#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 7.06 1.21 -3.46 0.01 -1.26 -4.25 113.70 113.01 1du6 s SER 2 Ca 0.00 2.16 0.00 0.00 1.31 0.00 0.00 55.95 59.42 1du6 s SER 2 Cb 0.00 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.62 1du6 s SER 2 CO 0.00 -0.29 0.00 0.61 0.41 0.00 0.00 173.24 173.97 1du6 n GLY 3 N 0.84 1.50 2.27 3.44 0.00 -1.26 -3.19 105.19 108.79 1du6 n GLY 3 Ca 0.01 -0.50 -0.28 0.00 0.00 0.00 0.00 46.02 45.25 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 12.42 3.14 -2.65 1.61 -0.00 -1.26 -4.97 115.22 123.51 1du6 n HIS 4 Ca 0.00 -2.32 -0.05 0.00 -0.00 0.00 0.00 57.72 55.34 1du6 n HIS 4 Cb 0.00 -1.15 -0.04 0.00 -0.00 0.00 0.00 29.99 28.80 1du6 n HIS 4 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.34 175.45 1du6 n ILE 5 N -1.06-12.09 -1.63 3.57 2.08 -1.19 -5.05 119.36 103.98 1du6 n ILE 5 Ca 0.61 2.56 0.00 0.00 0.56 0.00 0.00 62.75 66.48 1du6 n ILE 5 Cb 1.27 -6.31 0.00 0.00 -0.75 0.00 0.00 39.64 33.85 1du6 n ILE 5 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1du6 n GLU 6 N 1.72 0.00 0.00 0.38 2.13 -1.26 -4.91 120.64 118.69 1du6 n GLU 6 Ca -0.37 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.45 1du6 n GLU 6 Cb 0.58 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.29 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 0.00 0.82 2.11 8.31 0.00 -1.26 -4.11 105.19 111.06 1du6 n GLY 7 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.60 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 -5.05 116.66 113.70 1du6 n ARG 8 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1du6 n ARG 8 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 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 -2.96 0.00 0.00 -1.55 -0.00 -1.26 -4.73 115.22 104.72 1du6 n HIS 9 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1du6 n HIS 9 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 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 1.49 -3.49 1.57 0.00 -1.26 -4.69 117.12 110.74 1du6 n MET 10 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.70 57.58 1du6 n MET 10 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 33.22 33.12 1du6 n MET 10 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1du6 s ASN 11 N -1.03 0.47 0.35 6.12 2.47 -1.26 -5.03 114.94 117.03 1du6 s ASN 11 Ca 0.00 0.29 0.10 0.00 0.42 0.00 0.00 52.86 53.67 1du6 s ASN 11 Cb 0.00 0.89 0.86 0.00 -1.45 0.00 0.00 41.25 41.55 1du6 s ASN 11 CO 0.00 -0.29 1.83 0.11 -3.72 0.00 0.00 177.10 175.04 1du6 h LYS 12 N 8.23 0.63 0.00 0.43 1.57 -1.98 -1.20 116.57 124.25 1du6 h LYS 12 Ca -0.17 -0.04 -0.24 0.00 -1.87 0.00 0.00 60.65 58.33 1du6 h LYS 12 Cb 1.14 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 33.27 1du6 h LYS 12 CO 