#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3du7 n ASP 5 N 0.00 0.00 -0.03 0.00 -0.08 -1.26 -5.10 116.55 110.07 3du7 n ASP 5 Ca 0.00 0.00 -0.19 0.00 -1.51 0.00 0.00 54.79 53.09 3du7 n ASP 5 Cb 0.00 0.00 -0.14 0.00 2.34 0.00 0.00 41.12 43.32 3du7 n ASP 5 CO 0.00 0.00 0.00 0.23 0.12 0.00 0.00 177.20 177.55 3du7 n MET 6 N 0.00 0.72 -1.14 -0.67 2.81 -1.26 -5.09 117.12 112.49 3du7 n MET 6 Ca 0.00 0.23 0.15 0.00 -1.81 0.00 0.00 57.70 56.26 3du7 n MET 6 Cb 0.00 -1.67 -0.04 0.00 -0.71 0.00 0.00 33.22 30.80 3du7 n MET 6 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 3du7 n GLU 7 N -3.35 -2.27 0.00 0.03 0.00 -1.26 -4.65 120.64 109.14 3du7 n GLU 7 Ca -0.33 1.57 0.00 0.00 0.00 0.00 0.00 57.16 58.39 3du7 n GLU 7 Cb 1.04 -2.79 0.00 0.00 0.00 0.00 0.00 31.44 29.69 3du7 n GLU 7 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 3du7 n VAL 8 N -3.48 0.00 -1.60 3.84 0.24 -1.26 -4.44 118.33 111.63 3du7 n VAL 8 Ca -0.01 0.00 -0.49 0.00 -2.04 0.00 0.00 64.34 61.81 3du7 n VAL 8 Cb 0.63 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.96 3du7 n VAL 8 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 3du7 n ILE 9 N 0.00 0.57 -3.26 1.34 2.08 -1.21 -4.62 119.36 114.26 3du7 n ILE 9 Ca 0.00 -0.14 -0.40 0.00 0.56 0.00 0.00 62.75 62.77 3du7 n ILE 9 Cb 0.00 -0.99 -0.08 0.00 -0.75 0.00 0.00 39.64 37.82 3du7 n ILE 9 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 3du7 s GLU 10 N -0.02 4.00 -0.51 0.38 2.12 -1.26 -2.53 118.70 120.88 3du7 s GLU 10 Ca 0.76 0.21 0.01 0.00 0.36 0.00 0.00 54.97 56.31 3du7 s GLU 10 Cb -0.83 -3.67 0.13 0.00 0.26 0.00 0.00 34.13 30.01 3du7 s GLU 10 CO 0.49 -0.38 0.27 -0.51 -0.54 0.00 0.00 175.26 174.59 3du7 s LEU 11 N 2.28 4.78 0.00 2.70 1.43 -0.64 -4.94 118.68 124.29 3du7 s LEU 11 Ca 0.20 -2.71 0.00 0.00 -1.03 0.00 0.00 54.13 50.59 3du7 s LEU 11 Cb -0.16 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.34 3du7 s LEU 11 CO 0.10 -0.33 0.00 0.59 0.23 0.00 0.00 176.35 176.94 3du7 n ASN 12 N 3.58 0.00 -3.68 2.29 5.03 -1.26 -3.23 115.26 118.00 3du7 n ASN 12 Ca 0.05 0.00 -0.10 0.00 0.87 0.00 0.00 54.58 55.39 3du7 n ASN 12 Cb 0.37 0.07 -0.11 0.00 -1.02 0.00 0.00 39.78 39.09 3du7 n ASN 12 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 3du7 s LYS 13 N -3.75 0.30 0.50 3.52 1.02 -1.26 -3.40 119.74 116.67 3du7 s LYS 13 Ca 0.00 0.87 0.02 0.00 0.02 0.00 0.00 55.97 56.87 3du7 s LYS 13 Cb 0.00 0.12 -0.01 0.00 -0.52 0.00 0.00 37.83 37.41 3du7 s LYS 13 CO 0.00 -0.22 0.03 0.00 -0.92 0.00 0.00 175.35 174.23 3du7 h THR 15 N 1.34 0.69 -1.63 0.00 1.35 -2.06 -3.29 112.91 109.33 3du7 h THR 15 Ca -0.44 -0.84 -0.44 0.00 -0.55 0.00 0.00 66.41 64.14 3du7 h THR 15 Cb 1.31 1.53 -0.40 0.00 -1.73 0.00 0.00 68.15 68.86 3du7 h THR 15 CO 0.74 0.19 -1.19 -0.24 -0.25 0.00 0.00 175.52 174.77 3du7 n SER 16 N -3.65 1.14 0.00 5.36 2.88 -1.26 -5.13 113.62 