#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 0.54 0.00 7.83 1.11 -1.26 -4.97 116.67 119.92 2ks0 s ASP 2 Ca 0.00 -0.21 0.00 0.00 0.18 0.00 0.00 52.55 52.52 2ks0 s ASP 2 Cb 0.00 1.01 0.00 0.00 1.07 0.00 0.00 42.92 45.00 2ks0 s ASP 2 CO 0.00 -0.34 0.38 -0.46 1.18 0.00 0.00 175.17 175.93 2ks0 n ASN 3 N 5.35 0.00 -4.78 0.27 6.94 -1.26 -5.10 115.26 116.68 2ks0 n ASN 3 Ca -0.01 -1.11 -0.37 0.00 -0.02 0.00 0.00 54.58 53.06 2ks0 n ASN 3 Cb 0.49 -0.02 -0.05 0.00 -2.36 0.00 0.00 39.78 37.84 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 0.00 4.46 0.05 -3.83 1.81 -1.26 -4.29 118.95 115.89 2ks0 s ARG 4 Ca 0.00 1.43 -0.09 0.00 -1.72 0.00 0.00 55.73 55.35 2ks0 s ARG 4 Cb 0.00 -2.76 0.00 0.00 -0.45 0.00 0.00 34.95 31.75 2ks0 s ARG 4 CO 0.00 0.14 0.19 -1.14 -0.68 0.00 0.00 175.30 173.81 2ks0 s GLN 5 N -2.14 0.73 -0.30 3.54 0.74 -0.98 -4.96 119.66 116.29 2ks0 s GLN 5 Ca 0.52 -0.73 -0.06 0.00 0.05 0.00 0.00 55.36 55.14 2ks0 s GLN 5 Cb -0.21 0.30 0.02 0.00 1.10 0.00 0.00 33.01 34.22 2ks0 s GLN 5 CO 0.27 -0.22 0.07 -0.06 -0.55 0.00 0.00 175.29 174.80 2ks0 s PHE 6 N -2.92 3.16 -0.16 1.67 0.08 -1.26 -3.01 117.98 115.54 2ks0 s PHE 6 Ca -0.02 -1.10 -0.02 0.00 0.12 0.00 0.00 56.93 55.91 2ks0 s PHE 6 Cb 0.01 -2.24 -0.01 0.00 -0.57 0.00 0.00 43.02 40.20 2ks0 s PHE 6 CO -0.06 -0.62 -0.10 -1.17 -0.10 0.00 0.00 175.22 173.18 2ks0 s LEU 7 N 1.47 2.79 -0.01 -0.37 0.20 -0.89 -5.00 118.68 116.87 2ks0 s LEU 7 Ca 0.02 -0.34 0.03 0.00 0.69 0.00 0.00 54.13 54.52 2ks0 s LEU 7 Cb -0.18 -1.66 -0.01 0.00 -0.43 0.00 0.00 46.19 43.92 2ks0 s LEU 7 CO 0.02 0.10 -0.10 -0.55 -0.29 0.00 0.00 176.35 175.53 2ks0 s SER 8 N 0.74 1.21 0.05 3.68 0.15 -1.26 -0.93 113.70 117.34 2ks0 s SER 8 Ca -0.04 -0.20 0.05 0.00 0.70 0.00 0.00 55.95 56.46 2ks0 s SER 8 Cb -0.15 -0.13 -0.03 0.00 -1.71 0.00 0.00 66.02 64.00 2ks0 s SER 8 CO 0.02 0.12 -0.13 -0.22 1.20 0.00 0.00 173.24 174.22 2ks0 s LEU 9 N -0.28 2.23 0.14 3.45 2.96 -1.01 -5.03 118.68 121.13 2ks0 s LEU 9 Ca 0.04 -0.54 0.08 0.00 -0.22 0.00 0.00 54.13 53.49 2ks0 s LEU 9 Cb -0.04 -0.51 -0.04 0.00 0.50 0.00 0.00 46.19 46.10 2ks0 s LEU 9 CO -0.00 -0.04 -0.19 0.42 -1.32 0.00 0.00 176.35 175.21 2ks0 s THR 10 N -1.09 1.76 0.00 3.68 -4.23 -1.26 -2.68 115.64 111.82 2ks0 s THR 10 Ca -0.01 -1.78 0.00 0.00 -1.18 0.00 0.00 61.69 58.72 2ks0 s THR 10 Cb -0.09 -1.73 0.00 0.00 1.34 0.00 0.00 72.50 72.02 2ks0 s THR 10 CO 0.02 -0.23 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 