#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1du6 s SER 2 N 0.00 4.98 -0.04 6.43 0.15 -1.26 -4.85 113.70 119.12 1du6 s SER 2 Ca 0.00 -1.38 0.02 0.00 0.70 0.00 0.00 55.95 55.29 1du6 s SER 2 Cb 0.00 -1.74 0.05 0.00 -1.71 0.00 0.00 66.02 62.62 1du6 s SER 2 CO 0.00 -0.31 0.49 0.61 1.20 0.00 0.00 173.24 175.23 1du6 n GLY 3 N 4.63 -0.31 1.47 9.45 0.00 -1.26 -5.15 105.19 114.02 1du6 n GLY 3 Ca -0.11 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.01 1du6 n GLY 3 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1du6 n HIS 4 N -0.18 -3.97 -2.95 1.61 -0.00 -1.26 -4.76 115.22 103.70 1du6 n HIS 4 Ca -0.05 2.19 -0.41 0.00 -0.00 0.00 0.00 57.72 59.44 1du6 n HIS 4 Cb 0.47 -3.54 -0.05 0.00 -0.00 0.00 0.00 29.99 26.88 1du6 n HIS 4 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 176.34 177.30 1du6 s ILE 5 N -4.62 4.88 0.00 3.57 -5.25 -1.26 -5.04 121.20 113.48 1du6 s ILE 5 Ca 0.00 1.46 0.00 0.00 -0.99 0.00 0.00 60.65 61.12 1du6 s ILE 5 Cb 0.00 -4.07 0.00 0.00 2.95 0.00 0.00 42.46 41.34 1du6 s ILE 5 CO 0.00 -0.03 0.00 1.21 -1.79 0.00 0.00 174.94 174.33 1du6 n GLU 6 N 5.83 3.54 0.00 0.37 2.13 -1.26 -5.12 120.64 126.13 1du6 n GLU 6 Ca 0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.86 1du6 n GLU 6 Cb 0.48 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.19 1du6 n GLU 6 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1du6 n GLY 7 N 5.00 3.06 0.00 8.31 0.00 -1.26 -5.10 105.19 115.20 1du6 n GLY 7 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1du6 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1du6 n ARG 8 N 0.00 0.00 0.00 1.61 1.74 -1.26 -4.92 116.66 113.83 1du6 n ARG 8 Ca 0.00 0.20 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 1du6 n ARG 8 Cb 0.00 -0.76 0.00 0.00 -1.02 0.00 0.00 32.46 30.68 1du6 n ARG 8 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 1du6 n HIS 9 N -1.11 0.00 -1.02 -1.55 -0.00 -1.26 -4.84 115.22 105.44 1du6 n HIS 9 Ca 0.00 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.89 1du6 n HIS 9 Cb 0.00 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 29.83 1du6 n HIS 9 CO 0.00 0.00 0.00 -0.12 0.46 0.00 0.00 176.34 176.68 1du6 n MET 10 N 0.00 2.81 0.00 1.57 0.00 -1.26 -4.60 117.12 115.64 1du6 n MET 10 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 57.70 55.96 1du6 n MET 10 Cb 0.00 -2.56 0.00 0.00 0.00 0.00 0.00 33.22 30.66 1du6 n MET 10 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1du6 n ASN 11 N 3.73 0.00 -0.34 6.12 3.02 -1.26 -3.51 115.26 123.02 1du6 n ASN 11 Ca 0.60 0.00 0.23 0.00 -0.03 0.00 0.00 54.58 55.38 1du6 n ASN 11 Cb 0.24 0.00 0.50 0.00 -0.61 0.00 0.00 39.78 39.91 1du6 n ASN 11 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1du6 h LYS 12 N 0.00 0.38 -1.10 3.52 1.57 -2.02 1.01 116.57 119.93 1du6 h LYS 12 Ca 0.00 -0.02 -0.13 0.00 -1.87 0.00 0.00 60.65 58.63 1du6 h LYS 12 Cb 0.00 -0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.15 1du6 h LYS 12 CO 0.00 0.25 0.16 1.04 -0.57 0.00 0.00 179.45 180.33 1du6 n GLN 13 N -4.72 1.31 0.04 3.15 1.13 -1.26 -4.46 117.38 112.57 1du6 n GLN 13 Ca 0.28 -0.72 -0.11 0.00 -1.94 0.00 0.00 57.00 54.51 1du6 n GLN 13 Cb 0.93 -1.28 -0.04 0.00 0.11 0.00 0.00 30.24 29.95 1du6 n GLN 13 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1du6 h ALA 14 N 1.69 -0.12 -0.20 -1.58 0.00 0.85 0.22 119.26 120.13 1du6 h ALA 14 Ca 0.15 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.14 1du6 h ALA 14 Cb 1.38 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1du6 h ALA 14 CO 0.28 -0.61 0.25 1.15 0.00 0.00 0.00 179.25 180.32 1du6 h THR 15 N -0.19 0.39 0.00 0.00 2.02 -1.83 1.08 112.91 114.37 1du6 h THR 15 Ca 0.05 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 67.04 1du6 h THR 15 Cb 0.27 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 1du6 h THR 15 CO -0.14 0.00 -0.98 -0.33 0.37 0.00 0.00 175.52 174.43 1du6 h GLU 16 N 0.00 0.00 -0.22 6.66 4.39 -1.24 0.18 114.58 124.35 1du6 h GLU 16 Ca 0.10 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.69 1du6 h GLU 16 Cb 0.60 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1du6 h GLU 16 CO -0.00 0.86 -0.26 0.82 -1.16 0.00 0.00 179.01 179.27 1du6 h ILE 17 N 0.00 1.32 -0.37 3.13 1.08 0.39 0.86 117.51 123.93 1du6 h ILE 17 Ca -0.03 -1.45 -0.15 0.00 -0.39 0.00 0.00 64.86 62.84 1du6 h ILE 17 Cb 1.72 1.74 -0.01 0.00 -3.07 0.00 0.00 36.82 37.21 1du6 h ILE 17 CO 0.11 0.45 -0.37 -0.07 -0.69 0.00 0.00 178.15 177.58 1du6 h LEU 18 N 0.26 0.92 0.20 1.44 3.38 -0.16 0.33 115.31 121.68 1du6 h LEU 18 Ca 0.03 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 1du6 h LEU 18 Cb 0.83 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1du6 h LEU 18 CO 0.06 1.19 -0.09 -1.13 0.09 0.00 0.00 178.44 178.56 1du6 h ASN 19 N 0.72 -0.22 -0.11 -0.43 -0.73 -0.50 1.20 115.58 115.51 1du6 h ASN 19 Ca 0.06 -0.22 0.03 0.00 1.87 0.00 0.00 56.30 58.05 1du6 h ASN 19 Cb 0.94 0.06 -0.00 0.00 0.27 0.00 0.00 38.32 39.59 1du6 h ASN 19 CO 0.09 0.11 0.08 -0.08 -0.37 0.00 0.00 177.43 177.26 1du6 h GLU 20 N -0.58 0.00 0.07 6.67 4.81 0.81 0.18 114.58 126.55 1du6 h GLU 20 Ca -0.03 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1du6 h GLU 20 Cb 0.43 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.81 1du6 h GLU 20 CO 0.04 0.00 -0.03 -0.92 -0.73 0.00 0.00 179.01 177.37 1du6 h TYR 21 N 0.00 -0.08 -1.05 0.92 3.20 0.16 -0.36 116.97 119.75 1du6 h TYR 21 Ca 0.05 -0.00 0.30 0.00 3.14 0.00 0.00 58.73 62.22 1du6 h TYR 21 Cb 0.21 0.03 -0.13 0.00 1.54 0.00 0.00 36.73 38.38 1du6 h TYR 21 CO 0.00 -0.05 0.64 0.35 -1.64 0.00 0.00 178.16 177.46 1du6 h PHE 22 N -0.49 0.83 0.04 -3.82 3.57 0.16 -1.79 116.94 115.45 1du6 h PHE 