#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 -0.24 0.00 4.04 1.04 -1.26 -5.01 113.70 112.28 1du6 s SER 2 Ca 0.00 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.17 1du6 s SER 2 Cb 0.00 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1du6 s SER 2 CO 0.00 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 174.03 1du6 n GLY 3 N -0.40 0.05 2.73 7.32 0.00 -1.26 -5.00 105.19 108.64 1du6 n GLY 3 Ca -0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 46.02 45.88 1du6 n GLY 3 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1du6 n HIS 4 N -1.14 -0.91 -3.56 1.61 -0.00 -1.26 -4.98 115.22 104.98 1du6 n HIS 4 Ca 0.00 -1.89 -0.23 0.00 -0.00 0.00 0.00 57.72 55.60 1du6 n HIS 4 Cb 0.00 0.93 0.08 0.00 -0.00 0.00 0.00 29.99 31.00 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 -1.18 -3.08 -2.69 0.61 -0.00 -1.26 -4.19 119.36 107.58 1du6 n ILE 5 Ca -0.09 -0.03 -0.05 0.00 -0.00 0.00 0.00 62.75 62.59 1du6 n ILE 5 Cb 0.85 -3.98 -0.04 0.00 -0.00 0.00 0.00 39.64 36.47 1du6 n ILE 5 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1du6 n GLU 6 N -4.83 -4.06 0.00 0.38 4.07 -1.26 -5.06 120.64 109.88 1du6 n GLU 6 Ca -0.01 3.10 0.00 0.00 -0.06 0.00 0.00 57.16 60.20 1du6 n GLU 6 Cb 0.56 -4.47 0.00 0.00 -0.06 0.00 0.00 31.44 27.47 1du6 n GLU 6 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1du6 n GLY 7 N 1.77 0.45 7.00 8.31 0.00 -1.26 -4.96 105.19 116.49 1du6 n GLY 7 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.03 1.61 5.12 -1.26 -4.74 116.66 115.36 1du6 n ARG 8 Ca 0.00 0.00 -0.08 0.00 -1.93 0.00 0.00 57.85 55.84 1du6 n ARG 8 Cb 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 32.46 31.29 1du6 n ARG 8 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1du6 n HIS 9 N 0.00 -1.28 -2.85 -1.55 8.25 -1.26 -4.80 115.22 111.74 1du6 n HIS 9 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.44 1du6 n HIS 9 Cb 0.00 -2.05 0.01 0.00 1.12 0.00 0.00 29.99 29.07 1du6 n HIS 9 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1du6 s MET 10 N -4.19 0.80 0.73 -0.41 -1.94 -1.26 -5.09 119.30 107.93 1du6 s MET 10 Ca 0.00 -0.65 0.00 0.00 -1.71 0.00 0.00 55.69 53.33 1du6 s MET 10 Cb 0.00 -0.00 0.00 0.00 2.01 0.00 0.00 34.83 36.84 1du6 s MET 10 CO 0.00 -1.03 0.00 -1.71 -0.01 0.00 0.00 175.02 172.27 1du6 n ASN 11 N 3.29 -2.50 0.00 3.03 5.15 -1.26 -3.20 115.26 119.76 1du6 n ASN 11 Ca 0.14 0.06 0.00 0.00 -0.60 0.00 0.00 54.58 54.19 1du6 n ASN 11 Cb 0.58 -0.21 0.00 0.00 -0.53 0.00 0.00 39.78 39.62 1du6 n ASN 11 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1du6 n LYS 12 N -0.92 0.00 -0.17 1.20 5.02 -1.26 -4.41 118.16 117.62 1du6 n LYS 12 Ca 0.00 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.31 