#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 -5.96 -1.86 -0.41 0.00 -1.26 -4.92 117.12 102.71 1hk6 n MET 4 Ca 0.00 0.72 -0.39 0.00 0.00 0.00 0.00 57.70 58.03 1hk6 n MET 4 Cb 0.00 -5.54 0.02 0.00 0.00 0.00 0.00 33.22 27.71 1hk6 n MET 4 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 1hk6 s ARG 5 N -5.92 3.50 0.30 0.03 3.52 -1.26 -4.92 118.95 114.19 1hk6 s ARG 5 Ca 0.18 2.25 -0.30 0.00 -0.13 0.00 0.00 55.73 57.73 1hk6 s ARG 5 Cb -0.08 -2.48 -0.12 0.00 -1.56 0.00 0.00 34.95 30.71 1hk6 s ARG 5 CO 0.78 -0.91 1.56 0.94 -0.81 0.00 0.00 175.30 176.85 1hk6 n GLN 6 N -0.53 2.63 -1.61 5.12 -0.06 -1.26 -4.75 117.38 116.92 1hk6 n GLN 6 Ca 0.07 0.93 -0.40 0.00 -2.00 0.00 0.00 57.00 55.61 1hk6 n GLN 6 Cb 0.44 -2.69 0.03 0.00 -4.06 0.00 0.00 30.24 23.95 1hk6 n GLN 6 CO 0.00 0.00 0.00 -2.30 -0.20 0.00 0.00 177.06 174.56 1hk6 n PRO 7 N 1.86 1.16 -1.56 3.69 -0.02 -1.26 -4.89 135.00 133.99 1hk6 n PRO 7 Ca 0.08 0.43 -0.41 0.00 -2.02 0.00 0.00 63.50 61.57 1hk6 n PRO 7 Cb 0.37 -2.09 0.01 0.00 -0.02 0.00 0.00 33.50 31.77 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 -0.29 1.04 -3.67 0.52 -0.04 -1.26 -4.76 135.00 126.54 1hk6 n PRO 8 Ca 0.11 0.38 -0.18 0.00 -0.04 0.00 0.00 63.50 63.76 1hk6 n PRO 8 Cb 0.43 -1.86 -0.17 0.00 -0.04 0.00 0.00 33.50 31.86 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 0.16 0.03 0.14 1.53 1.98 -0.43 -1.61 118.68 120.48 1hk6 s LEU 9 Ca 0.64 0.20 -0.30 0.00 -2.89 0.00 0.00 54.13 51.78 1hk6 s LEU 9 Cb -0.57 0.07 -0.07 0.00 0.66 0.00 0.00 46.19 46.28 1hk6 s LEU 9 CO 0.56 -0.25 1.05 -0.69 -1.89 0.00 0.00 176.35 175.14 1hk6 s VAL 10 N 2.23 4.17 -0.32 1.68 1.01 -1.23 -0.30 120.40 127.64 1hk6 s VAL 10 Ca 0.04 1.80 0.17 0.00 0.00 0.00 0.00 61.98 63.99 1hk6 s VAL 10 Cb -0.12 -4.15 0.45 0.00 0.00 0.00 0.00 36.38 32.56 1hk6 s VAL 10 CO -0.04 0.28 1.21 0.35 0.00 0.00 0.00 175.10 176.89 1hk6 n THR 11 N 2.72 0.69 0.00 3.92 -2.24 -0.08 -3.42 114.28 115.86 1hk6 n THR 11 Ca 0.03 -2.28 0.00 0.00 -2.27 0.00 0.00 64.05 59.53 1hk6 n THR 11 Cb 0.48 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 1hk6 n THR 11 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hk6 n GLY 12 N -0.66 1.46 3.63 3.38 0.00 -0.36 -4.76 105.19 107.87 1hk6 n GLY 12 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 46.02 45.84 1hk6 n GLY 12 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1hk6 s ILE 13 N -1.51 -0.08 0.00 -0.61 2.07 -1.26 -2.47 121.20 117.34 1hk6 s ILE 13 Ca 0.00 0.00 -0.24 0.00 -1.41 0.00 0.00 60.65 59.00 1hk6 s ILE 13 Cb 0.00 -1.00 -0.13 0.00 0.13 0.00 0.00 42.46 41.46 1hk6 s ILE 13 CO 0.00 0.00 1.01 -1.28 -1.91 0.00 0.00 174.94 172.76 1hk6 h SER 14 N 6.67 -0.74 -3.58 4.50 0.87 -1.97 -3.41 113.55 115.88 1hk6 h SER 14 Ca -0.28 0.03 -0.64 0.00 -1.23 0.00 0.00 61.79 59.67 1hk6 h SER 14 Cb 1.20 0.19 -0.14 0.00 -0.44 0.00 0.00 62.40 63.21 1hk6 h SER 14 CO 0.17 -0.35 0.07 -2.16 -0.53 0.00 0.00 176.83 174.02 1hk6 s PRO 15 N -4.39 