#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hk6 n MET 4 N 0.00 1.45 -2.15 1.57 0.00 -1.26 -4.90 117.12 111.82 1hk6 n MET 4 Ca 0.00 -0.47 -0.42 0.00 -0.00 0.00 0.00 57.70 56.81 1hk6 n MET 4 Cb 0.00 -1.48 -0.03 0.00 0.00 0.00 0.00 33.22 31.71 1hk6 n MET 4 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 1hk6 s ARG 5 N 0.51 4.31 0.20 2.12 1.81 -1.26 -4.96 118.95 121.67 1hk6 s ARG 5 Ca 0.31 2.09 -0.30 0.00 -1.72 0.00 0.00 55.73 56.11 1hk6 s ARG 5 Cb 0.15 -3.27 -0.09 0.00 -0.45 0.00 0.00 34.95 31.29 1hk6 s ARG 5 CO 0.00 -0.46 1.40 -0.65 -0.68 0.00 0.00 175.30 174.91 1hk6 s GLN 6 N 1.21 4.31 0.52 3.54 -0.21 -1.26 -4.66 119.66 123.12 1hk6 s GLN 6 Ca 0.65 2.18 -0.21 0.00 0.02 0.00 0.00 55.36 58.00 1hk6 s GLN 6 Cb -0.37 -3.17 -0.07 0.00 1.00 0.00 0.00 33.01 30.40 1hk6 s GLN 6 CO 0.30 -0.39 1.10 -2.30 -2.12 0.00 0.00 175.29 171.88 1hk6 n PRO 7 N 2.94 1.31 -1.70 2.91 -0.02 -1.26 -4.88 135.00 134.30 1hk6 n PRO 7 Ca 0.08 0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 61.61 1hk6 n PRO 7 Cb 0.41 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.60 1hk6 n PRO 7 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1hk6 n PRO 8 N -0.61 2.57 -3.94 0.52 -0.04 -1.26 -4.71 135.00 127.53 1hk6 n PRO 8 Ca 0.11 0.93 -0.35 0.00 -0.04 0.00 0.00 63.50 64.15 1hk6 n PRO 8 Cb 0.44 -2.75 -0.14 0.00 -0.04 0.00 0.00 33.50 31.00 1hk6 n PRO 8 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1hk6 s LEU 9 N 1.21 2.78 0.00 1.53 2.96 -0.57 -0.59 118.68 126.00 1hk6 s LEU 9 Ca 0.77 -0.45 -0.24 0.00 -0.22 0.00 0.00 54.13 53.98 1hk6 s LEU 9 Cb -0.56 -1.69 -0.05 0.00 0.50 0.00 0.00 46.19 44.39 1hk6 s LEU 9 CO 0.35 -0.02 0.75 -0.69 -1.32 0.00 0.00 176.35 175.41 1hk6 s VAL 10 N 1.44 4.86 -0.35 1.68 1.01 -0.81 -0.18 120.40 128.05 1hk6 s VAL 10 Ca 0.06 1.57 0.14 0.00 0.00 0.00 0.00 61.98 63.74 1hk6 s VAL 10 Cb -0.14 -4.09 0.43 0.00 0.00 0.00 0.00 36.38 32.57 1hk6 s VAL 10 CO -0.05 0.32 1.22 0.35 0.00 0.00 0.00 175.10 176.94 1hk6 n THR 11 N 3.20 0.44 -3.64 3.92 -2.24 -0.36 -4.06 114.28 111.54 1hk6 n THR 11 Ca -0.02 -2.08 -0.03 0.00 -2.27 0.00 0.00 64.05 59.65 1hk6 n THR 11 Cb 0.51 0.92 -0.06 0.00 -2.10 0.00 0.00 70.33 69.60 1hk6 n THR 11 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1hk6 s GLY 12 N -2.06 0.23 -0.27 3.38 0.00 -0.74 -4.80 107.32 103.06 1hk6 s GLY 12 Ca 0.23 3.20 -0.16 0.00 0.00 0.00 0.00 44.72 47.99 1hk6 s GLY 12 CO -0.05 1.56 0.66 -1.50 0.00 0.00 0.00 173.10 173.77 1hk6 s ILE 13 N -0.45 -0.00 0.05 0.90 2.07 -1.26 -2.58 121.20 119.92 1hk6 s ILE 13 Ca 0.08 0.01 -0.34 0.00 -1.41 0.00 0.00 60.65 58.99 1hk6 s ILE 13 Cb -0.03 -0.95 -0.19 0.00 0.13 0.00 0.00 42.46 41.42 1hk6 s ILE 13 CO -0.12 0.00 1.46 0.28 -1.91 0.00 0.00 174.94 174.66 1hk6 h SER 14 N 6.82 -1.03 0.00 4.50 0.02 -1.94 -3.45 113.55 118.47 1hk6 h SER 14 Ca -0.31 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1hk6 h SER 14 Cb 1.22 0.27 0.00 0.00 0.14 0.00 0.00 62.40 64.03 1hk6 h SER 14 CO 0.17 -0.72 0.00 -2.65 -1.14 0.00 0.00 176.83 172.49 