112.97 3du7 n SER 16 Ca -0.01 -2.91 0.00 0.00 -1.33 0.00 0.00 58.87 54.61 3du7 n SER 16 Cb 0.32 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 63.20 3du7 n SER 16 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3du7 n GLY 17 N 0.14 -0.86 0.00 0.46 0.00 -1.24 -5.18 105.19 98.51 3du7 n GLY 17 Ca 0.19 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3du7 n GLY 17 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3du7 n GLN 18 N 0.00 0.00 -4.28 1.61 7.27 -1.26 -3.86 117.38 116.85 3du7 n GLN 18 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 57.00 56.92 3du7 n GLN 18 Cb 0.00 0.00 -0.10 0.00 2.41 0.00 0.00 30.24 32.55 3du7 n GLN 18 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 3du7 s SER 19 N 0.00 0.97 0.00 1.69 0.01 -1.20 -5.02 113.70 110.15 3du7 s SER 19 Ca 0.00 -1.36 0.00 0.00 1.31 0.00 0.00 55.95 55.90 3du7 s SER 19 Cb 0.00 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.43 3du7 s SER 19 CO 0.00 -0.74 0.00 2.22 0.41 0.00 0.00 173.24 175.13 3du7 n PHE 20 N -0.40 0.00 -2.42 2.43 -1.74 -1.26 -1.62 117.46 112.46 3du7 n PHE 20 Ca -0.00 0.00 -0.40 0.00 -0.56 0.00 0.00 57.45 56.49 3du7 n PHE 20 Cb 0.66 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.62 3du7 n PHE 20 CO 0.00 0.00 0.00 -1.83 -0.56 0.00 0.00 176.76 174.37 3du7 s GLU 21 N -0.42 4.46 -0.26 3.97 1.03 -1.05 -4.88 118.70 121.56 3du7 s GLU 21 Ca 0.00 1.82 0.10 0.00 0.03 0.00 0.00 54.97 56.92 3du7 s GLU 21 Cb 0.00 -3.02 0.45 0.00 -0.80 0.00 0.00 34.13 30.77 3du7 s GLU 21 CO 0.00 0.04 1.19 1.33 -1.33 0.00 0.00 175.26 176.49 3du7 n VAL 22 N 0.82 2.26 -1.54 1.83 0.24 -1.26 -3.29 118.33 117.39 3du7 n VAL 22 Ca 0.01 -3.77 -0.51 0.00 -2.04 0.00 0.00 64.34 58.02 3du7 n VAL 22 Cb 0.45 -0.64 -0.05 0.00 -1.47 0.00 0.00 33.84 32.13 3du7 n VAL 22 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 3du7 n ILE 23 N -0.76 0.75 -0.06 1.34 2.08 -1.26 -4.85 119.36 116.59 3du7 n ILE 23 Ca 0.34 -0.19 -0.07 0.00 0.56 0.00 0.00 62.75 63.39 3du7 n ILE 23 Cb 0.90 -0.53 -0.09 0.00 -0.75 0.00 0.00 39.64 39.16 3du7 n ILE 23 CO 0.00 0.00 0.00 -0.11 0.56 0.00 0.00 176.55 177.00 3du7 n LEU 24 N 1.94 0.50 -3.69 1.39 7.94 -1.26 -4.71 117.00 119.11 3du7 n LEU 24 Ca 0.17 -0.01 -0.14 0.00 -1.11 0.00 0.00 56.01 54.92 3du7 n LEU 24 Cb 0.20 0.16 -0.09 0.00 0.53 0.00 0.00 43.42 44.22 3du7 n LEU 24 CO 0.60 0.38 0.22 -0.54 -1.11 0.00 0.00 177.39 176.94 3du7 s LYS 25 N -2.30 0.64 0.19 1.96 -0.14 -1.26 -4.87 119.74 113.96 3du7 s LYS 25 Ca -0.09 0.70 -0.23 0.00 -1.36 0.00 0.00 55.97 54.99 3du7 s LYS 25 Cb 0.04 0.31 -0.14 0.00 -1.68 0.00 0.00 37.83 36.36 3du7 s LYS 25 CO 0.48 -0.09 0.39 -2.30 -0.76 0.00 0.00 175.35 173.07 3du7 n PRO 26 N 2.68 0.00 -0.27 -1.68 -0.02 -1.26 -4.82 135.00 129.63 3du7 n PRO 26 Ca -0.14 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.42 3du7 n PRO 26 Cb 0.56 -0.83 0.16 