3.62 -0.29 2.24 0.04 -1.26 -4.93 135.00 130.03 1hk6 s PRO 15 Ca -0.13 -0.06 0.03 0.00 0.04 0.00 0.00 61.00 60.87 1hk6 s PRO 15 Cb 0.01 -3.82 0.43 0.00 0.04 0.00 0.00 34.50 31.16 1hk6 s PRO 15 CO 0.38 -0.72 1.60 0.09 0.04 0.00 0.00 177.00 178.39 1hk6 n ASN 16 N 5.94 3.55 0.00 6.66 4.13 -1.26 -4.81 115.26 129.47 1hk6 n ASN 16 Ca -0.03 -3.05 0.00 0.00 1.68 0.00 0.00 54.58 53.19 1hk6 n ASN 16 Cb 0.49 -0.73 0.00 0.00 -1.54 0.00 0.00 39.78 38.00 1hk6 n ASN 16 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 1hk6 n GLU 17 N -0.56 0.00 0.00 3.52 0.28 -1.26 -4.49 120.64 118.13 1hk6 n GLU 17 Ca 0.39 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.39 1hk6 n GLU 17 Cb 1.25 0.00 0.00 0.00 1.43 0.00 0.00 31.44 34.12 1hk6 n GLU 17 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1hk6 n GLY 18 N -0.01 2.61 3.62 -1.84 0.00 -1.17 -4.93 105.19 103.47 1hk6 n GLY 18 Ca 0.00 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.56 0.00 -0.34 -0.61 -5.35 -1.26 -3.41 119.36 107.83 1hk6 n ILE 19 Ca 0.00 -0.09 0.23 0.00 -0.27 0.00 0.00 62.75 62.63 1hk6 n ILE 19 Cb 0.00 -0.97 0.50 0.00 -1.74 0.00 0.00 39.64 37.43 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 -2.02 0.38 0.00 6.28 0.11 -1.85 0.33 132.00 135.23 1hk6 h PRO 20 Ca -0.46 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.53 1hk6 h PRO 20 Cb 1.28 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1hk6 h PRO 20 CO 0.42 0.25 -0.48 -1.49 -0.21 0.00 0.00 178.00 176.49 1hk6 h TRP 21 N 0.39 0.00 -2.33 0.65 4.06 -1.90 -1.89 115.95 114.93 1hk6 h TRP 21 Ca 0.64 0.00 -0.57 0.00 2.06 0.00 0.00 58.89 61.02 1hk6 h TRP 21 Cb 1.58 0.00 0.05 0.00 -1.00 0.00 0.00 29.16 29.79 1hk6 h TRP 21 CO -0.00 0.48 0.89 2.41 -3.56 0.00 0.00 178.44 178.66 1hk6 n THR 22 N -3.67 0.09 -2.25 1.49 -1.04 0.12 -4.76 114.28 104.26 1hk6 n THR 22 Ca -0.01 -0.02 -0.41 0.00 -2.04 0.00 0.00 64.05 61.58 1hk6 n THR 22 Cb 0.55 -1.70 -0.03 0.00 -1.82 0.00 0.00 70.33 67.33 1hk6 n THR 22 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1hk6 s LYS 23 N 1.44 4.44 -0.06 -2.82 1.02 -1.26 -3.80 119.74 118.68 1hk6 s LYS 23 Ca 0.80 2.03 -0.01 0.00 0.02 0.00 0.00 55.97 58.81 1hk6 s LYS 23 Cb -0.63 -3.17 0.03 0.00 -0.52 0.00 0.00 37.83 33.54 1hk6 s LYS 23 CO 0.38 -0.14 0.00 0.14 -0.92 0.00 0.00 175.35 174.82 1hk6 s VAL 24 N -0.44 0.35 -0.31 3.17 -7.23 -1.20 -4.86 120.40 109.87 1hk6 s VAL 24 Ca 0.52 0.12 -0.28 0.00 -1.81 0.00 0.00 61.98 60.53 1hk6 s VAL 24 Cb -0.36 -0.50 0.01 0.00 0.56 0.00 0.00 36.38 36.10 1hk6 s VAL 24 CO 0.42 0.25 1.04 -0.89 -0.31 0.00 0.00 175.10 175.60 1hk6 s THR 25 N 1.84 4.56 0.28 5.32 2.01 -1.26 -4.03 115.64 124.36 1hk6 s THR 25 Ca 0.03 1.70 -0.29 0.00 0.31 0.00 0.00 61.69 63.44 1hk6 s THR 25 Cb -0.12 -4.37 -0.09 0.00 0.01 0.00 0.00 72.50 67.92 1hk6 s THR 25 CO -0.04 -0.42 1.01 -0.63 -0.69 0.00 0.00 174.62 173.84 1hk6 s ILE 26 N 3.52 3.84 -0.11 1.82 1.01 -1.07 -3.99 121.20 126.22 1hk6 s ILE 26 Ca 0.44 