#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1du6 n SER 2 N 0.00 -0.12 0.00 4.04 7.64 -1.26 -5.15 113.62 118.76 1du6 n SER 2 Ca 0.00 -2.25 0.00 0.00 1.01 0.00 0.00 58.87 57.63 1du6 n SER 2 Cb 0.00 0.89 0.00 0.00 -1.01 0.00 0.00 64.21 64.09 1du6 n SER 2 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1du6 n GLY 3 N -0.20 1.02 3.56 0.23 0.00 -1.26 -5.18 105.19 103.37 1du6 n GLY 3 Ca 0.03 -0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.99 1du6 n GLY 3 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1du6 s HIS 4 N 0.96 -0.23 -0.05 1.61 5.65 -1.26 -5.09 115.29 116.88 1du6 s HIS 4 Ca 0.00 0.12 -0.02 0.00 0.25 0.00 0.00 55.06 55.41 1du6 s HIS 4 Cb 0.00 0.53 0.01 0.00 -1.18 0.00 0.00 32.58 31.94 1du6 s HIS 4 CO 0.00 -0.40 0.04 1.51 -0.65 0.00 0.00 174.74 175.24 1du6 n ILE 5 N -0.20 -4.00 -3.61 0.89 3.06 -1.26 -5.03 119.36 109.21 1du6 n ILE 5 Ca -0.05 0.72 -0.05 0.00 -2.50 0.00 0.00 62.75 60.88 1du6 n ILE 5 Cb 0.60 -3.63 -0.07 0.00 0.54 0.00 0.00 39.64 37.09 1du6 n ILE 5 CO 0.00 0.00 0.00 -1.61 -2.50 0.00 0.00 176.55 172.44 1du6 s GLU 6 N -0.55 0.45 0.00 9.51 0.41 -1.26 -5.02 118.70 122.24 1du6 s GLU 6 Ca -0.04 1.20 0.00 0.00 -0.41 0.00 0.00 54.97 55.71 1du6 s GLU 6 Cb 0.00 0.55 0.00 0.00 -1.78 0.00 0.00 34.13 32.90 1du6 s GLU 6 CO 0.18 -0.27 0.00 0.41 -0.49 0.00 0.00 175.26 175.10 1du6 n GLY 7 N 5.42 1.92 5.43 -1.39 0.00 -1.26 -5.06 105.19 110.25 1du6 n GLY 7 Ca -0.09 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 -3.65 1.61 1.74 -1.26 -4.44 116.66 110.67 1du6 n ARG 8 Ca 0.00 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.05 1du6 n ARG 8 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 1du6 n ARG 8 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1du6 s HIS 9 N 0.00 -1.25 -0.37 -1.55 -3.43 -1.26 -5.05 115.29 102.38 1du6 s HIS 9 Ca 0.00 2.26 0.06 0.00 -0.80 0.00 0.00 55.06 56.59 1du6 s HIS 9 Cb 0.00 0.75 0.28 0.00 -1.43 0.00 0.00 32.58 32.18 1du6 s HIS 9 CO 0.00 -0.62 1.26 -1.33 -2.00 0.00 0.00 174.74 172.05 1du6 n MET 10 N 5.04 0.86 -1.28 -0.38 2.81 -1.26 -5.02 117.12 117.89 1du6 n MET 10 Ca -0.15 -1.45 0.14 0.00 -1.81 0.00 0.00 57.70 54.43 1du6 n MET 10 Cb 0.53 -0.05 -0.08 0.00 -0.71 0.00 0.00 33.22 32.91 1du6 n MET 10 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1du6 n ASN 11 N -0.54 -6.49 0.00 7.83 4.13 -1.26 -4.00 115.26 114.93 1du6 n ASN 11 Ca -0.11 1.15 0.00 0.00 1.68 0.00 0.00 54.58 57.30 1du6 n ASN 11 Cb 0.78 -4.34 0.00 0.00 -1.54 0.00 0.00 39.78 34.69 1du6 n ASN 11 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1du6 n LYS 12 N -4.08 0.00 -0.09 3.52 4.76 -1.26 -4.08 118.16 116.92 1du6 n LYS 12 Ca -0.07 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.39 1du6 n LYS 12 Cb 0.57 -0.68 0.07 