#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 0.00 -1.72 -1.40 0.00 -1.26 -5.12 117.12 107.62 1hk6 n MET 4 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 57.70 57.27 1hk6 n MET 4 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 33.22 33.19 1hk6 n MET 4 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 1hk6 n ARG 5 N -1.47 2.62 -1.80 2.12 3.00 -1.26 -4.92 116.66 114.95 1hk6 n ARG 5 Ca 0.00 0.94 -0.41 0.00 -0.00 0.00 0.00 57.85 58.38 1hk6 n ARG 5 Cb 0.00 -2.75 -0.00 0.00 0.00 0.00 0.00 32.46 29.71 1hk6 n ARG 5 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 1hk6 s GLN 6 N 0.55 4.11 0.49 -0.14 -0.21 -1.26 -4.57 119.66 118.63 1hk6 s GLN 6 Ca 0.72 2.57 -0.24 0.00 0.02 0.00 0.00 55.36 58.43 1hk6 s GLN 6 Cb -0.54 -2.97 -0.07 0.00 1.00 0.00 0.00 33.01 30.43 1hk6 s GLN 6 CO 0.39 -0.54 1.38 -1.25 -2.12 0.00 0.00 175.29 173.15 1hk6 s PRO 7 N -1.92 3.48 -0.19 2.91 0.04 -1.26 -4.76 135.00 133.30 1hk6 s PRO 7 Ca 0.54 2.31 -0.34 0.00 0.04 0.00 0.00 61.00 63.55 1hk6 s PRO 7 Cb -0.47 -2.49 -0.11 0.00 0.04 0.00 0.00 34.50 31.47 1hk6 s PRO 7 CO 0.61 -0.94 2.01 -0.35 0.04 0.00 0.00 177.00 178.37 1hk6 n PRO 8 N -0.52 1.78 -2.96 0.56 -0.04 -1.25 -4.79 135.00 127.79 1hk6 n PRO 8 Ca 0.07 0.60 -0.44 0.00 -0.04 0.00 0.00 63.50 63.69 1hk6 n PRO 8 Cb 0.43 -2.65 -0.04 0.00 -0.04 0.00 0.00 33.50 31.21 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 5.56 4.85 0.13 1.53 2.96 0.87 -3.19 118.68 131.38 1hk6 s LEU 9 Ca 0.99 -1.32 -0.30 0.00 -0.22 0.00 0.00 54.13 53.28 1hk6 s LEU 9 Cb -0.71 -2.37 -0.06 0.00 0.50 0.00 0.00 46.19 43.54 1hk6 s LEU 9 CO 0.50 -1.27 0.96 -0.69 -1.32 0.00 0.00 176.35 174.53 1hk6 s VAL 10 N 3.36 4.43 -0.37 1.68 1.01 -1.18 -0.90 120.40 128.44 1hk6 s VAL 10 Ca 0.20 2.07 0.05 0.00 0.00 0.00 0.00 61.98 64.30 1hk6 s VAL 10 Cb -0.17 -4.32 0.26 0.00 0.00 0.00 0.00 36.38 32.14 1hk6 s VAL 10 CO 0.06 0.34 1.23 1.07 0.00 0.00 0.00 175.10 177.80 1hk6 n THR 11 N 2.59 0.00 -3.64 3.92 5.66 -0.76 -1.90 114.28 120.16 1hk6 n THR 11 Ca 0.02 -1.11 -0.09 0.00 -3.05 0.00 0.00 64.05 59.82 1hk6 n THR 11 Cb 0.49 0.92 -0.07 0.00 -1.55 0.00 0.00 70.33 70.12 1hk6 n THR 11 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1hk6 s GLY 12 N -0.74 -0.24 -0.29 1.09 0.00 0.77 -4.82 107.32 103.08 1hk6 s GLY 12 Ca 0.15 2.61 -0.15 0.00 0.00 0.00 0.00 44.72 47.33 1hk6 s GLY 12 CO -0.07 1.98 0.84 -1.50 0.00 0.00 0.00 173.10 174.35 1hk6 s ILE 13 N 0.54 -0.14 0.01 0.90 2.07 -1.26 -1.70 121.20 121.61 1hk6 s ILE 13 Ca -0.00 0.00 -0.25 0.00 -1.41 0.00 0.00 60.65 58.98 1hk6 s ILE 13 Cb -0.05 -1.00 -0.15 0.00 0.13 0.00 0.00 42.46 41.39 1hk6 s ILE 13 CO -0.07 0.00 1.13 -1.28 -1.91 0.00 0.00 174.94 172.81 1hk6 h SER 14 N 6.73 -0.62 -3.59 4.50 0.87 -1.97 -3.41 113.55 116.07 1hk6 h SER 14 Ca -0.27 -0.05 -0.65 0.00 -1.23 0.00 0.00 61.79 59.60 1hk6 h SER 14 Cb 1.19 0.16 -0.15 0.00 -0.44 0.00 0.00 62.40 63.16 