1.76 -0.06 0.00 0.00 0.00 0.00 60.65 62.78 1hk6 s ILE 26 Cb -0.13 -4.08 0.04 0.00 0.01 0.00 0.00 42.46 38.31 1hk6 s ILE 26 CO 0.14 0.35 0.26 -0.13 0.00 0.00 0.00 174.94 175.56 1hk6 s ARG 27 N -1.53 0.23 0.00 2.79 1.81 -1.03 -3.06 118.95 118.15 1hk6 s ARG 27 Ca 0.45 0.53 0.00 0.00 -1.72 0.00 0.00 55.73 54.99 1hk6 s ARG 27 Cb -0.27 -0.09 0.00 0.00 -0.45 0.00 0.00 34.95 34.14 1hk6 s ARG 27 CO 0.34 -0.15 0.00 0.41 -0.68 0.00 0.00 175.30 175.22 1hk6 n GLY 28 N 4.10 1.69 3.09 -3.53 0.00 -1.25 -0.90 105.19 108.39 1hk6 n GLY 28 Ca -0.24 0.18 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 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 4.08 0.25 -1.31 1.61 2.02 0.59 -4.74 118.70 121.19 1hk6 s GLU 29 Ca 0.00 0.41 -0.07 0.00 0.02 0.00 0.00 54.97 55.33 1hk6 s GLU 29 Cb 0.00 0.03 0.01 0.00 0.10 0.00 0.00 34.13 34.26 1hk6 s GLU 29 CO 0.00 -0.09 0.87 0.09 0.02 0.00 0.00 175.26 176.15 1hk6 n ASN 30 N 3.48 -5.90 -2.31 -0.19 3.02 -1.25 -1.31 115.26 110.81 1hk6 n ASN 30 Ca -0.18 -0.40 -0.20 0.00 -0.03 0.00 0.00 54.58 53.77 1hk6 n ASN 30 Cb 0.56 -4.60 -0.12 0.00 -0.61 0.00 0.00 39.78 35.01 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 -4.23 6.00 -1.29 3.41 4.32 -1.15 -4.05 117.00 119.99 1hk6 n LEU 31 Ca -0.04 -3.63 0.00 0.00 -0.02 0.00 0.00 56.01 52.32 1hk6 n LEU 31 Cb 0.58 -1.36 0.00 0.00 -1.62 0.00 0.00 43.42 41.02 1hk6 n LEU 31 CO 0.53 1.75 -0.23 0.61 -1.22 0.00 0.00 177.39 178.83 1hk6 n GLY 32 N 1.97 -4.46 2.00 -0.72 0.00 -1.26 -4.25 105.19 98.47 1hk6 n GLY 32 Ca 0.48 -0.48 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 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 0.90 2.90 0.00 2.61 -2.24 -1.26 -3.77 114.28 113.42 1hk6 n THR 33 Ca 0.00 -1.90 0.00 0.00 -2.27 0.00 0.00 64.05 59.88 1hk6 n THR 33 Cb 0.00 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 66.86 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 0.39 2.16 0.29 3.38 0.00 -1.26 -4.96 105.19 105.19 1hk6 n GLY 34 Ca 0.34 -0.47 0.03 0.00 0.00 0.00 0.00 46.02 45.92 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 0.68 -0.49 1.61 0.11 -1.95 -1.21 132.00 130.75 1hk6 h PRO 35 Ca 0.00 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.05 1hk6 h PRO 35 Cb 0.00 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 30.93 1hk6 h PRO 35 CO 0.00 0.45 0.22 0.00 -0.21 0.00 0.00 178.00 178.46 1hk6 h THR 36 N 0.70 1.17 -0.47 -1.15 1.03 -1.99 -2.92 112.91 109.28 1hk6 h THR 36 Ca 0.38 -0.51 0.09 0.00 -0.01 0.00 0.00 66.41 66.37 1hk6 h THR 36 Cb 0.38 0.56 -0.08 0.00 -1.07 0.00 0.00 68.15 67.94 1hk6 h THR 36 CO -0.26 0.20 -0.02 0.44 -0.01 0.00 0.00 175.52 175.87 1hk6 h ASP 37 N 0.69 -0.24 -2.88 0.00 5.19 -1.59 -3.40 116.42 114.20 1hk6 h ASP 37 Ca 0.17 0.12 -0.53 0.00 -0.62 0.00 0.00 57.03 56.17 1hk6 h ASP 37 Cb 0.10 0.21 0.02 0.00 0.18 0.00 0.00 39.33 39.84 1hk6 h ASP 37 CO -0.02 -0.08 0.84 -0.22 -3.12 0.00 0.00 179.24 176.64 1hk6 s LEU 38 N -10.58 4.35 0.00 1.55 