#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2os6 n SER 2 N 0.00 4.11 0.05 1.61 2.88 -1.26 -4.69 113.62 116.32 2os6 n SER 2 Ca 0.00 -3.41 0.00 0.00 -1.33 0.00 0.00 58.87 54.13 2os6 n SER 2 Cb 0.00 -0.80 0.00 0.00 -0.75 0.00 0.00 64.21 62.66 2os6 n SER 2 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2os6 n HIS 3 N -0.73 -2.64 -1.02 0.66 -0.00 -1.26 -5.18 115.22 105.05 2os6 n HIS 3 Ca 0.51 0.33 0.12 0.00 -0.00 0.00 0.00 57.72 58.69 2os6 n HIS 3 Cb 1.54 1.16 -0.07 0.00 -0.00 0.00 0.00 29.99 32.62 2os6 n HIS 3 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 2os6 n MET 4 N -2.88 -2.38 0.00 1.57 0.00 -1.26 -5.09 117.12 107.07 2os6 n MET 4 Ca 0.00 1.95 0.00 0.00 0.00 0.00 0.00 57.70 59.65 2os6 n MET 4 Cb 0.00 -2.78 0.00 0.00 0.00 0.00 0.00 33.22 30.44 2os6 n MET 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2os6 n GLY 5 N -3.67 -1.63 3.71 3.03 0.00 -1.26 -5.17 105.19 100.20 2os6 n GLY 5 Ca -0.07 0.73 -0.26 0.00 0.00 0.00 0.00 46.02 46.42 2os6 n GLY 5 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2os6 s LEU 6 N 0.00 3.02 -0.02 0.99 1.43 -1.26 -4.94 118.68 117.89 2os6 s LEU 6 Ca 0.00 -1.18 0.03 0.00 -1.03 0.00 0.00 54.13 51.95 2os6 s LEU 6 Cb 0.00 -1.26 -0.03 0.00 0.03 0.00 0.00 46.19 44.93 2os6 s LEU 6 CO 0.00 -0.53 -0.11 -0.69 0.23 0.00 0.00 176.35 175.25 2os6 s VAL 7 N -2.64 3.31 -0.11 -1.59 1.01 -1.26 -4.90 120.40 114.22 2os6 s VAL 7 Ca 0.38 -0.76 -0.09 0.00 0.00 0.00 0.00 61.98 61.52 2os6 s VAL 7 Cb 0.06 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 2os6 s VAL 7 CO 0.21 0.50 0.18 0.00 0.00 0.00 0.00 175.10 175.99 2os6 s GLN 8 N -1.05 3.62 0.03 2.72 1.03 -1.26 -1.47 119.66 123.28 2os6 s GLN 8 Ca 0.14 -0.05 -0.11 0.00 0.04 0.00 0.00 55.36 55.38 2os6 s GLN 8 Cb -0.11 -3.23 0.01 0.00 0.03 0.00 0.00 33.01 29.72 2os6 s GLN 8 CO 0.03 0.70 0.23 1.03 -2.54 0.00 0.00 175.29 174.75 2os6 s ARG 9 N -0.84 0.71 -0.26 9.60 0.52 0.16 -4.97 118.95 123.88 2os6 s ARG 9 Ca 0.16 -0.53 -0.14 0.00 -0.52 0.00 0.00 55.73 54.70 2os6 s ARG 9 Cb -0.13 0.30 -0.04 0.00 0.52 0.00 0.00 34.95 35.60 2os6 s ARG 9 CO 0.05 -0.21 0.33 0.00 0.02 0.00 0.00 175.30 175.49 2os6 s VAL 11 N 1.89 4.12 -0.41 0.00 -7.23 0.13 -4.85 120.40 114.04 2os6 s VAL 11 Ca 0.14 -0.26 -0.18 0.00 -1.81 0.00 0.00 61.98 59.86 2os6 s VAL 11 Cb -0.16 -2.85 0.02 0.00 0.56 0.00 0.00 36.38 33.95 2os6 s VAL 11 CO 0.10 0.44 0.50 -0.63 -0.31 0.00 0.00 175.10 175.20 2os6 s ILE 12 N 0.77 5.01 -0.16 -0.62 1.09 -1.26 0.22 121.20 126.26 2os6 s ILE 12 Ca 0.01 -0.10 -0.03 0.00 -1.10 0.00 0.00 60.65 59.43 2os6 s ILE 12 Cb -0.14 -4.06 -0.03 0.00 -1.06 0.00 0.00 42.46 37.17 2os6 s ILE 12 CO 0.02 -0.42 -0.05 -0.63 -0.10 0.00 0.00 174.94 173.77 2os6 s ILE 13 N 2.35 3.79 -0.20 2.92 1.01 0.12 -4.75 121.20 126.45 2os6 s ILE 13 Ca 0.16 -0.39 -0.06 0.00 0.00 0.00 0.00 60.65 60.35 2os6 s ILE 13 