1du6 n LYS 12 Cb 0.03 0.00 0.09 0.00 -0.02 0.00 0.00 35.03 35.12 1du6 n LYS 12 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1du6 n GLN 13 N 0.00 1.73 0.02 1.97 1.13 -1.26 -4.26 117.38 116.71 1du6 n GLN 13 Ca 0.00 -0.69 -0.10 0.00 -1.94 0.00 0.00 57.00 54.27 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 2.76 -0.04 -0.33 -1.58 0.00 -1.77 0.64 119.26 118.94 1du6 h ALA 14 Ca 0.00 0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.03 1du6 h ALA 14 Cb 0.63 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1du6 h ALA 14 CO 0.07 -0.56 0.36 1.15 0.00 0.00 0.00 179.25 180.28 1du6 h THR 15 N -0.12 0.40 0.07 0.00 2.02 -1.73 1.21 112.91 114.77 1du6 h THR 15 Ca 0.05 0.00 -0.25 0.00 0.77 0.00 0.00 66.41 66.98 1du6 h THR 15 Cb 0.19 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 1du6 h THR 15 CO -0.13 0.00 -1.18 -0.33 0.37 0.00 0.00 175.52 174.25 1du6 h GLU 16 N 0.00 0.16 0.08 6.66 4.39 -1.34 0.26 114.58 124.79 1du6 h GLU 16 Ca 0.15 -0.27 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 1du6 h GLU 16 Cb 0.88 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 1du6 h GLU 16 CO -0.00 1.11 -0.04 0.82 -1.16 0.00 0.00 179.01 179.74 1du6 h ILE 17 N 0.04 1.18 -0.27 3.13 1.08 0.30 0.38 117.51 123.35 1du6 h ILE 17 Ca -0.10 -1.01 -0.03 0.00 -0.39 0.00 0.00 64.86 63.33 1du6 h ILE 17 Cb 1.90 1.82 -0.01 0.00 -3.07 0.00 0.00 36.82 37.46 1du6 h ILE 17 CO 0.17 0.25 0.05 -0.07 -0.69 0.00 0.00 178.15 177.85 1du6 h LEU 18 N -0.57 0.43 -0.18 1.44 3.38 0.92 0.92 115.31 121.64 1du6 h LEU 18 Ca -0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 1du6 h LEU 18 Cb 0.48 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1du6 h LEU 18 CO 0.02 0.58 0.04 -1.13 0.09 0.00 0.00 178.44 178.03 1du6 h ASN 19 N 0.27 0.29 0.38 -0.43 -0.73 -0.52 1.17 115.58 116.01 1du6 h ASN 19 Ca 0.08 -0.25 -0.09 0.00 1.87 0.00 0.00 56.30 57.92 1du6 h ASN 19 Cb 0.33 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.83 1du6 h ASN 19 CO 0.01 0.46 -0.40 -0.08 -0.37 0.00 0.00 177.43 177.05 1du6 h GLU 20 N 0.10 0.03 0.05 6.67 4.81 -0.16 0.67 114.58 126.74 1du6 h GLU 20 Ca 0.06 -0.01 -0.24 0.00 -0.13 0.00 0.00 59.36 59.04 1du6 h GLU 20 Cb 0.29 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1du6 h GLU 20 CO 0.00 0.42 -1.11 -0.92 -0.73 0.00 0.00 179.01 176.67 1du6 h TYR 21 N 0.02 0.19 0.15 0.92 3.20 0.13 -2.41 116.97 119.17 1du6 h TYR 21 Ca -0.00 -0.14 -0.26 0.00 3.14 0.00 0.00 58.73 61.48 1du6 h TYR 21 Cb 0.72 -0.01 0.01 0.00 1.54 0.00 0.00 36.73 38.99 1du6 h TYR 21 CO 0.00 1.11 -1.22 0.35 -1.64 0.00 0.00 178.16 176.76 1du6 h PHE 22 N 0.03 0.57 0.37 -3.82 3.57 0.17 -3.27 116.94 114.56 1du6 