0.20 -1.10 -3.24 118.68 109.86 1hk6 s LEU 38 Ca -0.14 2.34 0.01 0.00 0.69 0.00 0.00 54.13 57.03 1hk6 s LEU 38 Cb 0.16 -3.57 0.02 0.00 -0.43 0.00 0.00 46.19 42.36 1hk6 s LEU 38 CO 0.72 -0.75 0.84 2.30 -0.29 0.00 0.00 176.35 179.17 1hk6 n ILE 39 N 4.34 0.00 0.00 6.68 -5.35 -1.11 -5.01 119.36 118.91 1hk6 n ILE 39 Ca 0.13 -0.05 0.00 0.00 -0.27 0.00 0.00 62.75 62.57 1hk6 n ILE 39 Cb 0.42 0.35 0.00 0.00 -1.74 0.00 0.00 39.64 38.67 1hk6 n ILE 39 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1hk6 n GLY 40 N 0.02 1.65 3.24 3.28 0.00 -1.25 -4.97 105.19 107.16 1hk6 n GLY 40 Ca -0.00 0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1hk6 n GLY 40 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1hk6 s LEU 41 N 0.00 0.78 -0.16 0.99 2.96 -1.26 -0.78 118.68 121.21 1hk6 s LEU 41 Ca 0.00 0.31 -0.11 0.00 -0.22 0.00 0.00 54.13 54.11 1hk6 s LEU 41 Cb 0.00 1.24 0.05 0.00 0.50 0.00 0.00 46.19 47.98 1hk6 s LEU 41 CO 0.00 -0.33 0.40 0.42 -1.32 0.00 0.00 176.35 175.52 1hk6 s THR 42 N -0.78 -0.01 -0.06 3.68 -4.23 -1.04 -3.51 115.64 109.69 1hk6 s THR 42 Ca -0.09 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.48 1hk6 s THR 42 Cb -0.04 -0.58 0.02 0.00 1.34 0.00 0.00 72.50 73.24 1hk6 s THR 42 CO 0.03 0.02 -0.03 -0.63 -0.54 0.00 0.00 174.62 173.47 1hk6 s ILE 43 N 0.86 0.50 -1.47 2.99 1.01 -0.85 -2.10 121.20 122.15 1hk6 s ILE 43 Ca -0.05 -0.04 -0.07 0.00 0.00 0.00 0.00 60.65 60.49 1hk6 s ILE 43 Cb -0.06 -0.58 0.03 0.00 0.01 0.00 0.00 42.46 41.86 1hk6 s ILE 43 CO -0.07 0.25 0.70 0.00 0.00 0.00 0.00 174.94 175.82 1hk6 n GLY 45 N -1.53 -0.35 2.99 0.00 0.00 -1.26 -1.14 105.19 103.90 1hk6 n GLY 45 Ca -0.06 -0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.03 1.18 0.16 1.61 5.65 -0.33 -4.75 115.29 115.79 1hk6 s HIS 46 Ca 0.19 -0.39 -0.31 0.00 0.25 0.00 0.00 55.06 54.80 1hk6 s HIS 46 Cb -0.08 -0.89 -0.09 0.00 -1.18 0.00 0.00 32.58 30.34 1hk6 s HIS 46 CO 0.23 -0.21 1.41 1.21 -0.65 0.00 0.00 174.74 176.73 1hk6 s ASN 47 N 0.61 6.77 -0.28 9.88 3.04 -1.26 -2.01 114.94 131.68 1hk6 s ASN 47 Ca -0.11 2.45 0.16 0.00 0.04 0.00 0.00 52.86 55.40 1hk6 s ASN 47 Cb -0.14 -2.60 0.42 0.00 -1.54 0.00 0.00 41.25 37.39 1hk6 s ASN 47 CO 0.02 -0.67 1.36 0.00 -3.04 0.00 0.00 177.10 174.78 1hk6 h LEU 49 N 1.44 0.28 -0.98 0.00 5.85 -1.91 -2.13 115.31 117.85 1hk6 h LEU 49 Ca -0.35 -0.68 0.16 0.00 0.84 0.00 0.00 57.88 57.85 1hk6 h LEU 49 Cb 1.32 -0.08 -0.10 0.00 0.37 0.00 0.00 40.66 42.17 1hk6 h LEU 49 CO -0.07 0.92 0.59 0.17 -0.34 0.00 0.00 178.44 179.71 1hk6 h LEU 50 N -0.34 0.79 0.09 2.25 -0.00 -1.95 -1.30 115.31 114.84 1hk6 h LEU 50 Ca -0.02 0.08 -0.26 0.00 -0.00 0.00 0.00 57.88 57.69 1hk6 h LEU 50 Cb 0.92 -0.06 -0.01 0.00 -0.00 0.00 0.00 40.66 41.51 1hk6 h LEU 50 CO 0.05 0.33 -1.19 0.71 -0.00 0.00 0.00 178.44 178.34 1hk6 h THR 51 N 0.81 1.54 -2.42 0.15 1.35 -1.96 -3.46 112.91 108.93 1hk6 h THR 51 Ca 0.54 -3.16 -0.60 0.00 -0.55 0.00 0.00 66.41 62.63 1hk6 h THR 51 Cb 0.75 