0.23 0.42 -1.25 -0.56 -0.57 0.00 0.00 179.45 177.72 1du6 h GLN 13 N 0.65 0.00 -1.02 3.15 -0.00 -2.02 -3.33 115.11 112.54 1du6 h GLN 13 Ca 0.50 0.00 0.26 0.00 -0.00 0.00 0.00 58.65 59.41 1du6 h GLN 13 Cb 0.91 0.00 -0.12 0.00 -0.00 0.00 0.00 27.48 28.26 1du6 h GLN 13 CO -0.26 0.79 0.61 0.00 -0.00 0.00 0.00 178.83 179.97 1du6 h ALA 14 N 1.02 1.91 -0.79 0.06 0.00 -1.62 1.03 119.26 120.88 1du6 h ALA 14 Ca -0.11 0.12 0.22 0.00 0.00 0.00 0.00 54.91 55.14 1du6 h ALA 14 Cb 1.84 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.63 1du6 h ALA 14 CO 0.11 -0.39 0.56 1.15 0.00 0.00 0.00 179.25 180.67 1du6 h THR 15 N 0.51 0.63 0.04 0.00 2.02 -1.67 1.31 112.91 115.75 1du6 h THR 15 Ca 0.65 -0.03 -0.23 0.00 0.77 0.00 0.00 66.41 67.58 1du6 h THR 15 Cb 1.36 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 1du6 h THR 15 CO -0.46 0.01 -1.01 -0.33 0.37 0.00 0.00 175.52 174.10 1du6 h GLU 16 N 0.08 0.24 -0.40 6.66 4.39 0.86 1.15 114.58 127.57 1du6 h GLU 16 Ca 0.38 -0.32 -0.10 0.00 0.34 0.00 0.00 59.36 59.67 1du6 h GLU 16 Cb 1.40 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 30.14 1du6 h GLU 16 CO -0.03 1.07 -0.14 0.82 -1.16 0.00 0.00 179.01 179.57 1du6 h ILE 17 N 0.11 1.28 0.05 3.13 1.08 0.14 0.82 117.51 124.12 1du6 h ILE 17 Ca -0.08 -1.25 -0.23 0.00 -0.39 0.00 0.00 64.86 62.91 1du6 h ILE 17 Cb 1.69 1.25 0.02 0.00 -3.07 0.00 0.00 36.82 36.71 1du6 h ILE 17 CO 0.16 0.42 -0.93 -0.07 -0.69 0.00 0.00 178.15 177.04 1du6 h LEU 18 N 0.60 0.73 -0.22 1.44 3.38 0.12 0.21 115.31 121.58 1du6 h LEU 18 Ca 0.10 -0.79 -0.04 0.00 0.09 0.00 0.00 57.88 57.23 1du6 h LEU 18 Cb 0.68 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1du6 h LEU 18 CO 0.05 1.44 -0.03 -1.13 0.09 0.00 0.00 178.44 178.86 1du6 h ASN 19 N 0.11 0.41 0.41 -0.43 -1.24 0.14 1.18 115.58 116.16 1du6 h ASN 19 Ca -0.13 -0.34 -0.09 0.00 0.71 0.00 0.00 56.30 56.45 1du6 h ASN 19 Cb 1.62 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 40.55 1du6 h ASN 19 CO 0.18 0.65 -0.41 -0.08 -1.29 0.00 0.00 177.43 176.48 1du6 h GLU 20 N 0.15 0.00 0.04 6.67 4.22 0.59 0.57 114.58 126.82 1du6 h GLU 20 Ca 0.06 0.00 -0.23 0.00 0.08 0.00 0.00 59.36 59.27 1du6 h GLU 20 Cb 0.46 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1du6 h GLU 20 CO 0.02 0.41 -1.08 -0.92 -2.18 0.00 0.00 179.01 175.25 1du6 h TYR 21 N 0.00 0.14 0.03 0.92 3.20 -0.57 -2.31 116.97 118.37 1du6 h TYR 21 Ca -0.00 -0.10 -0.04 0.00 3.14 0.00 0.00 58.73 61.72 1du6 h TYR 21 Cb 0.72 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.99 1du6 h TYR 21 CO 0.00 1.08 -0.18 0.35 -1.64 0.00 0.00 178.16 177.77 1du6 h PHE 22 N 0.02 0.11 0.61 -3.82 3.57 0.18 -3.23 116.94 114.39 1du6 h PHE 22 Ca -0.05 -0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.34 1du6 