22 Ca -0.01 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 1du6 h PHE 22 Cb 0.07 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.58 1du6 h PHE 22 CO 0.02 -0.05 -0.02 1.88 -2.23 0.00 0.00 178.31 177.91 1du6 h TYR 23 N 0.39 -0.05 -1.19 0.41 0.05 -0.75 -0.12 116.97 115.70 1du6 h TYR 23 Ca 0.68 -0.00 0.43 0.00 0.05 0.00 0.00 58.73 59.90 1du6 h TYR 23 Cb 1.61 0.02 -0.14 0.00 1.01 0.00 0.00 36.73 39.23 1du6 h TYR 23 CO -0.01 0.46 0.74 0.43 -1.05 0.00 0.00 178.16 178.73 1du6 n SER 24 N -4.75 0.24 -1.74 3.88 7.64 -0.14 0.19 113.62 118.93 1du6 n SER 24 Ca -0.06 1.39 -0.11 0.00 1.01 0.00 0.00 58.87 61.10 1du6 n SER 24 Cb 0.26 -0.68 0.07 0.00 -1.01 0.00 0.00 64.21 62.86 1du6 n SER 24 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1du6 n HIS 25 N -4.76 1.63 0.16 1.43 1.44 -0.76 -4.81 115.22 109.55 1du6 n HIS 25 Ca 0.37 -1.90 0.03 0.00 -2.01 0.00 0.00 57.72 54.21 1du6 n HIS 25 Cb 1.40 -0.29 0.12 0.00 0.12 0.00 0.00 29.99 31.34 1du6 n HIS 25 CO 0.00 0.00 0.00 -0.11 -2.81 0.00 0.00 176.34 173.42 1du6 n LEU 26 N -0.71 0.03 0.08 2.39 7.94 0.50 -1.80 117.00 125.42 1du6 n LEU 26 Ca 0.29 0.51 -0.02 0.00 -1.11 0.00 0.00 56.01 55.68 1du6 n LEU 26 Cb 0.89 -0.51 0.22 0.00 0.53 0.00 0.00 43.42 44.55 1du6 n LEU 26 CO 0.21 -0.44 0.67 0.28 -1.11 0.00 0.00 177.39 176.99 1du6 h SER 27 N 0.00 0.30 -1.03 1.96 0.02 -1.83 -3.36 113.55 109.61 1du6 h SER 27 Ca 0.00 -0.12 -0.39 0.00 -0.84 0.00 0.00 61.79 60.44 1du6 h SER 27 Cb 0.08 -0.08 -0.27 0.00 0.14 0.00 0.00 62.40 62.27 1du6 h SER 27 CO 0.00 0.65 -0.81 -0.46 -1.14 0.00 0.00 176.83 175.07 1du6 n ASN 28 N -4.05 -1.18 -4.37 3.07 0.23 -0.74 -5.07 115.26 103.15 1du6 n ASN 28 Ca -0.01 -3.08 -0.41 0.00 -0.53 0.00 0.00 54.58 50.55 1du6 n ASN 28 Cb 0.46 0.58 -0.01 0.00 -2.08 0.00 0.00 39.78 38.73 1du6 n ASN 28 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1du6 n PRO 29 N 1.24 2.90 -3.05 -0.53 -0.04 -1.05 -4.72 135.00 129.77 1du6 n PRO 29 Ca 0.15 -3.00 -0.20 0.00 -0.04 0.00 0.00 63.50 60.41 1du6 n PRO 29 Cb 0.60 -3.46 -0.03 0.00 -0.04 0.00 0.00 33.50 30.58 1du6 n PRO 29 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1du6 n TYR 30 N 8.48 1.58 -1.49 0.54 4.01 -1.26 -5.08 117.16 123.94 1du6 n TYR 30 Ca 0.49 -3.77 -0.45 0.00 -0.16 0.00 0.00 57.90 54.01 1du6 n TYR 30 Cb 0.44 -0.43 -0.07 0.00 -0.31 0.00 0.00 39.34 38.98 1du6 n TYR 30 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1du6 n PRO 31 N 0.06 1.05 -0.40 -0.72 -0.04 -1.26 -4.92 135.00 128.76 1du6 n PRO 31 Ca 0.26 0.22 -0.19 0.00 -0.04 0.00 0.00 63.50 63.74 1du6 n PRO 31 Cb 0.59 -2.67 0.19 0.00 -0.04 0.00 0.00 33.50 31.57 1du6 n PRO 31 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1du6 n SER 32 N 11.58 -3.39 0.14 3.54 7.64 -1.26 -4.31 113.62 127.56 1du6 n SER 32 Ca 0.42 -0.56 0.18 0.00 1.01 0.00 0.00 58.87 59.92 1du6 n