1hk6 h SER 14 CO 0.16 -0.24 0.14 -2.16 -0.53 0.00 0.00 176.83 174.20 1hk6 s PRO 15 N -4.61 3.33 -0.16 2.24 0.04 -1.26 -4.92 135.00 129.66 1hk6 s PRO 15 Ca -0.14 -0.31 0.03 0.00 0.04 0.00 0.00 61.00 60.63 1hk6 s PRO 15 Cb 0.02 -3.93 0.31 0.00 0.04 0.00 0.00 34.50 30.93 1hk6 s PRO 15 CO 0.46 -0.99 1.28 0.09 0.04 0.00 0.00 177.00 177.88 1hk6 n ASN 16 N 6.27 3.23 0.00 6.66 5.03 -1.26 -4.77 115.26 130.42 1hk6 n ASN 16 Ca -0.01 -2.59 0.00 0.00 0.87 0.00 0.00 54.58 52.85 1hk6 n ASN 16 Cb 0.48 -0.62 0.00 0.00 -1.02 0.00 0.00 39.78 38.62 1hk6 n ASN 16 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 1hk6 n GLU 17 N -0.05 0.00 0.00 3.52 0.28 -1.26 -4.27 120.64 118.86 1hk6 n GLU 17 Ca 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.21 1hk6 n GLU 17 Cb 0.89 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.76 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 -0.00 2.63 3.42 -1.84 0.00 -1.25 -4.94 105.19 103.21 1hk6 n GLY 18 Ca 0.00 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.55 0.00 -0.29 -0.61 -5.35 -1.26 -2.98 119.36 108.32 1hk6 n ILE 19 Ca 0.00 -0.19 0.12 0.00 -0.27 0.00 0.00 62.75 62.41 1hk6 n ILE 19 Cb 0.00 -0.66 0.28 0.00 -1.74 0.00 0.00 39.64 37.53 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 -1.67 0.34 0.00 6.28 0.11 -1.77 0.21 132.00 135.50 1hk6 h PRO 20 Ca -0.45 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1hk6 h PRO 20 Cb 1.29 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1hk6 h PRO 20 CO 0.36 0.22 -0.03 -1.49 -0.21 0.00 0.00 178.00 176.85 1hk6 h TRP 21 N 0.35 0.00 -2.59 0.65 4.06 -1.89 -2.69 115.95 113.84 1hk6 h TRP 21 Ca 0.53 0.00 -0.53 0.00 2.06 0.00 0.00 58.89 60.96 1hk6 h TRP 21 Cb 1.01 0.00 0.06 0.00 -1.00 0.00 0.00 29.16 29.23 1hk6 h TRP 21 CO -0.18 0.03 1.02 2.41 -3.56 0.00 0.00 178.44 178.16 1hk6 n THR 22 N -3.15 0.07 -2.35 1.49 -1.04 0.73 -4.81 114.28 105.23 1hk6 n THR 22 Ca -0.00 -0.01 -0.39 0.00 -2.04 0.00 0.00 64.05 61.61 1hk6 n THR 22 Cb 0.28 -1.98 -0.03 0.00 -1.82 0.00 0.00 70.33 66.78 1hk6 n THR 22 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1hk6 s LYS 23 N 1.45 4.19 -0.02 -2.82 2.20 -1.26 -3.53 119.74 119.94 1hk6 s LYS 23 Ca 0.77 1.81 -0.00 0.00 -0.36 0.00 0.00 55.97 58.19 1hk6 s LYS 23 Cb -0.51 -2.77 0.03 0.00 -1.51 0.00 0.00 37.83 33.06 1hk6 s LYS 23 CO 0.34 -0.19 0.04 0.14 -0.36 0.00 0.00 175.35 175.31 1hk6 s VAL 24 N -1.38 -0.05 -1.00 4.02 -7.23 -1.13 -4.85 120.40 108.77 1hk6 s VAL 24 Ca 0.54 0.19 -0.17 0.00 -1.81 0.00 0.00 61.98 60.74 1hk6 s VAL 24 Cb -0.30 -0.09 0.15 0.00 0.56 0.00 0.00 36.38 36.70 1hk6 s VAL 24 CO 0.38 0.08 1.18 -0.89 -0.31 0.00 0.00 175.10 175.55 1hk6 s THR 25 N 0.98 4.88 0.33 5.32 2.01 -1.26 -3.19 115.64 124.70 1hk6 s THR 25 Ca -0.08 -1.93 -0.29 0.00 0.31 0.00 0.00 61.69 59.70 1hk6 s THR 25 Cb -0.12 -4.79 -0.11 0.00 0.01 0.00 0.00 72.50 67.49 1hk6 s THR 25 CO -0.03 -1.50 1.54 -0.63 -0.69 