Cb -0.16 -2.66 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 2os6 s ILE 13 CO 0.15 0.49 0.03 0.00 0.00 0.00 0.00 174.94 175.62 2os6 s GLN 14 N 0.41 3.74 0.29 2.79 -2.07 -1.26 0.06 119.66 123.62 2os6 s GLN 14 Ca -0.04 -0.45 -0.29 0.00 -1.82 0.00 0.00 55.36 52.75 2os6 s GLN 14 Cb -0.14 -3.17 -0.10 0.00 -1.09 0.00 0.00 33.01 28.51 2os6 s GLN 14 CO 0.03 0.07 1.33 0.21 -1.32 0.00 0.00 175.29 175.61 2os6 s LYS 15 N 0.89 4.35 0.42 9.60 2.36 0.21 -4.87 119.74 132.70 2os6 s LYS 15 Ca 0.02 2.20 0.01 0.00 -2.55 0.00 0.00 55.97 55.65 2os6 s LYS 15 Cb -0.14 -3.10 -0.00 0.00 -1.05 0.00 0.00 37.83 33.53 2os6 s LYS 15 CO 0.02 -0.25 0.04 -0.25 1.55 0.00 0.00 175.35 176.46 2os6 n ASP 16 N 1.50 2.66 -0.15 1.43 9.92 -1.23 -4.88 116.55 125.80 2os6 n ASP 16 Ca 0.03 -2.93 0.11 0.00 -0.53 0.00 0.00 54.79 51.47 2os6 n ASP 16 Cb 0.42 0.48 0.45 0.00 -0.64 0.00 0.00 41.12 41.82 2os6 n ASP 16 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 2os6 h ASP 17 N 1.17 0.48 -0.51 -2.24 3.58 -2.04 0.15 116.42 117.01 2os6 h ASP 17 Ca -0.34 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.12 2os6 h ASP 17 Cb 1.10 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.06 2os6 h ASP 17 CO 0.56 0.28 0.00 0.59 -2.88 0.00 0.00 179.24 177.80 2os6 n ASN 18 N -4.49 3.59 -0.08 2.28 4.13 -1.26 -5.06 115.26 114.37 2os6 n ASN 18 Ca 0.12 -2.27 0.00 0.00 1.68 0.00 0.00 54.58 54.11 2os6 n ASN 18 Cb 0.38 -0.48 0.00 0.00 -1.54 0.00 0.00 39.78 38.14 2os6 n ASN 18 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2os6 n GLY 19 N 1.02 -1.32 0.11 7.41 0.00 0.52 -4.43 105.19 108.51 2os6 n GLY 19 Ca 0.19 -1.26 -0.20 0.00 0.00 0.00 0.00 46.02 44.75 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 0.46 -2.20 1.61 -1.00 -1.89 -3.26 116.94 110.67 2os6 h PHE 20 Ca 0.00 -0.34 0.00 0.00 2.81 0.00 0.00 57.97 60.44 2os6 h PHE 20 Cb 0.00 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 39.54 2os6 h PHE 20 CO 0.00 1.37 0.00 0.41 -1.61 0.00 0.00 178.31 178.48 2os6 n GLY 21 N 1.68 0.54 3.25 -1.45 0.00 -1.26 -2.94 105.19 105.01 2os6 n GLY 21 Ca -0.18 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.20 0.65 -0.19 0.99 0.05 -1.26 0.89 118.68 117.61 2os6 s LEU 22 Ca 0.00 0.59 -0.01 0.00 0.05 0.00 0.00 54.13 54.76 2os6 s LEU 22 Cb 0.00 1.27 0.00 0.00 -2.05 0.00 0.00 46.19 45.41 2os6 s LEU 22 CO 0.00 -0.20 -0.12 -0.89 -0.55 0.00 0.00 176.35 174.59 2os6 s THR 23 N -0.15 2.82 0.14 5.48 2.01 0.18 -4.99 115.64 121.13 2os6 s THR 23 Ca -0.03 -0.69 0.10 0.00 0.31 0.00 0.00 61.69 61.38 2os6 s THR 23 Cb -0.03 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.20 2os6 s THR 23 CO 0.01 0.48 -0.24 0.54 -0.69 0.00 0.00 174.62 174.73 2os6 s VAL 24 N 1.21 2.45 0.12 3.82 0.11 -1.26 0.17 120.40 127.02 2os6 s VAL 24 Ca 0.02 -1.72 0.01 0.00 -2.93 0.00 0.00 61.98 57.36 2os6 s VAL 24 Cb -0.14 -2.11 -0.04 0.00 -1.53 0.00 0.00 36.38 32.56 2os6 s VAL 24 CO -0.05 0.06 -0.03 -0.55 -3.33 0.00 0.00 175.10 171.20 2os6 s SER 25 N -2.17 1.05 0.00 3.54 0.15 0.67 -4.89 113.70 112.05 2os6 s SER 25 Ca 0.16 -1.07 0.00 0.00 0.70 0.00 0.00 55.95 55.74 2os6 s SER 25 Cb -0.10 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.34 2os6 s SER 25 CO 0.08 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.60 2os6 n GLY 26 N -0.09 0.26 0.00 9.45 0.00 -1.26 0.20 105.19 113.75 2os6 n GLY 26 Ca -0.10 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 43.98 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 -0.39 0.00 0.01 1.61 2.03 -1.26 -4.69 116.55 113.86 2os6 n ASP 27 Ca 0.00 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.18 2os6 n ASP 27 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 2os6 n ASP 27 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 2os6 h ASN 28 N 0.00 -1.40 -2.67 1.67 4.21 -1.92 -2.91 115.58 112.56 2os6 h ASN 28 Ca 0.00 0.16 -0.79 0.00 1.21 0.00 0.00 56.30 56.88 2os6 h ASN 28 Cb 0.00 0.54 -0.24 0.00 -1.12 0.00 0.00 38.32 37.50 2os6 h ASN 28 CO 0.00 -0.40 1.03 -0.81 -1.29 0.00 0.00 177.43 175.95 2os6 n PRO 29 N -4.90 4.00 -1.67 0.81 -0.04 -1.26 -4.60 135.00 127.33 2os6 n PRO 29 Ca -0.05 -4.26 -0.49 0.00 -0.04 0.00 0.00 63.50 58.66 2os6 n PRO 29 Cb 0.31 -2.65 -0.05 0.00 -0.04 0.00 0.00 33.50 31.07 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 2.33 0.32 -4.42 0.52 0.31 -0.70 -4.79 118.33 111.90 2os6 n VAL 30 Ca 0.29 -0.06 -0.33 0.00 -0.01 0.00 0.00 64.34 64.23 2os6 n VAL 30 Cb 0.36 -1.62 -0.15 0.00 -0.91 0.00 0.00 33.84 31.51 2os6 n VAL 30 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 2os6 s PHE 31 N 2.74 2.79 -0.30 3.52 2.19 0.13 0.66 117.98 129.70 2os6 s PHE 31 Ca 0.88 -1.14 -0.29 0.00 0.33 0.00 0.00 56.93 56.71 2os6 s PHE 31 Cb -0.75 -1.91 0.01 0.00 -1.31 0.00 0.00 43.02 39.07 2os6 s PHE 31 CO 0.48 -0.54 1.10 0.08 1.83 0.00 0.00 175.22 178.17 2os6 s VAL 32 N 0.95 4.49 0.00 3.12 1.01 0.32 -0.24 120.40 130.05 2os6 s VAL 32 Ca -0.03 1.72 0.00 0.00 0.00 0.00 0.00 61.98 63.67 2os6 s VAL 32 Cb -0.15 -4.37 0.00 0.00 0.00 0.00 0.00 36.38 31.86 2os6 s VAL 32 CO -0.02 -0.44 0.00 1.67 0.00 0.00 0.00 175.10 176.30 2os6 n GLN 33 N 6.85 0.00 -4.47 2.72 7.27 0.13 -2.10 117.38 127.77 2os6 n GLN 33 Ca 0.12 0.25 -0.30 0.00 0.07 0.00 0.00 57.00 57.14 2os6 n GLN 33 Cb 0.47 -0.74 -0.12 0.00 2.41 0.00 0.00 30.24 32.26 2os6 n GLN 33 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2os6 s SER 34 N -2.00 4.02 0.04 1.69 0.15 -1.04 -3.03 113.70 113.53 2os6 s SER 34 Ca 0.00 -0.42 0.01 0.00 0.70 0.00 0.00 55.95 56.24 2os6 s SER 34 Cb 0.00 -0.69 -0.03 0.00 -1.71 0.00 0.00 66.02 63.60 2os6 s SER 34 CO 0.00 0.23 -0.05 0.68 1.20 0.00 0.00 173.24 175.30 2os6 s VAL 35 N -1.04 0.34 0.09 4.45 -7.23 -1.26 0.52 120.40 116.27 2os6 s VAL 35 Ca 0.17 -1.27 -0.31 0.00 -1.81 0.00 0.00 61.98 58.75 2os6 s VAL 35 Cb -0.11 -0.80 -0.11 0.00 0.56 0.00 0.00 36.38 35.93 2os6 s VAL 35 CO 0.08 -0.61 1.86 0.29 -0.31 0.00 0.00 175.10 176.41 2os6 n LYS 36 N 1.05 2.74 -0.04 4.82 5.02 0.26 -4.82 118.16 127.19 2os6 n LYS 36 Ca -0.20 1.00 -0.04 0.00 -2.02 0.00 0.00 58.31 57.05 2os6 n LYS 36 Cb 0.57 -2.90 0.19 0.00 -0.02 0.00 0.00 35.03 32.87 2os6 n LYS 36 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2os6 h GLU 37 N 8.88 0.62 -1.70 1.97 4.39 -1.96 -2.80 114.58 123.97 2os6 h GLU 37 Ca -0.47 -0.20 -0.50 0.00 0.34 0.00 0.00 59.36 58.53 2os6 h GLU 37 Cb 1.23 -0.06 -0.41 0.00 -0.10 0.00 0.00 28.75 29.41 2os6 h GLU 37 CO 0.94 0.73 -0.94 -0.25 -1.16 0.00 0.00 179.01 178.33 2os6 n ASP 38 N -4.17 2.85 -1.35 1.42 9.92 -1.26 -4.78 116.55 119.18 2os6 n ASP 38 Ca 0.01 -3.28 -0.03 0.00 -0.53 0.00 0.00 54.79 50.96 2os6 n ASP 38 Cb 0.35 -0.54 -0.01 0.00 -0.64 0.00 0.00 41.12 40.28 2os6 n ASP 38 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2os6 n GLY 39 N -0.12 3.25 0.39 0.44 0.00 -1.24 -5.01 105.19 102.89 2os6 n GLY 39 Ca 0.26 -1.51 0.17 0.00 0.00 0.00 0.00 46.02 44.94 2os6 n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2os6 h ALA 40 N 1.42 2.10 0.54 4.61 0.00 -1.86 0.30 119.26 126.36 2os6 h ALA 40 Ca -0.04 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2os6 h ALA 40 Cb 0.20 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2os6 h ALA 40 CO 0.06 -0.36 -0.48 0.00 0.00 0.00 0.00 179.25 178.46 2os6 h ALA 41 N 1.62 -1.16 -0.31 0.00 0.00 -1.78 0.38 119.26 117.99 2os6 h ALA 41 Ca 0.45 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 2os6 h ALA 41 Cb 1.02 0.69 -0.00 0.00 0.00 0.00 0.00 17.79 19.50 2os6 h ALA 41 CO -0.18 -1.18 -0.37 0.52 0.00 0.00 0.00 179.25 178.04 2os6 h MET 42 N -1.01 0.81 -0.59 0.00 2.07 -1.16 0.72 114.93 115.77 2os6 h MET 42 Ca -0.07 -0.45 0.04 0.00 -2.07 0.00 0.00 59.70 57.15 2os6 h MET 42 Cb 0.86 0.03 -0.03 0.00 -1.87 0.00 0.00 31.60 30.58 2os6 h MET 42 CO -0.03 1.08 0.39 -0.09 1.07 0.00 0.00 176.91 179.33 2os6 h ARG 43 N 0.58 0.65 0.00 1.72 2.43 -0.34 -0.42 114.38 119.00 2os6 h ARG 43 Ca 0.04 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2os6 h ARG 43 Cb 0.96 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 2os6 h ARG 43 CO 0.09 0.43 0.00 0.00 -1.51 0.00 0.00 179.97 178.98 2os6 n ALA 44 N -2.46 2.07 0.00 2.80 0.00 0.13 -4.88 120.51 118.16 2os6 n ALA 44 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2os6 n ALA 44 Cb 0.15 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.18 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 0.87 1.17 3.61 0.00 0.00 -0.17 -4.49 105.19 106.19 2os6 n GLY 45 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 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 5.17 0.39 1.61 1.01 0.24 -5.00 120.40 121.82 2os6 s VAL 46 