2.90 0.08 0.00 -1.73 0.00 0.00 68.15 70.15 1hk6 h THR 51 CO -0.35 0.91 0.51 0.00 -0.25 0.00 0.00 175.52 176.35 1hk6 n ALA 52 N -2.48 0.51 -3.38 6.62 0.00 -0.49 -4.75 120.51 116.53 1hk6 n ALA 52 Ca -0.06 0.43 -0.26 0.00 0.00 0.00 0.00 53.44 53.54 1hk6 n ALA 52 Cb 1.00 -2.20 -0.17 0.00 0.00 0.00 0.00 19.45 18.08 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 -0.33 2.01 0.46 0.00 2.56 -0.00 -4.97 118.70 118.42 1hk6 s GLU 53 Ca 0.70 -0.53 -0.22 0.00 0.00 0.00 0.00 54.97 54.93 1hk6 s GLU 53 Cb -0.72 -1.61 -0.08 0.00 2.00 0.00 0.00 34.13 33.73 1hk6 s GLU 53 CO 0.50 0.07 1.11 -0.46 -0.56 0.00 0.00 175.26 175.92 1hk6 s TRP 54 N 0.56 2.96 0.00 5.30 -0.00 -1.26 -2.55 118.94 123.95 1hk6 s TRP 54 Ca -0.15 1.57 0.00 0.00 -0.00 0.00 0.00 56.10 57.52 1hk6 s TRP 54 Cb -0.16 -3.25 0.00 0.00 -0.00 0.00 0.00 33.47 30.06 1hk6 s TRP 54 CO 0.05 -1.18 0.00 -1.33 -0.00 0.00 0.00 176.95 174.48 1hk6 n MET 55 N -0.58 0.00 -2.42 5.86 2.81 -1.16 -4.87 117.12 116.76 1hk6 n MET 55 Ca 0.08 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.92 1hk6 n MET 55 Cb 0.50 -0.11 0.01 0.00 -0.71 0.00 0.00 33.22 32.91 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 -2.37 -1.15 -1.33 7.83 7.64 -0.66 -4.95 113.62 118.62 1hk6 n SER 56 Ca 0.00 -1.79 0.00 0.00 1.01 0.00 0.00 58.87 58.09 1hk6 n SER 56 Cb 0.03 1.92 0.00 0.00 -1.01 0.00 0.00 64.21 65.14 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 -1.77 3.29 0.00 -0.43 0.00 -1.25 -3.76 120.51 116.60 1hk6 n ALA 57 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1hk6 n ALA 57 Cb 0.30 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.71 1hk6 n ALA 57 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1hk6 n SER 58 N 1.16 0.00 -4.72 0.00 3.41 -1.26 -2.96 113.62 109.25 1hk6 n SER 58 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.21 1hk6 n SER 58 Cb 0.46 0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.39 1hk6 n SER 58 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1hk6 s LYS 59 N -1.31 4.48 -0.21 4.33 2.20 -1.23 -3.33 119.74 124.67 1hk6 s LYS 59 Ca 0.00 1.03 -0.04 0.00 -0.36 0.00 0.00 55.97 56.60 1hk6 s LYS 59 Cb 0.00 -3.43 0.11 0.00 -1.51 0.00 0.00 37.83 33.00 1hk6 s LYS 59 CO 0.00 0.10 0.35 0.42 -0.36 0.00 0.00 175.35 175.86 1hk6 s ILE 60 N 0.60 -0.55 -0.01 5.43 1.01 -1.17 -1.66 121.20 124.86 1hk6 s ILE 60 Ca 0.40 0.01 -0.27 0.00 0.00 0.00 0.00 60.65 60.80 1hk6 s ILE 60 Cb -0.19 -0.72 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 1hk6 s ILE 60 CO 0.21 -0.07 0.86 -0.69 0.00 0.00 0.00 174.94 175.25 1hk6 s VAL 61 N 2.51 4.89 -0.07 2.92 1.01 -1.06 -2.59 120.40 128.01 1hk6 s VAL 61 Ca 0.08 1.80 -0.31 0.00 0.00 0.00 0.00 61.98 63.54 1hk6 s VAL 61 Cb -0.14 -4.20 0.12 0.00 0.00 0.00 0.00 36.38 32.15 1hk6 s VAL 61 CO -0.14 0.23 1.02 0.00 0.00 0.00 0.00 175.10 176.21 1hk6 s ARG 63 N -2.84 4.38 0.21 0.00 1.81 -1.26 -3.27 118.95 117.97 1hk6 s ARG 63 Ca 0.07 1.10 -0.31 0.00 -1.72 0.00 0.00 