#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ks0 n ASP 2 N 0.00 -5.73 -1.42 7.83 9.92 -1.26 -4.83 116.55 121.06 2ks0 n ASP 2 Ca 0.00 -0.13 0.11 0.00 -0.53 0.00 0.00 54.79 54.24 2ks0 n ASP 2 Cb 0.00 -4.71 0.33 0.00 -0.64 0.00 0.00 41.12 36.10 2ks0 n ASP 2 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 2ks0 n ASN 3 N -2.23 4.14 -4.77 -2.24 6.94 -1.26 -4.96 115.26 110.88 2ks0 n ASN 3 Ca -0.17 -2.12 -0.38 0.00 -0.02 0.00 0.00 54.58 51.89 2ks0 n ASN 3 Cb 0.65 -0.51 -0.01 0.00 -2.36 0.00 0.00 39.78 37.54 2ks0 n ASN 3 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2ks0 s ARG 4 N -1.25 3.89 0.03 -3.83 1.81 -1.26 -4.52 118.95 113.81 2ks0 s ARG 4 Ca 0.49 1.81 0.02 0.00 -1.72 0.00 0.00 55.73 56.34 2ks0 s ARG 4 Cb 0.27 -2.53 -0.02 0.00 -0.45 0.00 0.00 34.95 32.23 2ks0 s ARG 4 CO 0.31 -0.45 -0.07 -0.65 -0.68 0.00 0.00 175.30 173.75 2ks0 s GLN 5 N -2.52 0.52 -0.28 3.54 -0.21 -0.08 -4.91 119.66 115.72 2ks0 s GLN 5 Ca 0.61 -0.58 -0.05 0.00 0.02 0.00 0.00 55.36 55.35 2ks0 s GLN 5 Cb -0.30 -0.37 0.01 0.00 1.00 0.00 0.00 33.01 33.35 2ks0 s GLN 5 CO 0.37 0.08 0.04 -0.06 -2.12 0.00 0.00 175.29 173.60 2ks0 s PHE 6 N -0.96 3.13 -0.18 0.91 0.08 -1.26 -2.36 117.98 117.35 2ks0 s PHE 6 Ca -0.05 -1.15 -0.03 0.00 0.12 0.00 0.00 56.93 55.81 2ks0 s PHE 6 Cb -0.07 -2.20 -0.02 0.00 -0.57 0.00 0.00 43.02 40.16 2ks0 s PHE 6 CO 0.00 -0.62 -0.05 -1.17 -0.10 0.00 0.00 175.22 173.28 2ks0 s LEU 7 N 1.45 2.99 0.10 -0.37 0.20 -0.91 -4.94 118.68 117.19 2ks0 s LEU 7 Ca 0.02 -0.29 0.10 0.00 0.69 0.00 0.00 54.13 54.65 2ks0 s LEU 7 Cb -0.17 -1.73 -0.04 0.00 -0.43 0.00 0.00 46.19 43.82 2ks0 s LEU 7 CO 0.01 0.08 -0.26 -0.55 -0.29 0.00 0.00 176.35 175.33 2ks0 s SER 8 N 0.91 3.33 0.35 3.68 0.15 -1.26 0.00 113.70 120.86 2ks0 s SER 8 Ca -0.01 -0.67 -0.02 0.00 0.70 0.00 0.00 55.95 55.95 2ks0 s SER 8 Cb -0.15 -0.28 0.01 0.00 -1.71 0.00 0.00 66.02 63.89 2ks0 s SER 8 CO 0.01 0.21 0.49 -0.11 1.20 0.00 0.00 173.24 175.04 2ks0 n LEU 9 N 1.20 0.00 -3.60 3.45 7.94 0.13 -4.97 117.00 121.15 2ks0 n LEU 9 Ca -0.17 -2.80 -0.05 0.00 -1.11 0.00 0.00 56.01 51.88 2ks0 n LEU 9 Cb 0.53 2.55 -0.02 0.00 0.53 0.00 0.00 43.42 47.00 2ks0 n LEU 9 CO 0.24 -0.65 1.01 0.28 -1.11 0.00 0.00 177.39 177.15 2ks0 s THR 10 N -2.78 0.00 0.00 1.96 -1.32 -1.26 0.45 115.64 112.68 2ks0 s THR 10 Ca 0.28 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.76 2ks0 s THR 10 Cb -0.01 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.98 2ks0 s THR 10 CO 0.20 