0.00 0.00 174.62 173.31 1hk6 s ILE 26 N 2.20 2.09 -0.10 1.82 1.01 -0.63 -4.19 121.20 123.39 1hk6 s ILE 26 Ca 0.34 0.08 -0.10 0.00 0.00 0.00 0.00 60.65 60.97 1hk6 s ILE 26 Cb -0.05 -3.05 0.03 0.00 0.01 0.00 0.00 42.46 39.40 1hk6 s ILE 26 CO -0.07 0.02 0.29 -0.60 0.00 0.00 0.00 174.94 174.57 1hk6 s ARG 27 N -1.21 0.35 0.00 2.79 3.52 -0.69 -0.95 118.95 122.76 1hk6 s ARG 27 Ca 0.58 0.37 0.00 0.00 -0.13 0.00 0.00 55.73 56.56 1hk6 s ARG 27 Cb -0.47 0.17 0.00 0.00 -1.56 0.00 0.00 34.95 33.09 1hk6 s ARG 27 CO 0.54 -0.05 0.00 0.41 -0.81 0.00 0.00 175.30 175.40 1hk6 n GLY 28 N 2.85 1.89 3.25 8.12 0.00 -1.16 -0.17 105.19 119.99 1hk6 n GLY 28 Ca -0.13 0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 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 3.76 0.41 -1.28 1.61 0.41 -0.07 -4.66 118.70 118.87 1hk6 s GLU 29 Ca 0.00 0.58 -0.02 0.00 -0.41 0.00 0.00 54.97 55.12 1hk6 s GLU 29 Cb 0.00 0.14 0.00 0.00 -1.78 0.00 0.00 34.13 32.49 1hk6 s GLU 29 CO 0.00 -0.08 0.23 0.09 -0.49 0.00 0.00 175.26 175.00 1hk6 n ASN 30 N 3.26 -4.91 -2.10 -0.19 3.02 -1.05 -0.09 115.26 113.20 1hk6 n ASN 30 Ca -0.16 -0.11 -0.15 0.00 -0.03 0.00 0.00 54.58 54.12 1hk6 n ASN 30 Cb 0.57 -3.90 -0.12 0.00 -0.61 0.00 0.00 39.78 35.72 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 -2.70 5.63 -0.95 3.41 4.32 -1.21 -3.76 117.00 121.74 1hk6 n LEU 31 Ca -0.14 -3.37 0.00 0.00 -0.02 0.00 0.00 56.01 52.48 1hk6 n LEU 31 Cb 0.62 -1.34 0.00 0.00 -1.62 0.00 0.00 43.42 41.08 1hk6 n LEU 31 CO 0.29 1.64 -0.16 0.61 -1.22 0.00 0.00 177.39 178.55 1hk6 n GLY 32 N 1.91 -4.18 1.95 -0.72 0.00 -1.26 -4.67 105.19 98.22 1hk6 n GLY 32 Ca 0.41 -0.63 -0.18 0.00 0.00 0.00 0.00 46.02 45.63 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 0.48 2.83 0.00 2.61 -2.24 -1.26 -4.11 114.28 112.60 1hk6 n THR 33 Ca 0.00 -1.78 0.00 0.00 -2.27 0.00 0.00 64.05 60.00 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 0.42 1.94 0.29 3.38 0.00 -1.26 -4.95 105.19 105.00 1hk6 n GLY 34 Ca 0.32 -0.24 0.02 0.00 0.00 0.00 0.00 46.02 46.11 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 0.69 -0.94 1.61 0.11 -1.95 -1.52 132.00 129.99 1hk6 h PRO 35 Ca 0.00 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 66.10 1hk6 h PRO 35 Cb 0.00 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 30.90 1hk6 h PRO 35 CO 0.00 0.46 0.62 1.79 -0.21 0.00 0.00 178.00 180.65 1hk6 h THR 36 N 0.71 1.18 -0.38 -1.15 1.35 -1.99 -1.27 112.91 111.36 1hk6 h THR 36 Ca 0.37 -0.42 0.05 0.00 -0.55 0.00 0.00 66.41 65.87 1hk6 h THR 36 Cb 0.34 -0.14 -0.02 0.00 -1.73 0.00 0.00 68.15 66.60 1hk6 h THR 36 CO -0.25 0.22 0.26 0.44 -0.25 0.00 0.00 175.52 175.94 1hk6 h ASP 37 N 1.21 0.25 0.00 5.36 3.32 -1.66 -3.11 116.42 121.79 1hk6 h ASP 37 Ca 0.37 -0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.93 1hk6 h ASP 37 Cb -0.04 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.47 1hk6 h ASP 