#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 6.18 0.00 6.43 0.01 -1.26 -4.95 113.70 120.11 1du6 s SER 2 Ca 0.00 -1.57 0.00 0.00 1.31 0.00 0.00 55.95 55.69 1du6 s SER 2 Cb 0.00 -2.22 0.00 0.00 0.21 0.00 0.00 66.02 64.01 1du6 s SER 2 CO 0.00 -0.83 0.00 0.61 0.41 0.00 0.00 173.24 173.43 1du6 n GLY 3 N 5.24 3.47 2.46 3.44 0.00 -1.26 -4.98 105.19 113.55 1du6 n GLY 3 Ca -0.13 -0.12 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 1du6 n GLY 3 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1du6 n HIS 4 N 0.00 -0.64 -2.94 1.61 8.25 -1.26 -4.94 115.22 115.29 1du6 n HIS 4 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 1du6 n HIS 4 Cb 0.00 -3.74 -0.05 0.00 1.12 0.00 0.00 29.99 27.32 1du6 n HIS 4 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1du6 s ILE 5 N -2.93 4.78 0.32 1.59 1.01 -1.26 -4.79 121.20 119.92 1du6 s ILE 5 Ca 0.00 1.13 0.00 0.00 0.00 0.00 0.00 60.65 61.78 1du6 s ILE 5 Cb 0.00 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 38.31 1du6 s ILE 5 CO 0.00 -0.29 0.00 -0.62 0.00 0.00 0.00 174.94 174.03 1du6 n GLU 6 N 6.26 -4.57 -2.79 2.79 -0.58 -1.26 -4.72 120.64 115.76 1du6 n GLU 6 Ca 0.04 3.30 -0.43 0.00 -0.42 0.00 0.00 57.16 59.64 1du6 n GLU 6 Cb 0.48 -3.62 -0.01 0.00 -0.57 0.00 0.00 31.44 27.73 1du6 n GLU 6 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1du6 s GLY 7 N -1.73 1.99 0.20 0.62 0.00 -1.26 -4.99 107.32 102.16 1du6 s GLY 7 Ca 0.00 -3.05 -0.30 0.00 0.00 0.00 0.00 44.72 41.37 1du6 s GLY 7 CO 0.00 2.33 1.01 0.50 0.00 0.00 0.00 173.10 176.94 1du6 s ARG 8 N 2.91 4.73 -0.18 2.90 0.52 -1.26 -4.94 118.95 123.63 1du6 s ARG 8 Ca 0.46 1.58 -0.05 0.00 -0.52 0.00 0.00 55.73 57.20 1du6 s ARG 8 Cb -0.00 -3.29 -0.16 0.00 0.52 0.00 0.00 34.95 32.02 1du6 s ARG 8 CO 0.01 0.30 3.34 0.72 0.02 0.00 0.00 175.30 179.69 1du6 n HIS 9 N 1.92 0.56 -3.57 -0.53 8.25 -1.26 -4.80 115.22 115.79 1du6 n HIS 9 Ca 0.00 -1.67 -0.12 0.00 -0.26 0.00 0.00 57.72 55.67 1du6 n HIS 9 Cb 0.47 -1.54 -0.05 0.00 1.12 0.00 0.00 29.99 29.98 1du6 n HIS 9 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 1du6 s MET 10 N 0.12 0.71 -0.03 -0.41 0.00 -1.26 -5.05 119.30 113.38 1du6 s MET 10 Ca 0.64 0.19 -0.19 0.00 0.00 0.00 0.00 55.69 56.34 1du6 s MET 10 Cb 0.34 0.33 -0.05 0.00 0.00 0.00 0.00 34.83 35.45 1du6 s MET 10 CO -0.07 -0.22 0.53 0.54 0.00 0.00 0.00 175.02 175.80 1du6 s ASN 11 N -1.08 6.87 0.32 1.11 4.22 -1.26 -4.97 114.94 120.14 1du6 s ASN 11 Ca -0.04 1.04 0.07 0.00 -2.14 0.00 0.00 52.86 51.78 1du6 s ASN 11 Cb -0.00 -2.32 0.88 0.00 1.28 0.00 0.00 41.25 41.08 1du6 s ASN 11 CO 0.03 0.11 1.60 0.50 -2.04 0.00 0.00 177.10 177.31 1du6 h LYS 12 N 5.77 0.09 0.31 3.55 1.63 -1.98 -1.26 116.57 124.67 1du6 h LYS 12 Ca -0.45 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.34 1du6 h LYS 12 Cb 1.20 