h PHE 22 Cb 1.83 -0.00 0.01 0.00 2.79 0.00 0.00 35.95 40.57 1du6 h PHE 22 CO 0.02 1.07 -0.29 1.88 -2.23 0.00 0.00 178.31 178.75 1du6 h TYR 23 N -0.87 -0.76 -0.93 0.41 -1.99 0.01 0.80 116.97 113.64 1du6 h TYR 23 Ca -0.03 -0.02 0.39 0.00 2.00 0.00 0.00 58.73 61.07 1du6 h TYR 23 Cb 1.14 0.25 -0.17 0.00 2.00 0.00 0.00 36.73 39.95 1du6 h TYR 23 CO 0.26 -0.47 0.49 0.45 -0.00 0.00 0.00 178.16 178.89 1du6 n SER 24 N -4.86 0.31 -1.12 3.88 2.88 -0.87 0.23 113.62 114.07 1du6 n SER 24 Ca -0.10 1.55 -0.02 0.00 -1.33 0.00 0.00 58.87 58.97 1du6 n SER 24 Cb 0.32 -0.75 0.21 0.00 -0.75 0.00 0.00 64.21 63.24 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 -5.12 1.08 0.28 0.66 8.25 -1.15 -4.66 115.22 114.56 1du6 n HIS 25 Ca 0.35 -1.48 0.17 0.00 -0.26 0.00 0.00 57.72 56.51 1du6 n HIS 25 Cb 1.19 -0.47 0.70 0.00 1.12 0.00 0.00 29.99 32.54 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 1.11 0.00 -2.19 2.41 7.12 0.99 0.48 115.31 125.23 1du6 h LEU 26 Ca 0.19 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.19 1du6 h LEU 26 Cb 1.64 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 41.76 1du6 h LEU 26 CO 0.37 0.01 -0.06 -1.28 -0.13 0.00 0.00 178.44 177.35 1du6 h SER 27 N 0.00 0.00 0.00 1.25 0.87 -1.83 -3.37 113.55 110.47 1du6 h SER 27 Ca -0.00 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.47 1du6 h SER 27 Cb 0.49 0.00 -0.12 0.00 -0.44 0.00 0.00 62.40 62.34 1du6 h SER 27 CO 0.00 0.06 0.01 -3.20 -0.53 0.00 0.00 176.83 173.17 1du6 n ASN 28 N -3.51 -1.28 0.00 6.23 2.85 -0.95 -5.12 115.26 113.48 1du6 n ASN 28 Ca -0.02 -1.87 0.00 0.00 -0.11 0.00 0.00 54.58 52.58 1du6 n ASN 28 Cb 0.18 0.99 0.00 0.00 1.24 0.00 0.00 39.78 42.20 1du6 n ASN 28 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1du6 n PRO 29 N 0.90 0.00 -4.09 1.20 -0.04 0.16 -4.91 135.00 128.23 1du6 n PRO 29 Ca -0.03 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.12 1du6 n PRO 29 Cb 0.74 -0.20 -0.04 0.00 -0.04 0.00 0.00 33.50 33.96 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 -0.01 -1.48 -1.44 0.54 4.02 -1.26 -4.71 117.16 112.83 1du6 n TYR 30 Ca 0.00 0.55 -0.53 0.00 -0.01 0.00 0.00 57.90 57.91 1du6 n TYR 30 Cb 0.00 -3.19 -0.08 0.00 -0.02 0.00 0.00 39.34 36.05 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 -4.56 0.86 -0.18 -0.72 -0.02 -1.26 -4.92 135.00 124.20 1du6 n PRO 31 Ca -0.27 0.25 -0.15 0.00 -2.02 0.00 0.00 63.50 61.31 1du6 n PRO 31 Cb 0.66 -2.21 0.14 0.00 -0.02 0.00 0.00 33.50 32.07 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 8.79 -2.93 0.12 2.55 7.64 -1.26 -4.22 113.62 124.32 1du6 n SER 32 Ca 0.42 -0.42 0.12 0.00 1.01 0.00 0.00 58.87 60.00 1du6 n SER 32 Cb 0.16 -0.53 0.63 0.00 -1.01 0.00 0.00 64.21 63.46 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 