37 CO -0.11 0.17 2.72 -0.11 -1.72 0.00 0.00 179.24 180.19 1hk6 n LEU 38 N -4.48 6.86 0.27 1.55 0.00 -0.48 -2.17 117.00 118.56 1hk6 n LEU 38 Ca 0.05 -3.64 0.15 0.00 0.00 0.00 0.00 56.01 52.57 1hk6 n LEU 38 Cb 0.24 -1.36 0.76 0.00 0.00 0.00 0.00 43.42 43.07 1hk6 n LEU 38 CO 0.35 1.53 0.99 0.16 0.00 0.00 0.00 177.39 180.42 1hk6 h ILE 39 N 2.96 0.31 -3.41 1.96 3.07 -1.65 -3.44 117.51 117.31 1hk6 h ILE 39 Ca 0.63 -0.52 -0.18 0.00 1.55 0.00 0.00 64.86 66.34 1hk6 h ILE 39 Cb 0.44 1.40 -0.25 0.00 -0.27 0.00 0.00 36.82 38.13 1hk6 h ILE 39 CO 1.40 0.08 -0.54 -0.83 -1.05 0.00 0.00 178.15 177.21 1hk6 s GLY 40 N -4.20 -0.08 -0.15 0.16 0.00 -1.24 -5.04 107.32 96.79 1hk6 s GLY 40 Ca -0.02 0.30 -0.08 0.00 0.00 0.00 0.00 44.72 44.92 1hk6 s GLY 40 CO 0.55 0.23 0.35 -2.27 0.00 0.00 0.00 173.10 171.96 1hk6 s LEU 41 N -0.21 0.11 -0.29 0.66 1.98 -1.26 -0.96 118.68 118.71 1hk6 s LEU 41 Ca -0.03 0.76 -0.15 0.00 -2.89 0.00 0.00 54.13 51.83 1hk6 s LEU 41 Cb -0.02 1.14 0.10 0.00 0.66 0.00 0.00 46.19 48.06 1hk6 s LEU 41 CO 0.00 -0.18 0.72 -0.89 -1.89 0.00 0.00 176.35 174.12 1hk6 s THR 42 N 1.31 -0.22 -0.20 3.68 2.01 -1.12 -2.78 115.64 118.32 1hk6 s THR 42 Ca -0.09 0.00 -0.10 0.00 0.31 0.00 0.00 61.69 61.81 1hk6 s THR 42 Cb -0.09 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.37 1hk6 s THR 42 CO -0.11 0.00 0.12 -0.63 -0.69 0.00 0.00 174.62 173.31 1hk6 s ILE 43 N 1.89 5.31 0.00 1.82 1.01 -1.19 -2.84 121.20 127.21 1hk6 s ILE 43 Ca -0.09 0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.72 1hk6 s ILE 43 Cb -0.06 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 38.98 1hk6 s ILE 43 CO -0.19 0.44 0.00 0.00 0.00 0.00 0.00 174.94 175.19 1hk6 n GLY 45 N 0.00 -0.06 2.95 0.00 0.00 -1.26 -4.69 105.19 102.14 1hk6 n GLY 45 Ca 0.00 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 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 0.00 1.18 0.26 1.61 5.65 -0.90 -4.91 115.29 118.18 1hk6 s HIS 46 Ca 0.00 -0.43 -0.30 0.00 0.25 0.00 0.00 55.06 54.58 1hk6 s HIS 46 Cb 0.01 -0.93 -0.11 0.00 -1.18 0.00 0.00 32.58 30.38 1hk6 s HIS 46 CO -0.00 -0.27 1.52 -0.80 -0.65 0.00 0.00 174.74 174.54 1hk6 s ASN 47 N 0.91 6.52 -0.30 9.88 -0.87 -1.26 -3.14 114.94 126.68 1hk6 s ASN 47 Ca -0.11 2.79 0.16 0.00 -1.57 0.00 0.00 52.86 54.14 1hk6 s ASN 47 Cb -0.15 -2.62 0.44 0.00 -0.02 0.00 0.00 41.25 38.89 1hk6 s ASN 47 CO 0.01 -0.81 1.38 0.00 -2.57 0.00 0.00 177.10 175.11 1hk6 h LEU 49 N 1.55 0.36 -1.22 0.00 5.85 -1.91 -1.51 115.31 118.43 1hk6 h LEU 49 Ca -0.34 -0.68 0.11 0.00 0.84 0.00 0.00 57.88 57.81 1hk6 h LEU 49 Cb 1.30 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 42.16 1hk6 h LEU 49 CO -0.06 0.98 0.57 0.17 -0.34 0.00 0.00 178.44 179.77 1hk6 h LEU 50 N -0.24 0.76 0.18 2.25 -0.00 -1.92 -1.93 115.31 114.41 1hk6 h LEU 50 Ca -0.03 0.03 -0.30 0.00 -0.00 0.00 0.00 57.88 57.58 1hk6 h LEU 50 Cb 0.99 -0.13 0.02 0.00 -0.00 0.00 