55.73 54.86 1hk6 s ARG 63 Cb -0.01 -3.53 -0.11 0.00 -0.45 0.00 0.00 34.95 30.86 1hk6 s ARG 63 CO -0.07 -0.20 1.59 0.54 -0.68 0.00 0.00 175.30 176.48 1hk6 s VAL 64 N 1.68 2.41 0.41 3.52 0.11 -0.71 -4.93 120.40 122.88 1hk6 s VAL 64 Ca 0.41 0.31 -0.25 0.00 -2.93 0.00 0.00 61.98 59.52 1hk6 s VAL 64 Cb -0.18 -3.20 -0.08 0.00 -1.53 0.00 0.00 36.38 31.39 1hk6 s VAL 64 CO 0.17 0.03 1.14 -0.83 -3.33 0.00 0.00 175.10 172.27 1hk6 s GLY 65 N 0.94 2.83 0.52 6.54 0.00 -1.25 -4.28 107.32 112.62 1hk6 s GLY 65 Ca 0.69 0.89 -0.23 0.00 0.00 0.00 0.00 44.72 46.07 1hk6 s GLY 65 CO 0.36 1.38 1.38 0.61 0.00 0.00 0.00 173.10 176.82 1hk6 n GLN 66 N -0.02 1.85 -1.68 2.90 10.64 -1.26 -4.43 117.38 125.38 1hk6 n GLN 66 Ca 0.05 0.67 -0.44 0.00 -1.83 0.00 0.00 57.00 55.45 1hk6 n GLN 66 Cb 0.47 -2.59 -0.03 0.00 -0.86 0.00 0.00 30.24 27.24 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 -0.82 1.29 0.00 2.61 0.00 -1.26 -4.42 120.51 117.91 1hk6 n ALA 67 Ca 0.09 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1hk6 n ALA 67 Cb 0.44 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.59 1hk6 n ALA 67 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1hk6 n LYS 68 N 2.04 0.00 0.00 0.00 4.76 -0.29 -5.02 118.16 119.66 1hk6 n LYS 68 Ca 0.11 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 1hk6 n LYS 68 Cb 0.32 -0.17 0.00 0.00 -1.84 0.00 0.00 35.03 33.34 1hk6 n LYS 68 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1hk6 n ASN 69 N -2.52 0.00 0.00 4.39 3.02 -1.24 -5.02 115.26 113.89 1hk6 n ASN 69 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1hk6 n ASN 69 Cb 0.12 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 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 0.00 0.00 -0.03 6.41 8.00 -1.26 -4.95 116.55 124.71 1hk6 n ASP 70 Ca 0.00 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.36 1hk6 n ASP 70 Cb 0.00 0.13 -0.11 0.00 -0.02 0.00 0.00 41.12 41.11 1hk6 n ASP 70 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1hk6 h LYS 71 N 0.00 0.10 -0.89 -1.24 1.63 -1.98 -3.49 116.57 110.71 1hk6 h LYS 71 Ca 0.00 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 59.69 1hk6 h LYS 71 Cb 0.00 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.66 1hk6 h LYS 71 CO 0.00 0.86 0.00 0.41 -3.45 0.00 0.00 179.45 177.27 1hk6 n GLY 72 N 1.02 0.80 3.76 5.01 0.00 -1.26 -4.51 105.19 110.01 1hk6 n GLY 72 Ca -0.10 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.11 1hk6 n GLY 72 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1hk6 s ASP 73 N -2.57 7.28 0.09 1.61 1.01 -1.26 -1.89 116.67 120.94 1hk6 s ASP 73 Ca 0.00 2.24 -0.24 0.00 0.71 0.00 0.00 52.55 55.26 1hk6 s ASP 73 Cb 0.00 -2.62 -0.06 0.00 1.01 0.00 0.00 42.92 41.24 1hk6 s ASP 73 CO 0.00 -0.13 0.74 -0.63 0.21 0.00 0.00 175.17 175.36 1hk6 s ILE 74 N -1.18 4.61 -0.01 0.77 1.01 -1.25 -3.96 121.20 121.20 1hk6 s ILE 74 Ca 0.45 1.60 0.03 0.00 0.00 0.00 0.00 60.65 62.72 1hk6 s ILE 74 Cb -0.31 -4.10 -0.00 0.00 0.01 0.00 0.00 42.46 38.06 1hk6 s ILE 74 CO 0.40 0.44 -0.08 -0.63 0.00 0.00 0.00 174.94 175.06 1hk6 s ILE 75 N -0.52 0.67 -0.05 2.92 -1.09 -0.89 -4.02 121.20 118.22 1hk6 s ILE 75 Ca 0.36 -0.35 0.00 0.00 -2.23 0.00 0.00 60.65 58.44 1hk6 s ILE 75 Cb -0.21 -0.57 0.02 0.00 -1.58 0.00 0.00 42.46 40.12 1hk6 s ILE 75 CO 0.23 0.20 -0.02 0.54 -1.23 0.00 0.00 174.94 174.66 1hk6 s VAL 76 N -0.10 0.42 -0.07 2.92 0.11 -1.26 -2.48 120.40 119.93 1hk6 s VAL 76 Ca 0.02 -0.01 -0.11 0.00 -2.93 0.00 0.00 61.98 58.95 1hk6 s VAL 76 Cb -0.04 -0.50 -0.05 0.00 -1.53 0.00 0.00 36.38 34.26 1hk6 s VAL 76 CO -0.00 0.22 0.27 -0.89 -3.33 0.00 0.00 175.10 171.37 1hk6 s THR 77 N 1.24 5.28 -0.13 5.04 2.01 0.04 -2.33 115.64 126.79 1hk6 s THR 77 Ca -0.06 0.51 -0.16 0.00 0.31 0.00 0.00 61.69 62.29 1hk6 s THR 77 Cb -0.14 -3.56 0.04 0.00 0.01 0.00 0.00 72.50 68.86 1hk6 s THR 77 CO -0.02 0.58 0.42 0.42 -0.69 0.00 0.00 174.62 175.33 1hk6 s THR 78 N -0.87 0.01 0.52 -0.82 -4.23 -1.26 -2.75 115.64 106.24 1hk6 s THR 78 Ca 0.19 -0.09 0.24 0.00 -1.18 0.00 0.00 61.69 60.85 1hk6 s THR 78 Cb -0.14 -0.63 0.39 0.00 1.34 0.00 0.00 72.50 73.47 1hk6 s THR 78 CO 0.08 -0.05 1.99 0.11 -0.54 0.00 0.00 174.62 176.21 1hk6 h LYS 79 N 5.03 0.05 0.67 3.99 6.56 -1.89 1.40 116.57 132.38 1hk6 h LYS 79 Ca -0.27 -0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.28 1hk6 h LYS 79 Cb 1.18 -0.01 0.01 0.00 -0.57 0.00 0.00 32.23 32.83 1hk6 h LYS 79 CO 0.27 0.03 -0.32 1.03 -2.06 0.00 0.00 179.45 178.40 1hk6 h SER 80 N 0.05 -0.76 0.00 0.86 0.87 -1.96 -3.40 113.55 109.20 1hk6 h SER 80 Ca 0.26 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.62 1hk6 h SER 80 Cb 0.99 0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1hk6 h SER 80 CO -0.02 -0.49 -1.73 0.61 -0.53 0.00 0.00 176.83 174.68 1hk6 n GLY 81 N -1.23 -0.20 0.84 5.77 0.00 -0.95 -4.78 105.19 104.64 1hk6 n GLY 81 Ca -0.13 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 2.51 -4.05 3.64 -0.02 0.00 0.48 -4.83 105.19 102.91 1hk6 n GLY 82 Ca -0.24 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 44.87 1hk6 n GLY 82 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1hk6 n LYS 83 N 0.39 -1.23 0.00 1.61 4.81 -1.25 -4.82 118.16 117.67 1hk6 n LYS 83 Ca 0.00 0.71 0.00 0.00 -0.87 0.00 0.00 58.31 58.15 1hk6 n LYS 83 Cb 0.00 -3.68 0.00 0.00 0.02 0.00 0.00 35.03 31.37 1hk6 n LYS 83 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1hk6 n GLY 84 N -1.73 -2.51 0.00 3.14 0.00 -0.99 -4.97 105.19 98.12 1hk6 n GLY 84 Ca -0.15 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1hk6 n GLY 84 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hk6 n THR 85 N 0.00 0.00 -3.64 2.61 -2.24 -0.63 -4.85 114.28 105.53 1hk6 n THR 85 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 1hk6 n THR 85 Cb 0.00 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.17 1hk6 n THR 85 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1hk6 s SER 86 