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.22 2ks0 n GLY 11 N 0.03 0.55 3.77 6.08 0.00 -1.26 -5.02 105.19 109.35 2ks0 n GLY 11 Ca -0.00 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 2ks0 n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ks0 s VAL 12 N -2.00 2.67 0.05 1.61 0.11 -1.26 -4.36 120.40 117.23 2ks0 s VAL 12 Ca 0.00 0.68 -0.17 0.00 -2.93 0.00 0.00 61.98 59.55 2ks0 s VAL 12 Cb 0.00 -3.43 -0.16 0.00 -1.53 0.00 0.00 36.38 31.26 2ks0 s VAL 12 CO 0.00 0.16 1.27 -1.28 -3.33 0.00 0.00 175.10 171.92 2ks0 h SER 13 N 3.39 0.64 -4.51 3.54 0.87 -1.18 -3.48 113.55 112.82 2ks0 h SER 13 Ca -0.49 -0.61 0.14 0.00 -1.23 0.00 0.00 61.79 59.60 2ks0 h SER 13 Cb 1.23 -0.19 -0.17 0.00 -0.44 0.00 0.00 62.40 62.83 2ks0 h SER 13 CO 0.66 1.14 0.56 -1.59 -0.53 0.00 0.00 176.83 177.07 2ks0 s LYS 14 N -3.82 0.69 -0.50 2.24 0.00 -1.07 -5.05 119.74 112.24 2ks0 s LYS 14 Ca -0.13 -0.22 -0.21 0.00 0.00 0.00 0.00 55.97 55.41 2ks0 s LYS 14 Cb 0.06 0.32 0.05 0.00 0.00 0.00 0.00 37.83 38.26 2ks0 s LYS 14 CO 0.83 -0.30 0.71 0.08 0.00 0.00 0.00 175.35 176.67 2ks0 s VAL 15 N -2.80 4.74 0.18 1.79 1.01 -1.26 -2.58 120.40 121.48 2ks0 s VAL 15 Ca 0.05 -0.15 -0.07 0.00 0.00 0.00 0.00 61.98 61.82 2ks0 s VAL 15 Cb -0.01 -4.34 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 2ks0 s VAL 15 CO -0.07 -0.84 1.55 -0.61 0.00 0.00 0.00 175.10 175.13 2ks0 h GLN 16 N 9.05 0.80 -2.11 2.72 4.15 -1.90 -3.47 115.11 124.35 2ks0 h GLN 16 Ca -0.27 -0.39 0.17 0.00 0.77 0.00 0.00 58.65 58.94 2ks0 h GLN 16 Cb 1.09 -0.00 -0.13 0.00 0.21 0.00 0.00 27.48 28.64 2ks0 h GLN 16 CO 0.98 1.02 0.57 0.45 -1.93 0.00 0.00 178.83 179.91 2ks0 s SER 17 N -6.81 -0.25 -0.26 -0.69 0.15 -1.04 -4.98 113.70 99.82 2ks0 s SER 17 Ca -0.10 -0.14 -0.01 0.00 0.70 0.00 0.00 55.95 56.40 2ks0 s SER 17 Cb 0.12 0.36 0.13 0.00 -1.71 0.00 0.00 66.02 64.93 2ks0 s SER 17 CO 0.85 -0.63 0.33 0.12 1.20 0.00 0.00 173.24 175.11 2ks0 s PHE 18 N -3.01 -0.64 0.06 3.44 5.36 -1.26 -2.63 117.98 119.29 2ks0 s PHE 18 Ca 0.09 0.32 0.04 0.00 -0.96 0.00 0.00 56.93 56.41 2ks0 s PHE 18 Cb -0.00 -0.23 -0.03 0.00 -0.34 0.00 0.00 43.02 42.41 2ks0 s PHE 18 CO -0.04 -0.81 -0.12 -0.51 -1.46 0.00 0.00 175.22 172.28 2ks0 s ASP 19 N 2.45 1.36 0.52 6.13 1.01 0.17 -5.02 116.67 123.28 2ks0 s ASP 19 Ca 0.10 -0.61 0.33 0.00 0.71 0.00 0.00 52.55 53.08 2ks0 s ASP 19 Cb -0.14 -0.01 1.37 0.00 1.01 0.00 0.00 42.92 45.15 2ks0 s ASP 19 CO -0.23 -0.14 1.97 1.55 0.21 0.00 0.00 175.17 178.53 2ks0 h PRO 20 N 4.31 0.00 -0.02 8.23 0.13 -2.02 -2.32 132.00 140.30 2ks0 h PRO 20 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2ks0 h PRO 20 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2ks0 h PRO 20 CO 0.41 0.00 -0.33 1.63 -0.23 0.00 0.00 178.00 179.48 2ks0 n LYS 21 N -2.98 1.55 -3.62 0.86 5.02 -1.26 -2.86 118.16 114.86 2ks0 n LYS 21 Ca 0.01 -1.28 -0.06 0.00 -2.02 0.00 0.00 58.31 54.96 2ks0 n LYS 21 Cb 0.28 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.77 2ks0 n LYS 21 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2ks0 s GLU 22 N -2.33 0.27 -0.05 1.97 2.12 -0.87 -4.55 118.70 115.26 2ks0 s GLU 22 Ca 0.21 0.13 0.01 0.00 0.36 0.00 0.00 54.97 55.69 2ks0 s GLU 22 Cb 0.19 0.13 0.02 0.00 0.26 0.00 0.00 34.13 34.73 2ks0 s GLU 22 CO 0.49 -0.07 -0.06 0.42 -0.54 0.00 0.00 175.26 175.50 2ks0 s ILE 23 N -0.70 0.68 -0.16 -3.70 1.01 -1.09 -0.66 121.20 116.59 2ks0 s ILE 23 Ca 0.05 -0.21 0.01 0.00 0.00 0.00 0.00 60.65 60.49 2ks0 s ILE 23 Cb -0.02 -0.67 0.00 0.00 0.01 0.00 0.00 42.46 41.78 2ks0 s ILE 23 CO -0.06 0.25 -0.17 -0.76 0.00 0.00 0.00 174.94 174.21 2ks0 s LEU 24 N 0.84 2.40 -0.04 2.97 1.43 -1.08 -1.76 118.68 123.45 2ks0 s LEU 24 Ca -0.12 -0.50 0.01 0.00 -1.03 0.00 0.00 54.13 52.48 2ks0 s LEU 24 Cb -0.15 -1.54 0.03 0.00 0.03 0.00 0.00 46.19 44.56 2ks0 s LEU 24 CO 0.01 0.08 -0.01 -0.76 0.23 0.00 0.00 176.35 175.89 2ks0 s LEU 25 N 0.86 1.19 -0.23 1.79 1.43 -0.31 -2.49 118.68 120.92 2ks0 s LEU 25 Ca -0.05 -0.06 -0.08 0.00 -1.03 0.00 0.00 54.13 52.92 2ks0 s LEU 25 Cb -0.15 -0.30 -0.03 0.00 0.03 0.00 0.00 46.19 45.73 2ks0 s LEU 25 CO -0.01 -0.09 0.08 -0.70 0.23 0.00 0.00 176.35 175.86 2ks0 s GLU 26 N 1.02 3.78 0.17 1.70 2.12 -1.06 0.01 118.70 126.44 2ks0 s GLU 26 Ca -0.10 -0.42 0.09 0.00 0.36 0.00 0.00 54.97 54.91 2ks0 s GLU 26 Cb -0.14 -3.33 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 2ks0 s GLU 26 CO -0.01 -0.05 -0.20 -0.08 -0.54 0.00 0.00 175.26 174.38 2ks0 s THR 27 N 1.25 1.94 0.00 -1.70 -1.32 -0.94 -0.61 115.64 114.27 2ks0 s THR 27 Ca 0.05 -1.93 0.00 0.00 -1.21 0.00 0.00 61.69 58.60 2ks0 s THR 27 Cb -0.14 -1.90 0.00 0.00 -1.51 0.00 0.00 72.50 68.95 2ks0 s THR 27 CO 0.04 -0.25 0.00 -0.38 -2.21 0.00 0.00 174.62 171.81 2ks0 n ILE 28 N 0.32 0.00 -2.80 5.08 5.41 -1.26 -1.61 119.36 124.49 2ks0 n ILE 28 Ca -0.13 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.51 2ks0 n ILE 28 Cb 0.57 0.00 0.07 0.00 -0.71 0.00 0.00 39.64 39.57 2ks0 n ILE 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ks0 n