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.77 1du6 h LYS 12 CO 0.70 0.06 -0.49 1.96 -3.45 0.00 0.00 179.45 178.23 1du6 h GLN 13 N 0.09 -0.82 -0.70 1.90 1.08 -1.98 0.29 115.11 114.97 1du6 h GLN 13 Ca 0.64 0.06 0.14 0.00 -1.45 0.00 0.00 58.65 58.03 1du6 h GLN 13 Cb 1.43 0.19 -0.09 0.00 -0.05 0.00 0.00 27.48 28.95 1du6 h GLN 13 CO -0.79 -0.55 0.23 0.00 -0.95 0.00 0.00 178.83 176.78 1du6 h ALA 14 N -0.60 0.94 -0.52 3.87 0.00 -1.66 0.83 119.26 122.11 1du6 h ALA 14 Ca -0.03 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1du6 h ALA 14 Cb 0.80 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1du6 h ALA 14 CO -0.17 -0.26 0.35 1.15 0.00 0.00 0.00 179.25 180.32 1du6 h THR 15 N 0.36 1.00 0.00 0.00 2.02 -0.80 1.27 112.91 116.76 1du6 h THR 15 Ca 0.38 -0.17 -0.11 0.00 0.77 0.00 0.00 66.41 67.28 1du6 h THR 15 Cb 0.59 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1du6 h THR 15 CO -0.42 0.09 -0.51 1.05 0.37 0.00 0.00 175.52 176.10 1du6 h GLU 16 N 0.50 0.00 0.03 6.66 -0.00 0.38 0.23 114.58 122.39 1du6 h GLU 16 Ca 0.22 0.00 -0.24 0.00 -0.00 0.00 0.00 59.36 59.34 1du6 h GLU 16 Cb 0.24 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 29.00 1du6 h GLU 16 CO -0.06 0.51 -1.02 0.82 -0.00 0.00 0.00 179.01 179.26 1du6 h ILE 17 N 0.00 1.39 0.08 -1.06 1.08 0.36 0.07 117.51 119.44 1du6 h ILE 17 Ca -0.01 -2.52 -0.29 0.00 -0.39 0.00 0.00 64.86 61.66 1du6 h ILE 17 Cb 1.39 2.51 0.03 0.00 -3.07 0.00 0.00 36.82 37.67 1du6 h ILE 17 CO 0.07 0.75 -1.18 -0.07 -0.69 0.00 0.00 178.15 177.03 1du6 h LEU 18 N 0.23 0.90 -0.29 1.44 3.38 0.15 0.25 115.31 121.36 1du6 h LEU 18 Ca -0.10 -0.79 -0.06 0.00 0.09 0.00 0.00 57.88 57.02 1du6 h LEU 18 Cb 1.67 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 1du6 h LEU 18 CO 0.18 1.59 -0.04 0.78 0.09 0.00 0.00 178.44 181.04 1du6 h ASN 19 N 0.32 0.54 0.44 -0.43 4.21 -0.57 1.39 115.58 121.48 1du6 h ASN 19 Ca -0.17 -0.35 -0.11 0.00 1.21 0.00 0.00 56.30 56.89 1du6 h ASN 19 Cb 1.85 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 38.89 1du6 h ASN 19 CO 0.23 0.76 -0.48 -0.33 -1.29 0.00 0.00 177.43 176.31 1du6 h GLU 20 N 0.31 0.05 0.04 0.81 5.08 -1.03 0.96 114.58 120.81 1du6 h GLU 20 Ca 0.08 -0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.18 1du6 h GLU 20 Cb 0.51 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1du6 h GLU 20 CO 0.02 0.53 -1.08 -0.92 -1.00 0.00 0.00 179.01 176.56 1du6 h TYR 21 N 0.04 0.17 0.05 4.33 3.20 -0.10 -2.51 116.97 122.16 1du6 h TYR 21 Ca -0.00 -0.13 -0.00 0.00 3.14 0.00 0.00 58.73 61.74 1du6 h TYR 21 Cb 0.87 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.14 1du6 h TYR 21 CO 0.00 1.10 -0.03 0.35 -1.64 0.00 0.00 178.16 177.94 1du6 h PHE 22 N 0.03 -0.07 0.69 -3.82 3.57 0.21 -3.17 116.94 114.38 1du6 h PHE 22 Ca -0.05 