Ca 0.00 0.60 0.08 0.00 0.00 0.00 0.00 61.98 62.65 2os6 s VAL 46 Cb 0.00 -3.71 -0.00 0.00 0.00 0.00 0.00 36.38 32.67 2os6 s VAL 46 CO 0.00 0.16 0.48 -1.58 0.00 0.00 0.00 175.10 174.16 2os6 s GLN 47 N 2.03 2.84 -1.19 2.72 0.74 -1.26 -3.42 119.66 122.12 2os6 s GLN 47 Ca 0.16 -1.24 -0.17 0.00 0.05 0.00 0.00 55.36 54.16 2os6 s GLN 47 Cb -0.16 -2.68 -0.04 0.00 1.10 0.00 0.00 33.01 31.23 2os6 s GLN 47 CO 0.10 -0.13 2.14 -2.37 -0.55 0.00 0.00 175.29 174.48 2os6 n THR 48 N -1.69 2.83 0.00 -0.34 5.66 -1.26 -3.65 114.28 115.84 2os6 n THR 48 Ca 0.04 -2.39 0.00 0.00 -3.05 0.00 0.00 64.05 58.65 2os6 n THR 48 Cb 0.59 -2.48 0.00 0.00 -1.55 0.00 0.00 70.33 66.89 2os6 n THR 48 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2os6 n GLY 49 N 4.23 -0.16 3.94 1.09 0.00 -0.89 -4.82 105.19 108.57 2os6 n GLY 49 Ca 0.52 0.03 -0.21 0.00 0.00 0.00 0.00 46.02 46.35 2os6 n GLY 49 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2os6 s ASP 50 N 0.00 5.03 -0.55 1.61 1.01 -0.95 -4.92 116.67 117.90 2os6 s ASP 50 Ca 0.00 -0.87 0.04 0.00 0.71 0.00 0.00 52.55 52.43 2os6 s ASP 50 Cb 0.00 -0.09 0.16 0.00 1.01 0.00 0.00 42.92 44.00 2os6 s ASP 50 CO 0.00 -0.97 0.39 -0.13 0.21 0.00 0.00 175.17 174.67 2os6 s ARG 51 N -4.34 1.69 0.09 8.23 1.81 0.66 -0.52 118.95 126.58 2os6 s ARG 51 Ca 0.49 -2.66 -0.31 0.00 -1.72 0.00 0.00 55.73 51.52 2os6 s ARG 51 Cb -0.04 -2.51 -0.07 0.00 -0.45 0.00 0.00 34.95 31.88 2os6 s ARG 51 CO 0.30 -1.30 1.32 -1.50 -0.68 0.00 0.00 175.30 173.43 2os6 s ILE 52 N -0.59 3.57 -0.06 1.52 -1.16 0.21 0.41 121.20 125.11 2os6 s ILE 52 Ca 0.26 1.13 0.03 0.00 -0.51 0.00 0.00 60.65 61.56 2os6 s ILE 52 Cb -0.05 -3.72 -0.05 0.00 0.61 0.00 0.00 42.46 39.24 2os6 s ILE 52 CO -0.15 0.09 -0.01 -0.38 -2.81 0.00 0.00 174.94 171.67 2os6 n ILE 53 N 3.95 0.35 -4.26 2.00 -0.00 0.12 -1.72 119.36 119.80 2os6 n ILE 53 Ca 0.11 -0.18 -0.17 0.00 -0.00 0.00 0.00 62.75 62.50 2os6 n ILE 53 Cb 0.44 -0.81 -0.11 0.00 -0.00 0.00 0.00 39.64 39.16 2os6 n ILE 53 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 2os6 s LYS 54 N -2.12 1.07 -0.23 0.38 2.20 0.63 -2.71 119.74 118.96 2os6 s LYS 54 Ca -0.05 -1.32 -0.04 0.00 -0.36 0.00 0.00 55.97 54.19 2os6 s LYS 54 Cb 0.02 -0.88 0.08 0.00 -1.51 0.00 0.00 37.83 35.54 2os6 s LYS 54 CO 0.18 0.16 0.11 0.14 -0.36 0.00 0.00 175.35 175.57 2os6 s VAL 55 N -2.47 -0.06 -1.23 4.02 -7.23 -0.70 0.20 120.40 112.92 2os6 s VAL 55 Ca 0.12 -0.48 -0.01 0.00 -1.81 0.00 0.00 61.98 59.80 2os6 s VAL 55 Cb -0.03 -0.79 0.00 0.00 0.56 0.00 0.00 36.38 36.12 2os6 s VAL 55 CO 0.03 -0.51 1.00 0.59 -0.31 0.00 0.00 175.10 175.91 2os6 n ASN 56 N 5.26 -2.57 -1.37 4.85 4.13 0.10 -1.97 115.26 123.70 2os6 n ASN 56 Ca -0.06 -0.62 -0.15 0.00 1.68 0.00 0.00 54.58 55.42 2os6 n ASN 56 Cb 0.45 -5.04 -0.04 0.00 -1.54 0.00 0.00 39.78 33.62 2os6 n ASN 56 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2os6 