GLN 29 N 0.00 1.06 -3.64 0.38 10.64 -1.26 -4.97 117.38 119.59 2ks0 n GLN 29 Ca 0.00 -2.27 -0.06 0.00 -1.83 0.00 0.00 57.00 52.84 2ks0 n GLN 29 Cb 0.00 -0.97 -0.07 0.00 -0.86 0.00 0.00 30.24 28.35 2ks0 n GLN 29 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 2ks0 s GLY 30 N -1.60 0.09 -0.02 2.61 0.00 -0.64 -5.14 107.32 102.62 2ks0 s GLY 30 Ca 0.26 3.02 -0.23 0.00 0.00 0.00 0.00 44.72 47.76 2ks0 s GLY 30 CO -0.06 1.76 0.71 0.14 0.00 0.00 0.00 173.10 175.65 2ks0 s VAL 31 N -0.08 4.93 -0.20 1.40 1.01 -1.26 -2.22 120.40 123.99 2ks0 s VAL 31 Ca 0.05 1.47 -0.03 0.00 0.00 0.00 0.00 61.98 63.47 2ks0 s VAL 31 Cb -0.04 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.28 2ks0 s VAL 31 CO -0.10 0.31 -0.05 -0.22 0.00 0.00 0.00 175.10 175.05 2ks0 s LEU 32 N 0.38 2.98 -0.15 3.92 2.96 0.10 -4.44 118.68 124.43 2ks0 s LEU 32 Ca 0.37 -0.32 0.00 0.00 -0.22 0.00 0.00 54.13 53.96 2ks0 s LEU 32 Cb -0.19 -1.74 -0.01 0.00 0.50 0.00 0.00 46.19 44.76 2ks0 s LEU 32 CO 0.20 0.05 -0.15 -0.55 -1.32 0.00 0.00 176.35 174.57 2ks0 s SER 33 N 1.09 3.76 -0.13 3.68 0.15 -1.06 -1.16 113.70 120.02 2ks0 s SER 33 Ca 0.01 -0.43 -0.01 0.00 0.70 0.00 0.00 55.95 56.22 2ks0 s SER 33 Cb -0.15 -1.58 -0.02 0.00 -1.71 0.00 0.00 66.02 62.57 2ks0 s SER 33 CO -0.00 0.11 -0.10 -0.63 1.20 0.00 0.00 173.24 173.81 2ks0 s ILE 34 N 0.69 3.30 0.04 6.45 1.01 -0.72 -2.67 121.20 129.30 2ks0 s ILE 34 Ca -0.07 -0.58 0.06 0.00 0.00 0.00 0.00 60.65 60.07 2ks0 s ILE 34 Cb -0.16 -2.40 -0.02 0.00 0.01 0.00 0.00 42.46 39.89 2ks0 s ILE 34 CO 0.02 0.52 -0.18 -0.54 0.00 0.00 0.00 174.94 174.75 2ks0 s LYS 35 N 0.26 1.26 0.00 2.79 1.02 -1.01 -2.66 119.74 121.40 2ks0 s LYS 35 Ca -0.07 -0.86 0.00 0.00 0.02 0.00 0.00 55.97 55.06 2ks0 s LYS 35 Cb -0.15 -1.33 0.00 0.00 -0.52 0.00 0.00 37.83 35.83 2ks0 s LYS 35 CO 0.05 0.34 0.00 0.41 -0.92 0.00 0.00 175.35 175.23 2ks0 n GLY 36 N 1.94 -0.87 2.99 -3.33 0.00 -1.26 -1.28 105.19 103.37 2ks0 n GLY 36 Ca -0.17 -0.10 -0.15 0.00 0.00 0.00 0.00 46.02 45.60 2ks0 n GLY 36 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ks0 s GLU 37 N -0.72 0.46 -1.02 1.61 0.41 -1.21 -4.89 118.70 113.35 2ks0 s GLU 37 Ca 0.00 -0.36 -0.11 0.00 -0.41 0.00 0.00 54.97 54.08 2ks0 s GLU 37 Cb 0.00 -0.38 -0.03 0.00 -1.78 0.00 0.00 34.13 31.94 2ks0 s GLU 37 CO 0.00 0.09 0.81 1.63 -0.49 0.00 0.00 175.26 177.31 2ks0 n LYS 38 N 2.49 -1.61 -2.64 1.61 5.02 -1.26 -3.59 118.16 118.18 2ks0 n LYS 38 Ca -0.16 0.78 -0.43 0.00 -2.02 0.00 0.00 58.31 56.49 2ks0 n LYS 