1hk6 n PRO 15 N -5.39 2.65 0.00 3.45 -0.02 -1.26 -5.05 135.00 129.38 1hk6 n PRO 15 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 1hk6 n PRO 15 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.96 1hk6 n PRO 15 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1hk6 n ASN 16 N 0.00 0.00 -3.64 2.55 0.23 -1.26 -5.10 115.26 108.03 1hk6 n ASN 16 Ca 0.00 0.00 -0.07 0.00 -0.53 0.00 0.00 54.58 53.98 1hk6 n ASN 16 Cb 0.00 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 37.63 1hk6 n ASN 16 CO 0.00 0.00 0.00 -1.83 -0.93 0.00 0.00 177.26 174.50 1hk6 s GLU 17 N -0.08 0.68 0.00 -3.83 -1.05 -1.26 -3.16 118.70 110.00 1hk6 s GLU 17 Ca 0.00 1.22 0.00 0.00 -0.15 0.00 0.00 54.97 56.04 1hk6 s GLU 17 Cb 0.00 0.18 0.00 0.00 -0.44 0.00 0.00 34.13 33.87 1hk6 s GLU 17 CO 0.00 -0.15 0.00 0.41 0.95 0.00 0.00 175.26 176.47 1hk6 n GLY 18 N 4.39 1.94 3.44 -3.83 0.00 -0.91 -4.95 105.19 105.27 1hk6 n GLY 18 Ca -0.20 -0.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.72 1hk6 n GLY 18 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1hk6 n ILE 19 N -0.52 0.95 -0.33 -0.61 -5.35 -1.23 -2.25 119.36 110.02 1hk6 n ILE 19 Ca 0.00 -0.30 0.10 0.00 -0.27 0.00 0.00 62.75 62.28 1hk6 n ILE 19 Cb 0.00 -0.68 0.27 0.00 -1.74 0.00 0.00 39.64 37.50 1hk6 n ILE 19 CO 0.00 0.00 0.00 -0.65 -1.76 0.00 0.00 176.55 174.14 1hk6 h PRO 20 N -0.93 0.71 0.00 6.28 0.11 -1.77 0.69 132.00 137.08 1hk6 h PRO 20 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1hk6 h PRO 20 Cb 1.32 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1hk6 h PRO 20 CO 0.38 0.47 0.00 0.91 -0.21 0.00 0.00 178.00 179.55 1hk6 n TRP 21 N -4.80 0.00 -1.92 0.65 7.02 -1.26 -2.15 117.44 114.98 1hk6 n TRP 21 Ca 0.20 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.27 1hk6 n TRP 21 Cb 0.50 -0.29 -0.03 0.00 -2.42 0.00 0.00 31.31 29.07 1hk6 n TRP 21 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 1hk6 s THR 22 N -2.58 2.56 0.28 -0.99 2.01 0.23 -4.87 115.64 112.28 1hk6 s THR 22 Ca 0.15 0.41 -0.29 0.00 0.31 0.00 0.00 61.69 62.27 1hk6 s THR 22 Cb 0.11 -3.27 -0.10 0.00 0.01 0.00 0.00 72.50 69.25 1hk6 s THR 22 CO 0.25 0.04 1.38 -0.75 -0.69 0.00 0.00 174.62 174.85 1hk6 s LYS 23 N 0.84 4.30 -0.04 4.92 2.47 -1.26 -4.01 119.74 126.96 1hk6 s LYS 23 Ca 0.68 2.27 -0.01 0.00 -1.56 0.00 0.00 55.97 57.35 1hk6 s LYS 23 Cb -0.44 -3.10 0.03 0.00 -1.46 0.00 0.00 37.83 32.86 1hk6 s LYS 23 CO 0.34 -0.33 0.07 0.14 0.16 0.00 0.00 175.35 175.73 1hk6 s VAL 24 N -0.45 -0.05 -0.22 4.02 -7.23 -1.24 -4.80 120.40 110.43 1hk6 s VAL 24 Ca 0.55 0.18 -0.20 0.00 -1.81 0.00 0.00 61.98 60.70 1hk6 s VAL 24 Cb -0.41 -0.14 -0.03 0.00 0.56 0.00 0.00 36.38 36.37 1hk6 s VAL 24 CO 0.47 0.07 0.59 -0.89 -0.31 0.00 0.00 175.10 175.03 1hk6 s THR 25 N 0.97 5.04 0.27 5.32 2.01 -1.26 -3.76 115.64 124.24 1hk6 s THR 25 Ca -0.08 1.08 -0.29 0.00 0.31 0.00 0.00 61.69 62.71 1hk6 s THR 25 Cb -0.11 -3.90 -0.09 0.00 0.01 0.00 0.00 72.50 68.41 1hk6 s THR 25 CO -0.04 0.11 0.96 -0.63 -0.69 0.00 0.00 174.62 174.33 1hk6 