#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ks0 s ASP 2 N 0.00 6.43 0.00 7.83 2.15 -1.26 -4.86 116.67 126.97 2ks0 s ASP 2 Ca 0.00 -0.05 0.21 0.00 0.43 0.00 0.00 52.55 53.15 2ks0 s ASP 2 Cb 0.00 -2.40 0.05 0.00 -0.30 0.00 0.00 42.92 40.27 2ks0 s ASP 2 CO 0.00 -0.94 1.09 -0.46 -0.17 0.00 0.00 175.17 174.69 2ks0 n ASN 3 N 6.80 2.22 -4.76 -0.34 6.94 -1.26 -4.96 115.26 119.91 2ks0 n ASN 3 Ca 0.03 -1.61 -0.41 0.00 -0.02 0.00 0.00 54.58 52.57 2ks0 n ASN 3 Cb 0.48 0.33 -0.03 0.00 -2.36 0.00 0.00 39.78 38.20 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 -2.20 4.51 0.04 -3.83 1.81 -1.26 -4.33 118.95 113.68 2ks0 s ARG 4 Ca 0.20 1.96 -0.09 0.00 -1.72 0.00 0.00 55.73 56.08 2ks0 s ARG 4 Cb 0.17 -3.16 0.00 0.00 -0.45 0.00 0.00 34.95 31.51 2ks0 s ARG 4 CO 0.46 -0.00 0.18 -0.65 -0.68 0.00 0.00 175.30 174.61 2ks0 s GLN 5 N -1.22 0.68 -0.22 3.54 -0.21 -0.95 -4.97 119.66 116.32 2ks0 s GLN 5 Ca 0.48 -0.66 -0.04 0.00 0.02 0.00 0.00 55.36 55.16 2ks0 s GLN 5 Cb -0.35 0.28 -0.01 0.00 1.00 0.00 0.00 33.01 33.93 2ks0 s GLN 5 CO 0.44 -0.19 -0.03 -0.06 -2.12 0.00 0.00 175.29 173.33 2ks0 s PHE 6 N -2.62 2.98 -0.17 0.91 0.40 -1.26 -2.70 117.98 115.52 2ks0 s PHE 6 Ca -0.05 -0.79 -0.01 0.00 -0.60 0.00 0.00 56.93 55.48 2ks0 s PHE 6 Cb -0.01 -2.11 -0.01 0.00 0.51 0.00 0.00 43.02 41.41 2ks0 s PHE 6 CO -0.04 -0.46 -0.11 -1.17 0.70 0.00 0.00 175.22 174.14 2ks0 s LEU 7 N 1.38 2.70 0.10 -0.37 0.20 -0.55 -4.93 118.68 117.20 2ks0 s LEU 7 Ca 0.05 -0.40 0.08 0.00 0.69 0.00 0.00 54.13 54.55 2ks0 s LEU 7 Cb -0.14 -1.64 -0.03 0.00 -0.43 0.00 0.00 46.19 43.94 2ks0 s LEU 7 CO -0.01 0.07 -0.20 -0.94 -0.29 0.00 0.00 176.35 174.97 2ks0 s SER 8 N 0.93 2.48 -0.06 3.68 1.04 -1.26 -0.58 113.70 119.92 2ks0 s SER 8 Ca -0.02 -0.67 -0.11 0.00 0.48 0.00 0.00 55.95 55.63 2ks0 s SER 8 Cb -0.15 -0.14 0.02 0.00 0.10 0.00 0.00 66.02 65.86 2ks0 s SER 8 CO -0.01 0.06 0.27 -0.22 0.98 0.00 0.00 173.24 174.32 2ks0 s LEU 9 N -1.83 1.01 0.27 2.42 2.96 -1.08 -5.01 118.68 117.42 2ks0 s LEU 9 Ca 0.06 0.30 0.07 0.00 -0.22 0.00 0.00 54.13 54.34 2ks0 s LEU 9 Cb -0.10 1.00 -0.06 0.00 0.50 0.00 0.00 46.19 47.54 2ks0 s LEU 9 CO 0.04 -0.24 -0.06 0.42 -1.32 0.00 0.00 176.35 175.18 2ks0 s THR 10 N -0.52 1.63 0.00 3.68 -4.23 -1.26 -2.70 115.64 112.23 2ks0 s THR 10 Ca -0.06 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.32 2ks0 s THR 10 Cb -0.04 -2.41 0.00 0.00 1.34 0.00 0.00 72.50 71.39 2ks0 s THR 10 CO 0.02 -0.33 0.00 