SER 32 Cb 0.31 -0.81 0.77 0.00 -1.01 0.00 0.00 64.21 63.47 1du6 n SER 32 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1du6 h GLU 33 N 0.00 0.00 0.20 1.43 5.08 -2.00 -2.31 114.58 116.99 1du6 h GLU 33 Ca -0.25 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1du6 h GLU 33 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1du6 h GLU 33 CO 0.15 0.00 -0.10 1.49 -1.00 0.00 0.00 179.01 179.55 1du6 h GLU 34 N 0.00 -0.26 0.02 2.33 4.81 -1.99 -2.47 114.58 117.02 1du6 h GLU 34 Ca 0.14 0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1du6 h GLU 34 Cb 0.69 0.06 -0.05 0.00 0.63 0.00 0.00 28.75 30.08 1du6 h GLU 34 CO -0.00 0.13 -0.36 0.00 -0.73 0.00 0.00 179.01 178.05 1du6 h ALA 35 N -0.26 -0.56 0.33 2.92 0.00 -1.69 0.77 119.26 120.77 1du6 h ALA 35 Ca -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1du6 h ALA 35 Cb 0.52 0.63 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 1du6 h ALA 35 CO 0.05 -0.89 -0.44 -0.22 0.00 0.00 0.00 179.25 177.75 1du6 h LYS 36 N -0.53 -0.77 -0.87 0.00 3.11 -1.61 0.21 116.57 116.12 1du6 h LYS 36 Ca 0.05 0.05 0.13 0.00 -2.81 0.00 0.00 60.65 58.07 1du6 h LYS 36 Cb 0.60 0.17 -0.09 0.00 -1.00 0.00 0.00 32.23 31.92 1du6 h LYS 36 CO -0.27 -0.51 0.49 0.93 -2.81 0.00 0.00 179.45 177.27 1du6 h GLU 37 N -0.79 0.72 0.26 1.90 5.08 -1.30 0.99 114.58 121.43 1du6 h GLU 37 Ca -0.04 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1du6 h GLU 37 Cb 0.72 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 1du6 h GLU 37 CO -0.12 0.48 -0.49 0.93 -1.00 0.00 0.00 179.01 178.81 1du6 h GLU 38 N 0.74 -0.79 -0.70 2.33 4.39 0.12 -1.60 114.58 119.08 1du6 h GLU 38 Ca 0.45 0.05 0.05 0.00 0.34 0.00 0.00 59.36 60.25 1du6 h GLU 38 Cb 0.54 0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 29.32 1du6 h GLU 38 CO -0.31 -0.52 0.42 -0.07 -1.16 0.00 0.00 179.01 177.36 1du6 h LEU 39 N -0.82 0.65 -1.97 1.33 3.38 -0.37 -0.61 115.31 116.89 1du6 h LEU 39 Ca -0.02 0.02 0.29 0.00 0.09 0.00 0.00 57.88 58.26 1du6 h LEU 39 Cb 0.78 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 1du6 h LEU 39 CO -0.19 0.43 0.73 0.00 0.09 0.00 0.00 178.44 179.49 1du6 h ALA 40 N 1.34 2.93 -0.03 1.53 0.00 -0.10 0.83 119.26 125.76 1du6 h ALA 40 Ca 0.30 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.94 1du6 h ALA 40 Cb 0.13 0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.01 1du6 h ALA 40 CO -0.16 -1.22 -0.91 0.87 0.00 0.00 0.00 179.25 177.83 1du6 h LYS 41 N 0.02 0.66 -0.27 0.00 1.79 -0.18 -1.23 116.57 117.36 1du6 h LYS 41 Ca 0.49 -0.68 0.05 0.00 -2.18 0.00 0.00 60.65 58.32 1du6 h LYS 41 Cb 1.92 0.18 -0.08 0.00 -1.58 0.00 0.00 32.23 32.67 1du6 h LYS 41 CO -0.02 1.27 -0.50 0.87 -1.08 0.00 0.00 179.45 180.00 1du6 h LYS 42 N 0.32 -0.45 0.00 3.15 1.57 -0.73 -1.42 116.57 119.03 1du6 h LYS 42 Ca -0.11 