0.00 -1.84 0.00 0.00 35.03 33.16 1du6 n LYS 12 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1du6 n GLN 13 N -0.36 1.41 0.19 1.97 1.13 -1.26 -4.19 117.38 116.27 1du6 n GLN 13 Ca 0.00 -0.56 -0.14 0.00 -1.94 0.00 0.00 57.00 54.35 1du6 n GLN 13 Cb 0.00 -1.18 -0.07 0.00 0.11 0.00 0.00 30.24 29.10 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 3.18 -0.52 -0.23 -1.58 0.00 -1.74 0.31 119.26 118.67 1du6 h ALA 14 Ca 0.00 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.89 1du6 h ALA 14 Cb 0.28 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1du6 h ALA 14 CO 0.01 -0.82 0.26 1.15 0.00 0.00 0.00 179.25 179.85 1du6 h THR 15 N -0.54 0.44 0.08 0.00 2.02 -1.73 0.70 112.91 113.89 1du6 h THR 15 Ca -0.02 0.00 -0.25 0.00 0.77 0.00 0.00 66.41 66.91 1du6 h THR 15 Cb 0.48 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 1du6 h THR 15 CO -0.02 0.00 -1.12 -0.33 0.37 0.00 0.00 175.52 174.42 1du6 h GLU 16 N 0.00 0.28 -0.47 6.66 4.39 -1.38 0.82 114.58 124.88 1du6 h GLU 16 Ca 0.11 -0.41 -0.14 0.00 0.34 0.00 0.00 59.36 59.26 1du6 h GLU 16 Cb 0.62 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.40 1du6 h GLU 16 CO -0.00 1.16 -0.24 0.82 -1.16 0.00 0.00 179.01 179.58 1du6 h ILE 17 N 0.11 1.27 0.03 3.13 1.08 0.38 0.98 117.51 124.49 1du6 h ILE 17 Ca -0.11 -1.41 -0.15 0.00 -0.39 0.00 0.00 64.86 62.81 1du6 h ILE 17 Cb 1.82 1.16 0.01 0.00 -3.07 0.00 0.00 36.82 36.75 1du6 h ILE 17 CO 0.18 0.48 -0.60 -0.07 -0.69 0.00 0.00 178.15 177.46 1du6 h LEU 18 N 0.84 0.48 0.03 1.44 3.38 -0.10 -0.69 115.31 120.69 1du6 h LEU 18 Ca 0.10 -0.81 -0.00 0.00 0.09 0.00 0.00 57.88 57.27 1du6 h LEU 18 Cb 0.82 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1du6 h LEU 18 CO 0.07 1.23 -0.02 -1.13 0.09 0.00 0.00 178.44 178.68 1du6 h ASN 19 N -0.21 -0.04 0.24 -0.43 -0.73 0.71 0.85 115.58 115.96 1du6 h ASN 19 Ca -0.08 -0.27 -0.03 0.00 1.87 0.00 0.00 56.30 57.78 1du6 h ASN 19 Cb 1.35 0.01 -0.00 0.00 0.27 0.00 0.00 38.32 39.94 1du6 h ASN 19 CO 0.12 0.25 -0.17 -0.08 -0.37 0.00 0.00 177.43 177.18 1du6 h GLU 20 N -0.33 0.00 0.16 6.67 4.57 0.89 0.72 114.58 127.27 1du6 h GLU 20 Ca -0.00 0.00 -0.29 0.00 -1.18 0.00 0.00 59.36 57.88 1du6 h GLU 20 Cb 0.31 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 28.91 1du6 h GLU 20 CO 0.01 0.17 -1.31 -0.92 -1.18 0.00 0.00 179.01 175.78 1du6 h TYR 21 N 0.00 0.66 0.40 0.92 3.20 -0.69 -2.80 116.97 118.66 1du6 h TYR 21 Ca -0.00 -0.48 -0.02 0.00 3.14 0.00 0.00 58.73 61.37 1du6 h TYR 21 Cb 0.33 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.58 1du6 h TYR 21 CO 0.00 1.37 -0.19 0.35 -1.64 0.00 0.00 178.16 178.05 1du6 h PHE 22 N 0.11 -0.50 0.61 -3.82 3.57 0.13 -3.09 116.94 113.96 1du6 h PHE 22 Ca -0.17 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.30 