0.00 -0.02 0.00 0.00 33.50 33.37 3du7 n PRO 26 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3du7 n PRO 27 N 0.87 -0.07 -0.31 0.52 -0.02 -1.26 -5.25 135.00 129.49 3du7 n PRO 27 Ca 0.14 1.18 0.00 0.00 -2.02 0.00 0.00 63.50 62.80 3du7 n PRO 27 Cb 0.22 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 3du7 n PRO 27 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3du7 n SER 28 N -5.17 0.00 0.00 2.55 2.88 -1.26 -5.24 113.62 107.38 3du7 n SER 28 Ca 0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 3du7 n SER 28 Cb 0.48 -1.69 0.00 0.00 -0.75 0.00 0.00 64.21 62.25 3du7 n SER 28 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3du7 n SER 46 N 0.00 0.00 -3.14 -3.46 2.88 -1.26 -5.34 113.62 103.30 3du7 n SER 46 Ca 0.00 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.22 3du7 n SER 46 Cb 0.00 0.07 -0.01 0.00 -0.75 0.00 0.00 64.21 63.52 3du7 n SER 46 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3du7 n LEU 47 N -1.48 -1.52 -2.96 2.46 -0.00 -1.26 -4.99 117.00 107.25 3du7 n LEU 47 Ca 0.00 0.70 -0.15 0.00 -0.00 0.00 0.00 56.01 56.55 3du7 n LEU 47 Cb 0.00 -0.66 -0.01 0.00 -0.00 0.00 0.00 43.42 42.75 3du7 n LEU 47 CO 0.00 -2.62 -0.16 1.21 -0.00 0.00 0.00 177.39 175.82 3du7 n GLU 48 N 0.85 1.20 0.00 1.96 0.00 -1.26 -4.49 120.64 118.90 3du7 n GLU 48 Ca 0.10 -3.42 0.02 0.00 0.00 0.00 0.00 57.16 53.86 3du7 n GLU 48 Cb 0.24 -1.57 0.11 0.00 0.00 0.00 0.00 31.44 30.22 3du7 n GLU 48 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 3du7 n GLU 49 N 0.11 0.07 -2.71 5.31 0.00 -1.26 -4.10 120.64 118.05 3du7 n GLU 49 Ca 0.19 0.22 -0.42 0.00 0.00 0.00 0.00 57.16 57.16 3du7 n GLU 49 Cb 0.71 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.66 3du7 n GLU 49 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.13 178.64 3du7 n ILE 50 N -1.26 5.42 -1.26 6.31 3.06 -1.26 -3.96 119.36 126.41 3du7 n ILE 50 Ca 0.02 -5.60 0.08 0.00 -2.50 0.00 0.00 62.75 54.75 3du7 n ILE 50 Cb 0.03 -1.97 0.18 0.00 0.54 0.00 0.00 39.64 38.42 3du7 n ILE 50 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3du7 n GLN 51 N 1.32 1.54 0.16 9.51 0.00 -1.26 -4.58 117.38 124.06 3du7 n GLN 51 Ca 0.37 -2.88 0.01 0.00 0.00 0.00 0.00 57.00 54.50 3du7 n GLN 51 Cb 0.31 -1.58 0.25 0.00 0.00 0.00 0.00 30.24 29.21 3du7 n GLN 51 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 3du7 h LYS 52 N 0.52 0.00 0.00 2.61 3.11 -1.95 -2.62 116.57 118.25 3du7 h LYS 52 Ca 0.01 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 3du7 h LYS 52 Cb 1.07 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.30 3du7 h LYS 52 CO 0.04 0.52 0.00 1.63 -2.81 0.00 0.00 179.45 178.83 3du7 n LYS 53 N -3.81 0.08 -0.04 1.90 4.76 -1.26 -1.89 118.16 117.90 3du7 n LYS 53 Ca -0.01 0.24 -0.03 0.00 -2.87 0.00 0.00 58.31 55.63 3du7 n LYS 53 Cb 0.55 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 32.18 3du7 