0.07 0.40 1.43 4.11 -1.99 -1.80 114.58 116.79 1du6 h GLU 33 Ca -0.19 -0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.22 1du6 h GLU 33 Cb 0.64 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1du6 h GLU 33 CO 0.11 0.04 -0.19 1.49 0.07 0.00 0.00 179.01 180.54 1du6 h GLU 34 N 0.07 -0.51 -0.39 1.06 4.81 -1.98 -2.14 114.58 115.49 1du6 h GLU 34 Ca 0.12 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.46 1du6 h GLU 34 Cb 0.40 0.12 -0.07 0.00 0.63 0.00 0.00 28.75 29.82 1du6 h GLU 34 CO -0.01 -0.27 -0.04 0.00 -0.73 0.00 0.00 179.01 177.96 1du6 h ALA 35 N -0.97 0.32 0.68 2.92 0.00 -1.80 0.92 119.26 121.33 1du6 h ALA 35 Ca -0.05 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1du6 h ALA 35 Cb 0.47 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1du6 h ALA 35 CO 0.09 -0.42 -0.44 -0.22 0.00 0.00 0.00 179.25 178.26 1du6 h LYS 36 N 0.06 -1.02 -0.90 0.00 3.11 -1.45 0.22 116.57 116.59 1du6 h LYS 36 Ca 0.19 0.07 0.13 0.00 -2.81 0.00 0.00 60.65 58.23 1du6 h LYS 36 Cb 0.28 0.23 -0.07 0.00 -1.00 0.00 0.00 32.23 31.67 1du6 h LYS 36 CO -0.35 -0.68 0.58 0.93 -2.81 0.00 0.00 179.45 177.12 1du6 h GLU 37 N -1.06 0.75 0.38 1.90 5.08 -1.04 0.30 114.58 120.89 1du6 h GLU 37 Ca -0.09 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1du6 h GLU 37 Cb 0.86 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 1du6 h GLU 37 CO 0.07 0.50 -0.38 0.93 -1.00 0.00 0.00 179.01 179.13 1du6 h GLU 38 N 0.77 -0.75 -0.68 2.33 4.39 0.17 0.12 114.58 120.94 1du6 h GLU 38 Ca 0.45 0.05 -0.02 0.00 0.34 0.00 0.00 59.36 60.18 1du6 h GLU 38 Cb 0.62 0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 29.41 1du6 h GLU 38 CO -0.21 -0.50 0.33 -0.07 -1.16 0.00 0.00 179.01 177.40 1du6 h LEU 39 N -0.78 0.86 -0.51 1.33 3.38 -0.16 -1.51 115.31 117.93 1du6 h LEU 39 Ca -0.03 -0.09 0.07 0.00 0.09 0.00 0.00 57.88 57.93 1du6 h LEU 39 Cb 0.70 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 1du6 h LEU 39 CO -0.07 0.72 0.17 0.00 0.09 0.00 0.00 178.44 179.36 1du6 h ALA 40 N 1.41 0.62 0.00 1.53 0.00 0.31 -1.58 119.26 121.55 1du6 h ALA 40 Ca 0.24 0.07 -0.13 0.00 0.00 0.00 0.00 54.91 55.09 1du6 h ALA 40 Cb 0.09 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1du6 h ALA 40 CO -0.03 -0.23 -0.60 0.87 0.00 0.00 0.00 179.25 179.26 1du6 h LYS 41 N 0.34 0.00 -0.24 0.00 1.79 -0.31 -2.17 116.57 115.98 1du6 h LYS 41 Ca 0.25 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.77 1du6 h LYS 41 Cb 0.29 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.86 1du6 h LYS 41 CO -0.27 0.60 -0.48 0.87 -1.08 0.00 0.00 179.45 179.09 1du6 h LYS 42 N 0.00 -0.45 -0.51 3.15 1.57 -0.25 -0.75 116.57 119.32 1du6 h LYS 42 Ca -0.01 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1du6 h