0.61 -0.54 0.00 0.00 174.62 174.38 2ks0 n GLY 11 N -0.56 0.46 3.74 3.99 0.00 -1.26 -5.00 105.19 106.56 2ks0 n GLY 11 Ca -0.06 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 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 3.04 0.03 1.61 0.11 -1.26 -4.50 120.40 117.42 2ks0 s VAL 12 Ca 0.00 0.86 -0.20 0.00 -2.93 0.00 0.00 61.98 59.72 2ks0 s VAL 12 Cb 0.00 -3.55 -0.18 0.00 -1.53 0.00 0.00 36.38 31.12 2ks0 s VAL 12 CO 0.00 0.13 1.23 -1.28 -3.33 0.00 0.00 175.10 171.86 2ks0 h SER 13 N 5.21 0.48 -4.40 3.54 0.87 -1.76 -3.48 113.55 114.00 2ks0 h SER 13 Ca -0.45 -0.61 0.22 0.00 -1.23 0.00 0.00 61.79 59.71 2ks0 h SER 13 Cb 1.22 -0.14 -0.18 0.00 -0.44 0.00 0.00 62.40 62.86 2ks0 h SER 13 CO 0.77 1.01 0.73 -1.59 -0.53 0.00 0.00 176.83 177.22 2ks0 s LYS 14 N -3.78 0.45 -0.42 2.24 0.00 -1.10 -5.07 119.74 112.05 2ks0 s LYS 14 Ca -0.14 -0.17 -0.21 0.00 0.00 0.00 0.00 55.97 55.46 2ks0 s LYS 14 Cb 0.05 0.20 0.02 0.00 0.00 0.00 0.00 37.83 38.10 2ks0 s LYS 14 CO 0.79 -0.20 0.64 0.08 0.00 0.00 0.00 175.35 176.66 2ks0 s VAL 15 N -2.60 4.84 0.19 1.79 1.01 -1.26 -2.08 120.40 122.28 2ks0 s VAL 15 Ca 0.08 0.20 -0.07 0.00 0.00 0.00 0.00 61.98 62.20 2ks0 s VAL 15 Cb -0.01 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.20 2ks0 s VAL 15 CO -0.06 -0.54 1.57 -0.61 0.00 0.00 0.00 175.10 175.46 2ks0 h GLN 16 N 8.80 0.83 -2.41 2.72 4.15 -1.87 -3.47 115.11 123.86 2ks0 h GLN 16 Ca -0.26 -0.37 0.01 0.00 0.77 0.00 0.00 58.65 58.80 2ks0 h GLN 16 Cb 1.10 -0.02 -0.16 0.00 0.21 0.00 0.00 27.48 28.61 2ks0 h GLN 16 CO 0.88 1.01 0.31 0.45 -1.93 0.00 0.00 178.83 179.55 2ks0 s SER 17 N -6.78 -0.53 -0.23 -0.69 0.15 -0.98 -4.99 113.70 99.66 2ks0 s SER 17 Ca -0.10 0.24 -0.04 0.00 0.70 0.00 0.00 55.95 56.75 2ks0 s SER 17 Cb 0.12 0.50 0.09 0.00 -1.71 0.00 0.00 66.02 65.02 2ks0 s SER 17 CO 0.85 -0.72 0.15 0.12 1.20 0.00 0.00 173.24 174.84 2ks0 s PHE 18 N -2.62 0.08 0.04 3.44 5.36 -1.26 -2.49 117.98 120.53 2ks0 s PHE 18 Ca -0.02 -0.40 0.04 0.00 -0.96 0.00 0.00 56.93 55.59 2ks0 s PHE 18 Cb -0.01 -0.68 -0.02 0.00 -0.34 0.00 0.00 43.02 41.97 2ks0 s PHE 18 CO -0.04 -0.68 -0.11 -0.51 -1.46 0.00 0.00 175.22 172.42 2ks0 s ASP 19 N 2.18 1.26 0.46 6.13 1.01 -0.41 -5.02 116.67 122.28 2ks0 s ASP 19 Ca 0.06 -0.49 0.31 0.00 0.71 0.00 0.00 52.55 53.14 2ks0 s ASP 19 Cb -0.16 -0.04 1.33 0.00 1.01 0.00 0.00 42.92 45.07 2ks0 s ASP 19 CO -0.22 -0.08 1.92 1.55 0.21 0.00 0.00 175.17 178.55 2ks0 h PRO 20 N 4.73 0.00 -0.00 8.23 0.13 -2.01 -2.45 132.00 140.63 2ks0 h PRO 20 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2ks0 h PRO 20 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2ks0 h PRO 20 CO 0.42 0.00 -0.81 1.63 -0.23 0.00 0.00 178.00 179.01 2ks0 n LYS 21 N -2.77 0.86 -3.64 0.86 5.02 -1.26 -2.91 118.16 114.32 2ks0 n LYS 21 Ca 0.01 -0.16 -0.03 0.00 -2.02 0.00 0.00 58.31 56.11 2ks0 n LYS 21 Cb 0.25 -1.39 -0.07 0.00 -0.02 0.00 0.00 35.03 33.80 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 -2.70 0.31 -0.07 1.97 2.12 -0.92 -4.43 118.70 114.98 2ks0 s GLU 22 Ca 0.09 0.47 0.03 0.00 0.36 0.00 0.00 54.97 55.91 2ks0 s GLU 22 Cb 0.15 0.10 0.01 0.00 0.26 0.00 0.00 34.13 34.64 2ks0 s GLU 22 CO 0.73 -0.05 -0.15 0.42 -0.54 0.00 0.00 175.26 175.66 2ks0 s ILE 23 N 0.85 1.38 -0.15 -3.70 1.01 -1.12 -1.29 121.20 118.18 2ks0 s ILE 23 Ca -0.04 -0.62 0.00 0.00 0.00 0.00 0.00 60.65 59.99 2ks0 s ILE 23 Cb -0.04 -1.23 -0.00 0.00 0.01 0.00 0.00 42.46 41.20 2ks0 s ILE 23 CO -0.12 0.41 -0.15 -0.76 0.00 0.00 0.00 174.94 174.31 2ks0 s LEU 24 N 0.57 2.48 -0.09 2.97 1.43 -1.04 -1.82 118.68 123.18 2ks0 s LEU 24 Ca -0.16 -0.46 0.04 0.00 -1.03 0.00 0.00 54.13 52.52 2ks0 s LEU 24 Cb -0.16 -1.56 0.00 0.00 0.03 0.00 0.00 46.19 44.49 2ks0 s LEU 24 CO 0.05 0.09 -0.23 -0.76 0.23 0.00 0.00 176.35 175.74 2ks0 s LEU 25 N 0.77 2.03 -0.36 1.79 1.43 -0.63 -2.31 118.68 121.39 2ks0 s LEU 25 Ca -0.06 -0.52 -0.15 0.00 -1.03 0.00 0.00 54.13 52.37 2ks0 s LEU 25 Cb -0.15 -1.33 -0.00 0.00 0.03 0.00 0.00 46.19 44.73 2ks0 s LEU 25 CO 0.01 0.15 0.34 -0.70 0.23 0.00 0.00 176.35 176.38 2ks0 s GLU 26 N 0.34 3.39 0.20 1.70 2.12 -0.88 -0.91 118.70 124.66 2ks0 s GLU 26 Ca -0.17 -0.60 0.09 0.00 0.36 0.00 0.00 54.97 54.65 2ks0 s GLU 26 Cb -0.17 -3.86 -0.04 0.00 0.26 0.00 0.00 34.13 30.32 2ks0 s GLU 26 CO 0.08 -0.60 -0.17 -0.08 -0.54 0.00 0.00 175.26 173.95 2ks0 s THR 27 N 1.94 1.91 0.00 -1.70 -1.32 -0.64 -2.02 115.64 113.80 2ks0 s THR 27 Ca 0.10 -2.10 0.00 0.00 -1.21 0.00 0.00 61.69 58.48 2ks0 s THR 27 Cb -0.17 -1.99 0.00 0.00 -1.51 0.00 0.00 72.50 68.83 2ks0 s THR 27 CO 0.12 -0.42 0.00 -0.38 -2.21 0.00 0.00 174.62 171.72 2ks0 n ILE 28 N -0.09 0.00 -0.04 5.08 2.08 -1.26 -1.18 119.36 123.96 2ks0 n ILE 28 Ca -0.10 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.21 2ks0 n ILE 28 Cb 0.59 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.48 2ks0 n ILE 28 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2ks0 