1du6 h PHE 22 Cb 2.02 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 40.91 1du6 h PHE 22 CO 0.09 -0.31 -0.48 1.88 -2.23 0.00 0.00 178.31 177.26 1du6 h TYR 23 N -1.07 -1.30 -1.14 0.41 0.05 -1.05 -0.80 116.97 112.06 1du6 h TYR 23 Ca -0.05 -0.00 0.42 0.00 0.05 0.00 0.00 58.73 59.15 1du6 h TYR 23 Cb 0.41 0.49 -0.14 0.00 1.01 0.00 0.00 36.73 38.50 1du6 h TYR 23 CO 0.01 -0.68 0.70 0.45 -1.05 0.00 0.00 178.16 177.59 1du6 n SER 24 N -5.58 0.24 -1.89 3.88 2.88 -1.06 0.29 113.62 112.39 1du6 n SER 24 Ca -0.13 1.38 -0.22 0.00 -1.33 0.00 0.00 58.87 58.57 1du6 n SER 24 Cb 0.47 -0.68 0.12 0.00 -0.75 0.00 0.00 64.21 63.37 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 -4.76 2.45 0.23 0.66 8.25 -0.67 -4.64 115.22 116.74 1du6 n HIS 25 Ca 0.37 -2.23 0.10 0.00 -0.26 0.00 0.00 57.72 55.69 1du6 n HIS 25 Cb 1.35 -0.83 0.51 0.00 1.12 0.00 0.00 29.99 32.15 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 1.58 0.00 -2.05 2.41 5.85 0.58 0.54 115.31 124.22 1du6 h LEU 26 Ca 0.44 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 59.14 1du6 h LEU 26 Cb 1.56 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.59 1du6 h LEU 26 CO 0.96 0.23 -0.09 0.28 -0.34 0.00 0.00 178.44 179.48 1du6 h SER 27 N 0.00 0.00 0.00 1.25 0.02 -1.82 -3.38 113.55 109.62 1du6 h SER 27 Ca -0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.83 1du6 h SER 27 Cb 0.65 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.06 1du6 h SER 27 CO 0.03 0.09 -0.09 -0.46 -1.14 0.00 0.00 176.83 175.26 1du6 n ASN 28 N -3.80 -1.54 0.00 3.07 0.23 -0.98 -5.11 115.26 107.13 1du6 n ASN 28 Ca -0.02 -2.15 0.00 0.00 -0.53 0.00 0.00 54.58 51.88 1du6 n ASN 28 Cb 0.19 1.10 0.00 0.00 -2.08 0.00 0.00 39.78 38.99 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 1.06 0.00 -4.26 -0.53 -0.04 0.18 -4.87 135.00 126.55 1du6 n PRO 29 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 1du6 n PRO 29 Cb 0.72 -0.33 -0.09 0.00 -0.04 0.00 0.00 33.50 33.76 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 -0.07 -1.17 -1.54 0.54 4.02 -1.26 -4.70 117.16 112.98 1du6 n TYR 30 Ca 0.00 0.59 -0.37 0.00 -0.01 0.00 0.00 57.90 58.12 1du6 n TYR 30 Cb 0.00 -2.45 -0.06 0.00 -0.02 0.00 0.00 39.34 36.81 1du6 n TYR 30 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1du6 n PRO 31 N -4.28 0.75 -0.02 -0.72 -0.04 -1.26 -4.93 135.00 124.50 1du6 n PRO 31 Ca -0.22 -0.03 -0.02 0.00 -0.04 0.00 0.00 63.50 63.19 1du6 n PRO 31 Cb 0.61 -2.94 0.02 0.00 -0.04 0.00 0.00 33.50 31.15 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 14.57 -1.98 0.12 3.54 7.64 -1.26 -4.18 113.62 132.06 1du6 n SER 32 Ca 0.45 -0.06 0.06 0.00 1.01 0.00 0.00 58.87 60.33 1du6 n SER 32 Cb 0.41 -0.07 0.53 0.00 -1.01 0.00 0.00 64.21 64.07 