n LYS 53 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 3du7 n LEU 54 N -1.30 0.00 -0.06 -0.35 7.94 -1.00 -3.97 117.00 118.28 3du7 n LEU 54 Ca 0.03 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.79 3du7 n LEU 54 Cb 0.05 0.18 -0.07 0.00 0.53 0.00 0.00 43.42 44.12 3du7 n LEU 54 CO 0.05 0.18 0.52 -0.33 -1.11 0.00 0.00 177.39 176.70 3du7 h GLU 55 N 0.00 0.49 -0.95 1.96 5.08 -1.41 -3.12 114.58 116.63 3du7 h GLU 55 Ca -0.20 -0.31 0.29 0.00 -1.00 0.00 0.00 59.36 58.14 3du7 h GLU 55 Cb 1.41 0.03 -0.16 0.00 0.50 0.00 0.00 28.75 30.54 3du7 h GLU 55 CO 0.01 0.91 0.30 0.00 -1.00 0.00 0.00 179.01 179.23 3du7 h ALA 56 N 0.58 1.53 -0.92 3.43 0.00 -1.59 -0.05 119.26 122.23 3du7 h ALA 56 Ca 0.01 0.26 0.08 0.00 0.00 0.00 0.00 54.91 55.26 3du7 h ALA 56 Cb 0.88 0.36 -0.11 0.00 0.00 0.00 0.00 17.79 18.92 3du7 h ALA 56 CO 0.07 -0.60 -0.55 0.00 0.00 0.00 0.00 179.25 178.17 3du7 h ALA 57 N 1.88 -0.51 0.00 0.00 0.00 -1.67 0.69 119.26 119.65 3du7 h ALA 57 Ca 0.65 0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.55 3du7 h ALA 57 Cb 1.45 1.35 -0.02 0.00 0.00 0.00 0.00 17.79 20.57 3du7 h ALA 57 CO -0.73 -0.90 -0.56 0.93 0.00 0.00 0.00 179.25 177.98 3du7 h GLU 58 N -0.00 0.00 -0.37 0.00 3.07 -1.21 -0.82 114.58 115.25 3du7 h GLU 58 Ca 0.15 0.00 0.09 0.00 -0.50 0.00 0.00 59.36 59.10 3du7 h GLU 58 Cb 0.38 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.27 3du7 h GLU 58 CO -0.87 0.56 0.26 0.93 -1.40 0.00 0.00 179.01 178.49 3du7 h GLU 59 N 0.00 0.08 0.13 2.33 5.08 0.33 0.71 114.58 123.24 3du7 h GLU 59 Ca -0.01 -0.01 -0.27 0.00 -1.00 0.00 0.00 59.36 58.08 3du7 h GLU 59 Cb 1.08 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.31 3du7 h GLU 59 CO 0.07 0.06 -1.36 0.00 -1.00 0.00 0.00 179.01 176.78 3du7 h ARG 60 N 0.09 0.27 0.00 2.33 3.08 -0.20 -3.24 114.38 116.70 3du7 h ARG 60 Ca 0.17 -0.45 0.00 0.00 0.07 0.00 0.00 59.98 59.77 3du7 h ARG 60 Cb 0.58 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.80 3du7 h ARG 60 CO -0.02 1.22 0.00 -2.13 -1.07 0.00 0.00 179.97 177.97 3du7 n ARG 61 N -3.92 0.00 0.00 0.04 0.63 -0.40 -0.03 116.66 112.97 3du7 n ARG 61 Ca -0.23 0.26 0.01 0.00 -0.92 0.00 0.00 57.85 56.97 3du7 n ARG 61 Cb 0.91 -1.14 0.07 0.00 0.45 0.00 0.00 32.46 32.74 3du7 n ARG 61 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 3du7 n LYS 62 N -1.07 0.06 0.00 -0.14 4.76 0.24 0.65 118.16 122.66 3du7 n LYS 62 Ca 0.00 0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.55 3du7 n LYS 62 Cb 0.00 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 3du7 n LYS 62 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 3du7 n TYR 63 N -1.12 0.00 0.00 2.13 9.36 -1.13 -2.47 117.16 123.93 3du7 n TYR 63 Ca 0.02 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.24 3du7 n TYR 63 Cb 0.01 -0.20 0.00 0.00 -0.63 0.00 0.00 39.34 38.52 3du7 n TYR 63 CO 0.00 0.00 0.00 