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1du6 h LYS 42 Cb 1.57 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.98 1du6 h LYS 42 CO 0.18 -0.30 -0.17 0.00 -0.57 0.00 0.00 179.45 178.59 1du6 n GLY 44 N 1.22 -0.29 0.00 0.00 0.00 -0.49 -5.00 105.19 100.62 1du6 n GLY 44 Ca 0.04 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1du6 n GLY 44 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1du6 n ILE 45 N -4.48 0.00 -3.87 -0.61 -0.00 -1.03 -5.03 119.36 104.33 1du6 n ILE 45 Ca -0.03 0.00 -0.15 0.00 -0.00 0.00 0.00 62.75 62.57 1du6 n ILE 45 Cb 0.57 0.00 -0.15 0.00 -0.00 0.00 0.00 39.64 40.05 1du6 n ILE 45 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.55 176.97 1du6 s THR 46 N 2.63 0.06 0.52 7.28 -4.23 -1.26 -5.00 115.64 115.64 1du6 s THR 46 Ca 0.00 0.09 0.34 0.00 -1.18 0.00 0.00 61.69 60.94 1du6 s THR 46 Cb 0.00 -0.14 0.53 0.00 1.34 0.00 0.00 72.50 74.22 1du6 s THR 46 CO 0.00 0.09 1.79 0.58 -0.54 0.00 0.00 174.62 176.54 1du6 h VAL 47 N 5.91 0.42 -0.31 2.29 2.07 -1.94 1.30 116.25 125.98 1du6 h VAL 47 Ca -0.39 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.20 1du6 h VAL 47 Cb 1.15 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1du6 h VAL 47 CO 0.49 0.01 0.24 0.28 0.02 0.00 0.00 177.57 178.62 1du6 h SER 48 N 0.07 0.00 -0.84 0.57 0.02 -1.95 12.19 113.55 123.61 1du6 h SER 48 Ca 0.58 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.52 1du6 h SER 48 Cb 2.16 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 64.66 1du6 h SER 48 CO -0.07 0.00 0.50 -0.61 -1.14 0.00 0.00 176.83 175.51 1du6 h GLN 49 N 0.00 1.14 0.00 3.45 5.75 0.13 1.18 115.11 126.76 1du6 h GLN 49 Ca 0.15 -0.11 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 1du6 h GLN 49 Cb 0.64 -0.24 0.00 0.00 1.07 0.00 0.00 27.48 28.95 1du6 h GLN 49 CO -0.00 0.81 -0.11 0.28 -2.65 0.00 0.00 178.83 177.16 1du6 h VAL 50 N 1.15 0.00 -0.88 2.39 2.07 0.19 -2.66 116.25 118.52 1du6 h VAL 50 Ca 0.30 -0.81 0.22 0.00 0.82 0.00 0.00 66.70 67.23 1du6 h VAL 50 Cb -0.03 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.57 1du6 h VAL 50 CO -0.05 0.00 -0.04 -0.24 0.02 0.00 0.00 177.57 177.25 1du6 n SER 51 N -4.23 -0.15 -0.04 0.57 2.88 3.72 0.11 113.62 116.47 1du6 n SER 51 Ca -0.02 1.49 -0.17 0.00 -1.33 0.00 0.00 58.87 58.85 1du6 n SER 51 Cb 0.06 -0.52 -0.07 0.00 -0.75 0.00 0.00 64.21 62.93 1du6 n SER 51 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 1du6 h ASN 52 N 0.00 0.92 -0.17 -3.46 2.35 0.13 -2.08 115.58 113.27 1du6 h ASN 52 Ca 0.50 -0.61 0.05 0.00 -0.55 0.00 0.00 56.30 55.70 1du6 h ASN 52 Cb 0.98 -0.27 -0.07 0.00 0.05 0.00 0.00 38.32 39.02 1du6 h ASN 52 CO -0.84 1.37 -0.31 -0.25 -1.65 0.00 0.00 177.43 175.75 1du6 h TRP 53 N 0.52 -0.84 0.00 1.19 7.01 0.12 0.70 115.95 124.65 1du6 h TRP 53 Ca -0.03 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.01 1du6 h