LYS 42 Cb 1.10 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1du6 h LYS 42 CO 0.08 -0.30 0.00 0.00 -0.57 0.00 0.00 179.45 178.66 1du6 n GLY 44 N 1.23 -0.25 0.00 0.00 0.00 -0.29 -4.94 105.19 100.94 1du6 n GLY 44 Ca 0.17 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.34 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 -4.42 0.00 -3.64 -0.61 -5.35 -0.84 -5.03 119.36 99.46 1du6 n ILE 45 Ca -0.24 0.00 -0.08 0.00 -0.27 0.00 0.00 62.75 62.16 1du6 n ILE 45 Cb 0.65 0.00 -0.07 0.00 -1.74 0.00 0.00 39.64 38.48 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 2.13 0.00 0.35 7.28 -4.23 -1.26 -5.01 115.64 114.89 1du6 s THR 46 Ca 0.00 0.00 0.13 0.00 -1.18 0.00 0.00 61.69 60.64 1du6 s THR 46 Cb 0.00 -1.00 0.34 0.00 1.34 0.00 0.00 72.50 73.18 1du6 s THR 46 CO 0.00 0.00 1.74 0.58 -0.54 0.00 0.00 174.62 176.40 1du6 h VAL 47 N 4.87 0.52 -0.31 2.29 2.07 -1.93 0.91 116.25 124.67 1du6 h VAL 47 Ca -0.30 -0.17 0.09 0.00 0.82 0.00 0.00 66.70 67.14 1du6 h VAL 47 Cb 1.22 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1du6 h VAL 47 CO 0.15 0.09 0.24 0.77 0.02 0.00 0.00 177.57 178.84 1du6 h SER 48 N 0.51 0.00 -0.76 0.57 4.64 -1.96 13.76 113.55 130.30 1du6 h SER 48 Ca 0.63 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.93 1du6 h SER 48 Cb 1.35 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.41 1du6 h SER 48 CO -0.42 0.00 0.39 1.56 -0.87 0.00 0.00 176.83 177.50 1du6 h GLN 49 N 0.00 1.08 0.00 4.77 1.08 0.44 0.39 115.11 122.87 1du6 h GLN 49 Ca 0.15 -0.14 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1du6 h GLN 49 Cb 0.63 -0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 27.86 1du6 h GLN 49 CO -0.00 0.83 -0.22 0.28 -0.95 0.00 0.00 178.83 178.76 1du6 h VAL 50 N 1.07 0.12 -0.87 -0.54 2.07 0.18 -2.77 116.25 115.51 1du6 h VAL 50 Ca 0.27 -1.11 0.18 0.00 0.82 0.00 0.00 66.70 66.86 1du6 h VAL 50 Cb 0.08 0.25 -0.17 0.00 -1.52 0.00 0.00 31.29 29.93 1du6 h VAL 50 CO -0.04 0.04 -0.18 -0.24 0.02 0.00 0.00 177.57 177.17 1du6 n SER 51 N -4.70 -0.28 0.03 0.57 2.88 4.19 -0.62 113.62 115.69 1du6 n SER 51 Ca -0.04 1.50 -0.19 0.00 -1.33 0.00 0.00 58.87 58.80 1du6 n SER 51 Cb 0.14 -0.47 -0.12 0.00 -0.75 0.00 0.00 64.21 63.02 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 0.67 -0.16 -3.46 2.35 -0.34 -3.08 115.58 111.56 1du6 h ASN 52 Ca 0.43 -0.79 0.05 0.00 -0.55 0.00 0.00 56.30 55.44 1du6 h ASN 52 Cb 0.70 -0.21 -0.07 0.00 0.05 0.00 0.00 38.32 38.80 1du6 h ASN 52 CO -0.89 1.38 -0.37 -0.25 -1.65 0.00 0.00 177.43 175.66 1du6 h TRP 53 N 0.04 -1.03 0.11 1.19 7.01 -0.56 0.36 115.95 123.07 1du6 h TRP 53 Ca -0.11 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 60.92 1du6 h TRP 53 Cb 1.54 0.47 0.00 0.00 -2.10 0.00 0.00 29.16 29.08 1du6 h TRP 