0.94 0.22 0.00 0.00 176.86 178.02 3du7 n GLN 64 N -1.53 0.00 0.00 2.98 7.27 0.21 0.07 117.38 126.38 3du7 n GLN 64 Ca 0.00 0.12 0.00 0.00 0.07 0.00 0.00 57.00 57.19 3du7 n GLN 64 Cb 0.00 -1.71 0.00 0.00 2.41 0.00 0.00 30.24 30.94 3du7 n GLN 64 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 3du7 n GLU 65 N -1.01 2.31 0.00 3.69 0.00 -0.43 -4.09 120.64 121.11 3du7 n GLU 65 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 3du7 n GLU 65 Cb 0.21 -0.97 0.00 0.00 0.00 0.00 0.00 31.44 30.68 3du7 n GLU 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3du7 n ALA 66 N -2.11 2.20 -0.38 4.31 0.00 0.11 -1.54 120.51 123.11 3du7 n ALA 66 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3du7 n ALA 66 Cb 0.47 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.92 3du7 n ALA 66 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3du7 n GLU 67 N -0.35 1.58 -0.03 0.00 2.13 0.83 -4.10 120.64 120.71 3du7 n GLU 67 Ca 0.00 -1.03 0.04 0.00 0.66 0.00 0.00 57.16 56.83 3du7 n GLU 67 Cb 0.04 -0.81 0.05 0.00 0.27 0.00 0.00 31.44 30.99 3du7 n GLU 67 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3du7 n LEU 68 N -0.28 1.88 0.03 4.31 4.77 -0.81 -3.12 117.00 123.78 3du7 n LEU 68 Ca 0.00 -1.25 0.08 0.00 -0.03 0.00 0.00 56.01 54.81 3du7 n LEU 68 Cb 0.31 -0.04 -0.09 0.00 -2.33 0.00 0.00 43.42 41.27 3du7 n LEU 68 CO 0.00 0.41 -0.42 -0.11 -1.33 0.00 0.00 177.39 175.94 3du7 n LEU 69 N 0.37 0.45 -0.33 2.23 0.00 -0.59 -3.83 117.00 115.30 3du7 n LEU 69 Ca 0.05 0.18 0.06 0.00 0.00 0.00 0.00 56.01 56.30 3du7 n LEU 69 Cb 0.23 0.02 0.13 0.00 0.00 0.00 0.00 43.42 43.80 3du7 n LEU 69 CO 0.05 -0.02 0.59 1.17 0.00 0.00 0.00 177.39 179.18 3du7 n LYS 70 N -2.55 2.45 0.00 1.96 4.81 -1.26 -0.47 118.16 123.10 3du7 n LYS 70 Ca -0.05 -2.21 0.07 0.00 -0.87 0.00 0.00 58.31 55.25 3du7 n LYS 70 Cb 0.64 -1.38 0.01 0.00 0.02 0.00 0.00 35.03 34.33 3du7 n LYS 70 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 3du7 n HIS 71 N -0.59 0.00 0.00 5.64 -0.00 -1.18 -4.67 115.22 114.42 3du7 n HIS 71 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.83 3du7 n HIS 71 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.52 3du7 n HIS 71 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 3du7 n LEU 72 N 0.07 0.00 0.07 2.41 7.94 -1.25 -3.79 117.00 122.45 3du7 n LEU 72 Ca 0.06 0.00 0.03 0.00 -1.11 0.00 0.00 56.01 55.00 3du7 n LEU 72 Cb 0.30 0.00 0.18 0.00 0.53 0.00 0.00 43.42 44.43 3du7 n LEU 72 CO 0.15 0.00 0.64 0.00 -1.11 0.00 0.00 177.39 177.06 3du7 n ALA 73 N -1.83 0.70 -0.11 1.96 0.00 0.38 -1.60 120.51 120.00 3du7 n ALA 73 Ca 0.00 0.06 -0.18 0.00 0.00 0.00 0.00 53.44 53.32 3du7 n ALA 73 Cb 0.36 -0.78 -0.07 0.00 0.00 0.00 0.00 19.45 18.97 3du7 n ALA 73 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3du7 n GLU 74 N -1.68 0.55 -0.33 0.00 2.13 -1.26 -3.39 120.64 116.66 3du7 n GLU 74 Ca -0.00 0.29 0.13 0.00 0.66 0.00 0.00 57.16 58.24 3du7 n GLU 74 Cb 0.20 -1.51 0.26 0.00 0.27 0.00 0.00 31.44 30.67 3du7 n GLU 74 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3du7 n LYS 75 N -4.38 -0.08 0.00 5.31 5.02 -1.05 -3.19 118.16 119.79 3du7 n LYS 75 Ca -0.32 1.43 0.00 0.00 -2.02 0.00 0.00 58.31 57.40 3du7 n LYS 75 Cb 0.67 -2.