#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dhk s THR 2 N 0.00 0.95 -0.16 0.00 2.01 -1.26 -5.12 115.64 112.06 1dhk s THR 2 Ca 0.00 -0.26 -0.10 0.00 0.31 0.00 0.00 61.69 61.64 1dhk s THR 2 Cb 0.00 -0.97 -0.05 0.00 0.01 0.00 0.00 72.50 71.50 1dhk s THR 2 CO 0.00 0.35 0.19 -1.61 -0.69 0.00 0.00 174.62 172.86 1dhk s GLU 3 N 1.57 3.99 0.04 4.92 2.02 -1.26 -4.54 118.70 125.44 1dhk s GLU 3 Ca 0.02 -0.08 -0.01 0.00 0.02 0.00 0.00 54.97 54.92 1dhk s GLU 3 Cb -0.13 -3.35 -0.03 0.00 0.10 0.00 0.00 34.13 30.72 1dhk s GLU 3 CO -0.06 0.44 -0.02 -0.08 0.02 0.00 0.00 175.26 175.55 1dhk s THR 4 N -0.07 0.16 -0.05 3.63 -1.32 -1.25 -5.00 115.64 111.74 1dhk s THR 4 Ca 0.13 -1.34 -0.04 0.00 -1.21 0.00 0.00 61.69 59.22 1dhk s THR 4 Cb -0.12 -0.88 0.02 0.00 -1.51 0.00 0.00 72.50 70.00 1dhk s THR 4 CO 0.02 -0.74 0.14 -0.44 -2.21 0.00 0.00 174.62 171.39 1dhk s SER 5 N -2.18 -0.14 -0.04 8.08 0.01 -1.26 -0.95 113.70 117.22 1dhk s SER 5 Ca -0.05 0.28 -0.17 0.00 1.31 0.00 0.00 55.95 57.33 1dhk s SER 5 Cb -0.01 0.26 0.03 0.00 0.21 0.00 0.00 66.02 66.51 1dhk s SER 5 CO -0.05 -0.07 0.37 0.72 0.41 0.00 0.00 173.24 174.61 1dhk s PHE 6 N 0.33 -0.27 -0.11 2.43 -0.12 -0.40 -5.00 117.98 114.84 1dhk s PHE 6 Ca -0.02 0.48 -0.00 0.00 -0.05 0.00 0.00 56.93 57.34 1dhk s PHE 6 Cb -0.03 0.14 0.02 0.00 -0.63 0.00 0.00 43.02 42.52 1dhk s PHE 6 CO -0.01 -0.39 -0.08 0.42 -0.05 0.00 0.00 175.22 175.11 1dhk s ILE 7 N -1.10 1.00 -0.27 -4.49 1.01 -1.26 -1.21 121.20 114.89 1dhk s ILE 7 Ca -0.11 -0.28 0.01 0.00 0.00 0.00 0.00 60.65 60.27 1dhk s ILE 7 Cb -0.04 -1.02 0.05 0.00 0.01 0.00 0.00 42.46 41.46 1dhk s ILE 7 CO 0.04 0.36 -0.07 -0.63 0.00 0.00 0.00 174.94 174.64 1dhk s ILE 8 N 1.66 2.50 -0.80 2.92 1.01 0.21 -4.96 121.20 123.73 1dhk s ILE 8 Ca 0.04 -1.47 0.24 0.00 0.00 0.00 0.00 60.65 59.45 1dhk s ILE 8 Cb -0.13 -2.42 -0.05 0.00 0.01 0.00 0.00 42.46 39.87 1dhk s ILE 8 CO -0.07 -0.01 1.22 -0.90 0.00 0.00 0.00 174.94 175.17 1dhk n ASP 9 N 4.52 0.62 -3.64 3.58 5.68 -1.26 -1.24 116.55 124.81 1dhk n ASP 9 Ca -0.14 -0.23 -0.05 0.00 -0.50 0.00 0.00 54.79 53.86 1dhk n ASP 9 Cb 0.43 0.48 -0.07 0.00 -1.14 0.00 0.00 41.12 40.83 1dhk n ASP 9 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1dhk s ALA 10 N -3.10 -2.03 0.69 2.12 0.00 -1.26 -4.67 121.76 113.52 1dhk s ALA 10 Ca 0.07 2.34 -0.11 0.00 0.00 0.00 0.00 51.96 54.26 1dhk s ALA 10 Cb 0.15 -1.53 0.01 0.00 0.00 0.00 0.00 23.12 21.75 1dhk s ALA 10 CO 0.75 -0.37 1.06 -0.06 0.00 0.00 0.00 175.76 177.15 1dhk s PHE 11 N 1.51 3.17 -0.15 0.00 0.40 0.64 -5.02 117.98 118.53 1dhk s PHE 11 Ca -0.09 1.38 -0.13 0.00 -0.60 0.00 0.00 56.93 57.49 1dhk s PHE 11 Cb -0.04 -2.88 0.04 0.00 0.51 0.00 0.00 43.02 40.65 1dhk s PHE 11 CO -0.18 -1.20 0.40 1.21 0.70 0.00 0.00 175.22 176.15 1dhk s ASN 12 N -3.86 -0.43 0.49 1.36 3.84 -1.26 -4.53 114.94 110.55 1dhk s ASN 12 Ca 0.58 0.81 0.15 0.00 0.21 0.00 0.00 52.86 54.61 1dhk s ASN 12 Cb -0.14 0.79 1.16 0.00 -0.55 0.00 0.00 41.25 42.52 1dhk s ASN 12 CO 0.55 -0.15 2.10 0.11 -2.79 0.00 0.00 177.10 176.92 1dhk h LYS 13 N 5.90 0.05 -0.76 0.43 1.57 -1.94 -3.29 116.57 118.52 1dhk h LYS 13 Ca -0.29 -0.00 0.17 0.00 -1.87 0.00 0.00 60.65 58.65 1dhk h LYS 13 Cb 1.18 -0.01 -0.13 0.00 0.08 0.00 0.00 32.23 33.35 1dhk h LYS 13 CO 0.27 0.08 -0.02 1.15 -0.57 0.00 0.00 179.45 180.36 1dhk h THR 14 N 0.05 0.32 -0.74 -0.16 2.02 -2.03 -1.83 112.91 110.54 1dhk h THR 14 Ca 0.01 -0.03 -0.26 0.00 0.77 0.00 0.00 66.41 66.91 1dhk h THR 14 Cb 0.08 0.23 -0.15 0.00 -1.74 0.00 0.00 68.15 66.56 1dhk h THR 14 CO 0.00 0.02 0.30 -0.46 0.37 0.00 0.00 175.52 175.75 1dhk n ASN 15 N -5.37 4.46 -4.37 4.18 6.94 -1.24 -4.96 115.26 114.89 1dhk n ASN 15 Ca 0.13 -3.32 -0.22 0.00 -0.02 0.00 0.00 54.58 51.15 1dhk n ASN 15 Cb 0.47 -0.75 -0.11 0.00 -2.36 0.00 0.00 39.78 37.03 1dhk n ASN 15 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1dhk s LEU 16 N -3.06 2.48 -0.28 -4.53 1.02 -0.69 -1.38 118.68 112.24 1dhk s LEU 16 Ca 0.54 -0.92 -0.02 0.00 0.02 0.00 0.00 54.13 53.76 1dhk s LEU 16 Cb 0.44 -0.90 0.04 0.00 0.02 0.00 0.00 46.19 45.79 1dhk s LEU 16 CO 0.12 -0.02 -0.03 -0.63 0.02 0.00 0.00 176.35 175.81 1dhk s ILE 17 N -2.22 2.95 -0.15 -0.59 1.01 0.43 -4.77 121.20 117.86 1dhk s ILE 17 Ca 0.20 -1.21 -0.04 0.00 0.00 0.00 0.00 60.65 59.61 1dhk s ILE 17 Cb -0.05 -2.61 -0.03 0.00 0.01 0.00 0.00 42.46 39.78 1dhk s ILE 17 CO 0.09 0.04 -0.02 -0.76 0.00 0.00 0.00 174.94 174.28 1dhk s LEU 18 N 1.29 3.38 -0.05 2.97 1.43 -1.26 -0.69 118.68 125.75 1dhk s LEU 18 Ca -0.03 -0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.04 1dhk s LEU 18 Cb -0.18 -1.81 0.01 0.00 0.03 0.00 0.00 46.19 44.23 1dhk s LEU 18 CO -0.02 0.20 -0.12 -1.10 0.23 0.00 0.00 176.35 175.54 1dhk s GLN 19 N 0.17 1.44 3.73 1.70 -0.21 0.49 -4.99 119.66 122.00 1dhk s GLN 19 Ca -0.00 -0.40 0.00 0.00 0.02 0.00 0.00 55.36 54.98 1dhk s GLN 19 Cb -0.13 -1.25 0.00 0.00 1.00 0.00 0.00 33.01 32.63 1dhk s GLN 19 CO 0.02 0.09 0.00 0.41 -2.12 0.00 0.00 175.29 173.69 1dhk n GLY 20 N 3.55 0.34 2.63 3.09 0.00 -1.26 -0.32 105.19 113.22 1dhk n GLY 20 Ca -0.21 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.48 1dhk n GLY 20 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1dhk n ASP 21 N 1.35 5.44 -3.96 1.61 2.03 -1.26 -4.85 116.55 116.91 1dhk n ASP 21 Ca 0.00 -2.82 -0.25 0.00 0.52 0.00 0.00 54.79 52.24 1dhk n ASP 21 Cb 0.00 -1.60 -0.17 0.00 -0.72 0.00 0.00 41.12 38.63 1dhk n ASP 21 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1dhk s ALA 22 N 2.42 1.25 0.18 -1.67 0.00 -1.26 -1.86 121.76 120.83 1dhk s ALA 22 Ca 0.52 -0.45 -0.03 0.00 0.00 0.00 0.00 51.96 52.01 1dhk s ALA 22 Cb 0.15 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.52 1dhk s ALA 22 CO -0.07 -0.14 0.15 0.95 0.00 0.00 0.00 175.76 176.66 1dhk s THR 23 N 1.16 0.04 -0.17 0.00 -4.23 -0.27 -4.78 115.64 107.38 1dhk s THR 23 Ca -0.05 -1.86 -0.01 0.00 -1.18 0.00 0.00 61.69 58.59 1dhk s THR 23 Cb -0.14 -2.27 -0.00 0.00 1.34 0.00 0.00 72.50 71.42 1dhk s THR 23 CO -0.02 -0.17 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.07 1dhk s VAL 24 N -4.10 2.78 0.76 2.29 1.01 -1.26 -0.40 120.40 121.49 1dhk s VAL 24 Ca 0.31 -0.72 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 1dhk s VAL 24 Cb 0.06 -2.20 0.05 0.00 0.00 0.00 0.00 36.38 34.29 1dhk s VAL 24 CO 0.07 0.50 1.11 -0.94 0.00 0.00 0.00 175.10 175.84 1dhk s SER 25 N 0.97 4.93 0.49 3.32 1.04 -0.13 -4.92 113.70 119.40 1dhk s SER 25 Ca -0.02 1.15 0.24 0.00 0.48 0.00 0.00 55.95 57.79 1dhk s SER 25 Cb -0.15 -1.88 1.28 0.00 0.10 0.00 0.00 66.02 65.37 1dhk s SER 25 CO -0.02 -1.67 1.91 0.28 0.98 0.00 0.00 173.24 174.72 1dhk h SER 26 N -0.89 0.17 -0.35 7.02 0.02 -1.99 0.18 113.55 117.72 1dhk h SER 26 Ca -0.46 