n GLN 29 N 0.00 3.66 -3.20 0.38 -0.00 -1.26 -5.00 117.38 111.96 2ks0 n GLN 29 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 57.00 56.80 2ks0 n GLN 29 Cb 0.00 -0.31 0.03 0.00 -0.00 0.00 0.00 30.24 29.96 2ks0 n GLN 29 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 2ks0 s GLY 30 N 0.00 1.92 -0.06 2.61 0.00 -0.32 -5.12 107.32 106.35 2ks0 s GLY 30 Ca 0.00 -1.87 0.04 0.00 0.00 0.00 0.00 44.72 42.88 2ks0 s GLY 30 CO 0.00 -1.67 -0.17 0.14 0.00 0.00 0.00 173.10 171.40 2ks0 s VAL 31 N -2.57 1.47 -0.20 1.40 1.01 -1.26 -1.63 120.40 118.62 2ks0 s VAL 31 Ca 0.55 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.73 2ks0 s VAL 31 Cb -0.06 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 2ks0 s VAL 31 CO 0.34 0.42 0.09 -0.22 0.00 0.00 0.00 175.10 175.73 2ks0 s LEU 32 N 0.21 3.89 -0.16 3.92 2.96 -0.08 -4.56 118.68 124.85 2ks0 s LEU 32 Ca -0.08 0.08 -0.02 0.00 -0.22 0.00 0.00 54.13 53.90 2ks0 s LEU 32 Cb -0.13 -2.00 -0.01 0.00 0.50 0.00 0.00 46.19 44.54 2ks0 s LEU 32 CO 0.03 0.14 -0.09 -0.44 -1.32 0.00 0.00 176.35 174.67 2ks0 s SER 33 N 0.58 4.19 -0.15 3.68 0.01 -1.04 -1.61 113.70 119.36 2ks0 s SER 33 Ca 0.05 -0.32 -0.04 0.00 1.31 0.00 0.00 55.95 56.95 2ks0 s SER 33 Cb -0.13 -1.67 -0.03 0.00 0.21 0.00 0.00 66.02 64.41 2ks0 s SER 33 CO 0.01 0.11 -0.04 -0.63 0.41 0.00 0.00 173.24 173.10 2ks0 s ILE 34 N 0.70 3.91 -0.01 1.44 1.01 -0.76 -2.72 121.20 124.77 2ks0 s ILE 34 Ca -0.05 -0.35 0.06 0.00 0.00 0.00 0.00 60.65 60.31 2ks0 s ILE 34 Cb -0.15 -2.71 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 2ks0 s ILE 34 CO 0.02 0.50 -0.20 -0.54 0.00 0.00 0.00 174.94 174.72 2ks0 s LYS 35 N 0.32 1.58 0.00 2.79 1.02 -0.89 -2.79 119.74 121.77 2ks0 s LYS 35 Ca -0.04 -0.73 0.00 0.00 0.02 0.00 0.00 55.97 55.23 2ks0 s LYS 35 Cb -0.14 -1.54 0.00 0.00 -0.52 0.00 0.00 37.83 35.63 2ks0 s LYS 35 CO 0.03 0.42 0.00 0.41 -0.92 0.00 0.00 175.35 175.29 2ks0 n GLY 36 N 2.52 -0.71 3.04 -3.33 0.00 -1.26 -1.86 105.19 103.58 2ks0 n GLY 36 Ca -0.15 -0.37 -0.16 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.99 0.59 -1.05 1.61 0.41 -1.25 -4.87 118.70 113.14 2ks0 s GLU 37 Ca 0.00 -0.51 -0.11 0.00 -0.41 0.00 0.00 54.97 53.94 2ks0 s GLU 37 Cb 0.00 -0.50 -0.04 0.00 -1.78 0.00 0.00 34.13 31.81 2ks0 s GLU 37 CO 0.00 0.12 0.84 1.63 -0.49 0.00 0.00 175.26 177.37 2ks0 n LYS 38 N 2.23 -1.73 -2.61 1.61 5.02 -1.26 -3.83 118.16 117.59 2ks0 n LYS 38 Ca -0.17 0.76 -0.43 0.00 -2.02 0.00 0.00 58.31 