0.00 40.66 41.54 1hk6 h LEU 50 CO 0.06 0.43 -1.33 0.71 -0.00 0.00 0.00 178.44 178.32 1hk6 h THR 51 N 0.84 1.42 -3.06 0.15 1.35 -1.94 -3.45 112.91 108.21 1hk6 h THR 51 Ca 0.42 -2.92 -0.55 0.00 -0.55 0.00 0.00 66.41 62.81 1hk6 h THR 51 Cb 0.48 2.98 0.08 0.00 -1.73 0.00 0.00 68.15 69.97 1hk6 h THR 51 CO -0.19 0.86 0.79 0.00 -0.25 0.00 0.00 175.52 176.73 1hk6 n ALA 52 N -2.61 2.05 -3.44 6.62 0.00 -0.57 -4.66 120.51 117.90 1hk6 n ALA 52 Ca -0.12 0.39 -0.27 0.00 0.00 0.00 0.00 53.44 53.44 1hk6 n ALA 52 Cb 1.05 -2.40 -0.17 0.00 0.00 0.00 0.00 19.45 17.94 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 -0.46 2.09 0.43 0.00 2.56 0.48 -4.93 118.70 118.87 1hk6 s GLU 53 Ca 0.65 -0.54 -0.24 0.00 0.00 0.00 0.00 54.97 54.84 1hk6 s GLU 53 Cb -0.55 -1.69 -0.08 0.00 2.00 0.00 0.00 34.13 33.81 1hk6 s GLU 53 CO 0.49 0.04 1.16 -0.46 -0.56 0.00 0.00 175.26 175.93 1hk6 s TRP 54 N 0.66 3.00 0.00 5.30 -0.00 -1.26 -2.40 118.94 124.24 1hk6 s TRP 54 Ca -0.14 1.55 0.00 0.00 -0.00 0.00 0.00 56.10 57.51 1hk6 s TRP 54 Cb -0.16 -3.37 0.00 0.00 -0.00 0.00 0.00 33.47 29.94 1hk6 s TRP 54 CO 0.04 -1.35 0.00 -1.33 -0.00 0.00 0.00 176.95 174.31 1hk6 n MET 55 N -0.18 0.00 -0.19 5.86 2.81 -1.21 -4.95 117.12 119.25 1hk6 n MET 55 Ca 0.06 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 1hk6 n MET 55 Cb 0.47 -0.26 0.00 0.00 -0.71 0.00 0.00 33.22 32.72 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 -2.56 0.00 -1.81 7.83 7.64 -1.24 -5.01 113.62 118.47 1hk6 n SER 56 Ca 0.00 -0.18 -0.16 0.00 1.01 0.00 0.00 58.87 59.54 1hk6 n SER 56 Cb 0.18 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.47 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 4.66 -2.07 -0.43 0.00 -1.26 -4.01 120.51 114.40 1hk6 n ALA 57 Ca 0.00 -1.83 -0.00 0.00 0.00 0.00 0.00 53.44 51.60 1hk6 n ALA 57 Cb 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.13 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 -0.33 -0.08 -3.64 0.00 3.41 -1.26 -2.54 113.62 109.18 1hk6 n SER 58 Ca 0.36 -0.65 -0.08 0.00 -0.26 0.00 0.00 58.87 58.25 1hk6 n SER 58 Cb 1.03 0.03 -0.07 0.00 -0.26 0.00 0.00 64.21 64.94 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 0.00 0.57 -0.18 4.33 2.20 -1.26 -2.97 119.74 122.44 1hk6 s LYS 59 Ca 0.00 0.81 -0.06 0.00 -0.36 0.00 0.00 55.97 56.36 1hk6 s LYS 59 Cb 0.02 0.21 0.08 0.00 -1.51 0.00 0.00 37.83 36.62 1hk6 s LYS 59 CO -0.00 -0.09 0.37 0.42 -0.36 0.00 0.00 175.35 175.69 1hk6 s ILE 60 N 0.82 -0.53 -0.14 5.43 1.01 -0.13 -3.36 121.20 124.31 1hk6 s ILE 60 Ca -0.03 0.19 -0.20 0.00 0.00 0.00 0.00 60.65 60.61 1hk6 s ILE 60 Cb -0.05 -0.60 -0.04 0.00 0.01 0.00 0.00 42.46 41.79 1hk6 s ILE 60 CO -0.10 0.08 0.55 -0.69 0.00 0.00 0.00 174.94 174.79 1hk6 s VAL 61 N 2.45 5.11 -0.14 2.92 1.01 -1.01 -1.60 120.40 129.15 1hk6 s VAL 61 Ca -0.02 1.09 -0.31 0.00 0.00 0.00 0.00 61.98 62.74 1hk6 s VAL 61 Cb -0.12 -3.89 0.13 0.00 0.00 0.00 0.00 