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1dhk h SER 26 Cb 1.27 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1dhk h SER 26 CO 0.62 0.08 0.00 -0.46 -1.14 0.00 0.00 176.83 175.93 1dhk n ASN 27 N -4.40 2.53 0.00 3.07 2.04 -1.26 -4.93 115.26 112.32 1dhk n ASN 27 Ca 0.16 -2.17 0.00 0.00 -0.44 0.00 0.00 54.58 52.13 1dhk n ASN 27 Cb 0.73 -0.37 0.00 0.00 -2.53 0.00 0.00 39.78 37.60 1dhk n ASN 27 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1dhk n GLY 28 N 0.84 0.52 3.81 4.83 0.00 0.05 -4.89 105.19 110.34 1dhk n GLY 28 Ca 0.13 -0.47 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 1dhk n GLY 28 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dhk s ASN 29 N -2.42 6.78 -0.24 1.61 0.02 -1.26 -0.26 114.94 119.17 1dhk s ASN 29 Ca 0.00 0.93 -0.26 0.00 -1.02 0.00 0.00 52.86 52.51 1dhk s ASN 29 Cb 0.00 -2.26 -0.00 0.00 0.02 0.00 0.00 41.25 39.01 1dhk s ASN 29 CO 0.00 0.25 0.89 -0.22 0.02 0.00 0.00 177.10 178.04 1dhk s LEU 30 N -0.69 4.08 -0.12 0.60 2.96 -0.47 -0.95 118.68 124.10 1dhk s LEU 30 Ca 0.24 1.13 0.01 0.00 -0.22 0.00 0.00 54.13 55.29 1dhk s LEU 30 Cb -0.16 -3.29 -0.01 0.00 0.50 0.00 0.00 46.19 43.23 1dhk s LEU 30 CO 0.13 -0.56 -0.15 -1.10 -1.32 0.00 0.00 176.35 173.34 1dhk s GLN 31 N 2.95 3.28 -0.01 1.98 -0.21 0.47 -1.31 119.66 126.80 1dhk s GLN 31 Ca 0.37 -0.73 0.04 0.00 0.02 0.00 0.00 55.36 55.07 1dhk s GLN 31 Cb -0.15 -2.55 -0.01 0.00 1.00 0.00 0.00 33.01 31.30 1dhk s GLN 31 CO 0.07 0.22 -0.13 -0.51 -2.12 0.00 0.00 175.29 172.82 1dhk s LEU 32 N 0.31 2.03 0.00 2.90 1.02 -0.08 -1.11 118.68 123.74 1dhk s LEU 32 Ca -0.12 -0.25 0.00 0.00 0.02 0.00 0.00 54.13 53.78 1dhk s LEU 32 Cb -0.16 -0.68 0.00 0.00 0.02 0.00 0.00 46.19 45.37 1dhk s LEU 32 CO 0.06 0.16 0.00 -1.20 0.02 0.00 0.00 176.35 175.39 1dhk n SER 33 N 2.72 -2.58 -0.03 2.29 7.64 -0.78 -1.66 113.62 121.23 1dhk n SER 33 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.74 1dhk n SER 33 Cb 0.55 -0.83 0.31 0.00 -1.01 0.00 0.00 64.21 63.23 1dhk n SER 33 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 1dhk h TYR 34 N 0.00 0.60 -0.11 1.43 -1.99 -1.85 -3.22 116.97 111.83 1dhk h TYR 34 Ca 0.00 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.69 1dhk h TYR 34 Cb 0.12 -0.18 0.00 0.00 2.00 0.00 0.00 36.73 38.67 1dhk h TYR 34 CO 0.08 0.52 0.00 0.09 -0.00 0.00 0.00 178.16 178.84 1dhk n ASN 35 N -4.33 2.45 -3.48 3.88 3.02 -1.26 -5.05 115.26 110.49 1dhk n ASN 35 Ca 0.02 -1.70 -0.21 0.00 -0.03 0.00 0.00 54.58 52.66 1dhk n ASN 35 Cb 0.19 -0.07 -0.08 0.00 -0.61 0.00 0.00 39.78 39.22 1dhk n ASN 35 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1dhk s SER 36 N -1.19 2.02 0.14 6.41 1.04 -1.22 -5.15 113.70 115.75 1dhk s SER 36 Ca 0.20 -1.77 -0.11 0.00 0.48 0.00 0.00 55.95 54.76 1dhk s SER 36 Cb 0.13 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.83 1dhk s SER 36 CO 0.19 -1.06 0.30 -0.72 0.98 0.00 0.00 173.24 172.93 1dhk s TYR 37 N -3.36 0.20 -1.43 5.02 1.13 -1.26 -4.86 117.35 112.79 1dhk s TYR 37 Ca 0.37 -0.58 -0.03 0.00 -1.41 0.00 0.00 57.07 55.42 1dhk s TYR 37 Cb 0.02 0.03 0.00 0.00 -1.10 0.00 0.00 41.96 40.91 1dhk s TYR 37 CO 0.25 -0.69 0.29 -3.47 -2.51 0.00 0.00 175.55 169.43 1dhk n ASP 38 N -0.18 -0.31 -3.83 -0.18 2.03 0.57 -4.92 116.55 109.73 1dhk n ASP 38 Ca -0.11 -1.13 -0.06 0.00 0.52 0.00 0.00 54.79 54.01 1dhk n ASP 38 Cb 0.63 -2.43 -0.02 0.00 -0.72 0.00 0.00 41.12 38.58 1dhk n ASP 38 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1dhk s SER 39 N -4.28 -0.24 0.00 1.67 1.04 -1.07 -4.98 113.70 105.84 1dhk s SER 39 Ca 0.06 -0.58 0.07 0.00 0.48 0.00 0.00 55.95 55.98 1dhk s SER 39 Cb -0.03 0.69 -0.03 0.00 0.10 0.00 0.00 66.02 66.76 1dhk s SER 39 CO 0.93 -1.27 -0.22 -0.32 0.98 0.00 0.00 173.24 173.34 1dhk s MET 40 N -3.78 2.10 0.05 4.02 1.75 -1.26 -1.86 119.30 120.32 1dhk s MET 40 Ca 0.11 -0.94 0.06 0.00 -1.25 0.00 0.00 55.69 53.67 1dhk s MET 40 Cb -0.05 -2.12 -0.03 0.00 2.84 0.00 0.00 34.83 35.48 1dhk s MET 40 CO 0.06 0.56 -0.18 -1.12 -0.65 0.00 0.00 175.02 173.69 1dhk s SER 41 N -0.96 2.09 0.06 1.11 0.01 -0.28 -4.58 113.70 111.16 1dhk s SER 41 Ca 0.12 -0.52 0.01 0.00 1.31 0.00 0.00 55.95 56.87 1dhk s SER 41 Cb -0.10 -0.15 -0.03 0.00 0.21 0.00 0.00 66.02 65.95 1dhk s SER 41 CO 0.01 0.08 -0.06 -0.13 0.41 0.00 0.00 173.24 173.55 1dhk s ARG 42 N -1.28 0.61 -0.10 12.44 0.52 0.56 -0.83 118.95 130.87 1dhk s ARG 42 Ca 0.04 -0.99 -0.04 0.00 -0.52 0.00 0.00 55.73 54.23 1dhk s ARG 42 Cb -0.09 -0.14 0.05 0.00 0.52 0.00 0.00 34.95 35.29 1dhk s ARG 42 CO 0.02 -0.01 0.19 0.00 0.02 0.00 0.00 175.30 175.52 1dhk s ALA 43 N -2.47 -0.27 0.19 2.13 0.00 -0.45 -0.38 121.76 120.51 1dhk s ALA 43 Ca -0.01 0.66 0.11 0.00 0.00 0.00 0.00 51.96 52.71 1dhk s ALA 43 Cb -0.03 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.17 1dhk s ALA 43 CO -0.03 -0.60 -0.22 -0.06 0.00 0.00 0.00 175.76 174.85 1dhk s PHE 44 N 2.33 2.17 0.32 0.00 0.08 0.13 -0.69 117.98 122.33 1dhk s PHE 44 Ca 0.03 -0.38 -0.28 0.00 0.12 0.00 0.00 56.93 56.41 1dhk s PHE 44 Cb -0.12 -1.07 -0.09 0.00 -0.57 0.00 0.00 43.02 41.17 1dhk s PHE 44 CO -0.07 0.47 1.16 -0.47 -0.10 0.00 0.00 175.22 176.21 1dhk s TYR 45 N -1.83 3.34 0.53 0.36 5.04 -0.66 -0.43 117.35 123.70 1dhk s TYR 45 Ca 0.20 1.61 0.18 0.00 -2.44 0.00 0.00 57.07 56.62 1dhk s TYR 45 Cb -0.07 -3.38 1.34 0.00 0.35 0.00 0.00 41.96 40.19 1dhk s TYR 45 CO 0.09 -0.99 2.16 0.66 -1.34 0.00 0.00 175.55 176.13 1dhk h SER 46 N 3.40 0.00 -3.01 4.32 4.64 -1.53 -3.43 113.55 117.94 1dhk h SER 46 Ca -0.48 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.22 1dhk h SER 46 Cb 1.22 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.23 1dhk h SER 46 CO 0.65 0.01 -0.34 0.00 -0.87 0.00 0.00 176.83 176.28 1dhk s ALA 47 N -4.98 3.71 0.49 5.18 0.00 -1.26 -5.01 121.76 119.89 1dhk s ALA 47 Ca -0.05 -0.45 -0.21 0.00 0.00 0.00 0.00 51.96 51.25 1dhk s ALA 47 Cb 0.17 -2.25 -0.07 0.00 0.00 0.00 0.00 23.12 20.96 1dhk s ALA 47 CO 0.65 0.37 1.13 -2.14 0.00 0.00 0.00 175.76 175.77 1dhk s PRO 48 N -0.46 3.66 -0.09 0.00 0.02 -1.26 -4.76 135.00 132.10 1dhk s PRO 48 Ca 0.18 1.64 -0.01 0.00 0.02 0.00 0.00 61.00 62.83 1dhk s PRO 48 Cb -0.14 -2.24 -0.03 0.00 0.02 0.00 0.00 34.50 32.11 1dhk s PRO 48 CO 0.07 -0.61 -0.02 0.42 -0.33 0.00 0.00 177.00 176.53 1dhk s ILE 49 N -1.69 4.09 -0.30 2.83 -1.09 0.57 -4.91 121.20 120.69 1dhk s ILE 49 Ca 0.67 -0.33 -0.21 0.00 -2.23 0.00 0.00 60.65 58.55 1dhk s ILE 49 Cb -0.25 -2.72 -0.01 0.00 -1.58 0.00 0.00 42.46 37.91 1dhk s ILE 49 CO 0.29 0.59 0.67 -1.58 -1.23 0.00 0.00 174.94 173.68 1dhk s GLN 50 N -0.68 3.95 -0.12 2.79 0.74 -1.26 -1.02 119.66 124.06 1dhk s GLN 50 Ca 0.11 0.41 0.19 0.00 0.05 0.00 0.00 55.36 56.11 1dhk s GLN 50 Cb -0.12 -3.72 -0.26 0.00 1.10 