38 Cb 0.57 -4.87 0.00 0.00 -0.02 0.00 0.00 35.03 30.72 2ks0 n LYS 38 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2ks0 n LEU 39 N -3.37 6.22 0.00 -0.35 4.32 -1.14 -3.97 117.00 118.71 2ks0 n LEU 39 Ca -0.08 -4.71 0.00 0.00 -0.02 0.00 0.00 56.01 51.19 2ks0 n LEU 39 Cb 0.59 -1.48 0.00 0.00 -1.62 0.00 0.00 43.42 40.91 2ks0 n LEU 39 CO 0.62 1.27 0.00 0.61 -1.22 0.00 0.00 177.39 178.67 2ks0 n GLY 40 N 2.87 -0.25 0.00 -0.72 0.00 -0.82 -4.59 105.19 101.68 2ks0 n GLY 40 Ca 0.36 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.59 2ks0 n GLY 40 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2ks0 n LEU 46 N 0.00 0.00 -3.63 0.99 7.94 -1.26 -1.94 117.00 119.10 2ks0 n LEU 46 Ca 0.00 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.57 2ks0 n LEU 46 Cb 0.00 0.00 0.01 0.00 0.53 0.00 0.00 43.42 43.96 2ks0 n LEU 46 CO 0.00 0.00 -0.54 1.17 -1.11 0.00 0.00 177.39 176.91 2ks0 n LYS 47 N -1.04 0.00 0.00 1.96 3.00 -1.26 0.61 118.16 121.44 2ks0 n LYS 47 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2ks0 n LYS 47 Cb 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 35.03 34.18 2ks0 n LYS 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ks0 n ALA 48 N -1.27 0.00 -2.88 3.14 0.00 -1.26 -3.51 120.51 114.74 2ks0 n ALA 48 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.35 2ks0 n ALA 48 Cb 0.40 -0.09 0.03 0.00 0.00 0.00 0.00 19.45 19.79 2ks0 n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ks0 n GLY 49 N -1.85 -0.17 3.89 0.00 0.00 0.20 -4.99 105.19 102.27 2ks0 n GLY 49 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 2ks0 n GLY 49 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2ks0 s GLN 50 N -5.46 3.19 -0.08 1.61 2.00 -1.23 -4.68 119.66 115.01 2ks0 s GLN 50 Ca 0.25 0.45 0.02 0.00 -2.00 0.00 0.00 55.36 54.08 2ks0 s GLN 50 Cb -0.11 -2.12 -0.02 0.00 0.80 0.00 0.00 33.01 31.55 2ks0 s GLN 50 CO 0.31 -0.73 -0.13 0.08 -0.50 0.00 0.00 175.29 174.32 2ks0 s VAL 51 N -3.17 3.13 -0.03 1.34 1.01 0.17 -4.91 120.40 117.94 2ks0 s VAL 51 Ca 0.55 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.86 2ks0 s VAL 51 Cb -0.11 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 34.03 2ks0 s VAL 51 CO 0.51 0.57 -0.02 -0.70 0.00 0.00 0.00 175.10 175.45 2ks0 s GLU 52 N -0.34 0.50 0.09 2.72 2.12 -1.26 -0.70 118.70 121.83 2ks0 s GLU 52 Ca 0.03 -0.02 0.08 0.00 0.36 0.00 0.00 54.97 55.43 2ks0 s GLU 52 Cb -0.13 -0.59 -0.03 0.00 0.26 0.00 0.00 34.13 33.64 2ks0 s GLU 52 CO 0.02 -0.09 -0.21 0.08 -0.54 