h PHE 22 Ca -0.06 -0.42 -0.02 0.00 3.53 0.00 0.00 57.97 61.00 1du6 h PHE 22 Cb 1.85 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.57 1du6 h PHE 22 CO 0.02 1.47 -0.18 1.88 -2.23 0.00 0.00 178.31 179.28 1du6 h TYR 23 N -0.24 -0.46 -0.92 0.41 -1.99 0.23 -1.98 116.97 112.02 1du6 h TYR 23 Ca -0.24 -0.01 0.36 0.00 2.00 0.00 0.00 58.73 60.84 1du6 h TYR 23 Cb 1.80 0.15 -0.17 0.00 2.00 0.00 0.00 36.73 40.51 1du6 h TYR 23 CO 0.15 -0.28 0.41 0.43 -0.00 0.00 0.00 178.16 178.87 1du6 n SER 24 N -4.54 0.24 -2.04 3.88 7.64 -0.90 0.31 113.62 118.21 1du6 n SER 24 Ca -0.06 1.53 -0.23 0.00 1.01 0.00 0.00 58.87 61.12 1du6 n SER 24 Cb 0.19 -0.71 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 -5.13 2.71 0.18 1.43 8.25 -1.22 -4.57 115.22 116.87 1du6 n HIS 25 Ca 0.32 -2.13 0.03 0.00 -0.26 0.00 0.00 57.72 55.69 1du6 n HIS 25 Cb 1.10 -0.96 0.33 0.00 1.12 0.00 0.00 29.99 31.59 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 -2.17 2.41 5.85 0.56 0.69 115.31 123.96 1du6 h LEU 26 Ca 0.54 0.00 0.07 0.00 0.84 0.00 0.00 57.88 59.32 1du6 h LEU 26 Cb 2.04 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 43.06 1du6 h LEU 26 CO 1.07 0.42 0.24 0.77 -0.34 0.00 0.00 178.44 180.60 1du6 h SER 27 N 0.00 0.00 0.00 1.25 4.64 -1.81 -3.35 113.55 114.28 1du6 h SER 27 Ca -0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 1du6 h SER 27 Cb 0.80 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.76 1du6 h SER 27 CO 0.05 0.00 -0.02 -0.46 -0.87 0.00 0.00 176.83 175.53 1du6 n ASN 28 N -3.85 -1.31 0.00 4.97 6.94 -1.01 -5.11 115.26 115.90 1du6 n ASN 28 Ca 0.03 -1.83 0.00 0.00 -0.02 0.00 0.00 54.58 52.76 1du6 n ASN 28 Cb 0.37 0.84 0.00 0.00 -2.36 0.00 0.00 39.78 38.63 1du6 n ASN 28 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 1du6 n PRO 29 N 1.27 0.00 -4.33 -0.53 -0.04 0.24 -4.87 135.00 126.74 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 -0.49 -0.10 0.00 -0.04 0.00 0.00 33.50 33.59 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 -0.14 -1.25 -1.54 0.54 4.02 -1.26 -4.72 117.16 112.81 1du6 n TYR 30 Ca 0.00 0.61 -0.40 0.00 -0.01 0.00 0.00 57.90 58.11 1du6 n TYR 30 Cb 0.00 -2.72 -0.05 0.00 -0.02 0.00 0.00 39.34 36.55 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 -4.54 1.08 -0.46 -0.72 -0.04 -1.26 -4.93 135.00 124.12 1du6 n PRO 31 Ca -0.30 0.13 -0.19 0.00 -0.04 0.00 0.00 63.50 63.10 1du6 n PRO 31 Cb 0.68 -3.03 0.17 0.00 -0.04 0.00 0.00 33.50 31.29 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 13.67 -3.23 -0.30 3.54 7.64 -1.26 -4.13 113.62 129.54 1du6 n SER 32 Ca 0.40 -0.48 0.16 0.00 1.01 0.00 0.00 58.87 59.96 1du6 n SER 32 Cb 0.42 -0.81 0.42 0.00 -1.01 0.00 0.00 64.21 63.22 