s ILE 26 N 2.01 4.06 -0.12 1.82 1.01 -1.06 -3.46 121.20 125.45 1hk6 s ILE 26 Ca 0.26 1.94 -0.07 0.00 0.00 0.00 0.00 60.65 62.79 1hk6 s ILE 26 Cb -0.16 -4.18 0.05 0.00 0.01 0.00 0.00 42.46 38.18 1hk6 s ILE 26 CO 0.10 0.37 0.28 -0.60 0.00 0.00 0.00 174.94 175.08 1hk6 s ARG 27 N -1.50 0.25 0.00 2.79 6.06 -1.07 -3.59 118.95 121.89 1hk6 s ARG 27 Ca 0.45 0.55 0.00 0.00 -2.50 0.00 0.00 55.73 54.23 1hk6 s ARG 27 Cb -0.24 -0.07 0.00 0.00 0.06 0.00 0.00 34.95 34.70 1hk6 s ARG 27 CO 0.30 -0.15 0.00 0.41 -2.50 0.00 0.00 175.30 173.37 1hk6 n GLY 28 N 4.06 1.91 3.07 8.12 0.00 -1.25 -1.22 105.19 119.87 1hk6 n GLY 28 Ca -0.23 0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 1hk6 n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hk6 s GLU 29 N 4.56 0.22 -1.24 1.61 0.41 0.74 -4.81 118.70 120.19 1hk6 s GLU 29 Ca 0.00 0.38 -0.08 0.00 -0.41 0.00 0.00 54.97 54.86 1hk6 s GLU 29 Cb 0.00 0.02 0.01 0.00 -1.78 0.00 0.00 34.13 32.37 1hk6 s GLU 29 CO 0.00 -0.09 1.08 0.09 -0.49 0.00 0.00 175.26 175.86 1hk6 n ASN 30 N 3.49 -5.82 -2.12 -0.19 3.02 -1.24 -1.51 115.26 110.89 1hk6 n ASN 30 Ca -0.18 -0.50 -0.16 0.00 -0.03 0.00 0.00 54.58 53.71 1hk6 n ASN 30 Cb 0.56 -4.68 -0.12 0.00 -0.61 0.00 0.00 39.78 34.93 1hk6 n ASN 30 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1hk6 n LEU 31 N -4.61 5.66 -1.20 3.41 4.32 0.38 -4.03 117.00 120.93 1hk6 n LEU 31 Ca -0.01 -3.41 0.00 0.00 -0.02 0.00 0.00 56.01 52.58 1hk6 n LEU 31 Cb 0.56 -1.33 0.00 0.00 -1.62 0.00 0.00 43.42 41.03 1hk6 n LEU 31 CO 0.60 1.65 -0.26 0.61 -1.22 0.00 0.00 177.39 178.77 1hk6 n GLY 32 N 1.87 -4.45 1.82 -0.72 0.00 -1.26 -4.64 105.19 97.81 1hk6 n GLY 32 Ca 0.42 -0.56 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 1hk6 n GLY 32 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hk6 n THR 33 N 0.61 2.62 0.00 2.61 -2.24 -1.26 -4.16 114.28 112.46 1hk6 n THR 33 Ca 0.00 -1.45 0.00 0.00 -2.27 0.00 0.00 64.05 60.33 1hk6 n THR 33 Cb 0.00 -1.32 0.00 0.00 -2.10 0.00 0.00 70.33 66.91 1hk6 n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hk6 n GLY 34 N 0.45 3.22 0.33 3.38 0.00 -1.26 -4.94 105.19 106.37 1hk6 n GLY 34 Ca 0.26 -0.42 0.09 0.00 0.00 0.00 0.00 46.02 45.95 1hk6 n GLY 34 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1hk6 h PRO 35 N 0.00 0.67 -0.44 1.61 0.11 -1.95 0.11 132.00 132.12 1hk6 h PRO 35 Ca 0.00 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 1hk6 h PRO 35 Cb 0.00 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 30.94 1hk6 h PRO 35 CO 0.00 0.44 0.22 1.79 -0.21 0.00 0.00 178.00 180.24 1hk6 h THR 36 N 0.69 1.14 0.00 -1.15 1.35 -1.99 -2.87 112.91 110.08 1hk6 h THR 36 Ca 0.50 -0.39 -0.10 0.00 -0.55 0.00 0.00 66.41 65.87 1hk6 h THR 36 Cb 0.73 0.57 -0.04 0.00 -1.73 0.00 0.00 68.15 67.69 1hk6 h THR 36 CO -0.37 0.16 -0.18 0.47 -0.25 0.00 0.00 175.52 175.35 1hk6 n ASP 37 N -4.41 4.74 -3.65 5.36 9.92 0.40 -4.64 116.55 124.26 1hk6 n ASP 37 Ca 0.03 -2.33 -0.04 0.00 -0.53 0.00 0.00 54.79 51.92 1hk6 n ASP 37 Cb 0.11 -1.17 -0.06 0.00 -0.64 0.00 