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.41 1du6 h PHE 22 Cb 1.84 0.02 0.01 0.00 2.79 0.00 0.00 35.95 40.61 1du6 h PHE 22 CO 0.02 0.53 -0.33 1.88 -2.23 0.00 0.00 178.31 178.18 1du6 h TYR 23 N -0.90 -0.86 -1.20 0.41 -1.99 -0.95 0.17 116.97 111.64 1du6 h TYR 23 Ca -0.01 -0.02 0.43 0.00 2.00 0.00 0.00 58.73 61.13 1du6 h TYR 23 Cb 0.63 0.29 -0.14 0.00 2.00 0.00 0.00 36.73 39.50 1du6 h TYR 23 CO 0.15 -0.54 0.75 0.45 -0.00 0.00 0.00 178.16 178.97 1du6 n SER 24 N -4.96 0.23 -1.94 3.88 2.88 -0.95 0.25 113.62 113.01 1du6 n SER 24 Ca -0.12 1.35 -0.23 0.00 -1.33 0.00 0.00 58.87 58.54 1du6 n SER 24 Cb 0.37 -0.66 0.07 0.00 -0.75 0.00 0.00 64.21 63.23 1du6 n SER 24 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1du6 n HIS 25 N -4.70 2.57 0.31 0.66 8.25 -1.10 -4.72 115.22 116.49 1du6 n HIS 25 Ca 0.37 -2.32 0.10 0.00 -0.26 0.00 0.00 57.72 55.61 1du6 n HIS 25 Cb 1.40 -0.64 0.48 0.00 1.12 0.00 0.00 29.99 32.35 1du6 n HIS 25 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1du6 n LEU 26 N -0.83 0.54 0.13 2.41 7.94 0.70 -1.30 117.00 126.58 1du6 n LEU 26 Ca 0.47 0.67 -0.01 0.00 -1.11 0.00 0.00 56.01 56.02 1du6 n LEU 26 Cb 0.90 -0.64 0.11 0.00 0.53 0.00 0.00 43.42 44.31 1du6 n LEU 26 CO 0.46 -0.65 0.43 0.28 -1.11 0.00 0.00 177.39 176.80 1du6 h SER 27 N 0.00 0.00 -1.35 1.96 0.02 -1.84 -3.36 113.55 108.97 1du6 h SER 27 Ca 0.00 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.54 1du6 h SER 27 Cb 0.22 0.00 -0.32 0.00 0.14 0.00 0.00 62.40 62.44 1du6 h SER 27 CO 0.00 0.67 -0.95 0.59 -1.14 0.00 0.00 176.83 176.00 1du6 n ASN 28 N -3.60 -0.27 -0.28 3.07 5.03 -0.65 -4.99 115.26 113.58 1du6 n ASN 28 Ca -0.00 -3.20 0.03 0.00 0.87 0.00 0.00 54.58 52.28 1du6 n ASN 28 Cb 0.69 0.20 0.16 0.00 -1.02 0.00 0.00 39.78 39.82 1du6 n ASN 28 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.26 174.78 1du6 h PRO 29 N 3.12 0.70 -5.23 3.52 0.11 -1.36 -3.42 132.00 129.44 1du6 h PRO 29 Ca 0.03 -0.04 -0.52 0.00 0.11 0.00 0.00 66.00 65.58 1du6 h PRO 29 Cb 1.00 -0.16 -0.07 0.00 0.11 0.00 0.00 31.00 31.89 1du6 h PRO 29 CO 0.38 0.46 1.69 0.66 -0.21 0.00 0.00 178.00 180.99 1du6 n TYR 30 N -4.79 0.81 -2.77 0.65 4.01 -1.26 -4.85 117.16 108.95 1du6 n TYR 30 Ca 0.13 0.36 -0.43 0.00 -0.16 0.00 0.00 57.90 57.80 1du6 n TYR 30 Cb 0.29 -2.43 -0.04 0.00 -0.31 0.00 0.00 39.34 36.86 1du6 n TYR 30 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1du6 s PRO 31 N 8.53 3.59 1.34 -0.72 0.04 -1.26 -5.04 135.00 141.48 1du6 s PRO 31 Ca 1.27 0.27 -0.21 0.00 0.04 0.00 0.00 61.00 62.37 1du6 s PRO 31 Cb -1.06 -3.91 0.32 0.00 0.04 0.00 0.00 34.50 29.88 1du6 s PRO 31 CO 0.46 -1.24 0.75 0.43 0.04 0.00 0.00 177.00 177.44 1du6 n SER 32 N 7.27 -3.64 -0.14 6.66 7.64 -1.26 -4.27 113.62 125.90 1du6 n SER 32 Ca 0.07 -0.67 0.18 0.00 1.01 0.00 0.00 58.87 59.46 1du6 n SER 32 Cb 0.49 -0.98 0.57 0.00 -1.01 0.00 0.00 64.21 63.28 1du6 n SER 32 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 1du6 h GLU 33 N -3.31 0.27 -0.24 1.43 -0.00 -2.00 -0.53 114.58 110.20 1du6 h GLU 33 Ca -0.39 -0.02 -0.14 0.00 -0.00 0.00 0.00 59.36 58.81 1du6 h GLU 33 Cb 1.20 -0.06 -0.00 0.00 -0.00 0.00 0.00 28.75 29.89 1du6 h GLU 33 CO 0.25 0.18 -0.40 1.49 -0.00 0.00 0.00 179.01 180.53 1du6 h GLU 34 N 0.27 0.69 0.77 1.06 4.81 -1.99 -2.64 114.58 117.55 1du6 h GLU 34 Ca 0.36 -0.43 -0.04 0.00 -0.13 0.00 0.00 59.36 59.12 1du6 h GLU 34 Cb 1.01 0.05 0.01 0.00 0.63 0.00 0.00 28.75 30.44 1du6 h GLU 34 CO -0.09 1.05 -0.37 0.00 -0.73 0.00 0.00 179.01 178.87 1du6 h ALA 35 N 0.64 -1.28 -0.70 2.92 0.00 -1.38 0.41 119.26 119.87 1du6 h ALA 35 Ca 0.02 -0.23 0.15 0.00 0.00 0.00 0.00 54.91 54.86 1du6 h ALA 35 Cb 1.00 0.40 -0.11 0.00 0.00 0.00 0.00 17.79 19.07 1du6 h ALA 35 CO 0.09 -1.20 0.10 1.57 0.00 0.00 0.00 179.25 179.81 1du6 h LYS 36 N -1.03 0.19 -0.67 0.00 5.09 -1.51 0.37 116.57 119.01 1du6 h LYS 36 Ca -0.11 -0.01 0.00 0.00 0.09 0.00 0.00 60.65 60.62 1du6 h LYS 36 Cb 0.79 -0.04 -0.03 0.00 0.10 0.00 0.00 32.23 33.04 1du6 h LYS 36 CO 0.17 0.13 0.42 0.93 -2.09 0.00 0.00 179.45 179.01 1du6 h GLU 37 N 0.20 0.90 0.19 0.07 5.08 -1.36 0.42 114.58 120.09 1du6 h GLU 37 Ca 0.39 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.67 1du6 h GLU 37 Cb 0.66 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1du6 h GLU 37 CO -0.54 0.62 -0.09 1.05 -1.00 0.00 0.00 179.01 179.04 1du6 h GLU 38 N 0.92 -0.25 0.00 2.33 4.11 0.19 -0.66 114.58 121.22 1du6 h GLU 38 Ca 0.24 0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.68 1du6 h GLU 38 Cb -0.06 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 1du6 h GLU 38 CO -0.05 0.07 -0.02 -0.07 0.07 0.00 0.00 179.01 179.01 1du6 h LEU 39 N -0.59 0.00 0.11 3.06 3.38 -0.49 -0.47 115.31 120.32 1du6 h LEU 39 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1du6 h LEU 39 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1du6 h LEU 39 CO 0.04 0.02 -0.05 0.00 0.09 0.00 0.00 178.44 178.54 1du6 h ALA 40 N 1.98 -0.15 0.00 1.53 0.00 0.20 -2.78 119.26 120.03 1du6 h ALA 40 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1du6 h ALA 40 Cb 0.04 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1du6 h ALA 40 CO 0.00 -0.43 0.00 1.63 0.00 0.00 0.00 179.25 180.45 1du6 n LYS 41 N -5.02 0.10 0.03 0.00 4.76 -0.28 0.62 118.16 118.37 1du6 n LYS 41 Ca -0.09 0.20 -0.19 0.00 -2.87 0.00 0.00 58.31 55.36 1du6 n LYS 41 Cb 0.20 -1.65 -0.12 0.00 -1.84 0.00 0.00 35.03 31.62 1du6 n LYS 41 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1du6 h LYS 42 N 0.00 0.45 0.00 1.97 3.11 -0.96 -3.33 116.57 117.82 1du6 h LYS 42 Ca 0.00 -0.55 -0.22 0.00 -2.81 0.00 0.00 60.65 57.07 1du6 h LYS 42 Cb 0.47 0.17 -0.04 