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 -2.90 0.58 0.83 1.43 -0.00 -1.99 -1.78 114.58 110.75 1du6 h GLU 33 Ca -0.26 -0.03 -0.04 0.00 -0.00 0.00 0.00 59.36 59.03 1du6 h GLU 33 Cb 0.84 -0.13 0.00 0.00 -0.00 0.00 0.00 28.75 29.46 1du6 h GLU 33 CO 0.16 0.38 -0.45 1.49 -0.00 0.00 0.00 179.01 180.59 1du6 h GLU 34 N 0.59 -1.14 -0.21 1.06 4.57 -1.98 0.15 114.58 117.63 1du6 h GLU 34 Ca 0.53 0.08 0.05 0.00 -1.18 0.00 0.00 59.36 58.84 1du6 h GLU 34 Cb 1.04 0.26 -0.05 0.00 -0.16 0.00 0.00 28.75 29.84 1du6 h GLU 34 CO -0.28 -0.76 -0.14 0.00 -1.18 0.00 0.00 179.01 176.65 1du6 h ALA 35 N -1.07 0.02 0.64 2.92 0.00 -1.67 0.90 119.26 121.01 1du6 h ALA 35 Ca -0.11 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1du6 h ALA 35 Cb 0.93 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1du6 h ALA 35 CO 0.15 -0.56 -0.43 -0.22 0.00 0.00 0.00 179.25 178.19 1du6 h LYS 36 N -0.13 -0.98 -0.94 0.00 3.11 -1.30 -0.11 116.57 116.21 1du6 h LYS 36 Ca 0.12 0.07 0.09 0.00 -2.81 0.00 0.00 60.65 58.11 1du6 h LYS 36 Cb 0.31 0.22 -0.07 0.00 -1.00 0.00 0.00 32.23 31.70 1du6 h LYS 36 CO -0.29 -0.66 0.61 1.49 -2.81 0.00 0.00 179.45 177.79 1du6 h GLU 37 N -1.02 0.98 0.25 1.90 4.22 -0.48 0.18 114.58 120.61 1du6 h GLU 37 Ca -0.08 -0.06 0.01 0.00 0.08 0.00 0.00 59.36 59.31 1du6 h GLU 37 Cb 0.84 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 1du6 h GLU 37 CO 0.06 0.65 -0.36 0.93 -2.18 0.00 0.00 179.01 178.11 1du6 h GLU 38 N 1.01 -0.65 -0.87 1.92 5.08 0.14 -0.81 114.58 120.39 1du6 h GLU 38 Ca 0.43 0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.80 1du6 h GLU 38 Cb 0.32 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.68 1du6 h GLU 38 CO -0.18 -0.43 0.43 -0.07 -1.00 0.00 0.00 179.01 177.75 1du6 h LEU 39 N -0.67 1.13 -0.77 1.33 3.38 -0.46 -2.17 115.31 117.06 1du6 h LEU 39 Ca -0.00 -0.13 0.14 0.00 0.09 0.00 0.00 57.88 57.98 1du6 h LEU 39 Cb 0.65 -0.29 -0.09 0.00 0.09 0.00 0.00 40.66 41.02 1du6 h LEU 39 CO -0.13 0.94 0.34 0.00 0.09 0.00 0.00 178.44 179.67 1du6 h ALA 40 N 1.24 1.11 -0.01 1.53 0.00 -0.00 -0.81 119.26 122.31 1du6 h ALA 40 Ca 0.30 0.10 -0.17 0.00 0.00 0.00 0.00 54.91 55.14 1du6 h ALA 40 Cb 0.10 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1du6 h ALA 40 CO -0.04 -0.18 -0.79 0.87 0.00 0.00 0.00 179.25 179.12 1du6 h LYS 41 N 0.49 0.13 -0.42 0.00 1.79 -0.79 -2.17 116.57 115.61 1du6 h LYS 41 Ca 0.42 -0.13 0.08 0.00 -2.18 0.00 0.00 60.65 58.84 1du6 h LYS 41 Cb 0.62 0.03 -0.09 0.00 -1.58 0.00 0.00 32.23 31.21 1du6 h LYS 41 CO -0.39 0.85 -0.35 0.87 -1.08 0.00 0.00 179.45 179.35 1du6 h LYS 42 N 0.08 -0.25 -0.43 3.15 1.57 -0.51 0.28 116.57 120.45 1du6 h LYS 42 Ca -0.02 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1du6 