0.00 41.12 39.36 1hk6 n ASP 37 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1hk6 s LEU 38 N 0.00 -0.93 -0.09 0.64 0.20 -1.09 -3.79 118.68 113.63 1hk6 s LEU 38 Ca 0.37 1.37 0.21 0.00 0.69 0.00 0.00 54.13 56.77 1hk6 s LEU 38 Cb 0.17 2.01 0.39 0.00 -0.43 0.00 0.00 46.19 48.33 1hk6 s LEU 38 CO 0.00 -0.22 1.16 2.30 -0.29 0.00 0.00 176.35 179.29 1hk6 n ILE 39 N 5.22 0.32 -3.59 6.68 -5.35 -1.22 -4.95 119.36 116.46 1hk6 n ILE 39 Ca -0.13 -1.34 0.00 0.00 -0.27 0.00 0.00 62.75 61.02 1hk6 n ILE 39 Cb 0.51 1.01 -0.06 0.00 -1.74 0.00 0.00 39.64 39.35 1hk6 n ILE 39 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1hk6 s GLY 40 N -2.25 0.28 -0.15 3.28 0.00 -1.26 -4.91 107.32 102.31 1hk6 s GLY 40 Ca 0.26 3.47 -0.10 0.00 0.00 0.00 0.00 44.72 48.35 1hk6 s GLY 40 CO -0.11 2.78 0.38 -2.27 0.00 0.00 0.00 173.10 173.88 1hk6 s LEU 41 N 1.35 0.22 -0.26 0.66 1.98 -1.26 -0.70 118.68 120.67 1hk6 s LEU 41 Ca -0.07 0.80 -0.14 0.00 -2.89 0.00 0.00 54.13 51.83 1hk6 s LEU 41 Cb -0.03 1.26 0.08 0.00 0.66 0.00 0.00 46.19 48.16 1hk6 s LEU 41 CO -0.13 -0.17 0.63 -0.89 -1.89 0.00 0.00 176.35 173.90 1hk6 s THR 42 N 0.91 -0.18 -0.15 3.68 2.01 -1.18 -3.24 115.64 117.49 1hk6 s THR 42 Ca -0.06 0.02 0.00 0.00 0.31 0.00 0.00 61.69 61.96 1hk6 s THR 42 Cb -0.06 -0.92 -0.00 0.00 0.01 0.00 0.00 72.50 71.52 1hk6 s THR 42 CO -0.07 0.01 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.10 1hk6 s ILE 43 N 1.83 2.77 -1.32 1.82 -1.09 0.22 -2.57 121.20 122.86 1hk6 s ILE 43 Ca -0.09 -0.74 -0.05 0.00 -2.23 0.00 0.00 60.65 57.55 1hk6 s ILE 43 Cb -0.07 -2.17 0.02 0.00 -1.58 0.00 0.00 42.46 38.66 1hk6 s ILE 43 CO -0.18 0.51 0.98 0.00 -1.23 0.00 0.00 174.94 175.02 1hk6 n GLY 45 N -1.56 0.34 3.35 0.00 0.00 -1.26 -1.88 105.19 104.19 1hk6 n GLY 45 Ca -0.16 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 1hk6 n GLY 45 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1hk6 s HIS 46 N -1.36 2.68 0.24 1.61 5.65 -0.28 -4.90 115.29 118.93 1hk6 s HIS 46 Ca 0.00 -0.61 -0.31 0.00 0.25 0.00 0.00 55.06 54.39 1hk6 s HIS 46 Cb 0.00 -1.73 -0.11 0.00 -1.18 0.00 0.00 32.58 29.56 1hk6 s HIS 46 CO 0.00 -0.16 1.55 1.21 -0.65 0.00 0.00 174.74 176.69 1hk6 s ASN 47 N 0.02 6.52 -0.28 9.88 2.47 -1.26 -0.61 114.94 131.68 1hk6 s ASN 47 Ca -0.06 2.76 0.16 0.00 0.42 0.00 0.00 52.86 56.13 1hk6 s ASN 47 Cb -0.15 -2.62 0.41 0.00 -1.45 0.00 0.00 41.25 37.45 1hk6 s ASN 47 CO 0.05 -0.82 1.37 0.00 -3.72 0.00 0.00 177.10 173.97 1hk6 h LEU 49 N 1.42 0.78 -1.65 0.00 5.85 -1.91 -2.46 115.31 117.33 1hk6 h LEU 49 Ca -0.36 -0.58 0.05 0.00 0.84 0.00 0.00 57.88 57.83 1hk6 h LEU 49 Cb 1.32 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 1hk6 h LEU 49 CO -0.08 1.23 0.32 0.17 -0.34 0.00 0.00 178.44 179.74 1hk6 h LEU 50 N 0.38 0.38 0.20 2.25 8.10 -1.93 -2.10 115.31 122.58 1hk6 h LEU 50 Ca -0.01 -0.00 -0.31 0.00 0.11 0.00 0.00 57.88 57.67 1hk6 h LEU 50 Cb 1.14 -0.08 0.02 0.00 -0.44 0.00 0.00 40.66 41.31 1hk6 h LEU 50 CO 0.11 0.25 -1.38 0.71 -4.11 0.00 0.00 178.44 174.03 1hk6 h THR 