36.38 32.51 1hk6 s VAL 61 CO -0.12 0.24 1.04 0.00 0.00 0.00 0.00 175.10 176.27 1hk6 s ARG 63 N -1.89 4.51 0.20 0.00 0.52 -1.26 -2.85 118.95 118.18 1hk6 s ARG 63 Ca 0.03 1.11 -0.31 0.00 -0.52 0.00 0.00 55.73 56.03 1hk6 s ARG 63 Cb -0.01 -3.38 -0.11 0.00 0.52 0.00 0.00 34.95 31.97 1hk6 s ARG 63 CO -0.03 0.22 1.63 0.14 0.02 0.00 0.00 175.30 177.28 1hk6 s VAL 64 N 0.14 2.30 0.67 3.52 -7.23 -1.01 -4.92 120.40 113.87 1hk6 s VAL 64 Ca 0.40 0.22 -0.10 0.00 -1.81 0.00 0.00 61.98 60.69 1hk6 s VAL 64 Cb -0.20 -3.14 0.00 0.00 0.56 0.00 0.00 36.38 33.60 1hk6 s VAL 64 CO 0.23 0.02 1.05 -0.83 -0.31 0.00 0.00 175.10 175.26 1hk6 s GLY 65 N 1.03 1.63 0.23 2.32 0.00 -1.26 -4.23 107.32 107.04 1hk6 s GLY 65 Ca 0.70 -0.36 -0.30 0.00 0.00 0.00 0.00 44.72 44.76 1hk6 s GLY 65 CO 0.34 -0.03 1.07 0.61 0.00 0.00 0.00 173.10 175.09 1hk6 n GLN 66 N -2.89 1.22 -1.31 2.90 10.64 -1.26 -4.80 117.38 121.88 1hk6 n GLN 66 Ca 0.06 0.43 -0.38 0.00 -1.83 0.00 0.00 57.00 55.28 1hk6 n GLN 66 Cb 0.57 -1.85 -0.02 0.00 -0.86 0.00 0.00 30.24 28.07 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 0.84 5.23 -0.12 2.61 0.00 -1.26 -4.20 120.51 123.61 1hk6 n ALA 67 Ca 0.12 -3.32 -0.08 0.00 0.00 0.00 0.00 53.44 50.17 1hk6 n ALA 67 Cb 0.28 -3.44 0.01 0.00 0.00 0.00 0.00 19.45 16.30 1hk6 n ALA 67 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1hk6 h LYS 68 N 6.35 0.48 0.00 0.00 1.57 -1.90 -3.42 116.57 119.65 1hk6 h LYS 68 Ca 0.58 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.33 1hk6 h LYS 68 Cb 0.49 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1hk6 h LYS 68 CO 1.81 0.32 0.00 0.09 -0.57 0.00 0.00 179.45 181.10 1hk6 n ASN 69 N -4.84 0.00 -1.44 0.86 5.03 -1.26 -5.04 115.26 108.57 1hk6 n ASN 69 Ca 0.01 0.00 -0.04 0.00 0.87 0.00 0.00 54.58 55.42 1hk6 n ASN 69 Cb 0.04 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 38.79 1hk6 n ASN 69 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1hk6 n ASP 70 N 0.00 -0.50 -1.14 6.41 8.00 -1.26 -4.92 116.55 123.13 1hk6 n ASP 70 Ca 0.00 -2.03 -0.06 0.00 0.71 0.00 0.00 54.79 53.41 1hk6 n ASP 70 Cb 0.00 0.18 -0.05 0.00 -0.02 0.00 0.00 41.12 41.23 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 -0.14 0.09 -3.64 -1.24 4.76 -1.26 -5.02 118.16 111.71 1hk6 n LYS 71 Ca -0.17 -1.09 -0.28 0.00 -2.87 0.00 0.00 58.31 53.89 1hk6 n LYS 71 Cb 0.83 0.45 -0.06 0.00 -1.84 0.00 0.00 35.03 34.41 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 -0.06 -0.24 3.67 0.72 0.00 -1.25 -4.44 105.19 103.59 1hk6 n GLY 72 Ca -0.25 0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.86 6.63 -0.16 1.61 1.01 -1.26 -1.94 116.67 119.70 1hk6 s ASP 73 Ca 0.46 2.36 -0.12 0.00 0.71 0.00 0.00 52.55 55.96 1hk6 s ASP 73 Cb -0.27 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.07 1hk6 s ASP 73 CO 0.71 -0.92 0.23 -0.63 0.21 0.00 0.00 175.17 174.77 1hk6 s ILE 74 N 3.54 5.35 -0.00 0.77 1.01 -1.26 -0.46 