0.00 0.00 33.01 30.02 1dhk s GLN 50 CO 0.02 -0.58 0.30 -0.89 -0.55 0.00 0.00 175.29 173.59 1dhk n ILE 51 N 5.40 1.03 -3.79 -2.34 2.08 0.48 -4.80 119.36 117.42 1dhk n ILE 51 Ca 0.00 -0.75 -0.16 0.00 0.56 0.00 0.00 62.75 62.41 1dhk n ILE 51 Cb 0.49 -0.41 -0.16 0.00 -0.75 0.00 0.00 39.64 38.80 1dhk n ILE 51 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 1dhk s ARG 52 N -2.80 0.03 -0.48 0.38 3.52 -1.05 0.11 118.95 118.66 1dhk s ARG 52 Ca -0.08 0.19 -0.21 0.00 -0.13 0.00 0.00 55.73 55.49 1dhk s ARG 52 Cb 0.08 -0.34 0.04 0.00 -1.56 0.00 0.00 34.95 33.18 1dhk s ARG 52 CO 0.85 -0.18 0.70 0.34 -0.81 0.00 0.00 175.30 176.19 1dhk s ASP 53 N 1.20 6.30 0.51 -2.12 2.15 0.12 -4.48 116.67 120.35 1dhk s ASP 53 Ca -0.07 -0.51 0.15 0.00 0.43 0.00 0.00 52.55 52.55 1dhk s ASP 53 Cb -0.13 -2.34 1.23 0.00 -0.30 0.00 0.00 42.92 41.38 1dhk s ASP 53 CO -0.03 -0.90 2.13 0.77 -0.17 0.00 0.00 175.17 176.97 1dhk h SER 54 N 9.00 0.06 0.15 -0.34 4.64 -1.94 0.45 113.55 125.57 1dhk h SER 54 Ca -0.26 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.03 1dhk h SER 54 Cb 1.09 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1dhk h SER 54 CO 0.96 0.04 -0.13 0.74 -0.87 0.00 0.00 176.83 177.56 1dhk h THR 55 N 0.07 1.03 0.00 2.95 2.02 -1.96 -3.27 112.91 113.74 1dhk h THR 55 Ca 0.03 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.75 1dhk h THR 55 Cb 0.04 1.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 1dhk h THR 55 CO -0.00 0.13 0.00 0.35 0.37 0.00 0.00 175.52 176.36 1dhk n THR 56 N -4.29 0.00 -0.88 3.16 -2.24 -0.85 -4.99 114.28 104.19 1dhk n THR 56 Ca -0.03 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1dhk n THR 56 Cb 0.20 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 1dhk n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dhk n GLY 57 N 0.57 0.75 3.73 3.38 0.00 0.15 -4.97 105.19 108.80 1dhk n GLY 57 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1dhk n GLY 57 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1dhk s ASN 58 N -2.74 6.92 -0.10 1.61 3.84 -1.20 -4.81 114.94 118.46 1dhk s ASN 58 Ca 0.00 2.33 -0.01 0.00 0.21 0.00 0.00 52.86 55.39 1dhk s ASN 58 Cb 0.00 -2.60 -0.03 0.00 -0.55 0.00 0.00 41.25 38.07 1dhk s ASN 58 CO 0.00 -0.54 -0.04 -0.69 -2.79 0.00 0.00 177.10 173.04 1dhk s VAL 59 N 0.41 3.91 0.46 -5.21 1.01 -1.26 -0.71 120.40 119.02 1dhk s VAL 59 Ca 0.58 -0.38 -0.16 0.00 0.00 0.00 0.00 61.98 62.02 1dhk s VAL 59 Cb -0.36 -2.65 -0.08 0.00 0.00 0.00 0.00 36.38 33.29 1dhk s VAL 59 CO 0.35 0.57 0.92 0.00 0.00 0.00 0.00 175.10 176.94 1dhk s ALA 60 N -0.45 3.13 0.01 5.51 0.00 0.12 -4.76 121.76 125.32 1dhk s ALA 60 Ca 0.07 0.15 -0.07 0.00 0.00 0.00 0.00 51.96 52.11 1dhk s ALA 60 Cb -0.12 -3.02 -0.05 0.00 0.00 0.00 0.00 23.12 19.93 1dhk s ALA 60 CO 0.02 -0.07 0.28 -1.12 0.00 0.00 0.00 175.76 174.88 1dhk s SER 61 N -2.82 6.51 0.05 0.00 0.01 -0.05 -4.47 113.70 112.93 1dhk s SER 61 Ca 0.58 0.59 0.00 0.00 1.31 0.00 0.00 55.95 58.43 1dhk s SER 61 Cb -0.10 -2.10 -0.03 0.00 0.21 0.00 0.00 66.02 64.00 1dhk s SER 61 CO 0.26 0.25 -0.05 0.72 0.41 0.00 0.00 173.24 174.84 1dhk s PHE 62 N -1.30 0.53 -0.01 2.43 -0.12 -0.75 -0.56 117.98 118.20 1dhk s PHE 62 Ca 0.28 -0.74 -0.01 0.00 -0.05 0.00 0.00 56.93 56.40 1dhk s PHE 62 Cb -0.13 -0.35 0.01 0.00 -0.63 0.00 0.00 43.02 41.91 1dhk s PHE 62 CO 0.16 -0.21 0.03 0.34 -0.05 0.00 0.00 175.22 175.48 1dhk s ASP 63 N -2.18 -0.02 -0.14 1.98 2.15 0.02 -0.82 116.67 117.66 1dhk s ASP 63 Ca -0.03 0.05 -0.12 0.00 0.43 0.00 0.00 52.55 52.88 1dhk s ASP 63 Cb -0.02 0.04 0.04 0.00 -0.30 0.00 0.00 42.92 42.68 1dhk s ASP 63 CO -0.04 -0.02 0.37 0.28 -0.17 0.00 0.00 175.17 175.59 1dhk s THR 64 N 0.14 -0.01 0.02 1.71 -1.32 -0.27 -1.09 115.64 114.82 1dhk s THR 64 Ca -0.01 0.02 0.07 0.00 -1.21 0.00 0.00 61.69 60.56 1dhk s THR 64 Cb -0.02 -0.53 -0.02 0.00 -1.51 0.00 0.00 72.50 70.43 1dhk s THR 64 CO -0.00 0.01 -0.20 0.20 -2.21 0.00 0.00 174.62 172.41 1dhk s ASN 65 N 0.43 2.38 -0.03 8.08 0.01 -0.34 -1.18 114.94 124.29 1dhk s ASN 65 Ca -0.02 -0.46 -0.24 0.00 -0.71 0.00 0.00 52.86 51.42 1dhk s ASN 65 Cb -0.04 -0.22 0.05 0.00 0.41 0.00 0.00 41.25 41.45 1dhk s ASN 65 CO -0.02 0.18 0.52 0.72 -1.51 0.00 0.00 177.10 177.00 1dhk s PHE 66 N -0.69 -0.46 -0.15 2.20 -0.12 -0.35 -0.59 117.98 117.83 1dhk s PHE 66 Ca 0.07 0.77 -0.01 0.00 -0.05 0.00 0.00 56.93 57.71 1dhk s PHE 66 Cb -0.08 0.28 -0.01 0.00 -0.63 0.00 0.00 43.02 42.57 1dhk s PHE 66 CO 0.01 -0.52 -0.11 0.99 -0.05 0.00 0.00 175.22 175.54 1dhk s THR 67 N -1.25 3.18 0.28 -4.49 2.01 -1.08 -0.11 115.64 114.18 1dhk s THR 67 Ca -0.12 -0.60 0.07 0.00 0.31 0.00 0.00 61.69 61.35 1dhk s THR 67 Cb -0.02 -2.36 -0.06 0.00 0.01 0.00 0.00 72.50 70.07 1dhk s THR 67 CO 0.08 0.51 -0.08 0.00 -0.69 0.00 0.00 174.62 174.44 1dhk s MET 68 N 0.54 1.55 -0.24 4.92 0.23 0.06 -1.16 119.30 125.21 1dhk s MET 68 Ca -0.07 -1.78 -0.04 0.00 -1.03 0.00 0.00 55.69 52.78 1dhk s MET 68 Cb -0.15 -1.22 0.10 0.00 -1.53 0.00 0.00 34.83 32.02 1dhk s MET 68 CO 0.03 0.07 0.17 1.21 -2.03 0.00 0.00 175.02 174.48 1dhk s ASN 69 N -3.45 2.40 -0.19 -1.18 3.84 0.06 -0.66 114.94 115.76 1dhk s ASN 69 Ca 0.29 -0.78 -0.12 0.00 0.21 0.00 0.00 52.86 52.46 1dhk s ASN 69 Cb 0.03 0.01 -0.05 0.00 -0.55 0.00 0.00 41.25 40.69 1dhk s ASN 69 CO 0.12 -0.38 0.20 -0.63 -2.79 0.00 0.00 177.10 173.61 1dhk s ILE 70 N 2.21 5.36 -0.31 -5.21 1.01 -1.26 -1.81 121.20 121.20 1dhk s ILE 70 Ca 0.07 0.33 0.02 0.00 0.00 0.00 0.00 60.65 61.06 1dhk s ILE 70 Cb -0.16 -3.54 0.07 0.00 0.01 0.00 0.00 42.46 38.85 1dhk s ILE 70 CO -0.24 0.40 -0.01 -0.13 0.00 0.00 0.00 174.94 174.96 1dhk s ARG 71 N 0.53 2.06 0.29 2.79 0.52 -0.77 0.10 118.95 124.47 1dhk s ARG 71 Ca 0.11 -1.52 0.00 0.00 -0.52 0.00 0.00 55.73 53.80 1dhk s ARG 71 Cb -0.12 -3.11 0.42 0.00 0.52 0.00 0.00 34.95 32.66 1dhk s ARG 71 CO 0.01 -0.73 1.80 1.79 0.02 0.00 0.00 175.30 178.19 1dhk h THR 72 N 6.62 1.23 -3.70 0.02 1.35 -1.89 -1.52 112.91 115.01 1dhk h THR 72 Ca -0.15 -0.92 -0.33 0.00 -0.55 0.00 0.00 66.41 64.47 1dhk h THR 72 Cb 1.04 0.88 0.05 0.00 -1.73 0.00 0.00 68.15 68.39 1dhk h THR 72 CO 0.52 0.32 -0.49 1.41 -0.25 0.00 0.00 175.52 177.03 1dhk n HIS 73 N -4.24 -1.60 0.00 4.73 8.25 -1.26 -3.55 115.22 117.55 1dhk n HIS 73 Ca 0.02 0.43 0.00 0.00 -0.26 0.00 0.00 57.72 57.92 1dhk n HIS 73 Cb 0.28 -3.83 0.00 0.00 1.12 0.00 0.00 29.99 27.56 1dhk n HIS 73 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1dhk n ARG 74 N -3.40 0.00 -0.12 -0.41 3.00 -1.26 -4.89 116.66 109.58 1dhk n ARG 74 Ca -0.09 0.00 0.01 0.00 -0.01 0.00 0.00 57.85 57.76 1dhk n ARG 74 Cb 0.60 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 33.05 1dhk n ARG 74 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1dhk n SER 78 N -0.18 -0.65 -0.11 0.55 7.64 -1.26 -5.18 113.62 114.42 1dhk n SER 78 Ca 0.00 0.14 -0.12 0.00 1.01 0.00 0.00 58.87 59.90 1dhk n SER 78 Cb 0.00 0.15 -0.03 0.00 -1.01 0.00 0.00 64.21 63.32 1dhk n SER 78 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dhk h ALA 79 N -0.04 0.47 -2.68 -0.43 0.00 -1.96 -3.43 119.26 111.19 1dhk h ALA 79 Ca -0.01 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.45 1dhk h ALA 79 Cb 0.09 -0.12 -0.29 0.00 0.00 0.00 0.00 17.79 17.48 1dhk h ALA 79 CO 0.00 0.35 -0.40 0.08 0.00 0.00 0.00 179.25 179.28 1dhk s VAL 80 N -4.70 -0.38 -5.00 0.00 1.01 -1.26 -4.39 120.40 105.68 1dhk s VAL 80 Ca -0.13 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1dhk s VAL 80 Cb 0.09 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.90 1dhk s VAL 80 CO 0.80 0.07 0.00 0.61 0.00 0.00 0.00 175.10 176.59 1dhk n GLY 81 N 4.99 -0.69 3.26 4.51 0.00 -0.88 -0.70 105.19 115.69 1dhk n GLY 81 Ca -0.13 -1.45 -0.32 0.00 0.00 0.00 0.00 46.02 44.12 1dhk n GLY 81 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1dhk s LEU 82 N 0.00 2.27 0.05 0.99 2.96 -1.03 -1.20 118.68 122.72 1dhk s LEU 82 Ca 0.00 -0.49 0.08 0.00 -0.22 0.00 0.00 54.13 53.50 1dhk s LEU 82 Cb 0.00 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.19 1dhk s LEU 82 CO 0.00 0.16 -0.23 -1.81 -1.32 0.00 0.00 176.35 173.15 1dhk s ASP 83 N 0.34 2.80 -0.18 3.68 1.01 0.11 -1.60 116.67 122.84 1dhk s ASP 83 Ca -0.17 -0.58 -0.08 0.00 0.71 0.00 0.00 52.55 52.44 1dhk s ASP 83 Cb -0.17 -0.23 -0.04 0.00 1.01 0.00 0.00 42.92 43.48 1dhk s ASP 83 CO 0.08 0.19 0.10 0.12 0.21 0.00 0.00 175.17 175.87 1dhk s PHE 84 N -0.84 3.36 0.09 4.23 5.36 -0.29 -0.85 117.98 129.02 1dhk s PHE 84 Ca 0.10 0.24 0.05 0.00 -0.96 0.00 0.00 56.93 56.35 1dhk s PHE 84 Cb -0.09 -2.08 -0.03 0.00 -0.34 0.00 0.00 43.02 40.47 1dhk s PHE 84 CO 0.02 0.30 -0.13 0.14 -1.46 0.00 0.00 175.22 174.10 1dhk s VAL 85 N 0.13 1.07 -0.30 3.12 -7.23 -0.14 -1.02 120.40 116.03 1dhk s VAL 85 Ca 0.07 -1.47 0.02 0.00 -1.81 0.00 0.00 61.98 58.80 1dhk s VAL 85 Cb -0.12 -1.21 0.08 0.00 0.56 0.00 0.00 36.38 35.70 1dhk s VAL 85 CO -0.00 -0.37 0.01 -0.76 -0.31 0.00 0.00 175.10 173.67 1dhk s LEU 86 N -2.07 3.65 -0.25 1.32 1.43 -0.49 -2.01 118.68 120.28 1dhk s LEU 86 Ca 0.02 -1.72 -0.08 0.00 -1.03 0.00 0.00 54.13 51.31 1dhk s LEU 86 Cb -0.07 -1.40 -0.03 0.00 0.03 0.00 0.00 46.19 44.72 1dhk s LEU 86 CO 0.02 -0.32 0.09 -0.69 0.23 0.00 0.00 176.35 175.68 1dhk s VAL 87 N 1.16 4.56 0.30 -1.59 1.01 -0.27 -2.40 120.40 123.17 1dhk s VAL 87 Ca 0.03 -0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.63 1dhk s VAL 87 Cb -0.19 -3.13 -0.12 0.00 0.00 0.00 0.00 36.38 32.94 1dhk s VAL 87 CO -0.10 0.34 1.41 -2.65 0.00 0.00 0.00 175.10 174.11 1dhk n PRO 88 N 4.76 2.27 0.00 2.72 -0.02 -1.26 0.08 135.00 143.55 1dhk n PRO 88 Ca -0.16 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1dhk n PRO 88 Cb 0.52 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1dhk n PRO 88 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1dhk n VAL 89 N 1.28 0.26 -1.08 -1.45 0.24 -0.67 -4.80 118.33 112.11 1dhk n VAL 89 Ca 0.08 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.35 1dhk n VAL 89 Cb 0.35 -0.54 -0.01 0.00 -1.47 0.00 0.00 33.84 32.16 1dhk n VAL 89 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1dhk n ASP 96 N 0.69 -3.55 -4.75 -1.34 -0.08 -1.26 -5.10 116.55 101.16 1dhk n ASP 96 Ca 0.00 0.07 -0.41 0.00 -1.51 0.00 0.00 54.79 52.94 1dhk n ASP 96 Cb 0.15 -1.28 -0.03 0.00 2.34 0.00 0.00 41.12 42.31 1dhk n ASP 96 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1dhk s THR 97 N -2.02 2.98 -0.21 5.18 2.01 -1.26 -4.68 115.64 117.63 1dhk s THR 97 Ca 0.00 0.88 -0.06 0.00 0.31 0.00 0.00 61.69 62.82 1dhk s THR 97 Cb 0.00 -3.56 -0.03 0.00 0.01 0.00 0.00 72.50 68.92 1dhk s THR 97 CO 0.00 0.17 0.03 -0.69 -0.69 0.00 0.00 174.62 173.44 1dhk s VAL 98 N -0.50 4.19 0.06 3.82 1.01 -1.01 -1.55 120.40 126.42 1dhk s VAL 98 Ca 0.53 -0.23 0.07 0.00 0.00 0.00 0.00 61.98 62.35 1dhk s VAL 98 Cb -0.38 -2.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 1dhk s VAL 98 CO 0.45 0.40 -0.19 -0.89 0.00 0.00 0.00 175.10 174.87 1dhk s THR 99 N 1.10 1.50 -0.28 3.92 2.01 0.68 -1.39 115.64 123.18 1dhk s THR 99 Ca 0.03 -1.27 -0.01 0.00 0.31 0.00 0.00 61.69 60.76 1dhk s THR 99 Cb -0.14 -1.34 0.05 0.00 0.01 0.00 0.00 72.50 71.07 1dhk s THR 99 CO 0.02 0.04 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.26 1dhk s VAL 100 N -0.97 2.79 -0.21 3.82 1.01 -0.19 -0.25 120.40 126.40 1dhk s VAL 100 Ca 0.05 -1.38 -0.10 0.00 0.00 0.00 0.00 61.98 60.54 1dhk s VAL 100 Cb -0.09 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 1dhk s VAL 100 CO 0.02 -0.04 0.14 -1.61 0.00 0.00 0.00 175.10 173.62 1dhk s GLU 101 N 1.23 4.15 -0.90 2.72 2.02 0.06 -1.14 118.70 126.83 1dhk s GLU 101 Ca -0.05 -0.23 -0.02 0.00 0.02 0.00 0.00 54.97 54.69 1dhk s GLU 101 Cb -0.19 -3.46 0.23 0.00 0.10 0.00 0.00 34.13 30.81 1dhk s GLU 101 CO -0.02 0.22 0.82 1.19 0.02 0.00 0.00 175.26 177.49 1dhk n PHE 102 N 3.77 4.15 -2.76 1.61 3.72 -0.63 -1.61 117.46 125.71 1dhk n PHE 102 Ca -0.16 -4.07 -0.43 0.00 -0.05 0.00 0.00 57.45 52.75 1dhk n PHE 102 Cb 0.52 -1.13 -0.03 0.00 -0.94 0.00 0.00 39.48 37.90 1dhk n PHE 102 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1dhk s ASP 103 N -0.30 6.66 0.29 4.37 -1.08 -0.64 -2.47 116.67 123.50 1dhk s ASP 103 Ca 0.29 0.51 0.23 0.00 -0.52 0.00 0.00 52.55 53.06 1dhk s ASP 103 Cb -0.06 -2.48 0.30 0.00 -1.46 0.00 0.00 42.92 39.22 1dhk s ASP 103 CO -0.11 -0.96 1.41 0.71 0.52 0.00 0.00 175.17 176.74 1dhk h THR 104 N 5.93 0.00 0.06 1.71 1.35 -1.20 -1.02 112.91 119.75 1dhk h THR 104 Ca -0.23 -0.86 -0.08 0.00 -0.55 0.00 0.00 66.41 64.69 1dhk h THR 104 Cb 1.07 1.64 0.01 0.00 -1.73 0.00 0.00 68.15 69.14 1dhk h THR 104 CO 1.02 0.00 -0.37 0.15 -0.25 0.00 0.00 175.52 176.07 1dhk h PHE 105 N 0.00 0.23 0.00 4.73 3.57 -1.90 -3.33 116.94 120.24 1dhk h PHE 105 Ca 0.00 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.33 1dhk h PHE 105 Cb 0.93 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.66 1dhk h PHE 105 CO 0.00 1.14 -0.20 1.28 -2.23 0.00 0.00 178.31 178.30 1dhk n LEU 106 N -4.40 0.23 -3.64 0.59 7.99 -1.25 -4.95 117.00 111.57 1dhk n LEU 106 Ca -0.12 0.31 -0.22 0.00 -0.01 0.00 0.00 56.01 55.98 1dhk n LEU 106 Cb 0.63 -0.39 0.05 0.00 -0.11 0.00 0.00 43.42 43.60 1dhk n LEU 106 CO 0.40 0.04 0.05 -1.20 -1.51 0.00 0.00 177.39 175.17 1dhk n SER 107 N -1.55 -2.61 -3.91 -1.43 7.64 -0.45 -4.97 113.62 106.34 1dhk n SER 107 Ca 0.06 -0.72 -0.10 0.00 1.01 0.00 0.00 58.87 59.12 1dhk n SER 107 Cb 0.34 -4.46 -0.09 0.00 -1.01 0.00 0.00 64.21 58.99 1dhk n SER 107 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dhk s ARG 108 N -5.94 0.57 -0.20 1.43 3.03 -0.80 -1.88 118.95 115.16 1dhk s ARG 108 Ca 0.17 -0.66 -0.02 0.00 2.03 0.00 0.00 55.73 57.25 1dhk s ARG 108 Cb -0.08 0.23 -0.00 0.00 -1.03 0.00 0.00 34.95 34.06 1dhk s ARG 108 CO 0.78 -0.14 -0.09 0.42 -1.13 0.00 0.00 175.30 175.14 1dhk s ILE 109 N -2.32 3.06 0.11 4.99 1.01 0.19 -1.61 121.20 126.62 1dhk s ILE 109 Ca -0.07 -0.61 0.08 0.00 0.00 0.00 0.00 60.65 60.05 1dhk s ILE 109 Cb -0.03 -2.