#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 4.81 -0.22 4.04 1.04 -1.26 -5.04 113.70 117.08 1du6 s SER 2 Ca 0.00 2.41 -0.28 0.00 0.48 0.00 0.00 55.95 58.56 1du6 s SER 2 Cb 0.00 -2.60 0.14 0.00 0.10 0.00 0.00 66.02 63.66 1du6 s SER 2 CO 0.00 -1.85 1.07 -0.83 0.98 0.00 0.00 173.24 172.61 1du6 s GLY 3 N -1.71 -0.15 -0.73 7.32 0.00 -1.26 -5.04 107.32 105.76 1du6 s GLY 3 Ca 0.77 2.42 -0.02 0.00 0.00 0.00 0.00 44.72 47.89 1du6 s GLY 3 CO 0.38 1.36 2.02 1.42 0.00 0.00 0.00 173.10 178.28 1du6 n HIS 4 N 1.24 3.15 -3.02 1.90 -0.00 -1.26 -4.97 115.22 112.25 1du6 n HIS 4 Ca -0.10 -2.79 -0.40 0.00 -0.00 0.00 0.00 57.72 54.43 1du6 n HIS 4 Cb 0.57 -1.35 -0.05 0.00 -0.00 0.00 0.00 29.99 29.16 1du6 n HIS 4 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.34 174.84 1du6 s ILE 5 N -4.92 5.01 0.00 1.59 1.10 -1.26 -4.99 121.20 117.73 1du6 s ILE 5 Ca 0.60 1.45 0.00 0.00 -0.51 0.00 0.00 60.65 62.20 1du6 s ILE 5 Cb 0.48 -4.05 0.00 0.00 0.15 0.00 0.00 42.46 39.05 1du6 s ILE 5 CO -0.15 0.19 0.00 -1.84 -2.11 0.00 0.00 174.94 171.03 1du6 n GLU 6 N 4.20 0.00 -1.68 3.50 0.28 -1.26 -4.96 120.64 120.72 1du6 n GLU 6 Ca -0.00 0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 56.85 1du6 n GLU 6 Cb 0.51 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 33.33 1du6 n GLU 6 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1du6 n GLY 7 N 0.00 0.88 0.00 -1.84 0.00 -1.26 -4.82 105.19 98.16 1du6 n GLY 7 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.19 0.00 -2.71 1.61 1.74 -1.26 -5.02 116.66 108.83 1du6 n ARG 8 Ca -0.15 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 56.87 1du6 n ARG 8 Cb 0.51 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 31.97 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 0.00 -0.66 -3.57 -1.55 -0.00 -1.26 -5.05 115.22 103.13 1du6 n HIS 9 Ca 0.00 0.24 -0.13 0.00 0.46 0.00 0.00 57.72 58.28 1du6 n HIS 9 Cb 0.00 -2.02 -0.06 0.00 -0.12 0.00 0.00 29.99 27.80 1du6 n HIS 9 CO 0.00 0.00 0.00 1.41 0.46 0.00 0.00 176.34 178.21 1du6 s MET 10 N -5.21 0.76 0.57 1.57 1.75 -1.26 -5.07 119.30 112.41 1du6 s MET 10 Ca 0.12 0.31 -0.02 0.00 -1.25 0.00 0.00 55.69 54.85 1du6 s MET 10 Cb -0.05 0.36 0.02 0.00 2.84 0.00 0.00 34.83 38.00 1du6 s MET 10 CO 0.17 -0.21 0.83 -0.80 -0.65 0.00 0.00 175.02 174.36 1du6 s ASN 11 N -0.84 5.38 0.00 1.11 -0.87 -1.26 -5.08 114.94 113.38 1du6 s ASN 11 Ca -0.04 0.33 0.00 0.00 -1.57 0.00 0.00 52.86 51.58 1du6 s ASN 11 Cb -0.01 -1.27 0.00 0.00 -0.02 0.00 0.00 41.25 39.94 1du6 s ASN 11 CO 0.03 -1.12 0.10 0.29 -2.57 0.00 0.00 177.10 173.84 1du6 n LYS 12 N -2.46 0.00 0.00 -0.60 4.01 -1.26 -4.31 118.16 113.54 1du6 n LYS 12 Ca 0.06 0.00 0.15 0.00 -0.51 0.00 0.00 58.31 58.00 1du6 n LYS 12 Cb 0.59 -0.48 0.72 0.00 -0.51 0.00 0.00 35.03 