51 N 0.43 1.38 -2.79 0.15 1.35 -1.92 -3.45 112.91 108.06 1hk6 h THR 51 Ca 0.21 -2.87 -0.52 0.00 -0.55 0.00 0.00 66.41 62.68 1hk6 h THR 51 Cb 0.27 3.00 0.07 0.00 -1.73 0.00 0.00 68.15 69.75 1hk6 h THR 51 CO -0.05 0.85 0.99 0.00 -0.25 0.00 0.00 175.52 177.05 1hk6 n ALA 52 N -2.64 2.78 -3.55 6.62 0.00 -0.79 -4.52 120.51 118.42 1hk6 n ALA 52 Ca -0.13 0.39 -0.26 0.00 0.00 0.00 0.00 53.44 53.44 1hk6 n ALA 52 Cb 1.07 -2.51 -0.17 0.00 0.00 0.00 0.00 19.45 17.84 1hk6 n ALA 52 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1hk6 s GLU 53 N 0.80 1.92 0.38 0.00 2.12 0.45 -4.95 118.70 119.43 1hk6 s GLU 53 Ca 0.73 -0.47 -0.27 0.00 0.36 0.00 0.00 54.97 55.32 1hk6 s GLU 53 Cb -0.50 -1.63 -0.09 0.00 0.26 0.00 0.00 34.13 32.17 1hk6 s GLU 53 CO 0.36 -0.02 1.32 -0.46 -0.54 0.00 0.00 175.26 175.92 1hk6 s TRP 54 N 0.85 2.87 0.00 5.30 -0.00 -1.26 -1.97 118.94 124.73 1hk6 s TRP 54 Ca -0.10 1.39 0.00 0.00 -0.00 0.00 0.00 56.10 57.38 1hk6 s TRP 54 Cb -0.15 -3.71 0.00 0.00 -0.00 0.00 0.00 33.47 29.61 1hk6 s TRP 54 CO 0.01 -2.10 0.00 -1.33 -0.00 0.00 0.00 176.95 173.54 1hk6 n MET 55 N 0.38 0.00 -0.66 5.86 2.81 -0.95 -4.90 117.12 119.66 1hk6 n MET 55 Ca 0.02 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 1hk6 n MET 55 Cb 0.43 -0.56 0.00 0.00 -0.71 0.00 0.00 33.22 32.37 1hk6 n MET 55 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1hk6 n SER 56 N -2.10 0.00 0.00 7.83 7.64 -1.03 -4.97 113.62 120.99 1hk6 n SER 56 Ca 0.00 -0.63 0.12 0.00 1.01 0.00 0.00 58.87 59.36 1hk6 n SER 56 Cb 0.19 0.00 0.56 0.00 -1.01 0.00 0.00 64.21 63.96 1hk6 n SER 56 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hk6 n ALA 57 N -3.00 2.16 -2.69 -0.43 0.00 -1.26 -3.85 120.51 111.44 1hk6 n ALA 57 Ca 0.00 -0.10 -0.06 0.00 0.00 0.00 0.00 53.44 53.28 1hk6 n ALA 57 Cb 0.00 -1.39 0.11 0.00 0.00 0.00 0.00 19.45 18.17 1hk6 n ALA 57 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1hk6 n SER 58 N -1.38 -1.18 -3.63 0.00 7.64 -1.26 -0.47 113.62 113.33 1hk6 n SER 58 Ca 0.09 -2.43 -0.04 0.00 1.01 0.00 0.00 58.87 57.50 1hk6 n SER 58 Cb 0.23 0.66 -0.07 0.00 -1.01 0.00 0.00 64.21 64.03 1hk6 n SER 58 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1hk6 s LYS 59 N -0.47 0.54 -0.16 1.43 2.20 -1.25 -3.91 119.74 118.12 1hk6 s LYS 59 Ca 0.20 0.97 -0.08 0.00 -0.36 0.00 0.00 55.97 56.71 1hk6 s LYS 59 Cb 0.41 0.16 0.06 0.00 -1.51 0.00 0.00 37.83 36.96 1hk6 s LYS 59 CO -0.08 -0.12 0.37 0.42 -0.36 0.00 0.00 175.35 175.58 1hk6 s ILE 60 N 1.61 -0.19 -0.09 5.43 1.01 -1.24 -2.23 121.20 125.50 1hk6 s ILE 60 Ca -0.09 0.14 -0.25 0.00 0.00 0.00 0.00 60.65 60.45 1hk6 s ILE 60 Cb -0.05 -0.56 -0.03 0.00 0.01 0.00 0.00 42.46 41.83 1hk6 s ILE 60 CO -0.18 0.06 0.80 -0.69 0.00 0.00 0.00 174.94 174.93 1hk6 s VAL 61 N 1.73 4.96 -0.23 2.92 1.01 -0.83 -2.57 120.40 127.38 1hk6 s VAL 61 Ca -0.07 1.63 -0.28 0.00 0.00 0.00 0.00 61.98 63.26 1hk6 s VAL 61 Cb -0.10 -4.13 0.14 0.00 0.00 0.00 0.00 36.38 32.29 1hk6 s VAL 61 CO -0.12 0.16 1.10 0.00 0.00 0.00 0.00 175.10 176.24 1hk6 s ARG 