53 CO 0.14 -0.43 -0.05 0.74 -2.79 0.00 0.00 178.44 176.04 1du6 h PHE 54 N -0.42 -0.14 0.00 2.65 -1.00 -1.57 0.71 116.94 117.17 1du6 h PHE 54 Ca 0.10 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.87 1du6 h PHE 54 Cb 0.58 0.05 0.00 0.00 3.61 0.00 0.00 35.95 40.19 1du6 h PHE 54 CO -0.46 0.26 0.00 0.78 -1.61 0.00 0.00 178.31 177.29 1du6 h GLY 55 N -0.59 0.00 0.00 -1.45 0.00 -1.43 -1.89 103.07 97.71 1du6 h GLY 55 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1du6 h GLY 55 CO 0.03 0.00 -0.77 -2.01 0.00 0.00 0.00 176.54 173.79 1du6 n ASN 56 N -2.93 1.68 0.32 0.19 5.15 0.13 -4.33 115.26 115.46 1du6 n ASN 56 Ca -0.03 0.37 0.10 0.00 -0.60 0.00 0.00 54.58 54.43 1du6 n ASN 56 Cb 0.08 -0.74 0.55 0.00 -0.53 0.00 0.00 39.78 39.13 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 -0.88 0.00 0.00 1.20 1.63 0.45 1.88 116.57 120.86 1du6 h LYS 57 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1du6 h LYS 57 Cb 0.77 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.40 1du6 h LYS 57 CO 0.00 0.00 0.00 -2.13 -3.45 0.00 0.00 179.45 173.87 1du6 n ARG 58 N -2.72 0.09 0.00 1.90 0.00 -0.71 -2.85 116.66 112.36 1du6 n ARG 58 Ca -0.01 0.22 0.00 0.00 -0.00 0.00 0.00 57.85 58.05 1du6 n ARG 58 Cb 0.57 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.53 1du6 n ARG 58 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 1du6 n ILE 59 N -1.41 0.00 -2.83 5.15 -6.64 0.64 -4.73 119.36 109.55 1du6 n ILE 59 Ca 0.05 1.30 -0.11 0.00 -1.77 0.00 0.00 62.75 62.23 1du6 n ILE 59 Cb 0.14 -2.29 0.03 0.00 -1.44 0.00 0.00 39.64 36.08 1du6 n ILE 59 CO 0.00 0.00 0.00 0.54 -1.77 0.00 0.00 176.55 175.32 1du6 n ARG 60 N -1.43 0.75 0.00 6.28 3.00 -1.24 -4.99 116.66 119.02 1du6 n ARG 60 Ca 0.00 -2.00 0.00 0.00 -0.01 0.00 0.00 57.85 55.84 1du6 n ARG 60 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 32.46 31.03 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 1.69 0.00 -1.61 -1.55 4.11 -1.13 -4.73 117.16 113.95 1du6 n TYR 61 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.02 1du6 n TYR 61 Cb 0.61 -0.03 0.00 0.00 -0.00 0.00 0.00 39.34 39.92 1du6 n TYR 61 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.86 178.03 1du6 n LYS 62 N -0.03 0.00 -0.16 -3.48 0.00 -1.26 -5.01 118.16 108.22 1du6 n LYS 62 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 58.31 58.31 1du6 n LYS 62 Cb 0.07 0.00 0.05 0.00 0.00 0.00 0.00 35.03 35.15 1du6 n LYS 62 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1du6 n LYS 63 N 0.00 1.49 0.00 1.64 4.01 -1.26 -5.20 118.16 118.84 1du6 n LYS 63 Ca 0.00 -0.49 0.00 0.00 -0.51 0.00 0.00 58.31 57.31 1du6 n LYS 63 Cb 0.00 -1.49 0.00 0.00 -0.51 0.00 0.00 35.03 33.03 1du6 n LYS 63 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56