n GLY 57 N -1.28 0.80 2.93 7.41 0.00 -1.26 -4.98 105.19 108.81 2os6 n GLY 57 Ca -0.25 -0.30 -0.31 0.00 0.00 0.00 0.00 46.02 45.17 2os6 n GLY 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2os6 s THR 58 N -2.63 1.71 0.21 2.61 2.01 -0.83 -5.10 115.64 113.61 2os6 s THR 58 Ca 0.00 -1.73 -0.31 0.00 0.31 0.00 0.00 61.69 59.96 2os6 s THR 58 Cb 0.00 -2.15 -0.10 0.00 0.01 0.00 0.00 72.50 70.26 2os6 s THR 58 CO 0.00 -0.43 1.48 -0.76 -0.69 0.00 0.00 174.62 174.22 2os6 s LEU 59 N 1.23 4.38 0.00 4.42 1.43 -1.26 -1.72 118.68 127.16 2os6 s LEU 59 Ca 0.04 2.63 0.17 0.00 -1.03 0.00 0.00 54.13 55.94 2os6 s LEU 59 Cb -0.19 -3.61 0.78 0.00 0.03 0.00 0.00 46.19 43.20 2os6 s LEU 59 CO -0.11 -0.74 1.55 1.33 0.23 0.00 0.00 176.35 178.61 2os6 n VAL 60 N 2.99 0.74 0.07 -1.59 0.24 -1.10 -3.10 118.33 116.58 2os6 n VAL 60 Ca 0.09 0.18 0.05 0.00 -2.04 0.00 0.00 64.34 62.63 2os6 n VAL 60 Cb 0.40 -0.88 0.49 0.00 -1.47 0.00 0.00 33.84 32.37 2os6 n VAL 60 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 2os6 h THR 61 N 0.00 1.07 -0.42 3.34 1.35 -1.83 -2.06 112.91 114.35 2os6 h THR 61 Ca 0.00 -0.14 -0.24 0.00 -0.55 0.00 0.00 66.41 65.48 2os6 h THR 61 Cb 0.27 0.63 -0.15 0.00 -1.73 0.00 0.00 68.15 67.18 2os6 h THR 61 CO 0.00 0.07 -0.11 0.00 -0.25 0.00 0.00 175.52 175.24 2os6 n HIS 62 N -4.49 1.35 -3.93 4.73 1.44 -1.18 -4.97 115.22 108.18 2os6 n HIS 62 Ca 0.02 -1.75 -0.16 0.00 -2.01 0.00 0.00 57.72 53.82 2os6 n HIS 62 Cb 0.08 -0.53 -0.16 0.00 0.12 0.00 0.00 29.99 29.51 2os6 n HIS 62 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 2os6 s SER 63 N -2.61 0.31 0.89 4.39 0.01 -0.77 -5.06 113.70 110.85 2os6 s SER 63 Ca 0.46 -0.02 -0.09 0.00 1.31 0.00 0.00 55.95 57.62 2os6 s SER 63 Cb 0.41 -0.14 0.16 0.00 0.21 0.00 0.00 66.02 66.66 2os6 s SER 63 CO -0.00 -0.06 0.96 0.59 0.41 0.00 0.00 173.24 175.13 2os6 n ASN 64 N 3.80 0.41 0.19 2.44 3.02 -1.26 -4.81 115.26 119.04 2os6 n ASN 64 Ca -0.23 -1.55 -0.09 0.00 -0.03 0.00 0.00 54.58 52.68 2os6 n ASN 64 Cb 0.53 -0.70 -0.05 0.00 -0.61 0.00 0.00 39.78 38.95 2os6 n ASN 64 CO 0.00 0.00 0.00 -0.74 -2.62 0.00 0.00 177.26 173.90 2os6 h HIS 65 N -1.26 -0.63 -0.15 3.10 6.17 -1.97 -1.58 115.15 118.83 2os6 h HIS 65 Ca -0.31 -0.00 0.04 0.00 0.71 0.00 0.00 60.37 60.81 2os6 h HIS 65 Cb 0.94 0.23 -0.01 0.00 2.52 0.00 0.00 27.41 31.09 2os6 h HIS 65 CO 0.00 -0.34 0.13 -0.07 0.71 0.00 0.00 177.93 178.36 2os6 h LEU 66 N -0.54 0.00 0.05 0.26 4.07 -1.99 -2.44 115.31 114.71 2os6 h LEU 66 Ca -0.04 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.91 2os6 h LEU 66 Cb 0.44 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.18 2os6 h LEU 66 CO 0.03 0.00 -0.02 -0.33 -1.08 0.00 0.00 178.44 177.03 2os6 h GLU 67 N 0.00 -0.06 0.26 1.13 4.39 -1.85 -0.50 114.58 117.94 2os6 h GLU 67 Ca 0.07 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 