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 0.28 0.00 1.43 4.39 -2.00 -0.67 114.58 118.01 1du6 h GLU 33 Ca -0.03 -0.02 -0.10 0.00 0.34 0.00 0.00 59.36 59.56 1du6 h GLU 33 Cb 0.09 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 1du6 h GLU 33 CO 0.02 0.18 -0.46 1.49 -1.16 0.00 0.00 179.01 179.08 1du6 h GLU 34 N 0.28 0.00 0.00 2.33 4.22 -1.99 -2.06 114.58 117.36 1du6 h GLU 34 Ca 0.09 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.53 1du6 h GLU 34 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1du6 h GLU 34 CO -0.02 0.46 -0.00 0.00 -2.18 0.00 0.00 179.01 177.27 1du6 h ALA 35 N 1.54 -0.00 -0.85 2.92 0.00 -1.42 -2.33 119.26 119.13 1du6 h ALA 35 Ca -0.00 -0.46 0.03 0.00 0.00 0.00 0.00 54.91 54.47 1du6 h ALA 35 Cb 0.91 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 1du6 h ALA 35 CO 0.06 -0.01 0.55 1.57 0.00 0.00 0.00 179.25 181.42 1du6 h LYS 36 N -0.99 1.04 -0.58 0.00 5.09 -1.34 -0.61 116.57 119.19 1du6 h LYS 36 Ca -0.00 -0.06 -0.10 0.00 0.09 0.00 0.00 60.65 60.58 1du6 h LYS 36 Cb 0.92 -0.24 -0.02 0.00 0.10 0.00 0.00 32.23 33.00 1du6 h LYS 36 CO 0.00 0.69 -0.01 0.93 -2.09 0.00 0.00 179.45 178.97 1du6 h GLU 37 N 1.08 1.02 0.51 0.07 5.08 -1.49 -0.38 114.58 120.47 1du6 h GLU 37 Ca 0.33 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1du6 h GLU 37 Cb -0.02 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.13 1du6 h GLU 37 CO -0.11 1.01 -0.28 0.93 -1.00 0.00 0.00 179.01 179.57 1du6 h GLU 38 N 0.94 -0.70 -0.72 2.33 5.08 -0.72 -2.52 114.58 118.25 1du6 h GLU 38 Ca 0.17 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1du6 h GLU 38 Cb 0.56 0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.93 1du6 h GLU 38 CO 0.03 -0.47 0.45 -0.07 -1.00 0.00 0.00 179.01 177.95 1du6 h LEU 39 N -0.73 0.85 -1.24 1.33 3.38 -1.10 -2.03 115.31 115.77 1du6 h LEU 39 Ca -0.06 -0.04 0.20 0.00 0.09 0.00 0.00 57.88 58.07 1du6 h LEU 39 Cb 0.58 -0.21 -0.09 0.00 0.09 0.00 0.00 40.66 41.03 1du6 h LEU 39 CO 0.09 0.64 0.61 0.00 0.09 0.00 0.00 178.44 179.87 1du6 h ALA 40 N 1.51 1.92 -0.01 1.53 0.00 -0.65 -0.15 119.26 123.41 1du6 h ALA 40 Ca 0.26 0.05 -0.21 0.00 0.00 0.00 0.00 54.91 55.02 1du6 h ALA 40 Cb -0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1du6 h ALA 40 CO -0.05 -0.26 -0.87 0.87 0.00 0.00 0.00 179.25 178.94 1du6 h LYS 41 N 0.61 0.32 -0.31 0.00 1.79 -1.01 -1.41 116.57 116.56 1du6 h LYS 41 Ca 0.53 -0.33 0.06 0.00 -2.18 0.00 0.00 60.65 58.73 1du6 h LYS 41 Cb 1.04 0.09 -0.08 0.00 -1.58 0.00 0.00 32.23 31.69 1du6 h LYS 41 CO -0.29 1.01 -0.46 0.87 -1.08 0.00 0.00 179.45 179.51 1du6 h LYS 42 N 0.19 -0.39 -0.03 3.15 1.57 -0.87 -1.26 116.57 118.92 1du6 h LYS 42 Ca -0.06 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1du6 h LYS 42 Cb 1.49 