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.05 1dhk s ILE 109 CO -0.03 0.47 -0.20 -0.44 0.00 0.00 0.00 174.94 174.74 1dhk s SER 110 N 1.23 2.47 -0.39 3.58 0.01 -0.63 -1.15 113.70 118.82 1dhk s SER 110 Ca 0.02 -0.71 -0.08 0.00 1.31 0.00 0.00 55.95 56.50 1dhk s SER 110 Cb -0.14 -0.13 0.07 0.00 0.21 0.00 0.00 66.02 66.02 1dhk s SER 110 CO -0.03 0.03 0.20 -0.63 0.41 0.00 0.00 173.24 173.21 1dhk s ILE 111 N -1.33 3.99 -0.06 1.44 1.01 0.69 -0.76 121.20 126.18 1dhk s ILE 111 Ca 0.07 -1.36 0.02 0.00 0.00 0.00 0.00 60.65 59.37 1dhk s ILE 111 Cb -0.09 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 38.94 1dhk s ILE 111 CO 0.04 -0.41 -0.08 -0.62 0.00 0.00 0.00 174.94 173.87 1dhk s ASP 112 N 1.84 4.51 -0.06 3.58 -1.08 0.66 0.06 116.67 126.18 1dhk s ASP 112 Ca 0.02 -0.07 -0.01 0.00 -0.52 0.00 0.00 52.55 51.96 1dhk s ASP 112 Cb -0.22 -1.09 0.03 0.00 -1.46 0.00 0.00 42.92 40.18 1dhk s ASP 112 CO 0.02 0.35 0.02 -0.69 0.52 0.00 0.00 175.17 175.39 1dhk s VAL 113 N -0.81 0.20 -1.43 1.11 1.01 -0.19 -0.23 120.40 120.06 1dhk s VAL 113 Ca 0.13 0.21 -0.10 0.00 0.00 0.00 0.00 61.98 62.22 1dhk s VAL 113 Cb -0.11 -0.38 0.04 0.00 0.00 0.00 0.00 36.38 35.94 1dhk s VAL 113 CO 0.02 0.22 1.05 0.59 0.00 0.00 0.00 175.10 176.98 1dhk n ASN 114 N 5.06 -5.03 0.00 3.32 4.13 -0.59 -1.04 115.26 121.10 1dhk n ASN 114 Ca -0.08 -0.68 0.00 0.00 1.68 0.00 0.00 54.58 55.50 1dhk n ASN 114 Cb 0.50 -4.43 0.00 0.00 -1.54 0.00 0.00 39.78 34.31 1dhk n ASN 114 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1dhk n ASN 115 N -2.94 0.00 -4.55 6.41 3.02 -1.26 -4.98 115.26 110.96 1dhk n ASN 115 Ca -0.01 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.15 1dhk n ASN 115 Cb 0.56 -1.01 -0.11 0.00 -0.61 0.00 0.00 39.78 38.61 1dhk n ASN 115 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1dhk s ASN 116 N -2.60 5.86 -0.57 6.41 0.01 -0.21 -5.03 114.94 118.82 1dhk s ASN 116 Ca 0.00 -0.16 -0.27 0.00 -0.71 0.00 0.00 52.86 51.72 1dhk s ASN 116 Cb 0.00 -2.09 -0.00 0.00 0.41 0.00 0.00 41.25 39.57 1dhk s ASN 116 CO 0.00 -0.10 1.61 -1.81 -1.51 0.00 0.00 177.10 175.30 1dhk s ASP 117 N 1.72 5.79 0.39 -1.22 1.01 -1.26 -1.02 116.67 122.08 1dhk s ASP 117 Ca 0.07 0.35 0.16 0.00 0.71 0.00 0.00 52.55 53.83 1dhk s ASP 117 Cb -0.16 -2.54 0.80 0.00 1.01 0.00 0.00 42.92 42.03 1dhk s ASP 117 CO 0.09 -1.97 1.83 0.40 0.21 0.00 0.00 175.17 175.73 1dhk h ILE 118 N 6.58 1.08 -1.55 0.77 2.04 -0.72 -3.45 117.51 122.25 1dhk h ILE 118 Ca -0.27 -1.27 0.07 0.00 1.00 0.00 0.00 64.86 64.39 1dhk h ILE 118 Cb 1.12 1.72 -0.26 0.00 -0.74 0.00 0.00 36.82 38.66 1dhk h ILE 118 CO 1.19 0.34 0.50 -0.75 0.00 0.00 0.00 178.15 179.43 1dhk s LYS 119 N -4.01 0.48 -0.05 2.37 2.47 -1.15 -5.00 119.74 114.85 1dhk s LYS 119 Ca -0.02 0.50 -0.19 0.00 -1.56 0.00 0.00 55.97 54.70 1dhk s LYS 119 Cb 0.13 0.23 0.04 0.00 -1.46 0.00 0.00 37.83 36.77 1dhk s LYS 119 CO 0.70 -0.07 0.43 -1.54 0.16 0.00 0.00 175.35 175.02 1dhk s SER 120 N 0.06 -0.36 0.09 1.43 1.04 -1.26 -0.22 113.70 114.47 1dhk s SER 120 Ca 0.03 0.39 0.05 0.00 0.48 0.00 0.00 55.95 56.90 1dhk s SER 120 Cb -0.04 0.48 -0.03 0.00 0.10 0.00 0.00 66.02 66.52 1dhk s SER 120 CO -0.06 -0.44 -0.14 0.68 0.98 0.00 0.00 173.24 174.27 1dhk s VAL 121 N -1.01 1.16 0.59 5.02 -7.23 -0.30 -4.96 120.40 113.67 1dhk s VAL 121 Ca -0.11 -1.47 -0.11 0.00 -1.81 0.00 0.00 61.98 58.49 1dhk s VAL 121 Cb -0.04 -1.24 -0.04 0.00 0.56 0.00 0.00 36.38 35.62 1dhk s VAL 121 CO 0.05 -0.32 1.00 -2.16 -0.31 0.00 0.00 175.10 173.36 1dhk s PRO 122 N -2.13 3.64 -0.02 4.82 0.04 -1.26 -0.64 135.00 139.44 1dhk s PRO 122 Ca 0.02 0.72 -0.10 0.00 0.04 0.00 0.00 61.00 61.68 1dhk s PRO 122 Cb -0.08 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 32.36 1dhk s PRO 122 CO 0.02 -0.50 0.21 1.67 0.04 0.00 0.00 177.00 178.45 1dhk s TRP 123 N -3.07 -0.09 -0.60 0.56 1.48 -0.79 -4.79 118.94 111.64 1dhk s TRP 123 Ca 0.55 0.14 -0.18 0.00 -1.06 0.00 0.00 56.10 55.55 1dhk s TRP 123 Cb -0.11 0.03 0.11 0.00 -1.16 0.00 0.00 33.47 32.34 1dhk s TRP 123 CO 0.50 -0.29 0.70 0.34 -4.06 0.00 0.00 176.95 174.14 1dhk s ASP 124 N -1.08 6.21 0.58 -2.66 -1.08 -1.26 -4.59 116.67 112.80 1dhk s ASP 124 Ca -0.12 -1.52 0.28 0.00 -0.52 0.00 0.00 52.55 50.68 1dhk s ASP 124 Cb -0.06 -2.29 1.56 0.00 -1.46 0.00 0.00 42.92 40.67 1dhk s ASP 124 CO 0.02 -1.08 2.01 0.58 0.52 0.00 0.00 175.17 177.23 1dhk h VAL 125 N 5.89 0.46 0.00 1.11 2.07 -1.94 -0.56 116.25 123.28 1dhk h VAL 125 Ca -0.27 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1dhk h VAL 125 Cb 1.09 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1dhk h VAL 125 CO 1.09 0.00 -0.05 -0.74 0.02 0.00 0.00 177.57 177.89 1dhk h HIS 126 N 0.00 0.00 0.00 1.57 6.17 -1.96 0.14 115.15 121.07 1dhk h HIS 126 Ca 0.15 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.23 1dhk h HIS 126 Cb 0.80 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.73 1dhk h HIS 126 CO 0.00 0.05 0.00 -0.25 0.71 0.00 0.00 177.93 178.44 1dhk n ASP 127 N -3.89 0.37 0.00 3.26 8.00 -0.22 -3.92 116.55 120.16 1dhk n ASP 127 Ca -0.03 0.55 0.00 0.00 0.71 0.00 0.00 54.79 56.02 1dhk n ASP 127 Cb 0.14 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.60 1dhk n ASP 127 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1dhk n TYR 128 N -1.86 0.00 -1.68 1.24 4.01 -0.57 -4.92 117.16 113.38 1dhk n TYR 128 Ca 0.06 0.00 -0.48 0.00 -0.16 0.00 0.00 57.90 57.32 1dhk n TYR 128 Cb 0.34 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.33 1dhk n TYR 128 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1dhk n ASP 129 N -0.49 3.41 -0.19 7.72 2.03 0.37 -1.59 116.55 127.82 1dhk n ASP 129 Ca 0.00 0.99 -0.03 0.00 0.52 0.00 0.00 54.79 56.28 1dhk n ASP 129 Cb 0.02 -1.39 -0.01 0.00 -0.72 0.00 0.00 41.12 39.02 1dhk n ASP 129 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1dhk n GLY 130 N 4.20 0.51 3.28 0.27 0.00 0.12 -5.00 105.19 108.56 1dhk n GLY 130 Ca 0.21 -0.18 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 1dhk n GLY 130 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dhk s GLN 131 N -1.38 1.11 -0.01 1.61 -0.21 -0.62 -4.96 119.66 115.20 1dhk s GLN 131 Ca 0.00 -1.26 -0.30 0.00 0.02 0.00 0.00 55.36 53.82 1dhk s GLN 131 Cb 0.00 -1.13 -0.05 0.00 1.00 0.00 0.00 33.01 32.83 1dhk s GLN 131 CO 0.00 0.23 1.31 -0.80 -2.12 0.00 0.00 175.29 