2os6 h GLU 67 Cb 0.34 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 2os6 h GLU 67 CO -0.00 0.22 -0.12 0.28 -1.16 0.00 0.00 179.01 178.23 2os6 h VAL 68 N -0.35 0.77 -0.83 3.13 2.07 -0.83 -1.44 116.25 118.76 2os6 h VAL 68 Ca -0.01 -0.11 0.04 0.00 0.82 0.00 0.00 66.70 67.44 2os6 h VAL 68 Cb 0.31 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 2os6 h VAL 68 CO 0.01 0.02 0.53 1.62 0.02 0.00 0.00 177.57 179.77 2os6 h VAL 69 N -0.40 1.11 -0.82 2.57 3.04 -1.53 -0.08 116.25 120.13 2os6 h VAL 69 Ca -0.04 -0.35 -0.00 0.00 -1.01 0.00 0.00 66.70 65.30 2os6 h VAL 69 Cb 0.30 0.01 -0.04 0.00 -2.01 0.00 0.00 31.29 29.55 2os6 h VAL 69 CO 0.06 0.18 0.50 0.50 -1.01 0.00 0.00 177.57 177.80 2os6 h LYS 70 N 1.01 1.12 -0.10 4.17 3.64 -0.91 0.28 116.57 125.79 2os6 h LYS 70 Ca 0.34 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.59 2os6 h LYS 70 Cb 0.05 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.63 2os6 h LYS 70 CO -0.13 0.79 -0.07 -0.07 -2.27 0.00 0.00 179.45 177.70 2os6 h LEU 71 N 1.13 0.23 -0.50 5.20 3.38 -0.61 -0.78 115.31 123.36 2os6 h LEU 71 Ca 0.30 -0.44 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 2os6 h LEU 71 Cb -0.04 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2os6 h LEU 71 CO -0.06 0.62 0.14 0.40 0.09 0.00 0.00 178.44 179.63 2os6 h ILE 72 N -0.17 1.23 0.00 1.22 1.08 -0.87 -2.70 117.51 117.31 2os6 h ILE 72 Ca 0.02 -0.81 -0.07 0.00 -0.39 0.00 0.00 64.86 63.61 2os6 h ILE 72 Cb 0.55 0.82 -0.01 0.00 -3.07 0.00 0.00 36.82 35.10 2os6 h ILE 72 CO 0.02 0.29 -0.35 0.50 -0.69 0.00 0.00 178.15 177.92 2os6 h LYS 73 N 0.68 0.00 -3.77 2.37 3.64 -0.46 -3.33 116.57 115.69 2os6 h LYS 73 Ca 0.16 0.00 -0.69 0.00 -1.27 0.00 0.00 60.65 58.85 2os6 h LYS 73 Cb 0.30 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2os6 h LYS 73 CO -0.00 0.35 3.26 0.43 -2.27 0.00 0.00 179.45 181.23 2os6 n SER 74 N -4.00 5.03 0.00 4.20 7.64 -0.30 -4.78 113.62 121.41 2os6 n SER 74 Ca -0.02 -2.75 0.00 0.00 1.01 0.00 0.00 58.87 57.11 2os6 n SER 74 Cb 0.40 -1.59 0.00 0.00 -1.01 0.00 0.00 64.21 62.01 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 3.99 3.51 0.07 0.23 0.00 -1.25 -4.95 105.19 106.78 2os6 n GLY 75 Ca 0.58 -0.94 -0.02 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.13 -3.21 1.61 0.02 -1.87 -3.45 113.55 106.51 2os6 h SER 76 Ca 0.00 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 60.30 2os6 h SER 76 Cb 0.00 0.03 -0.18 0.00 0.14 0.00 0.00 62.40 62.40 2os6 h SER 76 CO 0.00 0.02 -0.80 -0.72 -1.14 0.00 0.00 176.83 174.19 2os6 s TYR 77 N -2.14 2.40 -0.04 3.45 1.13 -1.26 0.63 117.35 121.53 2os6 s TYR 77 Ca -0.02 -0.32 -0.15 0.00 -1.41 0.00 0.00 57.07 55.17 2os6 s TYR 77 Cb 0.00 -1.19 0.03 0.00 -1.10 0.00 0.00 41.96 39.69 2os6 s TYR 77 CO 0.07 0.49 0.32 0.14 -2.51 0.00 0.00 175.55 174.06 2os6 s VAL 78 N -1.62 0.05 -0.37 -3.49 -7.23 