2ks0 n GLY 11 N 0.58 0.50 3.73 3.99 0.00 -1.26 -4.98 105.19 107.74 2ks0 n GLY 11 Ca -0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 2ks0 n GLY 11 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2ks0 n VAL 12 N -2.75 3.01 -0.03 1.61 3.14 -1.26 -4.75 118.33 117.30 2ks0 n VAL 12 Ca 0.00 -0.50 -0.14 0.00 -2.96 0.00 0.00 64.34 60.74 2ks0 n VAL 12 Cb 0.05 -1.67 -0.10 0.00 -1.06 0.00 0.00 33.84 31.06 2ks0 n VAL 12 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2ks0 h SER 13 N 1.93 0.24 -5.63 6.55 0.02 -1.76 -3.49 113.55 111.40 2ks0 h SER 13 Ca -0.50 -0.66 0.27 0.00 -0.84 0.00 0.00 61.79 60.07 2ks0 h SER 13 Cb 1.29 -0.07 -0.09 0.00 0.14 0.00 0.00 62.40 63.67 2ks0 h SER 13 CO 0.59 0.86 0.73 -1.59 -1.14 0.00 0.00 176.83 176.27 2ks0 s LYS 14 N -3.60 0.72 -0.48 3.45 -2.85 -1.11 -5.05 119.74 110.82 2ks0 s LYS 14 Ca -0.15 -0.42 -0.14 0.00 -1.00 0.00 0.00 55.97 54.25 2ks0 s LYS 14 Cb 0.02 0.23 0.09 0.00 -2.06 0.00 0.00 37.83 36.11 2ks0 s LYS 14 CO 0.74 -0.33 0.40 0.08 0.10 0.00 0.00 175.35 176.33 2ks0 s VAL 15 N -2.51 5.05 0.20 1.79 1.01 -1.26 -2.56 120.40 122.11 2ks0 s VAL 15 Ca 0.17 -1.23 -0.09 0.00 0.00 0.00 0.00 61.98 60.83 2ks0 s VAL 15 Cb 0.01 -4.08 0.12 0.00 0.00 0.00 0.00 36.38 32.43 2ks0 s VAL 15 CO -0.01 -0.64 1.73 -0.61 0.00 0.00 0.00 175.10 175.58 2ks0 h GLN 16 N 8.72 1.12 -2.36 2.72 4.15 -1.89 -3.46 115.11 124.12 2ks0 h GLN 16 Ca -0.28 -0.25 -0.06 0.00 0.77 0.00 0.00 58.65 58.84 2ks0 h GLN 16 Cb 1.10 -0.16 -0.18 0.00 0.21 0.00 0.00 27.48 28.45 2ks0 h GLN 16 CO 0.90 0.96 0.11 0.45 -1.93 0.00 0.00 178.83 179.32 2ks0 s SER 17 N -6.38 -0.56 -0.19 -0.69 0.15 -1.21 -5.00 113.70 99.82 2ks0 s SER 17 Ca -0.12 0.48 -0.01 0.00 0.70 0.00 0.00 55.95 56.99 2ks0 s SER 17 Cb 0.15 0.51 0.05 0.00 -1.71 0.00 0.00 66.02 65.02 2ks0 s SER 17 CO 0.84 -0.65 -0.01 0.12 1.20 0.00 0.00 173.24 174.74 2ks0 s PHE 18 N -1.69 1.50 0.07 3.44 5.36 -1.26 -2.49 117.98 122.90 2ks0 s PHE 18 Ca -0.09 -1.08 0.04 0.00 -0.96 0.00 0.00 56.93 54.84 2ks0 s PHE 18 Cb -0.01 -1.22 -0.03 0.00 -0.34 0.00 0.00 43.02 41.43 2ks0 s PHE 18 CO 0.05 -0.63 -0.12 -0.51 -1.46 0.00 0.00 175.22 172.55 2ks0 s ASP 19 N 1.70 1.41 0.03 6.13 1.01 -0.38 -5.03 116.67 121.55 2ks0 s ASP 19 Ca -0.01 -0.63 0.19 0.00 0.71 0.00 0.00 52.55 52.80 2ks0 s ASP 19 Cb -0.17 -0.02 0.80 0.00 1.01 0.00 0.00 42.92 44.55 2ks0 s ASP 19 CO -0.07 -0.15 1.60 -0.81 0.21 0.00 0.00 175.17 175.96 2ks0 