121.20 130.15 1hk6 s ILE 74 Ca 0.75 0.41 0.02 0.00 0.00 0.00 0.00 60.65 61.83 1hk6 s ILE 74 Cb -0.36 -3.56 -0.01 0.00 0.01 0.00 0.00 42.46 38.54 1hk6 s ILE 74 CO 0.32 0.43 -0.08 -0.63 0.00 0.00 0.00 174.94 174.98 1hk6 s ILE 75 N 0.25 0.60 -0.04 2.92 -1.09 -1.13 -4.03 121.20 118.68 1hk6 s ILE 75 Ca 0.14 -0.34 -0.01 0.00 -2.23 0.00 0.00 60.65 58.21 1hk6 s ILE 75 Cb -0.12 -0.50 0.03 0.00 -1.58 0.00 0.00 42.46 40.29 1hk6 s ILE 75 CO 0.02 0.16 0.07 0.54 -1.23 0.00 0.00 174.94 174.50 1hk6 s VAL 76 N -0.20 -0.10 0.05 2.92 0.11 -1.26 -2.79 120.40 119.13 1hk6 s VAL 76 Ca 0.03 0.30 -0.18 0.00 -2.93 0.00 0.00 61.98 59.20 1hk6 s VAL 76 Cb -0.03 -0.15 -0.06 0.00 -1.53 0.00 0.00 36.38 34.61 1hk6 s VAL 76 CO -0.00 0.12 0.51 -0.89 -3.33 0.00 0.00 175.10 171.51 1hk6 s THR 77 N 1.58 4.85 -0.06 5.04 2.01 -0.13 -2.59 115.64 126.32 1hk6 s THR 77 Ca -0.03 1.08 -0.10 0.00 0.31 0.00 0.00 61.69 62.94 1hk6 s THR 77 Cb -0.12 -3.83 0.02 0.00 0.01 0.00 0.00 72.50 68.58 1hk6 s THR 77 CO -0.04 0.56 0.25 0.42 -0.69 0.00 0.00 174.62 175.13 1hk6 s THR 78 N -1.09 0.03 0.44 -0.82 -4.23 -1.26 -3.59 115.64 105.12 1hk6 s THR 78 Ca 0.27 -0.22 0.17 0.00 -1.18 0.00 0.00 61.69 60.73 1hk6 s THR 78 Cb -0.18 -0.44 0.36 0.00 1.34 0.00 0.00 72.50 73.58 1hk6 s THR 78 CO 0.17 -0.12 1.92 0.11 -0.54 0.00 0.00 174.62 176.16 1hk6 h LYS 79 N 5.07 0.36 -0.05 3.99 1.79 -1.77 1.36 116.57 127.33 1hk6 h LYS 79 Ca -0.28 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.17 1hk6 h LYS 79 Cb 1.19 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.76 1hk6 h LYS 79 CO 0.36 0.24 0.02 0.77 -1.08 0.00 0.00 179.45 179.76 1hk6 h SER 80 N 0.37 0.07 0.00 0.86 0.02 -1.96 -3.42 113.55 109.49 1hk6 h SER 80 Ca 0.37 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1hk6 h SER 80 Cb 0.92 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.44 1hk6 h SER 80 CO -0.11 0.22 -0.81 0.61 -1.14 0.00 0.00 176.83 175.60 1hk6 n GLY 81 N -0.64 0.00 0.53 -3.77 0.00 -0.76 -4.40 105.19 96.15 1hk6 n GLY 81 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 2.78 -3.80 3.66 -0.02 0.00 0.46 -4.84 105.19 103.44 1hk6 n GLY 82 Ca 0.00 -0.80 -0.27 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.08 -2.27 0.00 1.61 4.81 -1.23 -4.76 118.16 116.23 1hk6 n LYS 83 Ca 0.00 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 57.97 1hk6 n LYS 83 Cb 0.00 -4.57 0.00 0.00 0.02 0.00 0.00 35.03 30.48 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 -1.64 -1.91 0.00 3.14 0.00 -1.07 -4.96 105.19 98.75 1hk6 n GLY 84 Ca -0.15 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 -3.63 2.61 -2.24 -1.19 -4.81 114.28 105.01 1hk6 n THR 85 Ca 0.00 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.75 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 -0.55 -0.57 0.00 0.00 175.07 173.95 1hk6 s SER 86 N -0.55 -0.59 -0.40 3.42 0.15 -1.26 -3.07 113.70 111.40 1hk6 s SER 86 Ca 0.00 