0.11 -4.95 120.40 102.90 2os6 s VAL 78 Ca 0.21 -0.38 -0.13 0.00 -1.81 0.00 0.00 61.98 59.87 2os6 s VAL 78 Cb -0.08 -0.60 0.01 0.00 0.56 0.00 0.00 36.38 36.27 2os6 s VAL 78 CO 0.11 -0.21 0.24 0.00 -0.31 0.00 0.00 175.10 174.93 2os6 s ALA 79 N -1.05 3.40 -0.16 1.32 0.00 -1.26 0.13 121.76 124.14 2os6 s ALA 79 Ca -0.11 -1.61 -0.05 0.00 0.00 0.00 0.00 51.96 50.19 2os6 s ALA 79 Cb -0.05 -2.69 -0.03 0.00 0.00 0.00 0.00 23.12 20.35 2os6 s ALA 79 CO 0.04 -1.27 0.02 -0.51 0.00 0.00 0.00 175.76 174.03 2os6 s LEU 80 N 1.64 3.58 -0.41 0.00 1.02 0.13 0.02 118.68 124.67 2os6 s LEU 80 Ca 0.04 0.02 -0.25 0.00 0.02 0.00 0.00 54.13 53.96 2os6 s LEU 80 Cb -0.18 -1.88 0.02 0.00 0.02 0.00 0.00 46.19 44.17 2os6 s LEU 80 CO 0.09 0.20 0.89 -0.89 0.02 0.00 0.00 176.35 176.66 2os6 s THR 81 N 0.17 4.57 0.44 5.49 2.01 0.13 0.17 115.64 128.62 2os6 s THR 81 Ca 0.02 0.91 0.04 0.00 0.31 0.00 0.00 61.69 62.96 2os6 s THR 81 Cb -0.13 -4.35 -0.04 0.00 0.01 0.00 0.00 72.50 67.99 2os6 s THR 81 CO 0.02 -0.65 0.03 0.68 -0.69 0.00 0.00 174.62 174.01 2os6 s VAL 82 N 3.51 1.30 0.02 3.82 -7.23 0.12 0.11 120.40 122.05 2os6 s VAL 82 Ca 0.36 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.57 2os6 s VAL 82 Cb -0.11 -2.52 -0.02 0.00 0.56 0.00 0.00 36.38 34.29 2os6 s VAL 82 CO 0.22 0.00 -0.12 -1.58 -0.31 0.00 0.00 175.10 173.31 2os6 s GLN 83 N -3.80 0.87 0.00 4.82 0.74 0.17 0.40 119.66 122.85 2os6 s GLN 83 Ca 0.22 -0.59 0.00 0.00 0.05 0.00 0.00 55.36 55.03 2os6 s GLN 83 Cb 0.05 -0.84 0.00 0.00 1.10 0.00 0.00 33.01 33.32 2os6 s GLN 83 CO 0.11 0.22 0.00 0.41 -0.55 0.00 0.00 175.29 175.48 2os6 n GLY 84 N 2.26 3.09 3.27 2.59 0.00 -0.54 -0.24 105.19 115.61 2os6 n GLY 84 Ca -0.16 -0.31 -0.26 0.00 0.00 0.00 0.00 46.02 45.29 2os6 n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2os6 s ARG 85 N -1.48 1.35 0.57 1.61 0.52 -1.26 -4.22 118.95 116.04 2os6 s ARG 85 Ca 0.00 -1.02 -0.17 0.00 -0.52 0.00 0.00 55.73 54.03 2os6 s ARG 85 Cb 0.00 -1.52 -0.05 0.00 0.52 0.00 0.00 34.95 33.91 2os6 s ARG 85 CO 0.00 0.38 1.06 -1.25 0.02 0.00 0.00 175.30 175.50 2os6 s PRO 86 N -1.38 3.41 0.01 3.54 0.04 -1.26 -5.00 135.00 134.36 2os6 s PRO 86 Ca 0.08 1.24 -0.30 0.00 0.04 0.00 0.00 61.00 62.06 2os6 s PRO 86 Cb -0.09 -2.04 -0.06 0.00 0.04 0.00 0.00 34.50 32.35 2os6 s PRO 86 CO 0.02 -0.74 1.37 -1.25 0.04 0.00 0.00 177.00 176.44 2os6 s PRO 87 N -3.90 4.30 0.00 0.56 0.04 -1.26 -4.93 135.00 129.81 2os6 s PRO 87 Ca 0.64 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.63 2os6 s PRO 87 Cb -0.16 -3.53 0.00 0.00 0.04 0.00 0.00 34.50 30.85 2os6 s PRO 87 CO 0.34 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 177.25 2os6 n GLY 88 N 3.58 3.90 0.00 0.56 0.00 -1.26 -5.38 105.19 106.60 2os6 n GLY 88 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2os6 n GLY 88 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06