n PRO 20 N 1.20 0.03 -0.04 8.23 -0.04 -1.26 -2.91 135.00 140.20 2ks0 n PRO 20 Ca -0.21 0.21 0.01 0.00 -0.04 0.00 0.00 63.50 63.47 2ks0 n PRO 20 Cb 0.55 -1.55 0.01 0.00 -0.04 0.00 0.00 33.50 32.47 2ks0 n PRO 20 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2ks0 n LYS 21 N -1.60 1.48 -3.49 0.54 5.02 -1.26 0.82 118.16 119.66 2ks0 n LYS 21 Ca 0.04 -1.16 0.00 0.00 -2.02 0.00 0.00 58.31 55.18 2ks0 n LYS 21 Cb 0.22 -0.81 -0.05 0.00 -0.02 0.00 0.00 35.03 34.38 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 -0.69 0.33 -0.09 1.97 2.12 -1.15 -3.28 118.70 117.93 2ks0 s GLU 22 Ca 0.03 0.74 0.03 0.00 0.36 0.00 0.00 54.97 56.13 2ks0 s GLU 22 Cb 0.02 0.34 0.00 0.00 0.26 0.00 0.00 34.13 34.76 2ks0 s GLU 22 CO 0.00 -0.10 -0.20 0.42 -0.54 0.00 0.00 175.26 174.85 2ks0 s ILE 23 N 2.12 1.72 -0.13 -3.70 -1.09 -0.16 -1.25 121.20 118.71 2ks0 s ILE 23 Ca -0.05 -0.82 -0.00 0.00 -2.23 0.00 0.00 60.65 57.55 2ks0 s ILE 23 Cb -0.06 -1.51 -0.02 0.00 -1.58 0.00 0.00 42.46 39.30 2ks0 s ILE 23 CO -0.17 0.48 -0.13 -0.76 -1.23 0.00 0.00 174.94 173.14 2ks0 s LEU 24 N 0.44 2.74 -0.09 2.97 1.43 -1.04 -0.69 118.68 124.45 2ks0 s LEU 24 Ca -0.17 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 2ks0 s LEU 24 Cb -0.17 -1.62 0.02 0.00 0.03 0.00 0.00 46.19 44.45 2ks0 s LEU 24 CO 0.07 0.16 -0.09 -0.76 0.23 0.00 0.00 176.35 175.96 2ks0 s LEU 25 N 0.36 1.35 -0.23 1.79 1.43 -0.37 -3.01 118.68 120.00 2ks0 s LEU 25 Ca -0.10 -0.28 -0.14 0.00 -1.03 0.00 0.00 54.13 52.57 2ks0 s LEU 25 Cb -0.16 -0.80 -0.04 0.00 0.03 0.00 0.00 46.19 45.22 2ks0 s LEU 25 CO 0.05 -0.06 0.33 -0.70 0.23 0.00 0.00 176.35 176.21 2ks0 s GLU 26 N 1.28 4.09 0.15 1.70 2.12 -1.06 -1.09 118.70 125.89 2ks0 s GLU 26 Ca -0.03 0.03 0.08 0.00 0.36 0.00 0.00 54.97 55.41 2ks0 s GLU 26 Cb -0.14 -3.58 -0.04 0.00 0.26 0.00 0.00 34.13 30.63 2ks0 s GLU 26 CO -0.03 -0.10 -0.18 -0.08 -0.54 0.00 0.00 175.26 174.33 2ks0 s THR 27 N 1.51 1.73 0.00 -1.70 -1.32 -0.61 -2.03 115.64 113.22 2ks0 s THR 27 Ca 0.15 -1.81 0.00 0.00 -1.21 0.00 0.00 61.69 58.82 2ks0 s THR 27 Cb -0.15 -1.74 0.00 0.00 -1.51 0.00 0.00 72.50 69.10 2ks0 s THR 27 CO 0.08 -0.28 0.00 -0.38 -2.21 0.00 0.00 174.62 171.83 2ks0 n ILE 28 N 0.49 0.00 -3.08 5.08 5.41 -1.26 -0.93 119.36 125.08 2ks0 n ILE 28 Ca -0.15 0.00 -0.16 0.00 1.00 0.00 0.00 62.75 63.44 2ks0 n ILE 28 Cb 0.56 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 39.49 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 