56.45 2ks0 n LYS 38 Cb 0.56 -5.06 0.01 0.00 -0.02 0.00 0.00 35.03 30.52 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 -3.45 6.39 -4.84 -0.35 4.32 -1.15 -3.94 117.00 113.99 2ks0 n LEU 39 Ca -0.08 -4.79 -0.32 0.00 -0.02 0.00 0.00 56.01 50.80 2ks0 n LEU 39 Cb 0.60 -1.44 -0.05 0.00 -1.62 0.00 0.00 43.42 40.90 2ks0 n LEU 39 CO 0.62 1.39 0.61 -0.83 -1.22 0.00 0.00 177.39 177.95 2ks0 s GLY 40 N 0.43 2.23 0.00 -0.72 0.00 -0.50 -4.62 107.32 104.14 2ks0 s GLY 40 Ca 0.37 0.22 0.00 0.00 0.00 0.00 0.00 44.72 45.31 2ks0 s GLY 40 CO 0.03 0.48 0.00 1.47 0.00 0.00 0.00 173.10 175.07 2ks0 n LEU 46 N -0.99 0.00 0.00 0.66 -0.00 -1.26 -0.27 117.00 115.15 2ks0 n LEU 46 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.07 2ks0 n LEU 46 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 2ks0 n LEU 46 CO 0.42 0.00 0.00 1.17 -0.00 0.00 0.00 177.39 178.98 2ks0 n LYS 47 N 0.00 0.00 0.00 1.47 4.81 -1.26 0.16 118.16 123.34 2ks0 n LYS 47 Ca 0.00 0.00 0.15 0.00 -0.87 0.00 0.00 58.31 57.59 2ks0 n LYS 47 Cb 0.00 0.00 0.77 0.00 0.02 0.00 0.00 35.03 35.82 2ks0 n LYS 47 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2ks0 n ALA 48 N 3.11 2.65 -3.60 3.14 0.00 -1.26 -4.94 120.51 119.62 2ks0 n ALA 48 Ca 0.00 -0.29 -0.24 0.00 0.00 0.00 0.00 53.44 52.90 2ks0 n ALA 48 Cb 0.00 -1.38 0.02 0.00 0.00 0.00 0.00 19.45 18.10 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 1.09 -1.11 3.09 0.00 0.00 0.43 -4.92 105.19 103.78 2ks0 n GLY 49 Ca 0.21 0.49 -0.09 0.00 0.00 0.00 0.00 46.02 46.63 2ks0 n GLY 49 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ks0 s GLN 50 N -5.21 0.61 0.25 1.61 -2.07 -1.26 -4.38 119.66 109.20 2ks0 s GLN 50 Ca 0.27 -1.09 0.11 0.00 -1.82 0.00 0.00 55.36 52.83 2ks0 s GLN 50 Cb -0.10 0.03 -0.05 0.00 -1.09 0.00 0.00 33.01 31.80 2ks0 s GLN 50 CO 0.85 -0.06 -0.13 0.14 -1.32 0.00 0.00 175.29 174.78 2ks0 s VAL 51 N -3.14 2.87 -0.02 3.63 -7.23 -1.10 -4.55 120.40 110.87 2ks0 s VAL 51 Ca 0.02 -2.09 -0.02 0.00 -1.81 0.00 0.00 61.98 58.08 2ks0 s VAL 51 Cb 0.02 -2.49 0.01 0.00 0.56 0.00 0.00 36.38 34.48 2ks0 s VAL 51 CO -0.06 -0.31 0.05 -1.61 -0.31 0.00 0.00 175.10 172.86 2ks0 s GLU 52 N -3.34 0.07 -0.05 4.82 2.02 -1.26 -2.62 118.70 118.34 2ks0 s GLU 52 Ca 0.28 0.07 0.04 0.00 0.02 0.00 0.00 54.97 55.39 2ks0 s GLU 52 Cb -0.06 0.03 -0.00 0.00 0.10 0.00 0.00 34.13 34.20 2ks0 s GLU 52 CO 0.16 -0.01 -0.17 0.08 0.02 0.00 0.00 175.26 175.34 2ks0 s VAL 53 N 0.01 1.45 -0.15 2.63 