0.00 -1.00 0.00 0.00 32.23 31.83 1du6 h LYS 42 CO 0.00 1.20 -1.78 0.00 -2.81 0.00 0.00 179.45 176.05 1du6 n GLY 44 N 1.50 0.38 0.00 0.00 0.00 0.20 -5.03 105.19 102.24 1du6 n GLY 44 Ca -0.16 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.82 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 -3.30 0.00 -4.02 -0.61 -0.00 -1.06 -5.01 119.36 105.36 1du6 n ILE 45 Ca -0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 62.75 62.58 1du6 n ILE 45 Cb 0.15 0.00 -0.16 0.00 -0.00 0.00 0.00 39.64 39.63 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 3.08 0.30 0.47 7.28 -4.23 -1.26 -4.93 115.64 116.33 1du6 s THR 46 Ca 0.00 -0.01 0.26 0.00 -1.18 0.00 0.00 61.69 60.76 1du6 s THR 46 Cb 0.00 -0.35 0.45 0.00 1.34 0.00 0.00 72.50 73.94 1du6 s THR 46 CO 0.00 0.16 1.82 0.58 -0.54 0.00 0.00 174.62 176.63 1du6 h VAL 47 N 6.05 0.52 -0.55 2.29 2.07 -1.92 0.66 116.25 125.37 1du6 h VAL 47 Ca -0.40 -0.07 0.15 0.00 0.82 0.00 0.00 66.70 67.20 1du6 h VAL 47 Cb 1.15 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1du6 h VAL 47 CO 0.48 0.04 0.39 0.28 0.02 0.00 0.00 177.57 178.78 1du6 h SER 48 N 0.22 0.04 -0.78 0.57 0.02 -1.96 15.95 113.55 127.60 1du6 h SER 48 Ca 0.53 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.47 1du6 h SER 48 Cb 1.69 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 64.19 1du6 h SER 48 CO -0.15 0.02 0.43 1.56 -1.14 0.00 0.00 176.83 177.56 1du6 h GLN 49 N 0.04 1.09 0.00 3.45 1.08 -0.06 0.57 115.11 121.28 1du6 h GLN 49 Ca 0.26 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 1du6 h GLN 49 Cb 1.00 -0.22 0.00 0.00 -0.05 0.00 0.00 27.48 28.21 1du6 h GLN 49 CO -0.01 0.80 -0.09 0.28 -0.95 0.00 0.00 178.83 178.86 1du6 h VAL 50 N 1.09 0.00 -0.86 -0.54 2.07 0.31 -2.57 116.25 115.74 1du6 h VAL 50 Ca 0.28 -0.88 0.21 0.00 0.82 0.00 0.00 66.70 67.12 1du6 h VAL 50 Cb 0.03 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.63 1du6 h VAL 50 CO -0.05 0.00 -0.08 -1.54 0.02 0.00 0.00 177.57 175.92 1du6 n SER 51 N -4.42 -0.19 0.01 0.57 3.41 4.80 -0.05 113.62 117.74 1du6 n SER 51 Ca -0.01 1.46 -0.18 0.00 -0.26 0.00 0.00 58.87 59.88 1du6 n SER 51 Cb 0.05 -0.49 -0.11 0.00 -0.26 0.00 0.00 64.21 63.39 1du6 n SER 51 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1du6 h ASN 52 N 0.00 0.59 -0.45 4.04 -0.73 0.04 -3.00 115.58 116.07 1du6 h ASN 52 Ca 0.47 -0.77 0.09 0.00 1.87 0.00 0.00 56.30 57.96 1du6 h ASN 52 Cb 0.87 -0.18 -0.10 0.00 0.27 0.00 0.00 38.32 39.19 1du6 h ASN 52 CO -0.84 1.28 -0.32 -0.25 -0.37 0.00 0.00 177.43 176.93 1du6 h TRP 53 N -0.04 -0.89 0.00 0.67 7.01 -0.03 -0.27 115.95 122.39 1du6 h TRP 53 Ca -0.09 0.06 -0.10 0.00 2.11 0.00 0.00 58.89 60.87 1du6 h TRP 53 Cb 1.39 0.46 -0.01 0.00 -2.10 0.00 0.00 29.16 28.90 1du6 h TRP 53 CO 0.14 -0.38 -0.48 0.74 -2.79 0.00 0.00 178.44 175.68 1du6 