h LYS 42 Cb 1.37 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.74 1du6 h LYS 42 CO 0.11 -0.17 0.00 0.00 -0.57 0.00 0.00 179.45 178.82 1du6 n GLY 44 N 1.27 -0.38 0.00 0.00 0.00 0.09 -4.95 105.19 101.22 1du6 n GLY 44 Ca 0.16 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.40 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 -4.40 0.00 -3.64 -0.61 -5.35 -0.83 -5.04 119.36 99.49 1du6 n ILE 45 Ca -0.26 0.00 -0.06 0.00 -0.27 0.00 0.00 62.75 62.16 1du6 n ILE 45 Cb 0.66 0.00 -0.07 0.00 -1.74 0.00 0.00 39.64 38.50 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 1.84 0.00 0.36 7.28 -4.23 -1.26 -5.01 115.64 114.62 1du6 s THR 46 Ca 0.00 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 60.65 1du6 s THR 46 Cb 0.00 -1.00 0.35 0.00 1.34 0.00 0.00 72.50 73.19 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 4.76 0.50 -0.36 2.29 2.07 -1.92 0.93 116.25 124.53 1du6 h VAL 47 Ca -0.29 -0.16 0.10 0.00 0.82 0.00 0.00 66.70 67.17 1du6 h VAL 47 Cb 1.20 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1du6 h VAL 47 CO 0.16 0.09 0.27 -1.28 0.02 0.00 0.00 177.57 176.83 1du6 h SER 48 N 0.47 0.00 -0.84 0.57 0.87 -1.96 13.90 113.55 126.56 1du6 h SER 48 Ca 0.64 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 61.16 1du6 h SER 48 Cb 1.42 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.34 1du6 h SER 48 CO -0.41 0.00 0.40 1.56 -0.53 0.00 0.00 176.83 177.86 1du6 h GLN 49 N 0.00 1.21 0.00 2.24 1.08 0.50 0.11 115.11 120.25 1du6 h GLN 49 Ca 0.17 -0.18 -0.04 0.00 -1.45 0.00 0.00 58.65 57.14 1du6 h GLN 49 Cb 0.71 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 1du6 h GLN 49 CO -0.00 0.93 -0.43 0.28 -0.95 0.00 0.00 178.83 178.67 1du6 h VAL 50 N 1.20 0.43 -0.87 -0.54 2.07 0.18 -2.98 116.25 115.74 1du6 h VAL 50 Ca 0.29 -1.42 0.16 0.00 0.82 0.00 0.00 66.70 66.55 1du6 h VAL 50 Cb 0.12 0.91 -0.16 0.00 -1.52 0.00 0.00 31.29 30.65 1du6 h VAL 50 CO -0.04 0.15 -0.26 -0.24 0.02 0.00 0.00 177.57 177.20 1du6 n SER 51 N -4.63 -0.40 0.00 0.57 2.88 4.23 -1.13 113.62 115.14 1du6 n SER 51 Ca -0.10 1.50 -0.17 0.00 -1.33 0.00 0.00 58.87 58.77 1du6 n SER 51 Cb 0.30 -0.42 -0.12 0.00 -0.75 0.00 0.00 64.21 63.22 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 0.44 -0.79 -3.46 -0.26 -0.91 -3.17 115.58 107.43 1du6 h ASN 52 Ca 0.38 -0.80 0.18 0.00 -0.56 0.00 0.00 56.30 55.49 1du6 h ASN 52 Cb 0.59 -0.13 -0.14 0.00 -1.06 0.00 0.00 38.32 37.58 1du6 h ASN 52 CO -0.88 1.19 -0.06 -0.25 -1.06 0.00 0.00 177.43 176.37 1du6 h TRP 53 N -0.27 -0.17 -0.03 1.19 7.01 -0.96 1.07 115.95 123.79 1du6 h TRP 53 Ca -0.07 0.06 -0.05 0.00 2.11 0.00 0.00 58.89 60.94 1du6 h TRP 53 Cb 1.29 0.20 0.00 