1.01 0.25 -4.96 120.40 120.64 2ks0 s VAL 53 Ca -0.00 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.26 2ks0 s VAL 53 Cb -0.00 -1.25 0.00 0.00 0.00 0.00 0.00 36.38 35.13 2ks0 s VAL 53 CO 0.00 0.42 -0.17 -0.70 0.00 0.00 0.00 175.10 174.65 2ks0 s GLU 54 N 0.07 3.18 0.00 2.72 2.12 0.63 -1.48 118.70 125.94 2ks0 s GLU 54 Ca -0.05 -0.78 0.00 0.00 0.36 0.00 0.00 54.97 54.51 2ks0 s GLU 54 Cb -0.12 -2.57 0.00 0.00 0.26 0.00 0.00 34.13 31.70 2ks0 s GLU 54 CO 0.02 0.03 0.00 0.41 -0.54 0.00 0.00 175.26 175.19 2ks0 n GLY 55 N 4.00 0.67 3.71 -1.50 0.00 -1.10 -1.41 105.19 109.56 2ks0 n GLY 55 Ca -0.19 -1.21 -0.38 0.00 0.00 0.00 0.00 46.02 44.24 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 4.25 -0.08 0.99 2.34 -1.25 -2.24 118.68 122.70 2ks0 s LEU 56 Ca 0.00 0.82 -0.30 0.00 0.06 0.00 0.00 54.13 54.71 2ks0 s LEU 56 Cb 0.00 -2.73 -0.02 0.00 -0.56 0.00 0.00 46.19 42.88 2ks0 s LEU 56 CO 0.00 -0.05 1.06 -0.63 -1.06 0.00 0.00 176.35 175.67 2ks0 s ILE 57 N 0.86 4.64 -0.08 1.48 1.09 -1.26 -3.86 121.20 124.07 2ks0 s ILE 57 Ca 0.27 1.92 0.07 0.00 -1.10 0.00 0.00 60.65 61.80 2ks0 s ILE 57 Cb -0.15 -4.23 -0.10 0.00 -1.06 0.00 0.00 42.46 36.92 2ks0 s ILE 57 CO 0.11 0.02 0.03 -0.67 -0.10 0.00 0.00 174.94 174.33 2ks0 n ASP 58 N 4.91 3.05 -3.64 3.58 -0.08 -0.78 -5.01 116.55 118.58 2ks0 n ASP 58 Ca 0.09 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.28 2ks0 n ASP 58 Cb 0.48 0.70 -0.07 0.00 2.34 0.00 0.00 41.12 44.57 2ks0 n ASP 58 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ks0 s ALA 59 N -2.19 -1.98 -0.07 -1.67 0.00 -1.09 -5.00 121.76 109.75 2ks0 s ALA 59 Ca -0.04 1.99 0.04 0.00 0.00 0.00 0.00 51.96 53.95 2ks0 s ALA 59 Cb 0.02 -1.44 -0.02 0.00 0.00 0.00 0.00 23.12 21.69 2ks0 s ALA 59 CO 0.32 -0.28 -0.20 -0.51 0.00 0.00 0.00 175.76 175.10 2ks0 s LEU 60 N 0.51 2.39 -0.06 0.00 2.01 -1.26 -2.10 118.68 120.17 2ks0 s LEU 60 Ca -0.00 -0.39 0.02 0.00 0.01 0.00 0.00 54.13 53.77 2ks0 s LEU 60 Cb -0.05 -1.47 0.02 0.00 0.01 0.00 0.00 46.19 44.69 2ks0 s LEU 60 CO -0.07 0.26 -0.11 -0.69 1.01 0.00 0.00 176.35 176.75 2ks0 s VAL 61 N -0.22 1.02 -0.08 -1.59 1.01 -1.10 -5.05 120.40 114.39 2ks0 s VAL 61 Ca -0.01 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.50 2ks0 s VAL 61 Cb -0.13 -0.95 0.02 0.00 0.00 0.00 0.00 36.38 35.32 2ks0 s VAL 61 CO 0.03 0.33 0.20 -0.47 0.00 0.00 0.00 175.10 175.19 2ks0 s TYR 62 N 0.75 -0.23 -0.39 5.22 6.14 -1.26 -2.49 117.35 125.10 2ks0 s TYR 62 