35.35 1du6 n LYS 12 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1du6 n GLN 13 N -0.16 1.02 -0.01 1.97 1.13 -1.26 -3.98 117.38 116.08 1du6 n GLN 13 Ca 0.00 -0.31 -0.10 0.00 -1.94 0.00 0.00 57.00 54.64 1du6 n GLN 13 Cb 0.00 -1.49 -0.05 0.00 0.11 0.00 0.00 30.24 28.81 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 3.92 0.14 -0.31 -1.58 0.00 -1.99 0.15 119.26 119.59 1du6 h ALA 14 Ca 0.00 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1du6 h ALA 14 Cb 0.26 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1du6 h ALA 14 CO 0.00 -0.39 0.34 1.15 0.00 0.00 0.00 179.25 180.35 1du6 h THR 15 N 0.12 0.42 0.10 0.00 2.02 -1.75 1.12 112.91 114.95 1du6 h THR 15 Ca 0.05 0.00 -0.27 0.00 0.77 0.00 0.00 66.41 66.96 1du6 h THR 15 Cb 0.01 0.73 -0.00 0.00 -1.74 0.00 0.00 68.15 67.15 1du6 h THR 15 CO -0.04 0.00 -1.23 -0.33 0.37 0.00 0.00 175.52 174.29 1du6 h GLU 16 N 0.00 0.22 0.18 6.66 4.39 -1.24 0.29 114.58 125.08 1du6 h GLU 16 Ca 0.15 -0.38 -0.01 0.00 0.34 0.00 0.00 59.36 59.46 1du6 h GLU 16 Cb 0.82 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 1du6 h GLU 16 CO -0.00 1.17 -0.09 0.82 -1.16 0.00 0.00 179.01 179.75 1du6 h ILE 17 N 0.06 0.92 -0.40 3.13 1.08 0.34 0.96 117.51 123.61 1du6 h ILE 17 Ca -0.12 -0.61 -0.02 0.00 -0.39 0.00 0.00 64.86 63.71 1du6 h ILE 17 Cb 1.94 1.29 -0.02 0.00 -3.07 0.00 0.00 36.82 36.96 1du6 h ILE 17 CO 0.19 0.14 0.17 -0.07 -0.69 0.00 0.00 178.15 177.88 1du6 h LEU 18 N -0.55 0.54 0.23 1.44 3.38 0.72 0.92 115.31 121.99 1du6 h LEU 18 Ca -0.03 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1du6 h LEU 18 Cb 0.42 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1du6 h LEU 18 CO 0.04 0.55 -0.11 -1.13 0.09 0.00 0.00 178.44 177.88 1du6 h ASN 19 N 0.50 -0.26 0.26 -0.43 -1.24 -0.37 1.00 115.58 115.05 1du6 h ASN 19 Ca 0.13 -0.16 -0.03 0.00 0.71 0.00 0.00 56.30 56.95 1du6 h ASN 19 Cb 0.17 0.07 -0.00 0.00 0.73 0.00 0.00 38.32 39.28 1du6 h ASN 19 CO -0.01 0.02 -0.15 -0.33 -1.29 0.00 0.00 177.43 175.67 1du6 h GLU 20 N -0.55 0.00 0.21 6.67 4.39 0.10 0.44 114.58 125.84 1du6 h GLU 20 Ca -0.03 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.39 1du6 h GLU 20 Cb 0.41 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.09 1du6 h GLU 20 CO 0.05 0.15 -1.24 -0.92 -1.16 0.00 0.00 179.01 175.89 1du6 h TYR 21 N 0.00 0.80 0.12 4.33 3.20 0.13 -3.17 116.97 122.38 1du6 h TYR 21 Ca -0.00 -0.58 -0.01 0.00 3.14 0.00 0.00 58.73 61.28 1du6 h TYR 21 Cb 0.32 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.56 1du6 h TYR 21 CO 0.00 1.48 -0.06 0.35 -1.64 0.00 0.00 178.16 178.29 1du6 h PHE 22 N -0.06 -0.15 -0.02 -3.82 3.57 0.14 -3.20 116.94 113.40 1du6 h PHE 22 Ca -0.22 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.29 1du6 h PHE 22 Cb 1.96 