TRP 53 Cb 1.31 0.39 0.00 0.00 -2.10 0.00 0.00 29.16 28.77 1du6 h TRP 53 CO 0.09 -0.38 0.00 1.19 -2.79 0.00 0.00 178.44 176.55 1du6 n PHE 54 N -5.40 0.00 -0.05 2.65 3.01 -0.36 -0.13 117.46 117.18 1du6 n PHE 54 Ca -0.02 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.22 1du6 n PHE 54 Cb 0.32 -0.26 -0.13 0.00 -0.01 0.00 0.00 39.48 39.40 1du6 n PHE 54 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1du6 n GLY 55 N 1.19 -0.63 0.03 1.37 0.00 0.10 -4.03 105.19 103.21 1du6 n GLY 55 Ca 0.15 -0.13 -0.03 0.00 0.00 0.00 0.00 46.02 46.02 1du6 n GLY 55 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1du6 n ASN 56 N -3.85 0.57 0.13 1.61 2.85 0.22 -4.42 115.26 112.37 1du6 n ASN 56 Ca -0.35 0.11 0.05 0.00 -0.11 0.00 0.00 54.58 54.29 1du6 n ASN 56 Cb 0.91 -0.57 0.26 0.00 1.24 0.00 0.00 39.78 41.61 1du6 n ASN 56 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1du6 n LYS 57 N -3.07 0.07 0.32 1.20 4.81 0.82 0.21 118.16 122.52 1du6 n LYS 57 Ca -0.04 0.50 0.20 0.00 -0.87 0.00 0.00 58.31 58.10 1du6 n LYS 57 Cb 0.15 -2.03 1.09 0.00 0.02 0.00 0.00 35.03 34.26 1du6 n LYS 57 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 1du6 h ARG 58 N 0.00 0.00 0.00 1.64 1.12 -1.44 -3.32 114.38 112.38 1du6 h ARG 58 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 1du6 h ARG 58 Cb 0.63 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.59 1du6 h ARG 58 CO 0.00 0.00 0.00 1.51 -3.11 0.00 0.00 179.97 178.37 1du6 n ILE 59 N -3.36 0.00 0.00 1.20 0.13 0.13 -4.76 119.36 112.70 1du6 n ILE 59 Ca -0.03 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.62 1du6 n ILE 59 Cb 0.10 -0.07 0.00 0.00 -0.84 0.00 0.00 39.64 38.83 1du6 n ILE 59 CO 0.00 0.00 0.00 -2.11 2.80 0.00 0.00 176.55 177.24 1du6 n ARG 60 N 0.00 0.00 -0.48 9.51 -4.01 -1.25 -4.34 116.66 116.08 1du6 n ARG 60 Ca 0.00 0.00 0.05 0.00 -1.04 0.00 0.00 57.85 56.86 1du6 n ARG 60 Cb 0.00 -1.08 0.25 0.00 -3.04 0.00 0.00 32.46 28.59 1du6 n ARG 60 CO 0.00 0.00 0.00 2.48 -3.04 0.00 0.00 177.63 177.07 1du6 n TYR 61 N 0.00 1.14 -3.41 2.89 0.18 -1.26 -4.77 117.16 111.93 1du6 n TYR 61 Ca 0.00 -0.42 0.01 0.00 1.88 0.00 0.00 57.90 59.37 1du6 n TYR 61 Cb 0.00 -0.26 -0.03 0.00 -0.38 0.00 0.00 39.34 38.67 1du6 n TYR 61 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 1du6 s LYS 62 N -1.92 0.57 -0.61 -3.48 2.47 -1.26 -5.04 119.74 110.47 1du6 s LYS 62 Ca 0.34 1.23 -0.07 0.00 -1.56 0.00 0.00 55.97 55.91 1du6 s LYS 62 Cb 0.24 0.72 -0.18 0.00 -1.46 0.00 0.00 37.83 37.14 1du6 s LYS 62 CO 0.13 -0.39 3.19 1.63 0.16 0.00 0.00 175.35 180.06 1du6 n LYS 63 N 5.43 2.50 0.00 4.03 4.76 -1.26 -5.05 118.16 128.58 1du6 n LYS 63 Ca -0.07 -1.39 0.14 0.00 -2.87 0.00 0.00 58.31 54.12 1du6 n LYS 63 Cb 0.50 -2.28 0.58 0.00 -1.84 0.00 0.00 35.03 32.00 1du6 n LYS 63 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32