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.89 1du6 h LYS 42 CO 0.14 -0.26 0.00 0.00 -0.57 0.00 0.00 179.45 178.76 1du6 n GLY 44 N 1.24 -0.34 0.00 0.00 0.00 -0.48 -4.98 105.19 100.63 1du6 n GLY 44 Ca 0.17 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.36 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 -4.27 0.00 -3.72 -0.61 -0.00 -0.74 -5.02 119.36 105.00 1du6 n ILE 45 Ca -0.28 0.00 -0.12 0.00 -0.00 0.00 0.00 62.75 62.35 1du6 n ILE 45 Cb 0.67 0.00 -0.12 0.00 -0.00 0.00 0.00 39.64 40.20 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 3.25 -0.03 0.44 7.28 -4.23 -1.26 -4.99 115.64 116.11 1du6 s THR 46 Ca 0.00 0.10 0.24 0.00 -1.18 0.00 0.00 61.69 60.84 1du6 s THR 46 Cb 0.00 -0.50 0.43 0.00 1.34 0.00 0.00 72.50 73.78 1du6 s THR 46 CO 0.00 0.04 1.79 0.58 -0.54 0.00 0.00 174.62 176.49 1du6 h VAL 47 N 5.51 0.51 -0.45 2.29 2.07 -1.91 0.71 116.25 124.98 1du6 h VAL 47 Ca -0.36 -0.09 0.12 0.00 0.82 0.00 0.00 66.70 67.18 1du6 h VAL 47 Cb 1.17 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1du6 h VAL 47 CO 0.33 0.05 0.32 -1.28 0.02 0.00 0.00 177.57 177.01 1du6 h SER 48 N 0.27 0.05 -0.79 0.57 0.87 -1.96 16.24 113.55 128.79 1du6 h SER 48 Ca 0.56 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 61.09 1du6 h SER 48 Cb 1.67 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 63.58 1du6 h SER 48 CO -0.20 0.03 0.35 1.56 -0.53 0.00 0.00 176.83 178.04 1du6 h GLN 49 N 0.05 1.17 0.00 2.24 1.08 0.04 0.44 115.11 120.12 1du6 h GLN 49 Ca 0.21 -0.19 -0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1du6 h GLN 49 Cb 0.78 -0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 28.01 1du6 h GLN 49 CO -0.01 0.92 -0.10 0.28 -0.95 0.00 0.00 178.83 178.97 1du6 h VAL 50 N 1.14 0.07 -0.87 -0.54 2.07 0.21 -2.83 116.25 115.50 1du6 h VAL 50 Ca 0.27 -1.05 0.16 0.00 0.82 0.00 0.00 66.70 66.90 1du6 h VAL 50 Cb 0.17 0.13 -0.16 0.00 -1.52 0.00 0.00 31.29 29.91 1du6 h VAL 50 CO -0.03 0.02 -0.25 -0.24 0.02 0.00 0.00 177.57 177.10 1du6 n SER 51 N -4.74 -0.38 0.06 0.57 2.88 4.91 0.13 113.62 117.05 1du6 n SER 51 Ca -0.02 1.50 -0.07 0.00 -1.33 0.00 0.00 58.87 58.95 1du6 n SER 51 Cb 0.07 -0.42 0.09 0.00 -0.75 0.00 0.00 64.21 63.19 1du6 n SER 51 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 1du6 h ASN 52 N 0.00 0.40 0.64 -3.46 -0.73 -0.25 -2.31 115.58 109.88 1du6 h ASN 52 Ca 0.39 -0.23 -0.03 0.00 1.87 0.00 0.00 56.30 58.29 1du6 h ASN 52 Cb 0.60 -0.12 0.01 0.00 0.27 0.00 0.00 38.32 39.08 1du6 h ASN 52 CO -0.89 0.92 -0.31 -0.25 -0.37 0.00 0.00 177.43 176.53 1du6 h TRP 53 N 0.26 -0.80 0.00 0.67 7.01 0.14 -2.16 115.95 121.07 1du6 h TRP 53 Ca -0.01 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 60.97 1du6 h TRP 53 Cb 1.14 0.26 0.00 0.00 -2.10 0.00 0.00 29.16 