173.91 1dhk s ASN 132 N -2.37 6.94 -0.09 5.90 0.01 -1.26 -4.46 114.94 119.62 1dhk s ASN 132 Ca 0.10 2.01 0.03 0.00 -0.71 0.00 0.00 52.86 54.29 1dhk s ASN 132 Cb -0.07 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.02 1dhk s ASN 132 CO 0.04 -0.64 -0.20 0.00 -1.51 0.00 0.00 177.10 174.79 1dhk s ALA 133 N 2.11 2.36 -0.20 0.60 0.00 0.16 -4.32 121.76 122.48 1dhk s ALA 133 Ca 0.61 -0.97 -0.11 0.00 0.00 0.00 0.00 51.96 51.48 1dhk s ALA 133 Cb -0.29 -0.90 -0.05 0.00 0.00 0.00 0.00 23.12 21.88 1dhk s ALA 133 CO 0.25 0.35 0.18 -1.21 0.00 0.00 0.00 175.76 175.34 1dhk s GLU 134 N 0.04 4.18 -0.05 0.00 2.02 -0.33 -0.76 118.70 123.80 1dhk s GLU 134 Ca -0.08 -0.14 0.07 0.00 0.02 0.00 0.00 54.97 54.84 1dhk s GLU 134 Cb -0.15 -3.45 -0.01 0.00 0.10 0.00 0.00 34.13 30.61 1dhk s GLU 134 CO 0.05 0.22 -0.25 0.08 0.02 0.00 0.00 175.26 175.38 1dhk s VAL 135 N 0.58 2.06 -0.07 2.63 1.01 0.84 -1.66 120.40 125.79 1dhk s VAL 135 Ca 0.10 -1.08 0.02 0.00 0.00 0.00 0.00 61.98 61.02 1dhk s VAL 135 Cb -0.12 -1.73 0.02 0.00 0.00 0.00 0.00 36.38 34.54 1dhk s VAL 135 CO 0.01 0.57 -0.09 -0.60 0.00 0.00 0.00 175.10 174.99 1dhk s ARG 136 N -0.26 1.45 -0.10 2.72 3.52 -0.22 -1.21 118.95 124.84 1dhk s ARG 136 Ca -0.01 -0.31 0.02 0.00 -0.13 0.00 0.00 55.73 55.31 1dhk s ARG 136 Cb -0.13 -1.29 0.01 0.00 -1.56 0.00 0.00 34.95 31.98 1dhk s ARG 136 CO 0.03 -0.05 -0.17 0.42 -0.81 0.00 0.00 175.30 174.72 1dhk s ILE 137 N 0.90 1.59 0.02 4.11 1.01 -0.33 -0.70 121.20 127.80 1dhk s ILE 137 Ca -0.11 -0.72 0.02 0.00 0.00 0.00 0.00 60.65 59.85 1dhk s ILE 137 Cb -0.15 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 40.88 1dhk s ILE 137 CO 0.01 0.46 -0.08 -0.89 0.00 0.00 0.00 174.94 174.44 1dhk s THR 138 N 0.74 0.59 -0.07 2.92 2.01 -0.59 -1.12 115.64 120.12 1dhk s THR 138 Ca -0.12 -0.71 -0.01 0.00 0.31 0.00 0.00 61.69 61.16 1dhk s THR 138 Cb -0.16 -0.57 0.03 0.00 0.01 0.00 0.00 72.50 71.81 1dhk s THR 138 CO 0.02 -0.11 -0.01 -0.47 -0.69 0.00 0.00 174.62 173.37 1dhk s TYR 139 N -0.77 0.70 -0.39 4.92 5.04 0.00 -0.91 117.35 125.95 1dhk s TYR 139 Ca -0.03 -0.19 -0.12 0.00 -2.44 0.00 0.00 57.07 54.29 1dhk s TYR 139 Cb -0.06 -0.80 0.03 0.00 0.35 0.00 0.00 41.96 41.48 1dhk s TYR 139 CO 0.00 -0.32 0.24 1.21 -1.34 0.00 0.00 175.55 175.34 1dhk s ASN 140 N 1.83 5.84 0.56 4.32 3.84 -0.76 -1.81 114.94 128.75 1dhk s ASN 140 Ca 0.03 -1.01 0.37 0.00 0.21 0.00 0.00 52.86 52.45 1dhk s ASN 140 Cb -0.12 -2.06 1.78 0.00 -0.55 0.00 0.00 41.25 40.29 1dhk s ASN 140 CO -0.05 -0.42 2.10 0.77 -2.79 0.00 0.00 177.10 176.72 1dhk h SER 141 N 8.49 0.00 0.33 -4.21 4.64 -1.86 0.42 113.55 121.37 1dhk h SER 141 Ca -0.26 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.05 1dhk h SER 141 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1dhk h SER 141 CO 0.69 0.00 -0.16 0.28 -0.87 0.00 0.00 176.83 176.77 1dhk h SER 142 N 0.00 -0.38 0.98 4.97 0.02 -1.93 -3.31 113.55 113.91 1dhk h SER 142 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1dhk h SER 142 Cb 0.24 0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1dhk h SER 142 CO 0.00 0.00 -0.01 0.35 -1.14 0.00 0.00 176.83 176.03 1dhk n THR 143 N -4.71 0.00 -1.85 -2.27 -2.24 -1.20 -4.91 114.28 97.10 1dhk n THR 143 Ca -0.06 -0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.52 1dhk n THR 143 Cb 0.18 -0.48 -0.06 0.00 -2.10 0.00 0.00 70.33 67.86 1dhk n THR 143 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1dhk n LYS 144 N -1.50 -1.49 -3.17 -0.78 5.02 0.15 -4.96 118.16 111.43 1dhk n LYS 144 Ca 0.07 1.15 -0.39 0.00 -2.02 0.00 0.00 58.31 57.12 1dhk n LYS 144 Cb 0.34 -5.60 -0.06 0.00 -0.02 0.00 0.00 35.03 29.69 1dhk n LYS 144 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1dhk s VAL 145 N -2.85 5.08 -0.23 -0.18 1.01 -1.12 -1.93 120.40 120.19 1dhk s VAL 145 Ca 0.00 1.14 -0.06 0.00 0.00 0.00 0.00 61.98 63.07 1dhk s VAL 145 Cb 0.00 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 1dhk s VAL 145 CO 0.00 0.20 0.01 0.12 0.00 0.00 0.00 175.10 175.44 1dhk s PHE 146 N 1.31 3.02 0.11 5.22 2.19 0.80 -1.83 117.98 128.80 1dhk s PHE 146 Ca 0.29 -0.65 0.08 0.00 0.33 0.00 0.00 56.93 56.98 1dhk s PHE 146 Cb -0.16 -2.16 -0.04 0.00 -1.31 0.00 0.00 43.02 39.35 1dhk s PHE 146 CO 0.12 -0.43 -0.20 -1.54 1.83 0.00 0.00 175.22 175.00 1dhk s SER 147 N 1.48 2.52 -0.06 6.13 1.04 -0.09 -1.23 113.70 123.50 1dhk s SER 147 Ca 0.06 -0.71 0.02 0.00 0.48 0.00 0.00 55.95 55.80 1dhk s SER 147 Cb -0.15 -0.14 0.02 0.00 0.10 0.00 0.00 66.02 65.85 1dhk s SER 147 CO 0.00 0.04 -0.10 -0.69 0.98 0.00 0.00 173.24 173.48 1dhk s VAL 148 N -1.28 0.96 -0.08 5.02 1.01 0.56 -1.54 120.40 125.04 1dhk s VAL 148 Ca 0.07 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.71 1dhk s VAL 148 Cb -0.09 -0.90 0.01 0.00 0.00 0.00 0.00 36.38 35.39 1dhk s VAL 148 CO 0.04 0.32 -0.17 -0.44 0.00 0.00 0.00 175.10 174.86 1dhk s SER 149 N 0.78 2.32 -0.04 3.32 0.01 0.12 -1.54 113.70 118.67 1dhk s SER 149 Ca -0.13 -0.41 0.04 0.00 1.31 0.00 0.00 55.95 56.77 1dhk s SER 149 Cb -0.15 -1.06 -0.00 0.00 0.21 0.00 0.00 66.02 65.01 1dhk s SER 149 CO 0.02 0.07 -0.16 -0.22 0.41 0.00 0.00 173.24 173.37 1dhk s LEU 150 N 0.60 1.90 -0.09 2.44 0.20 0.54 -1.06 118.68 123.22 1dhk s LEU 150 Ca -0.15 -0.33 -0.17 0.00 0.69 0.00 0.00 54.13 54.17 1dhk s LEU 150 Cb -0.16 -0.91 0.04 0.00 -0.43 0.00 0.00 46.19 44.72 1dhk s LEU 150 CO 0.05 0.14 0.42 -0.94 -0.29 0.00 0.00 176.35 175.73 1dhk s SER 151 N 0.03 -0.37 -0.52 3.68 1.04 -0.66 -0.68 113.70 116.22 1dhk s SER 151 Ca -0.03 0.53 -0.15 0.00 0.48 0.00 0.00 55.95 56.78 1dhk s SER 151 Cb -0.11 0.61 0.12 0.00 0.10 0.00 0.00 66.02 66.74 1dhk s SER 151 CO 0.02 -0.34 0.46 0.21 0.98 0.00 0.00 173.24 174.57 1dhk s ASN 152 N -0.60 6.09 0.59 7.02 3.84 0.03 -1.18 114.94 130.72 1dhk s ASN 152 Ca -0.07 -1.76 0.29 0.00 0.21 0.00 0.00 52.86 51.52 1dhk s ASN 152 Cb -0.04 -2.17 1.59 0.00 -0.55 0.00 0.00 41.25 40.09 1dhk s ASN 152 CO 0.03 -0.80 2.03 1.55 -2.79 0.00 0.00 177.10 177.12 1dhk h PRO 153 N 8.79 0.00 0.12 0.43 0.13 -1.85 0.33 132.00 139.94 1dhk h PRO 153 Ca -0.28 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.64 1dhk h PRO 153 Cb 1.10 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.25 1dhk h PRO 153 CO 0.99 0.00 -0.91 1.03 -0.23 0.00 0.00 178.00 178.88 1dhk h SER 154 N 0.00 0.59 0.15 1.44 0.87 -1.92 -3.37 113.55 111.31 1dhk h SER 154 Ca 0.13 -0.88 0.00 0.00 -1.23 0.00 0.00 61.79 59.81 1dhk h SER 154 Cb 0.72 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.49 1dhk h SER 154 CO -0.00 1.42 -1.52 0.41 -0.53 0.00 0.00 176.83 176.61 1dhk n THR 155 N -4.05 0.08 -0.73 2.23 -1.04 -1.02 -4.99 114.28 104.76 1dhk n THR 155 Ca -0.13 -0.34 0.00 0.00 -2.04 0.00 0.00 64.05 61.53 1dhk n THR 155 Cb 0.84 0.24 0.00 