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 40.72 1du6 h PHE 22 CO 0.15 0.06 -0.22 1.88 -2.23 0.00 0.00 178.31 177.96 1du6 h TYR 23 N -1.02 -0.66 -1.18 0.41 -1.99 -0.31 0.37 116.97 112.60 1du6 h TYR 23 Ca -0.02 0.02 0.43 0.00 2.00 0.00 0.00 58.73 61.17 1du6 h TYR 23 Cb 0.27 0.29 -0.14 0.00 2.00 0.00 0.00 36.73 39.15 1du6 h TYR 23 CO 0.04 -0.23 0.73 0.43 -0.00 0.00 0.00 178.16 179.13 1du6 n SER 24 N -3.73 0.24 -1.79 3.88 7.64 -1.20 0.29 113.62 118.96 1du6 n SER 24 Ca -0.03 1.38 -0.18 0.00 1.01 0.00 0.00 58.87 61.05 1du6 n SER 24 Cb 0.16 -0.68 0.15 0.00 -1.01 0.00 0.00 64.21 62.83 1du6 n SER 24 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1du6 n HIS 25 N -4.76 2.24 0.22 1.43 8.25 0.06 -4.62 115.22 118.05 1du6 n HIS 25 Ca 0.37 -2.01 0.09 0.00 -0.26 0.00 0.00 57.72 55.91 1du6 n HIS 25 Cb 1.39 -0.79 0.51 0.00 1.12 0.00 0.00 29.99 32.22 1du6 n HIS 25 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1du6 h LEU 26 N 1.32 0.00 -1.14 2.41 5.85 0.82 0.74 115.31 125.30 1du6 h LEU 26 Ca 0.43 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 59.06 1du6 h LEU 26 Cb 1.84 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.86 1du6 h LEU 26 CO 0.86 0.23 -0.42 -1.28 -0.34 0.00 0.00 178.44 177.50 1du6 h SER 27 N 0.00 0.00 0.00 1.25 0.87 -1.82 -3.39 113.55 110.46 1du6 h SER 27 Ca -0.00 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.41 1du6 h SER 27 Cb 0.66 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 62.48 1du6 h SER 27 CO 0.03 0.42 -0.27 -3.20 -0.53 0.00 0.00 176.83 173.28 1du6 n ASN 28 N -3.96 -2.12 0.00 6.23 4.05 -0.99 -5.08 115.26 113.39 1du6 n ASN 28 Ca -0.02 -2.63 0.00 0.00 0.45 0.00 0.00 54.58 52.39 1du6 n ASN 28 Cb 0.46 1.34 0.00 0.00 1.23 0.00 0.00 39.78 42.81 1du6 n ASN 28 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 1du6 n PRO 29 N 1.45 0.00 -3.87 1.20 -0.04 0.25 -4.97 135.00 129.03 1du6 n PRO 29 Ca 0.05 0.15 -0.31 0.00 -0.04 0.00 0.00 63.50 63.35 1du6 n PRO 29 Cb 0.67 -0.63 0.01 0.00 -0.04 0.00 0.00 33.50 33.51 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 -1.06 -1.77 -1.54 0.54 4.02 -1.26 -4.61 117.16 111.49 1du6 n TYR 30 Ca 0.00 0.57 -0.20 0.00 -0.01 0.00 0.00 57.90 58.27 1du6 n TYR 30 Cb 0.00 -2.66 -0.13 0.00 -0.02 0.00 0.00 39.34 36.53 1du6 n TYR 30 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1du6 n PRO 31 N -3.32 0.38 0.00 -0.72 -0.02 -1.26 -4.90 135.00 125.16 1du6 n PRO 31 Ca -0.26 -0.45 0.00 0.00 -2.02 0.00 0.00 63.50 60.78 1du6 n PRO 31 Cb 0.64 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1du6 n PRO 31 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1du6 n SER 32 N 13.59 -1.57 0.09 2.55 7.64 -1.26 -4.17 113.62 130.49 1du6 n SER 32 Ca 0.54 0.00 0.08 0.00 1.01 0.00 0.00 58.87 60.50 1du6 