -1.26 -5.12 113.70 109.15 2os6 s SER 63 Ca 0.39 -0.71 -0.04 0.00 1.31 0.00 0.00 55.95 56.91 2os6 s SER 63 Cb 0.37 -0.71 0.08 0.00 0.21 0.00 0.00 66.02 65.97 2os6 s SER 63 CO -0.03 0.03 0.96 0.20 0.41 0.00 0.00 173.24 174.82 2os6 s ASN 64 N -3.47 4.70 -0.01 2.44 -0.87 -1.26 -5.01 114.94 111.47 2os6 s ASN 64 Ca 0.30 0.11 -0.05 0.00 -1.57 0.00 0.00 52.86 51.65 2os6 s ASN 64 Cb -0.07 -0.72 -0.03 0.00 -0.02 0.00 0.00 41.25 40.42 2os6 s ASN 64 CO 0.18 -1.62 0.45 -0.74 -2.57 0.00 0.00 177.10 172.80 2os6 h HIS 65 N -0.47 -0.18 -0.34 2.20 -0.00 -2.01 -3.02 115.15 111.34 2os6 h HIS 65 Ca -0.42 -0.00 0.10 0.00 -0.00 0.00 0.00 60.37 60.05 2os6 h HIS 65 Cb 1.29 0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 28.75 2os6 h HIS 65 CO 0.10 -0.11 0.25 -0.07 -0.00 0.00 0.00 177.93 178.10 2os6 h LEU 66 N -0.42 0.00 -0.24 0.26 4.07 -1.99 -2.00 115.31 115.00 2os6 h LEU 66 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 2os6 h LEU 66 Cb 0.15 -0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 2os6 h LEU 66 CO 0.03 0.00 0.10 -0.33 -1.08 0.00 0.00 178.44 177.16 2os6 h GLU 67 N 0.00 0.35 0.23 1.13 5.08 -1.97 -0.25 114.58 119.15 2os6 h GLU 67 Ca 0.16 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2os6 h GLU 67 Cb 0.65 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2os6 h GLU 67 CO -0.00 0.39 -0.11 0.28 -1.00 0.00 0.00 179.01 178.57 2os6 h VAL 68 N 0.23 0.82 -0.76 3.13 2.07 -1.23 -1.45 116.25 119.06 2os6 h VAL 68 Ca 0.08 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.34 2os6 h VAL 68 Cb 0.17 0.98 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 2os6 h VAL 68 CO -0.01 0.06 0.49 1.62 0.02 0.00 0.00 177.57 179.76 2os6 h VAL 69 N -0.45 1.15 -0.88 2.57 3.04 -1.49 -0.54 116.25 119.64 2os6 h VAL 69 Ca -0.03 -0.34 -0.02 0.00 -1.01 0.00 0.00 66.70 65.30 2os6 h VAL 69 Cb 0.34 0.08 -0.04 0.00 -2.01 0.00 0.00 31.29 29.66 2os6 h VAL 69 CO 0.05 0.18 0.47 0.50 -1.01 0.00 0.00 177.57 177.77 2os6 h LYS 70 N 0.98 1.23 -0.11 4.17 3.64 -0.96 0.29 116.57 125.81 2os6 h LYS 70 Ca 0.29 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 2os6 h LYS 70 Cb -0.04 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.54 2os6 h LYS 70 CO -0.09 0.91 -0.03 1.25 -2.27 0.00 0.00 179.45 179.22 2os6 h LEU 71 N 1.24 0.22 -0.63 5.20 5.85 -0.72 -0.65 115.31 125.81 2os6 h LEU 71 Ca 0.31 -0.38 -0.08 0.00 0.84 0.00 0.00 57.88 58.57 2os6 h LEU 71 Cb 0.04 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2os6 h LEU 71 CO -0.05 0.55 0.07 0.40 -0.34 0.00 0.00 178.44 179.07 2os6 h ILE 72 N -0.11 1.26 -0.12 4.05 1.08 -0.94 -2.72 117.51 120.02 2os6 h ILE 72 Ca 0.03 -1.07 -0.08 0.00 -0.39 0.00 0.00 64.86 63.35 2os6 h ILE 72 Cb 0.46 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 34.91 2os6 h ILE 72 CO 0.01 0.40 -0.30 0.50 -0.69 0.00 0.00 178.15 178.07 2os6 h LYS 73 N 0.98 0.21 -3.54 2.37 3.64 -0.41 -3.31 116.57 116.51 2os6 h LYS 73 Ca 0.19 -0.08 -0.70 0.00 -1.27 0.00 0.00 60.65 58.79 2os6 h LYS 73 Cb 0.48 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 2os6 h LYS 73 CO 0.02 0.50 3.25 0.43 -2.27 0.00 0.00 179.45 181.38 2os6 n SER 74 N -4.13 5.88 0.00 4.20 7.64 -0.26 -4.82 113.62 122.14 2os6 n SER 74 Ca -0.01 -2.79 0.00 0.00 1.01 0.00 0.00 58.87 57.08 2os6 n SER 74 Cb 0.39 -1.59 0.00 0.00 -1.01 0.00 0.00 64.21 61.99 2os6 n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2os6 n GLY 75 N 3.68 0.60 0.01 0.23 0.00 -1.25 -4.95 105.19 103.52 2os6 n GLY 75 Ca 0.61 -1.10 -0.00 0.00 0.00 0.00 0.00 46.02 45.52 2os6 n GLY 75 