0.00 -1.82 0.00 0.00 70.33 69.60 1dhk n THR 155 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1dhk n GLY 156 N 1.33 0.79 3.79 3.41 0.00 0.11 -5.04 105.19 109.58 1dhk n GLY 156 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1dhk n GLY 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dhk s LYS 157 N -0.27 3.64 0.06 1.61 -0.14 -1.22 -4.83 119.74 118.58 1dhk s LYS 157 Ca 0.00 1.46 -0.10 0.00 -1.36 0.00 0.00 55.97 55.97 1dhk s LYS 157 Cb 0.00 -2.07 0.01 0.00 -1.68 0.00 0.00 37.83 34.08 1dhk s LYS 157 CO 0.00 -0.58 0.22 -1.12 -0.76 0.00 0.00 175.35 173.11 1dhk s SER 158 N -1.89 0.02 -0.07 2.83 0.01 -1.26 -0.79 113.70 112.55 1dhk s SER 158 Ca 0.69 -0.42 -0.04 0.00 1.31 0.00 0.00 55.95 57.49 1dhk s SER 158 Cb -0.19 0.32 0.03 0.00 0.21 0.00 0.00 66.02 66.39 1dhk s SER 158 CO 0.23 -0.63 0.17 0.20 0.41 0.00 0.00 173.24 173.61 1dhk s ASN 159 N -2.34 -0.15 0.04 2.44 -0.87 0.14 -4.98 114.94 109.21 1dhk s ASN 159 Ca -0.02 0.35 0.02 0.00 -1.57 0.00 0.00 52.86 51.63 1dhk s ASN 159 Cb 0.01 0.26 -0.02 0.00 -0.02 0.00 0.00 41.25 41.48 1dhk s ASN 159 CO -0.06 -0.13 -0.07 0.20 -2.57 0.00 0.00 177.10 174.48 1dhk s ASN 160 N 0.88 0.71 -0.24 -1.22 0.01 -1.26 -0.34 114.94 113.48 1dhk s ASN 160 Ca -0.07 -0.54 -0.13 0.00 -0.71 0.00 0.00 52.86 51.41 1dhk s ASN 160 Cb -0.08 0.05 0.08 0.00 0.41 0.00 0.00 41.25 41.70 1dhk s ASN 160 CO -0.05 -0.23 0.58 0.54 -1.51 0.00 0.00 177.10 176.43 1dhk s VAL 161 N -1.43 -0.08 0.07 1.60 0.11 -0.59 -4.96 120.40 115.12 1dhk s VAL 161 Ca -0.11 0.04 0.01 0.00 -2.93 0.00 0.00 61.98 58.99 1dhk s VAL 161 Cb -0.10 -0.85 -0.03 0.00 -1.53 0.00 0.00 36.38 33.87 1dhk s VAL 161 CO -0.00 0.02 -0.06 -0.94 -3.33 0.00 0.00 175.10 170.79 1dhk s SER 162 N 1.65 0.86 0.28 3.54 1.04 -1.26 -0.33 113.70 119.48 1dhk s SER 162 Ca -0.09 -0.82 -0.19 0.00 0.48 0.00 0.00 55.95 55.33 1dhk s SER 162 Cb -0.07 0.09 0.07 0.00 0.10 0.00 0.00 66.02 66.21 1dhk s SER 162 CO -0.17 -0.39 0.92 0.28 0.98 0.00 0.00 173.24 174.86 1dhk s THR 163 N -2.77 0.00 -0.19 2.02 -1.32 -0.36 -5.00 115.64 108.02 1dhk s THR 163 Ca 0.02 -0.78 -0.04 0.00 -1.21 0.00 0.00 61.69 59.67 1dhk s THR 163 Cb -0.00 -2.90 -0.02 0.00 -1.51 0.00 0.00 72.50 68.06 1dhk s THR 163 CO -0.04 0.00 -0.02 0.42 -2.21 0.00 0.00 174.62 172.77 1dhk s THR 164 N -2.21 3.83 0.05 5.08 -4.23 -1.26 -0.14 115.64 116.77 1dhk s THR 164 Ca 0.19 -0.36 0.09 0.00 -1.18 0.00 0.00 61.69 60.43 1dhk s THR 164 Cb -0.04 -2.72 -0.03 0.00 1.34 0.00 0.00 72.50 71.06 1dhk s THR 164 CO 0.08 0.45 -0.25 0.68 -0.54 0.00 0.00 174.62 175.04 1dhk s VAL 165 N 0.85 2.00 -0.39 2.29 -7.23 -0.81 -4.95 120.40 112.16 1dhk s VAL 165 Ca -0.00 -1.37 -0.10 0.00 -1.81 0.00 0.00 61.98 58.69 1dhk s VAL 165 Cb -0.14 -1.72 0.05 0.00 0.56 0.00 0.00 36.38 35.12 1dhk s VAL 165 CO 0.02 0.28 0.22 -0.70 -0.31 0.00 0.00 175.10 174.61 1dhk s GLU 166 N -1.32 2.74 -0.03 4.82 -6.30 -1.26 -4.79 118.70 112.56 1dhk s GLU 166 Ca 0.11 -1.21 0.17 0.00 -2.50 0.00 0.00 54.97 51.54 1dhk s GLU 166 Cb -0.10 -3.74 0.55 0.00 0.00 0.00 0.00 34.13 30.84 1dhk s GLU 166 CO 0.02 -0.78 1.46 1.28 0.02 0.00 0.00 175.26 177.26 1dhk n LEU 167 N 4.97 3.79 -3.28 2.70 4.77 -1.26 -4.76 117.00 123.93 1dhk n LEU 167 Ca -0.11 -2.16 -0.38 0.00 -0.03 0.00 0.00 56.01 53.33 1dhk n LEU 167 Cb 0.45 -0.43 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1dhk n LEU 167 CO 0.37 0.85 3.37 1.21 -1.33 0.00 0.00 177.39 181.86 1dhk n GLU 168 N 1.04 3.68 -4.02 3.23 2.13 -1.26 -4.71 120.64 120.73 1dhk n GLU 168 Ca 0.20 -2.18 -0.12 0.00 0.66 0.00 0.00 57.16 55.73 1dhk n GLU 168 Cb 0.63 -2.78 -0.12 0.00 0.27 0.00 0.00 31.44 29.44 1dhk n GLU 168 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1dhk s LYS 169 N 2.11 0.36 0.32 5.31 1.02 -1.26 -5.05 119.74 122.55 1dhk s LYS 169 Ca 0.70 -0.54 0.07 0.00 0.02 0.00 0.00 55.97 56.22 1dhk s LYS 169 Cb 0.18 -0.11 0.78 0.00 -0.52 0.00 0.00 37.83 38.15 1dhk s LYS 169 CO -0.06 0.01 1.79 0.93 -0.92 0.00 0.00 175.35 177.10 1dhk h GLU 170 N 4.95 0.71 -0.30 1.68 4.39 -2.00 -0.95 114.58 123.06 1dhk h GLU 170 Ca -0.32 -0.04 0.09 0.00 0.34 0.00 0.00 59.36 59.43 1dhk h GLU 170 Cb 1.20 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.68 1dhk h GLU 170 CO 0.43 0.47 0.24 0.28 -1.16 0.00 0.00 179.01 179.27 1dhk h VAL 171 N 0.73 0.72 -0.37 3.13 2.07 -1.97 -0.93 116.25 119.64 1dhk h VAL 171 Ca 0.57 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.09 1dhk h VAL 171 Cb 0.93 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1dhk h VAL 171 CO -0.36 0.00 0.00 -1.22 0.02 0.00 0.00 177.57 176.01 1dhk n TYR 172 N -4.25 0.54 0.20 1.57 4.01 -0.36 -4.40 117.16 114.47 1dhk n TYR 172 Ca 0.04 -0.26 -0.15 0.00 -0.16 0.00 0.00 57.90 57.37 1dhk n TYR 172 Cb 0.40 -0.02 -0.08 0.00 -0.31 0.00 0.00 39.34 39.33 1dhk n TYR 172 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1dhk h ASP 173 N 2.16 -1.12 -3.91 7.72 3.32 -1.27 -3.15 116.42 120.18 1dhk h ASP 173 Ca 0.00 0.11 -0.53 0.00 0.02 0.00 0.00 57.03 56.63 1dhk h ASP 173 Cb 0.56 0.39 -0.31 0.00 0.22 0.00 0.00 39.33 40.19 1dhk h ASP 173 CO 0.02 -0.52 -0.83 0.26 -1.72 0.00 0.00 179.24 176.46 1dhk s TRP 174 N -5.95 1.52 0.06 4.55 0.52 -1.26 -0.39 118.94 117.99 1dhk s TRP 174 Ca -0.17 -0.42 -0.02 0.00 0.02 0.00 0.00 56.10 55.51 1dhk s TRP 174 Cb 0.06 -1.03 -0.03 0.00 -1.15 0.00 0.00 33.47 31.31 1dhk s TRP 174 CO 0.63 -0.14 0.00 0.14 0.02 0.00 0.00 176.95 177.60 1dhk s VAL 175 N 0.05 0.21 -0.17 4.03 -7.23 -0.19 -1.67 120.40 115.43 1dhk s VAL 175 Ca -0.03 -1.71 -0.08 0.00 -1.81 0.00 0.00 61.98 58.34 1dhk s VAL 175 Cb -0.11 -1.50 -0.04 0.00 0.56 0.00 0.00 36.38 35.29 1dhk s VAL 175 CO 0.02 -0.94 0.11 -0.44 -0.31 0.00 0.00 175.10 173.53 1dhk s SER 176 N -2.91 6.03 -0.10 4.85 0.01 0.11 -0.32 113.70 121.37 1dhk s SER 176 Ca 0.07 0.23 -0.03 0.00 1.31 0.00 0.00 55.95 57.54 1dhk s SER 176 Cb 0.08 -2.02 -0.03 0.00 0.21 0.00 0.00 66.02 64.26 1dhk s SER 176 CO -0.10 0.24 0.01 0.68 0.41 0.00 0.00 173.24 174.48 1dhk s VAL 177 N -0.00 4.40 -1.02 3.43 -7.23 -1.26 -1.11 120.40 117.61 1dhk s VAL 177 Ca 0.08 -0.21 0.00 0.00 -1.81 0.00 0.00 61.98 60.05 1dhk s VAL 177 Cb -0.12 -2.87 0.00 0.00 0.56 0.00 0.00 36.38 33.96 1dhk s VAL 177 CO 0.00 0.59 0.00 0.61 -0.31 0.00 0.00 175.10 175.99 1dhk n GLY 178 N 2.29 -0.63 3.36 2.32 0.00 -0.85 -1.66 105.19 110.02 1dhk n GLY 178 Ca -0.19 -0.56 -0.28 0.00 0.00 0.00 0.00 46.02 44.99 1dhk n GLY 178 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1dhk s PHE 179 N -3.39 2.21 -0.05 1.61 0.08 0.13 -0.97 117.98 117.60 1dhk s PHE 179 Ca 0.00 -0.39 -0.01 0.00 0.12 0.00 0.00 56.93 56.65 1dhk s PHE 179 Cb 0.00 -1.22 0.03 0.00 -0.57 0.00 0.00 43.02 41.26 1dhk s PHE 179 CO 0.00 0.29 0.01 0.45 -0.10 0.00 0.00 175.22 175.86 1dhk s SER 