n SER 32 Cb 0.32 0.00 0.54 0.00 -1.01 0.00 0.00 64.21 64.06 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 0.00 0.26 0.26 1.43 9.09 -2.00 -1.94 114.58 121.69 1du6 h GLU 33 Ca 0.00 -0.02 -0.01 0.00 0.05 0.00 0.00 59.36 59.38 1du6 h GLU 33 Cb 0.00 -0.06 0.00 0.00 -1.65 0.00 0.00 28.75 27.04 1du6 h GLU 33 CO 0.00 0.17 -0.12 1.49 0.05 0.00 0.00 179.01 180.60 1du6 h GLU 34 N 0.27 -0.34 -0.45 1.06 4.81 -1.98 -2.15 114.58 115.81 1du6 h GLU 34 Ca 0.12 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.45 1du6 h GLU 34 Cb 0.13 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.51 1du6 h GLU 34 CO -0.02 0.01 -0.02 0.00 -0.73 0.00 0.00 179.01 178.25 1du6 h ALA 35 N -0.49 0.40 0.18 2.92 0.00 -1.78 0.38 119.26 120.87 1du6 h ALA 35 Ca -0.04 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1du6 h ALA 35 Cb 0.50 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1du6 h ALA 35 CO 0.06 -0.40 -0.10 -0.22 0.00 0.00 0.00 179.25 178.59 1du6 h LYS 36 N 0.09 -0.25 -0.54 0.00 3.11 -1.45 0.42 116.57 117.95 1du6 h LYS 36 Ca 0.22 0.02 0.16 0.00 -2.81 0.00 0.00 60.65 58.23 1du6 h LYS 36 Cb 0.33 0.06 -0.02 0.00 -1.00 0.00 0.00 32.23 31.59 1du6 h LYS 36 CO -0.39 -0.17 0.64 1.49 -2.81 0.00 0.00 179.45 178.22 1du6 h GLU 37 N -0.26 0.00 0.25 1.90 4.81 -1.25 -0.82 114.58 119.20 1du6 h GLU 37 Ca -0.02 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1du6 h GLU 37 Cb 0.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1du6 h GLU 37 CO 0.03 0.00 -0.12 0.93 -0.73 0.00 0.00 179.01 179.12 1du6 h GLU 38 N 0.00 -0.32 -0.95 1.92 4.39 0.34 -3.17 114.58 116.79 1du6 h GLU 38 Ca 0.25 0.02 0.20 0.00 0.34 0.00 0.00 59.36 60.18 1du6 h GLU 38 Cb 1.53 0.07 -0.11 0.00 -0.10 0.00 0.00 28.75 30.14 1du6 h GLU 38 CO -0.00 -0.21 0.53 -0.07 -1.16 0.00 0.00 179.01 178.09 1du6 h LEU 39 N -0.79 0.62 -0.35 1.33 3.38 -0.01 -1.12 115.31 118.37 1du6 h LEU 39 Ca -0.03 0.12 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1du6 h LEU 39 Cb 0.25 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.94 1du6 h LEU 39 CO 0.06 0.16 -0.37 0.00 0.09 0.00 0.00 178.44 178.38 1du6 h ALA 40 N 1.67 -0.32 0.00 1.53 0.00 -1.27 0.11 119.26 120.98 1du6 h ALA 40 Ca 0.57 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.52 1du6 h ALA 40 Cb 0.98 0.76 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 1du6 h ALA 40 CO -0.43 -0.80 -0.17 0.87 0.00 0.00 0.00 179.25 178.72 1du6 h LYS 41 N -0.32 0.00 -0.08 0.00 1.79 -1.20 0.60 116.57 117.37 1du6 h LYS 41 Ca 0.14 0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.63 1du6 h LYS 41 Cb 0.56 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.18 1du6 h LYS 41 CO -0.52 0.17 -0.26 -0.22 -1.08 0.00 0.00 179.45 177.55 1du6 h LYS 42 N 0.00 -0.26 0.00 3.15 1.63 -0.03 -3.24 