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2os6 h SER 76 N 0.00 0.00 -2.57 1.61 0.02 -1.87 -3.46 113.55 107.28 2os6 h SER 76 Ca 0.00 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 2os6 h SER 76 Cb 0.00 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 62.39 2os6 h SER 76 CO 0.00 0.10 -0.76 -0.72 -1.14 0.00 0.00 176.83 174.30 2os6 s TYR 77 N -1.15 2.16 -0.02 3.45 1.13 -1.26 0.35 117.35 122.02 2os6 s TYR 77 Ca -0.02 -0.38 -0.10 0.00 -1.41 0.00 0.00 57.07 55.16 2os6 s TYR 77 Cb 0.00 -0.97 0.01 0.00 -1.10 0.00 0.00 41.96 39.91 2os6 s TYR 77 CO 0.02 0.61 0.21 0.14 -2.51 0.00 0.00 175.55 174.02 2os6 s VAL 78 N -2.48 0.06 -0.40 -3.49 -7.23 0.10 -4.95 120.40 102.02 2os6 s VAL 78 Ca 0.27 -0.52 -0.15 0.00 -1.81 0.00 0.00 61.98 59.76 2os6 s VAL 78 Cb -0.05 -0.48 0.02 0.00 0.56 0.00 0.00 36.38 36.43 2os6 s VAL 78 CO 0.12 -0.29 0.31 0.00 -0.31 0.00 0.00 175.10 174.94 2os6 s ALA 79 N -1.17 3.48 -0.23 1.32 0.00 -1.26 0.04 121.76 123.94 2os6 s ALA 79 Ca -0.12 -1.65 -0.09 0.00 0.00 0.00 0.00 51.96 50.09 2os6 s ALA 79 Cb -0.06 -2.89 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 2os6 s ALA 79 CO 0.02 -1.43 0.13 -0.51 0.00 0.00 0.00 175.76 173.97 2os6 s LEU 80 N 1.75 3.98 -0.50 0.00 1.02 0.13 0.11 118.68 125.16 2os6 s LEU 80 Ca 0.06 0.08 -0.25 0.00 0.02 0.00 0.00 54.13 54.04 2os6 s LEU 80 Cb -0.19 -2.05 0.03 0.00 0.02 0.00 0.00 46.19 44.01 2os6 s LEU 80 CO 0.11 0.09 0.93 -0.89 0.02 0.00 0.00 176.35 176.60 2os6 s THR 81 N 0.92 4.43 0.47 5.49 2.01 0.11 -0.01 115.64 129.06 2os6 s THR 81 Ca 0.06 0.52 0.03 0.00 0.31 0.00 0.00 61.69 62.61 2os6 s THR 81 Cb -0.13 -4.48 -0.03 0.00 0.01 0.00 0.00 72.50 67.86 2os6 s THR 81 CO 0.03 -0.97 0.02 0.68 -0.69 0.00 0.00 174.62 173.69 2os6 s VAL 82 N 3.85 1.30 -0.01 3.82 -7.23 0.11 0.61 120.40 122.86 2os6 s VAL 82 Ca 0.34 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.51 2os6 s VAL 82 Cb -0.11 -2.39 0.01 0.00 0.56 0.00 0.00 36.38 34.44 2os6 s VAL 82 CO 0.23 0.00 -0.00 -1.58 -0.31 0.00 0.00 175.10 173.44 2os6 s GLN 83 N -3.82 0.06 0.34 4.82 -0.44 0.21 0.63 119.66 121.47 2os6 s GLN 83 Ca 0.15 0.01 -0.06 0.00 -2.50 0.00 0.00 55.36 52.96 2os6 s GLN 83 Cb 0.04 -0.12 0.01 0.00 -1.64 0.00 0.00 33.01 31.30 2os6 s GLN 83 CO 0.08 -0.02 0.54 0.20 0.50 0.00 0.00 175.29 176.58 2os6 s GLY 84 N 0.23 1.16 -0.42 2.59 0.00 -0.48 -0.07 107.32 110.32 2os6 s GLY 84 Ca -0.02 -1.30 -0.16 0.00 0.00 0.00 0.00 44.72 43.24 2os6 s GLY 84 CO -0.01 -0.82 0.39 0.50 0.00 0.00 0.00 173.10 173.16 2os6 s ARG 85 N -3.02 3.04 -0.49 2.90 0.52 -1.26 -1.77 118.95 118.87 2os6 s ARG 85 Ca 0.27 -0.89 -0.34 0.00 -0.52 0.00 0.00 55.73 54.25 2os6 s ARG 85 Cb -0.01 -3.98 -0.13 0.00 0.52 0.00 0.00 34.95 31.34 2os6 s ARG 85 CO 0.17 -0.84 2.31 -2.30 0.02 0.00 0.00 175.30 174.66 2os6 n PRO 86 N 5.44 0.82 -1.74 3.54 -0.02 -1.26 -4.81 135.00 136.97 2os6 n PRO 86 Ca -0.09 0.18 -0.31 0.00 -2.02 0.00 0.00 63.50 61.26 2os6 n PRO 86 Cb 0.47 -2.40 -0.07 0.00 -0.02 0.00 0.00 33.50 31.48 2os6 n PRO 86 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2os6 n PRO 87 N 8.33 1.35 -3.18 0.52 -0.02 -1.26 -4.71 135.00 136.03 2os6 n PRO 87 Ca 0.46 -2.18 -0.22 0.00 -2.02 0.00 0.00 63.50 59.54 2os6 n PRO 87 Cb 0.23 -3.52 -0.06 0.00 -0.02 0.00 0.00 33.50 30.13 2os6 n PRO 87 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2os6 n GLY 88 N 5.51 1.91 0.00 -1.23 0.00 -1.26 -5.26 105.19 104.85 2os6 n GLY 88 Ca 0.46 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2os6 n GLY 88 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06