180 N -1.92 1.07 -0.04 1.36 0.15 -0.03 -1.34 113.70 112.95 1dhk s SER 180 Ca 0.12 -0.04 0.06 0.00 0.70 0.00 0.00 55.95 56.79 1dhk s SER 180 Cb -0.10 -0.32 -0.01 0.00 -1.71 0.00 0.00 66.02 63.88 1dhk s SER 180 CO 0.05 -0.16 -0.23 0.00 1.20 0.00 0.00 173.24 174.10 1dhk s ALA 181 N 1.58 1.96 -0.05 5.45 0.00 -0.01 0.08 121.76 130.77 1dhk s ALA 181 Ca -0.02 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.04 1dhk s ALA 181 Cb -0.13 -0.57 -0.01 0.00 0.00 0.00 0.00 23.12 22.41 1dhk s ALA 181 CO -0.03 0.42 -0.25 0.99 0.00 0.00 0.00 175.76 176.88 1dhk s THR 182 N -0.29 2.07 -0.04 0.00 2.01 -0.34 -1.12 115.64 117.92 1dhk s THR 182 Ca 0.02 -1.07 0.03 0.00 0.31 0.00 0.00 61.69 60.97 1dhk s THR 182 Cb -0.11 -1.73 -0.03 0.00 0.01 0.00 0.00 72.50 70.63 1dhk s THR 182 CO 0.01 0.57 -0.11 -0.55 -0.69 0.00 0.00 174.62 173.86 1dhk s SER 183 N -0.29 4.29 0.31 3.53 0.15 -0.78 -2.07 113.70 118.85 1dhk s SER 183 Ca 0.00 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.51 1dhk s SER 183 Cb -0.13 -0.97 0.00 0.00 -1.71 0.00 0.00 66.02 63.22 1dhk s SER 183 CO 0.02 0.34 0.00 0.61 1.20 0.00 0.00 173.24 175.41 1dhk n GLY 184 N 2.14 0.29 3.73 9.45 0.00 -0.70 -1.86 105.19 118.24 1dhk n GLY 184 Ca -0.17 -1.84 -0.24 0.00 0.00 0.00 0.00 46.02 43.77 1dhk n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dhk s ALA 185 N -3.13 3.53 0.00 4.61 0.00 -1.26 -0.31 121.76 125.20 1dhk s ALA 185 Ca 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 51.96 50.03 1dhk s ALA 185 Cb 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 23.12 22.51 1dhk s ALA 185 CO 0.00 -0.04 0.00 0.66 0.00 0.00 0.00 175.76 176.38 1dhk n TYR 186 N -1.18 0.00 0.37 0.00 4.01 -1.26 -0.95 117.16 118.14 1dhk n TYR 186 Ca -0.02 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.83 1dhk n TYR 186 Cb 0.62 0.00 0.47 0.00 -0.31 0.00 0.00 39.34 40.12 1dhk n TYR 186 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1dhk n GLN 187 N 14.00 0.16 -0.72 -0.72 0.00 -1.26 -1.83 117.38 127.01 1dhk n GLN 187 Ca 0.00 0.43 0.08 0.00 0.00 0.00 0.00 57.00 57.51 1dhk n GLN 187 Cb 0.00 -1.83 0.37 0.00 0.00 0.00 0.00 30.24 28.79 1dhk n GLN 187 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 1dhk n TRP 188 N -2.13 1.71 0.94 2.61 7.02 -0.13 -4.47 117.44 123.00 1dhk n TRP 188 Ca 0.02 -0.64 0.14 0.00 -1.02 0.00 0.00 57.50 56.00 1dhk n TRP 188 Cb 0.19 -0.35 0.59 0.00 -2.42 0.00 0.00 31.31 29.32 1dhk n TRP 188 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 1dhk n SER 189 N 0.92 0.13 -1.03 -0.99 7.64 -0.76 -1.72 113.62 117.80 1dhk n SER 189 Ca 0.26 0.51 0.09 0.00 1.01 0.00 0.00 58.87 60.74 1dhk n SER 189 Cb 1.00 -0.54 0.25 0.00 -1.01 0.00 0.00 64.21 63.91 1dhk n SER 189 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1dhk n TYR 190 N -1.62 0.76 -2.41 1.43 4.01 -1.26 -4.58 117.16 113.50 1dhk n TYR 190 Ca 0.07 -0.51 -0.41 0.00 -0.16 0.00 0.00 57.90 56.89 1dhk n TYR 190 Cb 0.35 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.32 1dhk n TYR 190 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 1dhk s GLU 191 N -1.05 4.50 0.17 -0.72 2.12 -1.23 -4.59 118.70 117.89 1dhk s GLU 191 Ca 0.37 1.82 0.09 0.00 0.36 0.00 0.00 54.97 57.62 1dhk s GLU 191 Cb 0.20 -3.27 -0.04 0.00 0.26 0.00 0.00 34.13 31.28 1dhk s GLU 191 CO 0.25 -0.09 -0.13 0.95 -0.54 0.00 0.00 175.26 175.69 1dhk s THR 192 N 0.16 3.01 -0.04 -1.70 -4.23 -0.57 -4.73 115.64 107.53 1dhk s THR 192 Ca 0.53 -1.67 0.02 0.00 -1.18 0.00 0.00 61.69 59.39 1dhk s THR 192 Cb -0.31 -2.46 0.01 0.00 1.34 0.00 0.00 72.50 71.08 1dhk s THR 192 CO 0.35 -0.07 -0.08 -1.00 -0.54 0.00 0.00 174.62 173.28 1dhk s HIS 193 N -1.58 0.97 -0.00 3.99 0.09 -0.66 -1.84 115.29 116.25 1dhk s HIS 193 Ca 0.23 -0.29 0.06 0.00 -0.00 0.00 0.00 55.06 55.05 1dhk s HIS 193 Cb -0.09 -0.76 -0.02 0.00 -0.00 0.00 0.00 32.58 31.71 1dhk s HIS 193 CO 0.13 -0.18 -0.18 -0.51 -0.00 0.00 0.00 174.74 174.00 1dhk s ASP 194 N 0.63 2.15 -0.14 1.40 1.11 -0.75 -0.91 116.67 120.16 1dhk s ASP 194 Ca -0.10 -0.36 0.01 0.00 0.18 0.00 0.00 52.55 52.28 1dhk s ASP 194 Cb -0.13 -0.23 0.02 0.00 1.07 0.00 0.00 42.92 43.65 1dhk s ASP 194 CO 0.01 0.20 -0.14 -0.69 1.18 0.00 0.00 175.17 175.74 1dhk s VAL 195 N -0.50 1.52 -0.09 -1.27 1.01 -0.43 -0.76 120.40 119.88 1dhk s VAL 195 Ca 0.07 -0.61 0.07 0.00 0.00 0.00 0.00 61.98 61.50 1dhk s VAL 195 Cb -0.07 -1.42 -0.24 0.00 0.00 0.00 0.00 36.38 34.64 1dhk s VAL 195 CO -0.00 0.45 0.46 0.18 0.00 0.00 0.00 175.10 176.19 1dhk n LEU 196 N 4.65 1.45 -3.78 3.92 4.77 -0.31 -1.36 117.00 126.35 1dhk n LEU 196 Ca -0.17 0.28 -0.10 0.00 -0.03 0.00 0.00 56.01 55.99 1dhk n LEU 196 Cb 0.50 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 41.28 1dhk n LEU 196 CO 0.22 0.58 0.16 -0.94 -1.33 0.00 0.00 177.39 176.07 1dhk s SER 197 N -6.35 -0.16 -0.28 -1.43 1.04 -1.25 -4.20 113.70 101.06 1dhk s SER 197 Ca -0.12 -0.55 -0.16 0.00 0.48 0.00 0.00 55.95 55.60 1dhk s SER 197 Cb 0.07 0.51 0.11 0.00 0.10 0.00 0.00 66.02 66.81 1dhk s SER 197 CO 0.80 -0.95 0.82 0.86 0.98 0.00 0.00 173.24 175.74 1dhk s TRP 198 N -3.88 -0.85 -0.02 5.02 -0.00 -0.38 -2.63 118.94 116.21 1dhk s TRP 198 Ca 0.10 1.69 0.04 0.00 -0.00 0.00 0.00 56.10 57.93 1dhk s TRP 198 Cb 0.01 0.51 -0.01 0.00 -0.00 0.00 0.00 33.47 33.98 1dhk s TRP 198 CO -0.04 -0.42 -0.15 -1.54 -0.00 0.00 0.00 176.95 174.80 1dhk s SER 199 N 1.52 1.76 0.01 5.86 1.04 0.24 -0.62 113.70 123.51 1dhk s SER 199 Ca -0.09 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.06 1dhk s SER 199 Cb -0.04 -0.25 -0.01 0.00 0.10 0.00 0.00 66.02 65.81 1dhk s SER 199 CO -0.18 0.17 -0.02 0.12 0.98 0.00 0.00 173.24 174.31 1dhk s PHE 200 N -0.26 0.18 -0.20 5.02 2.19 -0.35 -1.20 117.98 123.36 1dhk s PHE 200 Ca 0.04 -0.36 -0.10 0.00 0.33 0.00 0.00 56.93 56.83 1dhk s PHE 200 Cb -0.07 -0.13 0.07 0.00 -1.31 0.00 0.00 43.02 41.58 1dhk s PHE 200 CO -0.00 -0.13 0.48 0.45 1.83 0.00 0.00 175.22 177.84 1dhk s SER 201 N -1.00 -0.58 0.09 6.13 0.15 -0.25 -1.27 113.70 116.97 1dhk s SER 201 Ca -0.11 1.06 0.10 0.00 0.70 0.00 0.00 55.95 57.70 1dhk s SER 201 Cb -0.07 1.04 -0.04 0.00 -1.71 0.00 0.00 66.02 65.25 1dhk s SER 201 CO -0.01 -0.21 -0.25 -0.94 1.20 0.00 0.00 173.24 173.04 1dhk s SER 202 N 1.70 3.40 -0.20 5.45 1.04 -0.13 -0.80 113.70 124.16 1dhk s SER 202 Ca -0.08 -0.65 -0.18 0.00 0.48 0.00 0.00 55.95 55.52 1dhk s SER 202 Cb -0.08 -0.32 0.05 0.00 0.10 0.00 0.00 66.02 65.77 1dhk s SER 202 CO -0.14 0.21 0.53 -0.75 0.98 0.00 0.00 173.24 174.07 1dhk s LYS 203 N -1.77 0.61 0.00 4.02 2.20 0.27 -3.80 119.74 121.27 1dhk s LYS 203 Ca 0.14 0.76 0.25 0.00 -0.36 0.00 0.00 55.97 56.76 1dhk s LYS 203 Cb -0.10 0.28 0.44 0.00 -1.51 0.00 0.00 37.83 36.93 1dhk s LYS 203 CO 0.05 -0.08 1.40 1.19 -0.36 0.00 0.00 175.35 177.55