116.57 117.82 1du6 h LYS 42 Ca -0.00 0.02 -0.31 0.00 -0.85 0.00 0.00 60.65 59.50 1du6 h LYS 42 Cb 0.42 0.06 -0.06 0.00 -0.60 0.00 0.00 32.23 32.05 1du6 h LYS 42 CO 0.02 -0.17 -1.96 0.00 -3.45 0.00 0.00 179.45 173.89 1du6 n GLY 44 N 1.62 0.81 0.00 0.00 0.00 0.21 -5.09 105.19 102.73 1du6 n GLY 44 Ca -0.23 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.22 0.00 -4.03 -0.61 -5.35 -1.14 -5.02 119.36 101.99 1du6 n ILE 45 Ca 0.00 0.00 -0.17 0.00 -0.27 0.00 0.00 62.75 62.31 1du6 n ILE 45 Cb 0.30 0.00 -0.16 0.00 -1.74 0.00 0.00 39.64 38.05 1du6 n ILE 45 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1du6 s THR 46 N 3.64 0.30 0.42 7.28 -4.23 -1.26 -5.00 115.64 116.78 1du6 s THR 46 Ca 0.00 -0.04 0.16 0.00 -1.18 0.00 0.00 61.69 60.63 1du6 s THR 46 Cb 0.00 -0.33 0.37 0.00 1.34 0.00 0.00 72.50 73.88 1du6 s THR 46 CO 0.00 0.14 1.88 0.58 -0.54 0.00 0.00 174.62 176.68 1du6 h VAL 47 N 5.82 0.73 -0.27 2.29 2.07 -1.94 0.97 116.25 125.93 1du6 h VAL 47 Ca -0.37 -0.15 0.08 0.00 0.82 0.00 0.00 66.70 67.08 1du6 h VAL 47 Cb 1.16 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1du6 h VAL 47 CO 0.49 0.08 0.20 0.77 0.02 0.00 0.00 177.57 179.13 1du6 h SER 48 N 0.43 0.00 -0.83 0.57 4.64 -1.96 15.97 113.55 132.37 1du6 h SER 48 Ca 0.43 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.78 1du6 h SER 48 Cb 1.02 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.06 1du6 h SER 48 CO -0.16 0.00 0.53 -0.61 -0.87 0.00 0.00 176.83 175.73 1du6 h GLN 49 N 0.00 1.02 0.00 4.77 5.75 0.58 0.71 115.11 127.94 1du6 h GLN 49 Ca 0.13 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 1du6 h GLN 49 Cb 0.53 -0.23 0.00 0.00 1.07 0.00 0.00 27.48 28.85 1du6 h GLN 49 CO -0.00 0.67 -0.28 0.28 -2.65 0.00 0.00 178.83 176.85 1du6 h VAL 50 N 1.05 0.00 -0.86 2.39 2.07 0.23 -2.89 116.25 118.24 1du6 h VAL 50 Ca 0.33 -0.87 0.24 0.00 0.82 0.00 0.00 66.70 67.21 1du6 h VAL 50 Cb -0.01 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.60 1du6 h VAL 50 CO -0.11 0.00 0.02 -0.24 0.02 0.00 0.00 177.57 177.27 1du6 n SER 51 N -4.36 -0.09 0.04 0.57 2.88 4.83 0.26 113.62 117.74 1du6 n SER 51 Ca -0.04 1.45 -0.20 0.00 -1.33 0.00 0.00 58.87 58.76 1du6 n SER 51 Cb 0.15 -0.53 -0.12 0.00 -0.75 0.00 0.00 64.21 62.96 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 0.73 -0.15 -3.46 -0.26 0.33 -3.07 115.58 109.70 1du6 h ASN 52 Ca 0.52 -0.78 0.05 0.00 -0.56 0.00 0.00 56.30 55.53 1du6 h ASN 52 Cb 1.08 -0.22 -0.07 0.00 -1.06 0.00 0.00 38.32 38.05 1du6 h ASN 52 CO -0.80 1.42 -0.33 -0.25 -1.06 0.00 0.00 177.43 176.41 1du6 h TRP 53 N 0.11 -0.91 -0.22 1.19 7.01 0.04 0.33 115.95 123.50 1du6 h TRP 53 Ca -0.12 0.04 -0.12 0.00 2.11 0.00 0.00 58.89 60.80 1du6 h TRP 53 Cb 1.59 0.42 -0.01 0.00 -2.10 0.00 0.00 29.16 29.07 1du6 h TRP 