N -0.58 -0.52 -0.30 3.42 1.04 -1.26 -3.54 113.70 111.97 1hk6 s SER 86 Ca 0.00 0.83 0.03 0.00 0.48 0.00 0.00 55.95 57.29 1hk6 s SER 86 Cb 0.00 1.23 0.46 0.00 0.10 0.00 0.00 66.02 67.82 1hk6 s SER 86 CO 0.00 -0.13 1.61 0.35 0.98 0.00 0.00 173.24 176.04 1hk6 n THR 87 N 3.77 2.46 -3.69 2.02 -2.24 -1.22 -4.82 114.28 110.56 1hk6 n THR 87 Ca -0.18 -1.28 -0.14 0.00 -2.27 0.00 0.00 64.05 60.18 1hk6 n THR 87 Cb 0.57 -0.62 -0.09 0.00 -2.10 0.00 0.00 70.33 68.10 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 -2.24 0.00 -0.01 2.28 -7.23 -1.26 -5.03 120.40 106.91 1hk6 s VAL 88 Ca 0.39 -0.02 0.08 0.00 -1.81 0.00 0.00 61.98 60.62 1hk6 s VAL 88 Cb 0.32 -0.74 -0.02 0.00 0.56 0.00 0.00 36.38 36.51 1hk6 s VAL 88 CO 0.08 -0.01 -0.26 -0.94 -0.31 0.00 0.00 175.10 173.66 1hk6 s SER 89 N 0.17 3.03 -0.09 4.85 1.04 -1.26 -3.76 113.70 117.68 1hk6 s SER 89 Ca -0.01 -0.48 -0.21 0.00 0.48 0.00 0.00 55.95 55.73 1hk6 s SER 89 Cb -0.04 -0.33 -0.04 0.00 0.10 0.00 0.00 66.02 65.71 1hk6 s SER 89 CO 0.01 0.31 0.58 0.12 0.98 0.00 0.00 173.24 175.24 1hk6 s PHE 90 N -0.63 3.54 -0.19 5.02 5.36 -0.79 -4.98 117.98 125.31 1hk6 s PHE 90 Ca 0.10 1.06 -0.22 0.00 -0.96 0.00 0.00 56.93 56.91 1hk6 s PHE 90 Cb -0.10 -2.67 -0.02 0.00 -0.34 0.00 0.00 43.02 39.89 1hk6 s PHE 90 CO -0.01 0.13 0.66 0.21 -1.46 0.00 0.00 175.22 174.76 1hk6 s LYS 91 N 0.72 4.23 -0.07 10.12 2.20 -1.26 -4.76 119.74 130.92 1hk6 s LYS 91 Ca 0.31 0.69 -0.22 0.00 -0.36 0.00 0.00 55.97 56.39 1hk6 s LYS 91 Cb -0.16 -3.57 -0.04 0.00 -1.51 0.00 0.00 37.83 32.54 1hk6 s LYS 91 CO 0.14 -0.24 0.64 -0.51 -0.36 0.00 0.00 175.35 175.01 1hk6 s LEU 92 N 1.91 4.32 0.10 5.43 1.43 -1.26 -3.03 118.68 127.58 1hk6 s LEU 92 Ca 0.30 1.10 -0.19 0.00 -1.03 0.00 0.00 54.13 54.31 1hk6 s LEU 92 Cb -0.16 -2.98 -0.07 0.00 0.03 0.00 0.00 46.19 43.01 1hk6 s LEU 92 CO 0.11 -0.06 0.59 -0.76 0.23 0.00 0.00 176.35 176.46 1hk6 s LEU 93 N 0.63 4.51 0.14 1.79 1.43 -1.22 -4.88 118.68 121.08 1hk6 s LEU 93 Ca 0.34 1.29 -0.31 0.00 -1.03 0.00 0.00 54.13 54.42 1hk6 s LEU 93 Cb -0.17 -3.00 -0.10 0.00 0.03 0.00 0.00 46.19 42.94 1hk6 s LEU 93 CO 0.16 0.24 1.64 -0.75 0.23 0.00 0.00 176.35 177.88 1hk6 s LYS 94 N -1.24 4.19 0.09 1.70 2.20 -1.26 -4.09 119.74 121.33 1hk6 s LYS 94 Ca 0.31 2.41 -0.34 0.00 -0.36 0.00 0.00 55.97 57.99 1hk6 s LYS 94 Cb -0.19 -3.32 -0.13 0.00 -1.51 0.00 0.00 37.83 32.67 1hk6 s LYS 94 CO 0.20 -0.69 1.65 -2.30 -0.36 0.00 0.00 175.35 173.85 1hk6 n PRO 95 N 4.64 2.12 -2.36 4.03 -0.02 -1.26 -4.91 135.00 137.24 1hk6 n PRO 95 Ca 0.15 0.77 -0.43 0.00 -2.02 0.00 0.00 63.50 61.97 1hk6 n PRO 95 Cb 0.39 -2.55 -0.02 0.00 -0.02 0.00 0.00 33.50 31.29 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 1.74 4.08 0.00 -0.52 2.12 -1.26 -5.21 118.70 119.65 1hk6 s GLU 96 Ca 0.83 1.57 0.00 0.00 0.36 0.00 0.00 54.97 57.73 1hk6 s GLU 96 Cb -0.69 -3.85 0.00 0.00 0.26 0.00 0.00 34.13 29.85 1hk6 s GLU 96 CO 0.42 -0.92 0.45 1.17 -0.54 0.00 0.00 175.26 175.85