0.99 -3.60 0.38 10.64 -1.26 -5.04 117.38 119.48 2ks0 n GLN 29 Ca 0.00 -3.08 -0.04 0.00 -1.83 0.00 0.00 57.00 52.05 2ks0 n GLN 29 Cb 0.00 -1.55 -0.02 0.00 -0.86 0.00 0.00 30.24 27.82 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 -2.22 -0.29 -0.11 2.61 0.00 -0.10 -5.15 107.32 102.05 2ks0 s GLY 30 Ca 0.36 1.59 0.02 0.00 0.00 0.00 0.00 44.72 46.68 2ks0 s GLY 30 CO -0.07 0.52 -0.17 0.14 0.00 0.00 0.00 173.10 173.52 2ks0 s VAL 31 N -2.36 2.67 -0.18 1.40 1.01 -1.26 -1.57 120.40 120.11 2ks0 s VAL 31 Ca 0.10 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.24 2ks0 s VAL 31 Cb -0.01 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 2ks0 s VAL 31 CO -0.04 0.54 -0.04 -0.22 0.00 0.00 0.00 175.10 175.34 2ks0 s LEU 32 N 0.27 3.12 -0.20 3.92 2.96 -0.25 -4.42 118.68 124.08 2ks0 s LEU 32 Ca -0.12 -0.23 -0.04 0.00 -0.22 0.00 0.00 54.13 53.52 2ks0 s LEU 32 Cb -0.16 -1.77 -0.02 0.00 0.50 0.00 0.00 46.19 44.74 2ks0 s LEU 32 CO 0.07 0.10 -0.03 -0.55 -1.32 0.00 0.00 176.35 174.62 2ks0 s SER 33 N 0.78 4.55 -0.14 3.68 0.15 -0.93 -1.23 113.70 120.56 2ks0 s SER 33 Ca -0.01 -0.29 -0.01 0.00 0.70 0.00 0.00 55.95 56.33 2ks0 s SER 33 Cb -0.15 -1.77 -0.02 0.00 -1.71 0.00 0.00 66.02 62.37 2ks0 s SER 33 CO 0.02 0.04 -0.10 -0.63 1.20 0.00 0.00 173.24 173.77 2ks0 s ILE 34 N 1.15 3.33 -0.03 6.45 1.01 0.13 -2.47 121.20 130.78 2ks0 s ILE 34 Ca 0.02 -0.56 0.06 0.00 0.00 0.00 0.00 60.65 60.17 2ks0 s ILE 34 Cb -0.15 -2.42 -0.02 0.00 0.01 0.00 0.00 42.46 39.88 2ks0 s ILE 34 CO 0.00 0.51 -0.19 -0.54 0.00 0.00 0.00 174.94 174.72 2ks0 s LYS 35 N 0.38 2.29 0.00 2.79 1.02 -0.90 -0.99 119.74 124.33 2ks0 s LYS 35 Ca -0.08 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.08 2ks0 s LYS 35 Cb -0.15 -2.22 0.00 0.00 -0.52 0.00 0.00 37.83 34.93 2ks0 s LYS 35 CO 0.05 0.59 0.00 0.41 -0.92 0.00 0.00 175.35 175.47 2ks0 n GLY 36 N 2.26 -0.72 3.07 -3.33 0.00 -1.20 -0.33 105.19 104.94 2ks0 n GLY 36 Ca -0.17 -0.39 -0.16 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.01 0.65 -1.18 1.61 2.02 -1.21 -4.52 118.70 116.06 2ks0 s GLU 37 Ca 0.00 -0.66 -0.06 0.00 0.02 0.00 0.00 54.97 54.27 2ks0 s GLU 37 Cb 0.00 -0.56 -0.02 0.00 0.10 0.00 0.00 34.13 33.65 2ks0 s GLU 37 CO 0.00 0.13 0.83 1.63 0.02 0.00 0.00 175.26 177.87 2ks0 n LYS 38 N 1.88 -3.64 -2.36 1.61 5.02 -0.92 -3.54 118.16 116.21 2ks0 n LYS 38 Ca -0.19 0.70 -0.42 0.00 -2.02 0.00 0.00 58.31 56.37 2ks0 n LYS 38 Cb 0.55 -5.26 0.00 0.00 -0.02 0.00 0.00 35.03 30.31 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 -3.93 6.77 -4.67 -0.35 4.32 0.24 -4.02 117.00 115.36 2ks0 n LEU 39 Ca -0.19 -4.72 -0.35 0.00 -0.02 0.00 0.00 56.01 50.73 2ks0 n LEU 39 Cb 0.64 -1.45 -0.10 0.00 -1.62 0.00 0.00 43.42 40.90 2ks0 n LEU 39 CO 0.64 1.47 -0.32 -0.83 -1.22 0.00 0.00 177.39 177.14 2ks0 s GLY 40 N 0.56 1.84 0.33 -0.72 0.00 -0.65 -4.42 107.32 104.26 2ks0 s GLY 40 Ca 0.40 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 44.29 2ks0 s GLY 40 CO 0.01 -0.60 0.00 1.04 0.00 0.00 0.00 173.10 173.54 2ks0 n LEU 46 N 2.08 -0.99 0.00 0.66 4.77 -1.26 -1.79 117.00 120.47 2ks0 n LEU 46 Ca -0.18 0.59 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 2ks0 n LEU 46 Cb 0.53 1.12 0.00 0.00 -2.33 0.00 0.00 43.42 42.75 2ks0 n LEU 46 CO 0.29 -0.58 0.00 1.17 -1.33 0.00 0.00 177.39 176.93 2ks0 n LYS 47 N -3.49 0.00 0.00 3.23 0.00 -1.26 -2.76 118.16 113.88 2ks0 n LYS 47 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 58.31 58.41 2ks0 n LYS 47 Cb 0.00 0.00 0.54 0.00 0.00 0.00 0.00 35.03 35.57 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 0.32 2.13 -1.91 3.14 0.00 -1.26 -4.83 120.51 118.10 2ks0 n ALA 48 Ca 0.00 -0.11 -0.12 0.00 0.00 0.00 0.00 53.44 53.21 2ks0 n ALA 48 Cb 0.00 -1.34 -0.02 0.00 0.00 0.00 0.00 19.45 18.09 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 0.45 0.42 3.94 0.00 0.00 -1.11 -4.97 105.19 103.91 2ks0 n GLY 49 Ca 0.11 -0.39 -0.24 0.00 0.00 0.00 0.00 46.02 45.50 2ks0 n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ks0 s GLN 50 N -4.03 3.33 -0.00 1.61 -0.21 -1.26 -4.65 119.66 114.45 2ks0 s GLN 50 Ca 0.00 -0.28 0.06 0.00 0.02 0.00 0.00 55.36 55.16 2ks0 s GLN 50 Cb 0.00 -2.56 -0.02 0.00 1.00 0.00 0.00 33.01 31.43 2ks0 s GLN 50 CO 0.00 -0.09 -0.20 0.54 -2.12 0.00 0.00 175.29 173.42 2ks0 s VAL 51 N -2.50 1.57 0.07 1.09 0.11 -1.09 -4.91 120.40 114.74 2ks0 s VAL 51 Ca 0.45 -0.92 0.07 0.00 -2.93 0.00 0.00 61.98 58.64 2ks0 s VAL 51 Cb -0.10 -1.32 -0.03 0.00 -1.53 0.00 0.00 36.38 33.40 2ks0 s VAL 51 CO 0.39 0.38 -0.18 -1.61 -3.33 0.00 0.00 175.10 170.75 2ks0 s GLU 52 N -0.63 1.03 -0.01 1.54 2.02 -1.26 -2.41 118.70 118.97 2ks0 s GLU 52 Ca 0.07 -0.99 0.01 0.00 0.02 0.00 0.00 54.97 54.09 2ks0 s GLU 52 Cb -0.08 -1.15 0.01 0.00 0.10 0.00 0.00 34.13 33.01 2ks0 s GLU 52 CO -0.00 0.27 -0.03 0.08 0.02 0.00 0.00 175.26 175.60 2ks0 s VAL 53 N -1.08 0.29 -0.08 2.63 1.01 -0.11 -5.00 120.40 118.06 2ks0 s VAL 53 Ca 0.03 -0.09 0.02 0.00 0.00 0.00 0.00 61.98 61.94 2ks0 s VAL 53 Cb -0.09 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 36.01 2ks0 s VAL 53 CO 0.03 0.11 -0.15 -0.70 0.00 0.00 0.00 175.10 174.39 2ks0 s GLU 54 N 0.30 2.05 0.00 2.72 2.12 -0.74 -2.10 118.70 123.05 2ks0 s GLU 54 Ca -0.03 -0.53 0.00 0.00 0.36 0.00 0.00 54.97 54.78 2ks0 s GLU 54 Cb -0.06 -1.67 0.00 0.00 0.26 0.00 0.00 34.13 32.66 2ks0 s GLU 54 CO -0.01 0.03 0.00 0.41 -0.54 0.00 0.00 175.26 175.16 2ks0 n GLY 55 N 3.86 0.52 3.70 -1.50 0.00 -1.16 -1.64 105.19 108.97 2ks0 n GLY 55 Ca -0.21 -1.19 -0.36 0.00 0.00 0.00 0.00 46.02 44.26 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 4.19 0.11 0.99 2.34 -1.23 -2.33 118.68 122.74 2ks0 s LEU 56 Ca 0.00 0.30 -0.30 0.00 0.06 0.00 0.00 54.13 54.19 2ks0 s LEU 56 Cb 0.00 -2.22 -0.06 0.00 -0.56 0.00 0.00 46.19 43.35 2ks0 s LEU 56 CO 0.00 0.10 1.05 -0.63 -1.06 0.00 0.00 176.35 175.81 2ks0 s ILE 57 N 0.69 4.27 -0.05 1.48 1.09 -1.26 -3.28 121.20 124.14 2ks0 s ILE 57 Ca 0.11 1.81 0.07 0.00 -1.10 0.00 0.00 60.65 61.55 2ks0 s ILE 57 Cb -0.13 -4.16 -0.10 0.00 -1.06 0.00 0.00 42.46 37.01 2ks0 s ILE 57 CO 0.02 0.24 0.08 -0.67 -0.10 0.00 0.00 174.94 174.52 2ks0 n ASP 58 N 3.04 3.21 -3.54 3.58 2.03 0.56 -4.95 116.55 120.47 2ks0 n ASP 58 Ca 0.04 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.24 2ks0 n ASP 58 Cb 0.48 0.94 -0.04 0.00 -0.72 0.00 0.00 41.12 41.78 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 -2.32 -1.86 -0.05 -1.67 0.00 -1.08 -5.00 121.76 109.77 2ks0 s ALA 59 Ca -0.03 1.31 0.02 0.00 0.00 0.00 0.00 51.96 53.26 2ks0 s ALA 59 Cb 0.03 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.01 2ks0 s ALA 59 CO 0.31 -0.47 -0.09 -0.51 0.00 0.00 0.00 175.76 175.00 2ks0 s LEU 60 N -1.67 1.54 -0.04 0.00 2.01 -1.26 -2.12 118.68 117.14 2ks0 s LEU 60 Ca -0.00 -0.23 0.01 0.00 0.01 0.00 0.00 54.13 53.92 2ks0 s LEU 60 Cb -0.01 -0.66 0.02 0.00 0.01 0.00 0.00 46.19 45.55 2ks0 s LEU 60 CO -0.02 0.00 -0.05 -0.69 1.01 0.00 0.00 176.35 176.61 2ks0 s VAL 61 N 0.71 0.52 -0.04 -1.59 1.01 -1.03 -5.05 120.40 114.93 2ks0 s VAL 61 Ca -0.13 -0.14 -0.06 0.00 0.00 0.00 0.00 61.98 61.65 2ks0 s VAL 61 Cb -0.15 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.71 2ks0 s VAL 61 CO 0.02 0.21 0.16 -0.47 0.00 0.00 0.00 175.10 175.02 2ks0 s TYR 62 N 0.78 -0.11 -0.32 5.22 6.14 -1.26 -2.18 117.35 125.61 2ks0 s TYR 62 Ca -0.10 0.26 -0.13 0.00 0.64 0.00 0.00 57.07 57.73 2ks0 s TYR 62 Cb -0.13 0.03 -0.14 0.00 0.42 0.00 0.00 41.96 42.14 2ks0 s TYR 62 CO 0.00 -0.15 1.34 -2.30 0.64 0.00 0.00 175.55 175.08 2ks0 n PRO 63 N 2.49 0.03 -0.42 4.97 -0.02 -1.26 -4.54 135.00 136.25 2ks0 n PRO 63 Ca -0.16 -0.68 0.06 0.00 -2.02 0.00 0.00 63.50 60.70 2ks0 n PRO 63 Cb 0.58 -2.14 0.24 0.00 -0.02 0.00 0.00 33.50 32.15 2ks0 n PRO 63 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 2ks0 n LEU 64 N 9.73 3.33 0.00 2.45 -0.00 -1.26 -5.00 117.00 126.25 2ks0 n LEU 64 Ca 0.20 -1.68 0.00 0.00 -0.00 0.00 0.00 56.01 54.53 2ks0 n LEU 64 Cb 0.43 -0.48 0.00 0.00 -0.00 0.00 0.00 43.42 43.37 2ks0 n LEU 64 CO 0.60 0.56 0.00 -0.62 -0.00 0.00 0.00 177.39 177.93 2ks0 n GLU 65 N 0.64 0.00 0.00 1.47 1.02 -1.26 -4.87 120.64 117.63 2ks0 n GLU 65 Ca 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 2ks0 n GLU 65 Cb 0.64 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.06 2ks0 n GLU 65 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2ks0 n HIS 66 N 0.00 0.00 0.00 -0.32 8.25 -1.26 -4.77 115.22 117.11 2ks0 n HIS 66 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2ks0 n HIS 66 Cb 0.00 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 30.66 2ks0 n HIS 66 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2ks0 n HIS 67 N -1.84 0.00 -3.45 4.41 8.25 -1.26 -5.09 115.22 116.24 2ks0 n HIS 67 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.45 2ks0 n HIS 67 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2ks0 n HIS 67 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2ks0 n HIS 68 N 0.00 -0.85 -0.17 4.41 -0.00 -1.26 -4.97 115.22 112.37 2ks0 n HIS 68 Ca 0.00 -0.29 -0.10 0.00 0.46 0.00 0.00 57.72 57.79 2ks0 n HIS 68 Cb 0.00 0.14 0.00 0.00 -0.12 0.00 0.00 29.99 30.02 2ks0 n HIS 68 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2ks0 h HIS 69 N 1.21 0.99 0.00 1.57 -0.00 -1.98 -3.34 115.15 113.59 2ks0 h HIS 69 Ca -0.06 -0.18 0.00 0.00 -0.00 0.00 0.00 60.37 60.13 2ks0 h HIS 69 Cb 0.25 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 2ks0 h HIS 69 CO 0.00 0.93 -0.09 1.25 -0.00 0.00 0.00 177.93 180.02 2ks0 h HIS 70 N 0.77 0.00 0.00 2.45 2.76 -2.05 -3.55 115.15 115.53 2ks0 h HIS 70 Ca 0.14 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.31 2ks0 h HIS 70 Cb 0.56 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.52 2ks0 h HIS 70 CO 0.04 0.00 0.00 1.58 -1.30 0.00 0.00 177.93 178.25