53 CO 0.13 -0.40 -0.38 0.74 -2.79 0.00 0.00 178.44 175.73 1du6 h PHE 54 N -0.39 0.57 0.00 2.65 -1.00 -1.50 -0.01 116.94 117.26 1du6 h PHE 54 Ca 0.10 -0.16 -0.02 0.00 2.81 0.00 0.00 57.97 60.70 1du6 h PHE 54 Cb 0.55 -0.13 -0.00 0.00 3.61 0.00 0.00 35.95 39.98 1du6 h PHE 54 CO -0.42 0.80 -0.09 0.78 -1.61 0.00 0.00 178.31 177.77 1du6 h GLY 55 N 1.09 0.00 0.33 -1.45 0.00 -1.31 -2.31 103.07 99.42 1du6 h GLY 55 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.35 1du6 h GLY 55 CO 0.07 0.00 -1.70 -2.01 0.00 0.00 0.00 176.54 172.90 1du6 n ASN 56 N -3.20 0.28 0.08 0.19 5.15 0.11 -4.29 115.26 113.57 1du6 n ASN 56 Ca 0.01 0.11 -0.18 0.00 -0.60 0.00 0.00 54.58 53.92 1du6 n ASN 56 Cb 0.38 1.45 -0.14 0.00 -0.53 0.00 0.00 39.78 40.94 1du6 n ASN 56 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 1du6 h LYS 57 N 0.00 0.30 0.00 1.20 1.63 -0.86 -3.25 116.57 115.58 1du6 h LYS 57 Ca -0.02 -0.51 0.00 0.00 -0.85 0.00 0.00 60.65 59.27 1du6 h LYS 57 Cb 1.06 0.19 0.00 0.00 -0.60 0.00 0.00 32.23 32.88 1du6 h LYS 57 CO 0.00 1.18 0.00 -2.13 -3.45 0.00 0.00 179.45 175.05 1du6 n ARG 58 N -3.50 0.01 0.00 1.90 0.63 -0.88 -2.28 116.66 112.53 1du6 n ARG 58 Ca -0.17 0.35 0.00 0.00 -0.92 0.00 0.00 57.85 57.11 1du6 n ARG 58 Cb 1.05 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 32.46 1du6 n ARG 58 CO 0.00 0.00 0.00 1.51 -2.51 0.00 0.00 177.63 176.63 1du6 n ILE 59 N -1.49 0.00 -2.68 5.15 0.13 -1.23 -4.78 119.36 114.46 1du6 n ILE 59 Ca 0.02 1.15 -0.05 0.00 -1.10 0.00 0.00 62.75 62.77 1du6 n ILE 59 Cb 0.10 -2.10 0.09 0.00 -0.84 0.00 0.00 39.64 36.88 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 -1.62 0.94 0.00 9.51 0.00 -1.23 -4.99 116.66 119.27 1du6 n ARG 60 Ca 0.00 -1.41 0.00 0.00 -0.00 0.00 0.00 57.85 56.44 1du6 n ARG 60 Cb 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 32.46 32.49 1du6 n ARG 60 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.63 180.11 1du6 n TYR 61 N -0.69 0.00 -3.66 2.89 4.11 -0.97 -4.35 117.16 114.51 1du6 n TYR 61 Ca -0.10 0.00 -0.05 0.00 -0.00 0.00 0.00 57.90 57.74 1du6 n TYR 61 Cb 0.79 -0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 40.06 1du6 n TYR 61 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 1du6 s LYS 62 N -1.19 0.43 -1.35 -3.48 2.47 -1.26 -5.05 119.74 110.31 1du6 s LYS 62 Ca 0.00 1.21 -0.09 0.00 -1.56 0.00 0.00 55.97 55.53 1du6 s LYS 62 Cb 0.00 0.55 -0.07 0.00 -1.46 0.00 0.00 37.83 36.84 1du6 s LYS 62 CO 0.00 -0.23 2.61 1.63 0.16 0.00 0.00 175.35 179.53 1du6 n LYS 63 N 5.38 3.05 -0.50 4.03 4.76 -1.26 -5.20 118.16 128.43 1du6 n LYS 63 Ca -0.10 -1.94 0.00 0.00 -2.87 0.00 0.00 58.31 53.39 1du6 n LYS 63 Cb 0.49 -2.70 0.00 0.00 -1.84 0.00 0.00 35.03 30.99 1du6 n LYS 63 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12