Ca -0.13 0.56 -0.28 0.00 0.64 0.00 0.00 57.07 57.86 2ks0 s TYR 62 Cb -0.15 0.06 -0.01 0.00 0.42 0.00 0.00 41.96 42.27 2ks0 s TYR 62 CO 0.03 -0.13 1.71 -1.25 0.64 0.00 0.00 175.55 176.55 2ks0 s PRO 63 N 0.35 3.29 0.00 4.97 0.04 -1.26 -4.83 135.00 137.56 2ks0 s PRO 63 Ca -0.02 1.18 0.27 0.00 0.04 0.00 0.00 61.00 62.47 2ks0 s PRO 63 Cb -0.03 -4.18 0.81 0.00 0.04 0.00 0.00 34.50 31.13 2ks0 s PRO 63 CO -0.01 -1.91 1.61 1.47 0.04 0.00 0.00 177.00 178.20 2ks0 n LEU 64 N 10.27 0.54 -4.76 -3.56 -0.00 -1.26 -4.89 117.00 113.34 2ks0 n LEU 64 Ca 0.21 0.01 -0.41 0.00 -0.00 0.00 0.00 56.01 55.82 2ks0 n LEU 64 Cb 0.48 -0.24 -0.01 0.00 -0.00 0.00 0.00 43.42 43.64 2ks0 n LEU 64 CO 0.69 0.11 1.22 -1.61 -0.00 0.00 0.00 177.39 177.81 2ks0 s GLU 65 N -2.78 4.12 0.00 1.47 2.02 -1.26 -4.85 118.70 117.42 2ks0 s GLU 65 Ca 0.18 2.57 0.28 0.00 0.02 0.00 0.00 54.97 58.02 2ks0 s GLU 65 Cb 0.19 -3.01 1.04 0.00 0.10 0.00 0.00 34.13 32.45 2ks0 s GLU 65 CO 0.59 -0.61 1.76 1.58 0.02 0.00 0.00 175.26 178.60 2ks0 n HIS 66 N 1.84 0.00 -2.51 1.61 -0.00 -1.26 -4.84 115.22 110.05 2ks0 n HIS 66 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.79 2ks0 n HIS 66 Cb 0.38 -0.25 0.00 0.00 -0.00 0.00 0.00 29.99 30.12 2ks0 n HIS 66 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2ks0 n HIS 67 N -1.13 -1.71 -1.65 1.57 8.25 -1.26 -5.14 115.22 114.14 2ks0 n HIS 67 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2ks0 n HIS 67 Cb 0.31 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.42 2ks0 n HIS 67 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2ks0 n HIS 68 N -0.58 0.00 -1.54 4.41 1.44 -1.26 -5.07 115.22 112.62 2ks0 n HIS 68 Ca 0.00 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.39 2ks0 n HIS 68 Cb 0.00 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.04 2ks0 n HIS 68 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2ks0 n HIS 69 N 0.00 1.14 0.00 -1.40 -0.00 -1.26 -4.72 115.22 108.98 2ks0 n HIS 69 Ca 0.00 0.14 0.00 0.00 0.46 0.00 0.00 57.72 58.32 2ks0 n HIS 69 Cb 0.00 -2.47 0.00 0.00 -0.12 0.00 0.00 29.99 27.40 2ks0 n HIS 69 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2ks0 n HIS 70 N 14.83 0.00 -1.69 1.57 -0.00 -1.26 -5.33 115.22 123.33 2ks0 n HIS 70 Ca 0.46 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.64 2ks0 n HIS 70 Cb 0.41 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.28 2ks0 n HIS 70 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52