0.00 0.00 175.26 174.53 2ks0 s VAL 53 N 0.84 1.69 -0.06 3.70 1.01 0.10 -4.98 120.40 122.71 2ks0 s VAL 53 Ca -0.10 -1.46 0.01 0.00 0.00 0.00 0.00 61.98 60.43 2ks0 s VAL 53 Cb -0.13 -1.52 0.02 0.00 0.00 0.00 0.00 36.38 34.75 2ks0 s VAL 53 CO -0.01 -0.01 -0.06 -0.70 0.00 0.00 0.00 175.10 174.33 2ks0 s GLU 54 N -1.74 1.02 0.00 2.72 2.12 -0.82 -2.14 118.70 119.85 2ks0 s GLU 54 Ca 0.06 -0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.24 2ks0 s GLU 54 Cb -0.10 -1.01 0.00 0.00 0.26 0.00 0.00 34.13 33.28 2ks0 s GLU 54 CO 0.04 -0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.07 2ks0 n GLY 55 N 4.18 1.36 3.71 -1.50 0.00 -0.99 -1.94 105.19 110.00 2ks0 n GLY 55 Ca -0.22 -1.35 -0.37 0.00 0.00 0.00 0.00 46.02 44.08 2ks0 n GLY 55 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2ks0 s LEU 56 N 0.00 4.21 -0.21 0.99 2.34 -1.24 -0.90 118.68 123.88 2ks0 s LEU 56 Ca 0.00 0.51 -0.28 0.00 0.06 0.00 0.00 54.13 54.43 2ks0 s LEU 56 Cb 0.00 -2.43 0.00 0.00 -0.56 0.00 0.00 46.19 43.20 2ks0 s LEU 56 CO 0.00 0.03 0.97 -0.63 -1.06 0.00 0.00 176.35 175.66 2ks0 s ILE 57 N 0.78 4.75 -0.08 1.48 1.01 -1.26 -3.28 121.20 124.60 2ks0 s ILE 57 Ca 0.18 1.90 0.17 0.00 0.00 0.00 0.00 60.65 62.89 2ks0 s ILE 57 Cb -0.14 -4.25 -0.25 0.00 0.01 0.00 0.00 42.46 37.82 2ks0 s ILE 57 CO 0.06 -0.11 0.27 -0.67 0.00 0.00 0.00 174.94 174.49 2ks0 n ASP 58 N 5.92 0.84 -3.53 3.58 2.03 -0.41 -4.97 116.55 120.01 2ks0 n ASP 58 Ca 0.09 0.00 -0.15 0.00 0.52 0.00 0.00 54.79 55.26 2ks0 n ASP 58 Cb 0.47 1.49 -0.05 0.00 -0.72 0.00 0.00 41.12 42.31 2ks0 n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ks0 s ALA 59 N -2.94 -1.81 -0.07 -1.67 0.00 -1.08 -4.99 121.76 109.20 2ks0 s ALA 59 Ca -0.07 1.33 0.01 0.00 0.00 0.00 0.00 51.96 53.23 2ks0 s ALA 59 Cb 0.09 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.10 2ks0 s ALA 59 CO 0.73 -0.39 -0.08 -1.17 0.00 0.00 0.00 175.76 174.85 2ks0 s LEU 60 N -1.33 1.38 -0.13 0.00 1.98 -1.26 -2.41 118.68 116.91 2ks0 s LEU 60 Ca -0.07 -0.24 0.02 0.00 -2.89 0.00 0.00 54.13 50.95 2ks0 s LEU 60 Cb -0.00 -0.70 0.01 0.00 0.66 0.00 0.00 46.19 46.17 2ks0 s LEU 60 CO 0.05 -0.04 -0.18 -0.69 -1.89 0.00 0.00 176.35 173.60 2ks0 s VAL 61 N 1.06 1.73 -0.09 1.68 1.01 -1.09 -5.05 120.40 119.65 2ks0 s VAL 61 Ca -0.08 -0.77 -0.08 0.00 0.00 0.00 0.00 61.98 61.05 2ks0 s VAL 61 Cb -0.14 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.69 2ks0 s VAL 61 CO -0.01 0.49 0.23 -0.47 0.00 0.00 0.00 175.10 175.34 2ks0 s TYR 62 N 1.05 -0.25 -0.38 5.22 6.14 -1.26 -2.57 117.35 125.30 2ks0 s TYR 62 Ca -0.04 0.61 -0.29 0.00 0.64 0.00 0.00 57.07 58.00 2ks0 s TYR 62 Cb -0.15 0.08 -0.00 0.00 0.42 0.00 0.00 41.96 42.32 2ks0 s TYR 62 CO -0.04 -0.12 1.58 -1.25 0.64 0.00 0.00 175.55 176.35 2ks0 s PRO 63 N 0.15 3.48 0.00 4.97 0.04 -1.26 -4.84 135.00 137.53 2ks0 s PRO 63 Ca -0.00 1.15 0.22 0.00 0.04 0.00 0.00 61.00 62.41 2ks0 s PRO 63 Cb -0.02 -4.10 0.87 0.00 0.04 0.00 0.00 34.50 31.29 2ks0 s PRO 63 CO 0.00 -1.69 1.61 1.47 0.04 0.00 0.00 177.00 178.44 2ks0 n LEU 64 N 9.43 1.37 -4.01 -3.56 -0.00 -1.26 -4.95 117.00 114.03 2ks0 n LEU 64 Ca 0.19 -0.56 -0.36 0.00 -0.00 0.00 0.00 56.01 55.28 2ks0 n LEU 64 Cb 0.47 -0.07 0.04 0.00 -0.00 0.00 0.00 43.42 43.86 2ks0 n LEU 64 CO 0.70 0.28 -1.39 -1.84 -0.00 0.00 0.00 177.39 175.14 2ks0 n GLU 65 N 0.12 -0.01 -0.31 1.47 0.28 -1.26 -4.75 120.64 116.17 2ks0 n GLU 65 Ca 0.16 -0.00 0.04 0.00 -0.16 0.00 0.00 57.16 57.20 2ks0 n GLU 65 Cb 0.29 -1.02 0.18 0.00 1.43 0.00 0.00 31.44 32.32 2ks0 n GLU 65 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2ks0 h HIS 66 N -1.01 0.95 0.00 -1.84 3.86 -2.03 -3.41 115.15 111.66 2ks0 h HIS 66 Ca -0.44 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.81 2ks0 h HIS 66 Cb 1.31 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 29.48 2ks0 h HIS 66 CO 0.19 0.40 0.00 -2.39 0.86 0.00 0.00 177.93 176.99 2ks0 n HIS 67 N -4.69 0.00 0.00 2.45 -0.00 -1.26 -5.17 115.22 106.55 2ks0 n HIS 67 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.87 2ks0 n HIS 67 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.27 2ks0 n HIS 67 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2ks0 n HIS 68 N 0.00 -1.12 0.00 -1.40 8.25 -1.26 -5.03 115.22 114.66 2ks0 n HIS 68 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2ks0 n HIS 68 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2ks0 n HIS 68 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2ks0 n HIS 69 N -2.13 0.00 0.00 4.41 -0.00 -1.26 -5.08 115.22 111.16 2ks0 n HIS 69 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2ks0 n HIS 69 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2ks0 n HIS 69 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2ks0 n HIS 70 N 0.00 0.00 -1.68 1.57 -0.00 -1.26 -5.11 115.22 108.74 2ks0 n HIS 70 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2ks0 n HIS 70 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2ks0 n HIS 70 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52