63 N -0.47 4.48 0.11 0.00 1.70 -1.26 -3.71 118.95 119.81 1hk6 s ARG 63 Ca 0.02 1.05 -0.31 0.00 -0.47 0.00 0.00 55.73 56.03 1hk6 s ARG 63 Cb -0.03 -3.42 -0.10 0.00 -0.57 0.00 0.00 34.95 30.84 1hk6 s ARG 63 CO -0.04 0.12 1.80 0.14 -1.08 0.00 0.00 175.30 176.24 1hk6 s VAL 64 N 0.53 2.67 0.52 4.99 -7.23 -0.91 -4.96 120.40 116.00 1hk6 s VAL 64 Ca 0.41 0.14 -0.19 0.00 -1.81 0.00 0.00 61.98 60.53 1hk6 s VAL 64 Cb -0.19 -3.09 -0.07 0.00 0.56 0.00 0.00 36.38 33.59 1hk6 s VAL 64 CO 0.22 -0.00 1.05 -0.83 -0.31 0.00 0.00 175.10 175.23 1hk6 s GLY 65 N 2.74 2.41 0.33 2.32 0.00 -1.26 -4.23 107.32 109.64 1hk6 s GLY 65 Ca 0.80 0.57 -0.27 0.00 0.00 0.00 0.00 44.72 45.81 1hk6 s GLY 65 CO 0.36 0.89 1.10 0.61 0.00 0.00 0.00 173.10 176.05 1hk6 n GLN 66 N -1.28 1.61 -1.67 2.90 10.64 -1.26 -4.50 117.38 123.82 1hk6 n GLN 66 Ca 0.09 0.57 -0.42 0.00 -1.83 0.00 0.00 57.00 55.41 1hk6 n GLN 66 Cb 0.52 -2.04 -0.03 0.00 -0.86 0.00 0.00 30.24 27.83 1hk6 n GLN 66 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1hk6 n ALA 67 N 0.11 1.71 -0.09 2.61 0.00 -1.26 -4.63 120.51 118.97 1hk6 n ALA 67 Ca 0.08 0.24 -0.14 0.00 0.00 0.00 0.00 53.44 53.62 1hk6 n ALA 67 Cb 0.35 -2.66 -0.08 0.00 0.00 0.00 0.00 19.45 17.06 1hk6 n ALA 67 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1hk6 h LYS 68 N 10.09 0.00 0.00 0.00 3.64 -1.68 -3.45 116.57 125.16 1hk6 h LYS 68 Ca -0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1hk6 h LYS 68 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1hk6 h LYS 68 CO 0.94 0.63 0.00 0.09 -2.27 0.00 0.00 179.45 178.84 1hk6 n ASN 69 N -4.54 0.00 0.10 4.20 3.02 -1.26 -5.06 115.26 111.72 1hk6 n ASN 69 Ca -0.19 0.10 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 1hk6 n ASN 69 Cb 0.48 -0.29 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1hk6 n ASN 69 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1hk6 n ASP 70 N -1.81 -1.88 0.00 6.41 8.00 -1.26 -5.12 116.55 120.88 1hk6 n ASP 70 Ca 0.00 0.40 0.00 0.00 0.71 0.00 0.00 54.79 55.90 1hk6 n ASP 70 Cb 0.00 2.02 0.00 0.00 -0.02 0.00 0.00 41.12 43.12 1hk6 n ASP 70 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1hk6 n LYS 71 N -2.92 0.00 0.00 -1.24 4.76 -1.26 -4.97 118.16 112.53 1hk6 n LYS 71 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1hk6 n LYS 71 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1hk6 n LYS 71 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hk6 n GLY 72 N 4.59 0.00 3.71 0.72 0.00 -1.26 -4.79 105.19 108.15 1hk6 n GLY 72 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1hk6 n GLY 72 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1hk6 n ASP 73 N 0.00 3.54 -4.65 1.61 5.68 -1.26 -3.99 116.55 117.48 1hk6 n ASP 73 Ca 0.00 1.10 -0.41 0.00 -0.50 0.00 0.00 54.79 54.98 1hk6 n ASP 73 Cb 0.00 -1.52 -0.05 0.00 -1.14 0.00 0.00 41.12 38.41 1hk6 n ASP 73 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1hk6 s ILE 74 N 0.59 4.91 -0.07 2.12 1.01 -1.25 -3.83 121.20 124.68 1hk6 s ILE 74 Ca 0.72 1.40 0.01 0.00 0.00 0.00 