h PHE 54 N -0.22 0.00 -0.33 2.65 -1.00 -1.46 -0.20 116.94 116.37 1du6 h PHE 54 Ca 0.19 0.00 0.07 0.00 2.81 0.00 0.00 57.97 61.04 1du6 h PHE 54 Cb 0.54 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 40.01 1du6 h PHE 54 CO -0.56 0.48 -0.33 0.78 -1.61 0.00 0.00 178.31 177.07 1du6 h GLY 55 N 1.58 -0.32 0.00 -1.45 0.00 -0.89 -1.75 103.07 100.24 1du6 h GLY 55 Ca -0.00 0.42 -0.35 0.00 0.00 0.00 0.00 47.33 47.39 1du6 h GLY 55 CO 0.06 -0.21 -2.02 1.16 0.00 0.00 0.00 176.54 175.54 1du6 n ASN 56 N -5.41 1.93 0.31 0.19 6.94 -1.13 -4.37 115.26 113.72 1du6 n ASN 56 Ca -0.00 0.37 0.14 0.00 -0.02 0.00 0.00 54.58 55.07 1du6 n ASN 56 Cb 0.33 -0.85 0.71 0.00 -2.36 0.00 0.00 39.78 37.61 1du6 n ASN 56 CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 1du6 h LYS 57 N -1.00 0.00 -0.02 -3.83 3.64 -1.14 0.64 116.57 114.86 1du6 h LYS 57 Ca -0.53 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 58.70 1du6 h LYS 57 Cb 1.44 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.25 1du6 h LYS 57 CO -0.32 0.00 -0.67 -0.09 -2.27 0.00 0.00 179.45 176.10 1du6 h ARG 58 N 0.00 0.10 -0.01 1.90 2.43 -1.45 -2.79 114.38 114.57 1du6 h ARG 58 Ca 0.02 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1du6 h ARG 58 Cb 0.89 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1du6 h ARG 58 CO -0.00 0.73 -0.25 1.51 -1.51 0.00 0.00 179.97 180.45 1du6 n ILE 59 N -3.78 0.00 0.99 1.20 0.00 0.22 -3.89 119.36 114.10 1du6 n ILE 59 Ca -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 62.75 62.64 1du6 n ILE 59 Cb 0.66 0.27 0.00 0.00 0.00 0.00 0.00 39.64 40.57 1du6 n ILE 59 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1du6 n ARG 60 N -0.83 1.01 0.00 9.51 3.00 -0.95 -4.43 116.66 123.98 1du6 n ARG 60 Ca 0.12 -0.01 0.00 0.00 -0.00 0.00 0.00 57.85 57.95 1du6 n ARG 60 Cb 0.33 -1.39 0.00 0.00 0.00 0.00 0.00 32.46 31.40 1du6 n ARG 60 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.63 178.61 1du6 n TYR 61 N 0.11 0.00 -1.32 -0.14 4.19 -1.25 -5.07 117.16 113.67 1du6 n TYR 61 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1du6 n TYR 61 Cb 0.31 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.14 1du6 n TYR 61 CO 0.00 0.00 0.00 1.63 0.91 0.00 0.00 176.86 179.40 1du6 n LYS 62 N 0.00 3.84 -0.12 2.98 5.02 -1.26 -4.95 118.16 123.67 1du6 n LYS 62 Ca 0.00 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.31 1du6 n LYS 62 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.08 1du6 n LYS 62 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1du6 n LYS 63 N 0.00 1.54 0.00 1.97 3.00 -1.26 -5.05 118.16 118.36 1du6 n LYS 63 Ca 0.00 -0.54 0.00 0.00 -0.00 0.00 0.00 58.31 57.77 1du6 n LYS 63 Cb 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 35.03 33.63 1du6 n LYS 63 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67