0.93 -0.00 0.00 0.70 0.00 0.00 55.95 57.58 1hk6 s SER 86 Cb 0.00 1.28 0.32 0.00 -1.71 0.00 0.00 66.02 65.91 1hk6 s SER 86 CO 0.00 -0.15 1.93 0.35 1.20 0.00 0.00 173.24 176.58 1hk6 n THR 87 N 3.90 2.92 -3.74 6.45 -2.24 -0.80 -4.83 114.28 115.94 1hk6 n THR 87 Ca -0.18 -1.89 -0.13 0.00 -2.27 0.00 0.00 64.05 59.58 1hk6 n THR 87 Cb 0.57 -1.15 -0.10 0.00 -2.10 0.00 0.00 70.33 67.55 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 -2.91 -0.00 -0.12 2.28 -7.23 -1.26 -4.94 120.40 106.22 1hk6 s VAL 88 Ca 0.41 0.01 0.03 0.00 -1.81 0.00 0.00 61.98 60.61 1hk6 s VAL 88 Cb 0.33 -0.54 0.00 0.00 0.56 0.00 0.00 36.38 36.72 1hk6 s VAL 88 CO 0.01 0.00 -0.21 -0.44 -0.31 0.00 0.00 175.10 174.15 1hk6 s SER 89 N 0.31 3.26 -0.19 4.85 0.01 -1.26 -4.27 113.70 116.41 1hk6 s SER 89 Ca -0.01 -0.54 -0.21 0.00 1.31 0.00 0.00 55.95 56.51 1hk6 s SER 89 Cb -0.03 -1.46 -0.03 0.00 0.21 0.00 0.00 66.02 64.71 1hk6 s SER 89 CO -0.01 0.13 0.62 0.12 0.41 0.00 0.00 173.24 174.51 1hk6 s PHE 90 N 0.54 3.39 -0.92 2.43 5.36 -0.82 -4.87 117.98 123.08 1hk6 s PHE 90 Ca -0.13 0.93 -0.21 0.00 -0.96 0.00 0.00 56.93 56.56 1hk6 s PHE 90 Cb -0.17 -2.78 0.09 0.00 -0.34 0.00 0.00 43.02 39.82 1hk6 s PHE 90 CO 0.04 -0.14 1.24 0.21 -1.46 0.00 0.00 175.22 175.11 1hk6 s LYS 91 N 1.79 3.52 0.13 10.12 2.20 -1.26 -3.85 119.74 132.39 1hk6 s LYS 91 Ca 0.29 -1.32 -0.31 0.00 -0.36 0.00 0.00 55.97 54.27 1hk6 s LYS 91 Cb -0.16 -4.97 -0.09 0.00 -1.51 0.00 0.00 37.83 31.10 1hk6 s LYS 91 CO 0.11 -1.97 1.57 -1.17 -0.36 0.00 0.00 175.35 173.52 1hk6 s LEU 92 N 3.92 4.37 0.16 5.43 2.96 -1.26 -3.89 118.68 130.37 1hk6 s LEU 92 Ca 0.37 2.53 -0.30 0.00 -0.22 0.00 0.00 54.13 56.52 1hk6 s LEU 92 Cb -0.04 -3.58 -0.07 0.00 0.50 0.00 0.00 46.19 42.99 1hk6 s LEU 92 CO -0.06 -0.82 0.94 -0.76 -1.32 0.00 0.00 176.35 174.32 1hk6 s LEU 93 N 1.62 4.56 0.25 -0.68 1.43 -1.16 -4.90 118.68 119.80 1hk6 s LEU 93 Ca 0.70 1.83 -0.30 0.00 -1.03 0.00 0.00 54.13 55.34 1hk6 s LEU 93 Cb -0.41 -3.57 -0.10 0.00 0.03 0.00 0.00 46.19 42.13 1hk6 s LEU 93 CO 0.31 0.04 1.48 -0.75 0.23 0.00 0.00 176.35 177.67 1hk6 s LYS 94 N -0.53 4.23 0.18 1.70 2.20 -1.26 -4.08 119.74 122.18 1hk6 s LYS 94 Ca 0.44 2.37 -0.33 0.00 -0.36 0.00 0.00 55.97 58.08 1hk6 s LYS 94 Cb -0.24 -3.09 -0.14 0.00 -1.51 0.00 0.00 37.83 32.85 1hk6 s LYS 94 CO 0.30 -0.48 1.53 -2.30 -0.36 0.00 0.00 175.35 174.04 1hk6 n PRO 95 N 2.41 2.09 -2.31 4.03 -0.02 -1.26 -4.90 135.00 135.04 1hk6 n PRO 95 Ca 0.08 0.75 -0.43 0.00 -2.02 0.00 0.00 63.50 61.88 1hk6 n PRO 95 Cb 0.39 -2.49 -0.02 0.00 -0.02 0.00 0.00 33.50 31.36 1hk6 n PRO 95 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1hk6 s GLU 96 N 0.59 4.01 0.00 -0.52 2.02 -1.26 -5.20 118.70 118.34 1hk6 s GLU 96 Ca 0.76 1.57 0.00 0.00 0.02 0.00 0.00 54.97 57.32 1hk6 s GLU 96 Cb -0.68 -3.89 0.00 0.00 0.10 0.00 0.00 34.13 29.66 1hk6 s GLU 96 CO 0.41 -1.01 0.00 1.63 0.02 0.00 0.00 175.26 176.31