0.00 60.65 62.79 1hk6 s ILE 74 Cb -0.57 -4.04 -0.03 0.00 0.01 0.00 0.00 42.46 37.83 1hk6 s ILE 74 CO 0.41 -0.00 -0.09 -0.63 0.00 0.00 0.00 174.94 174.63 1hk6 s ILE 75 N 2.49 3.50 -0.17 2.92 -1.09 -1.06 -4.25 121.20 123.53 1hk6 s ILE 75 Ca 0.32 -0.55 -0.05 0.00 -2.23 0.00 0.00 60.65 58.14 1hk6 s ILE 75 Cb -0.16 -2.42 0.07 0.00 -1.58 0.00 0.00 42.46 38.37 1hk6 s ILE 75 CO 0.09 0.59 0.12 -0.69 -1.23 0.00 0.00 174.94 173.82 1hk6 s VAL 76 N -0.67 -0.15 0.31 2.92 1.01 -1.26 -3.08 120.40 119.48 1hk6 s VAL 76 Ca 0.10 -0.11 -0.27 0.00 0.00 0.00 0.00 61.98 61.70 1hk6 s VAL 76 Cb -0.11 -0.57 -0.10 0.00 0.00 0.00 0.00 36.38 35.60 1hk6 s VAL 76 CO 0.01 -0.23 0.95 -0.89 0.00 0.00 0.00 175.10 174.94 1hk6 s THR 77 N 2.19 4.15 -0.00 3.92 2.01 0.12 -1.83 115.64 126.21 1hk6 s THR 77 Ca 0.03 1.86 0.01 0.00 0.31 0.00 0.00 61.69 63.91 1hk6 s THR 77 Cb -0.16 -4.07 -0.00 0.00 0.01 0.00 0.00 72.50 68.28 1hk6 s THR 77 CO -0.09 0.22 -0.04 0.42 -0.69 0.00 0.00 174.62 174.43 1hk6 s THR 78 N -1.52 0.32 0.16 -0.82 -4.23 -1.04 -3.39 115.64 105.12 1hk6 s THR 78 Ca 0.48 -0.17 -0.16 0.00 -1.18 0.00 0.00 61.69 60.67 1hk6 s THR 78 Cb -0.21 -0.28 0.03 0.00 1.34 0.00 0.00 72.50 73.39 1hk6 s THR 78 CO 0.26 0.09 1.75 0.11 -0.54 0.00 0.00 174.62 176.30 1hk6 h LYS 79 N 6.08 0.29 0.18 3.99 1.79 -1.86 -2.97 116.57 124.06 1hk6 h LYS 79 Ca -0.27 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.17 1hk6 h LYS 79 Cb 1.19 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 1hk6 h LYS 79 CO 0.50 0.19 -0.09 0.77 -1.08 0.00 0.00 179.45 179.74 1hk6 h SER 80 N 0.30 -0.21 0.00 0.86 0.02 -1.97 -3.45 113.55 109.10 1hk6 h SER 80 Ca 0.17 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1hk6 h SER 80 Cb 0.15 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.74 1hk6 h SER 80 CO -0.17 0.16 0.00 0.61 -1.14 0.00 0.00 176.83 176.29 1hk6 n GLY 81 N -0.20 0.71 0.00 -3.77 0.00 -1.13 -4.66 105.19 96.14 1hk6 n GLY 81 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1hk6 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hk6 n GLY 82 N 5.00 2.85 3.69 -0.02 0.00 -1.19 -4.72 105.19 110.80 1hk6 n GLY 82 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1hk6 n GLY 82 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hk6 s LYS 83 N 4.50 4.14 0.09 1.61 2.20 -1.26 -2.50 119.74 128.51 1hk6 s LYS 83 Ca 0.00 2.59 -0.31 0.00 -0.36 0.00 0.00 55.97 57.89 1hk6 s LYS 83 Cb 0.00 -3.57 -0.06 0.00 -1.51 0.00 0.00 37.83 32.69 1hk6 s LYS 83 CO 0.00 -0.84 1.24 0.20 -0.36 0.00 0.00 175.35 175.59 1hk6 s GLY 84 N 2.63 2.35 0.02 5.54 0.00 -0.76 -4.59 107.32 112.52 1hk6 s GLY 84 Ca 0.80 0.92 -0.01 0.00 0.00 0.00 0.00 44.72 46.43 1hk6 s GLY 84 CO 0.36 2.08 0.18 -0.51 0.00 0.00 0.00 173.10 175.21 1hk6 s THR 85 N 0.91 5.35 -0.29 0.90 -4.23 0.24 -4.14 115.64 114.38 1hk6 s THR 85 Ca 0.59 -0.27 -0.13 0.00 -1.18 0.00 0.00 61.69 60.70 1hk6 s THR 85 Cb -0.31 -3.53 0.10 0.00 1.34 0.00 0.00 72.50 70.09 1hk6 s THR 85 CO 0.30 0.26 0.67 -0.94 -0.54 0.00 0.00 174.62 174.37 1hk6 s SER 86 N -2.12 -1.03 -0.65 3.99 1.04 -1.26 -1.92 113.70 111.75 1hk6 s SER 86 Ca 0.30 1.54 -0.02 0.00 0.48 0.00 0.00 55.95 58.24 1hk6 s SER 86 Cb -0.13 1.77 0.42 0.00 0.10 0.00 0.00 66.02 68.18 1hk6 s SER 86 CO 0.22 -0.23 2.04 0.35 0.98 0.00 0.00 173.24 176.60 1hk6 n THR 87 N 4.80 3.56 -3.82 2.02 -2.24 -1.26 -4.71 114.28 112.63 1hk6 n THR 87 Ca -0.17 -2.91 -0.10 0.00 -2.27 0.00 0.00 64.05 58.61 1hk6 n THR 87 Cb 0.55 -1.18 -0.07 0.00 -2.10 0.00 0.00 70.33 67.52 1hk6 n THR 87 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1hk6 s VAL 88 N -4.60 0.11 -0.15 2.28 -7.23 -1.26 -5.09 120.40 104.47 1hk6 s VAL 88 Ca 0.61 -0.94 -0.13 0.00 -1.81 0.00 0.00 61.98 59.71 1hk6 s VAL 88 Cb 0.48 -1.11 0.04 0.00 0.56 0.00 0.00 36.38 36.35 1hk6 s VAL 88 CO -0.04 -0.52 0.39 -0.94 -0.31 0.00 0.00 175.10 173.68 1hk6 s SER 89 N -2.45 -0.41 -0.10 4.85 1.04 -1.26 -3.94 113.70 111.43 1hk6 s SER 89 Ca -0.00 0.78 -0.25 0.00 0.48 0.00 0.00 55.95 56.96 1hk6 s SER 89 Cb 0.02 0.78 -0.03 0.00 0.10 0.00 0.00 66.02 66.89 1hk6 s SER 89 CO -0.07 -0.14 0.79 0.12 0.98 0.00 0.00 173.24 174.92 1hk6 s PHE 90 N 0.29 3.52 -0.12 5.02 5.36 -1.26 -4.93 117.98 125.87 1hk6 s PHE 90 Ca -0.01 1.31 -0.29 0.00 -0.96 0.00 0.00 56.93 56.98 1hk6 s PHE 90 Cb -0.03 -2.93 -0.03 0.00 -0.34 0.00 0.00 43.02 39.69 1hk6 s PHE 90 CO -0.00 -0.07 1.39 0.21 -1.46 0.00 0.00 175.22 175.29 1hk6 s LYS 91 N 1.40 4.22 -0.12 10.12 2.47 -1.19 -4.75 119.74 131.90 1hk6 s LYS 91 Ca 0.40 1.84 -0.20 0.00 -1.56 0.00 0.00 55.97 56.45 1hk6 s LYS 91 Cb -0.18 -3.83 -0.04 0.00 -1.46 0.00 0.00 37.83 32.33 1hk6 s LYS 91 CO 0.17 -0.74 0.55 -0.51 0.16 0.00 0.00 175.35 174.98 1hk6 s LEU 92 N 3.62 4.26 -0.09 5.43 1.43 -1.26 -2.13 118.68 129.94 1hk6 s LEU 92 Ca 0.61 0.90 -0.03 0.00 -1.03 0.00 0.00 54.13 54.59 1hk6 s LEU 92 Cb -0.26 -2.82 -0.03 0.00 0.03 0.00 0.00 46.19 43.11 1hk6 s LEU 92 CO 0.20 -0.07 0.03 -0.76 0.23 0.00 0.00 176.35 175.98 1hk6 s LEU 93 N 0.87 3.74 0.37 1.79 1.43 -0.95 -4.87 118.68 121.06 1hk6 s LEU 93 Ca 0.29 0.21 -0.28 0.00 -1.03 0.00 0.00 54.13 53.32 1hk6 s LEU 93 Cb -0.16 -1.87 -0.11 0.00 0.03 0.00 0.00 46.19 44.07 1hk6 s LEU 93 CO 0.12 0.38 1.42 2.29 0.23 0.00 0.00 176.35 180.80 1hk6 n LYS 94 N 2.09 2.48 -1.66 1.70 2.85 -1.26 -3.48 118.16 120.88 1hk6 n LYS 94 Ca -0.19 0.87 -0.47 0.00 -1.05 0.00 0.00 58.31 57.47 1hk6 n LYS 94 Cb 0.54 -2.56 -0.05 0.00 -0.65 0.00 0.00 35.03 32.31 1hk6 n LYS 94 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1hk6 n PRO 95 N 0.43 1.95 -2.79 -1.58 -0.02 -1.26 -4.83 135.00 126.90 1hk6 n PRO 95 Ca 0.03 0.71 -0.42 0.00 -2.02 0.00 0.00 63.50 61.79 1hk6 n PRO 95 Cb 0.38 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.37 1hk6 n PRO 95 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1hk6 s GLU 96 N 1.11 4.16 0.00 -0.52 2.12 -1.26 -5.16 118.70 119.15 1hk6 s GLU 96 Ca 0.81 1.05 0.00 0.00 0.36 0.00 0.00 54.97 57.19 1hk6 s GLU 96 Cb -0.74 -3.67 0.00 0.00 0.26 0.00 0.00 34.13 29.99 1hk6 s GLU 96 CO 0.41 -0.63 0.00 0.36 -0.54 0.00 0.00 175.26 174.86