28.47 1du6 h TRP 53 CO 0.03 -0.48 0.00 1.19 -2.79 0.00 0.00 178.44 176.39 1du6 n PHE 54 N -5.44 0.00 -0.01 2.65 3.01 -0.01 -0.14 117.46 117.52 1du6 n PHE 54 Ca -0.13 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.14 1du6 n PHE 54 Cb 0.36 -0.25 -0.14 0.00 -0.01 0.00 0.00 39.48 39.44 1du6 n PHE 54 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1du6 h GLY 55 N 4.10 0.20 0.00 1.37 0.00 -1.05 -3.28 103.07 104.42 1du6 h GLY 55 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 46.81 1du6 h GLY 55 CO 0.00 0.45 -0.89 -2.01 0.00 0.00 0.00 176.54 174.09 1du6 n ASN 56 N -4.21 1.83 0.15 0.19 4.05 -0.84 -4.33 115.26 112.10 1du6 n ASN 56 Ca -0.19 0.35 0.06 0.00 0.45 0.00 0.00 54.58 55.25 1du6 n ASN 56 Cb 0.75 -0.74 0.30 0.00 1.23 0.00 0.00 39.78 41.32 1du6 n ASN 56 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 177.26 175.38 1du6 n LYS 57 N -4.38 0.08 0.01 1.20 4.81 0.80 0.20 118.16 120.87 1du6 n LYS 57 Ca -0.12 0.54 0.19 0.00 -0.87 0.00 0.00 58.31 58.05 1du6 n LYS 57 Cb 0.46 -2.07 0.68 0.00 0.02 0.00 0.00 35.03 34.12 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 0.01 0.00 1.64 2.43 -1.60 -3.33 114.38 113.53 1du6 h ARG 58 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1du6 h ARG 58 Cb 0.64 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1du6 h ARG 58 CO 0.00 0.01 0.00 1.51 -1.51 0.00 0.00 179.97 179.98 1du6 n ILE 59 N -4.39 0.00 0.00 1.20 0.13 0.13 -4.78 119.36 111.65 1du6 n ILE 59 Ca 0.09 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.74 1du6 n ILE 59 Cb 0.58 -0.09 0.00 0.00 -0.84 0.00 0.00 39.64 39.29 1du6 n ILE 59 CO 0.00 0.00 0.00 -1.14 2.80 0.00 0.00 176.55 178.21 1du6 n ARG 60 N 0.00 0.00 -0.49 9.51 0.63 -1.25 -4.25 116.66 120.80 1du6 n ARG 60 Ca 0.00 0.00 0.05 0.00 -0.92 0.00 0.00 57.85 56.98 1du6 n ARG 60 Cb 0.00 -0.50 0.24 0.00 0.45 0.00 0.00 32.46 32.65 1du6 n ARG 60 CO 0.00 0.00 0.00 2.48 -2.51 0.00 0.00 177.63 177.60 1du6 n TYR 61 N 0.00 1.15 -3.35 -0.14 0.18 -1.26 -4.98 117.16 108.76 1du6 n TYR 61 Ca 0.00 -0.42 -0.23 0.00 1.88 0.00 0.00 57.90 59.13 1du6 n TYR 61 Cb 0.00 -0.28 0.02 0.00 -0.38 0.00 0.00 39.34 38.70 1du6 n TYR 61 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 1du6 n LYS 62 N 0.50 -1.39 -2.75 -3.48 3.00 -1.26 -4.98 118.16 107.79 1du6 n LYS 62 Ca 0.17 1.26 -0.06 0.00 -0.00 0.00 0.00 58.31 59.68 1du6 n LYS 62 Cb 0.74 -1.89 0.03 0.00 0.00 0.00 0.00 35.03 33.91 1du6 n LYS 62 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1du6 n LYS 63 N 0.37 0.59 -0.54 1.64 3.00 -1.26 -5.20 118.16 116.75 1du6 n LYS 63 Ca -0.05 -1.77 0.00 0.00 -0.00 0.00 0.00 58.31 56.49 1du6 n LYS 63 Cb 0.59 -1.31 0.00 0.00 0.00 0.00 0.00 35.03 34.31 1du6 n LYS 63 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69