0.00 -2.10 0.00 0.00 29.16 28.56 1du6 h TRP 53 CO 0.17 -0.29 -0.18 0.74 -2.79 0.00 0.00 178.44 176.08 1du6 h PHE 54 N 0.06 0.24 0.00 2.65 -1.00 -1.58 -2.02 116.94 115.29 1du6 h PHE 54 Ca 0.42 -0.11 0.00 0.00 2.81 0.00 0.00 57.97 61.09 1du6 h PHE 54 Cb 0.73 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 40.25 1du6 h PHE 54 CO -0.50 0.83 0.00 0.41 -1.61 0.00 0.00 178.31 177.44 1du6 n GLY 55 N 0.76 -0.87 0.13 -1.45 0.00 -0.77 -1.50 105.19 101.49 1du6 n GLY 55 Ca -0.09 -0.10 -0.19 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.24 2.02 0.16 1.61 5.15 0.36 -4.40 115.26 118.92 1du6 n ASN 56 Ca 0.10 -0.01 0.08 0.00 -0.60 0.00 0.00 54.58 54.14 1du6 n ASN 56 Cb 0.14 -0.57 0.07 0.00 -0.53 0.00 0.00 39.78 38.89 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 -0.02 0.00 0.00 1.20 1.63 -1.26 -3.25 116.57 114.87 1du6 h LYS 57 Ca -0.54 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.26 1du6 h LYS 57 Cb 1.92 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.55 1du6 h LYS 57 CO -0.05 0.18 0.00 -2.13 -3.45 0.00 0.00 179.45 174.00 1du6 n ARG 58 N -3.04 0.14 0.39 1.90 0.63 -0.56 -2.18 116.66 113.94 1du6 n ARG 58 Ca 0.01 0.52 -0.18 0.00 -0.92 0.00 0.00 57.85 57.29 1du6 n ARG 58 Cb 0.63 -1.86 -0.09 0.00 0.45 0.00 0.00 32.46 31.59 1du6 n ARG 58 CO 0.00 0.00 0.00 -0.84 -2.51 0.00 0.00 177.63 174.28 1du6 h ILE 59 N 0.00 0.00 0.00 5.15 -2.65 -1.78 -3.43 117.51 114.80 1du6 h ILE 59 Ca 0.00 0.00 -0.16 0.00 1.03 0.00 0.00 64.86 65.73 1du6 h ILE 59 Cb 0.15 0.00 -0.13 0.00 -2.05 0.00 0.00 36.82 34.79 1du6 h ILE 59 CO 0.00 0.00 -0.16 -2.11 0.03 0.00 0.00 178.15 175.91 1du6 n ARG 60 N -5.21 0.53 0.00 0.16 0.00 -1.20 -5.00 116.66 105.94 1du6 n ARG 60 Ca -0.13 -1.25 0.00 0.00 -0.00 0.00 0.00 57.85 56.47 1du6 n ARG 60 Cb 0.45 -0.55 0.00 0.00 -0.00 0.00 0.00 32.46 32.36 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 0.47 0.00 -2.26 2.89 4.11 -0.93 -4.72 117.16 116.73 1du6 n TYR 61 Ca -0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.90 57.83 1du6 n TYR 61 Cb 0.73 -0.00 -0.01 0.00 -0.00 0.00 0.00 39.34 40.06 1du6 n TYR 61 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 1du6 n LYS 62 N 0.00 -2.37 -3.27 -3.48 4.76 -1.26 -3.20 118.16 109.35 1du6 n LYS 62 Ca 0.00 0.31 -0.16 0.00 -2.87 0.00 0.00 58.31 55.59 1du6 n LYS 62 Cb 0.01 -4.79 0.02 0.00 -1.84 0.00 0.00 35.03 28.43 1du6 n LYS 62 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 1du6 n LYS 63 N -2.45 -1.22 -0.55 1.97 3.00 -1.26 -5.31 118.16 112.35 1du6 n LYS 63 Ca -0.07 1.22 0.00 0.00 -0.00 0.00 0.00 58.31 59.46 1du6 n LYS 63 Cb 0.50 -1.90 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 -1.71 0.00 0.00 0.00 177.40 175.69