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 3du7 n LYS 75 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 3du7 n ARG 76 N -5.43 0.00 -0.03 1.97 1.85 -0.63 -3.70 116.66 110.70 3du7 n ARG 76 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.07 3du7 n ARG 76 Cb 0.71 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.12 3du7 n ARG 76 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 3du7 n GLU 77 N 0.00 0.00 0.00 2.89 2.13 -1.20 0.15 120.64 124.60 3du7 n GLU 77 Ca 0.00 -0.23 0.00 0.00 0.66 0.00 0.00 57.16 57.59 3du7 n GLU 77 Cb 0.00 -1.66 0.00 0.00 0.27 0.00 0.00 31.44 30.05 3du7 n GLU 77 CO 0.00 0.00 0.00 1.58 -0.41 0.00 0.00 177.13 178.30 3du7 n HIS 78 N 3.83 0.00 0.36 4.31 -0.00 -1.19 -4.68 115.22 117.85 3du7 n HIS 78 Ca 0.00 0.00 -0.18 0.00 0.46 0.00 0.00 57.72 58.00 3du7 n HIS 78 Cb 0.00 0.00 -0.09 0.00 -0.12 0.00 0.00 29.99 29.78 3du7 n HIS 78 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 3du7 h GLU 79 N 0.00 -0.93 -0.06 1.57 5.08 0.12 1.99 114.58 122.36 3du7 h GLU 79 Ca 0.00 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3du7 h GLU 79 Cb 0.79 0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.25 3du7 h GLU 79 CO 0.00 -0.62 0.00 0.54 -1.00 0.00 0.00 179.01 177.93 3du7 n ARG 80 N -5.52 0.28 -0.01 2.33 1.74 -1.25 -2.40 116.66 111.82 3du7 n ARG 80 Ca -0.13 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 56.92 3du7 n ARG 80 Cb 0.41 -1.03 -0.01 0.00 -1.02 0.00 0.00 32.46 30.81 3du7 n ARG 80 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3du7 n GLU 81 N -0.31 0.06 -0.09 5.56 0.00 0.51 -4.55 120.64 121.82 3du7 n GLU 81 Ca 0.00 0.03 -0.06 0.00 0.00 0.00 0.00 57.16 57.12 3du7 n GLU 81 Cb 0.02 -0.60 0.00 0.00 0.00 0.00 0.00 31.44 30.86 3du7 n GLU 81 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.13 176.74 3du7 h VAL 82 N -0.10 0.52 0.00 6.31 -1.51 0.34 0.99 116.25 122.80 3du7 h VAL 82 Ca -0.07 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 3du7 h VAL 82 Cb 1.00 0.52 0.00 0.00 -2.13 0.00 0.00 31.29 30.68 3du7 h VAL 82 CO -0.04 0.00 0.00 2.30 -1.23 0.00 0.00 177.57 178.60 3du7 n ILE 83 N -5.33 0.10 -0.02 7.19 -0.00 -1.12 -1.53 119.36 118.65 3du7 n ILE 83 Ca 0.01 0.02 0.09 0.00 -0.00 0.00 0.00 62.75 62.87 3du7 n ILE 83 Cb 0.24 -0.72 -0.17 0.00 -0.00 0.00 0.00 39.64 38.99 3du7 n ILE 83 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.55 178.22 3du7 n GLN 84 N -1.06 0.66 -0.61 6.28 0.00 0.31 -3.80 117.38 119.16 3du7 n GLN 84 Ca 0.13 -0.18 0.10 0.00 -0.00 0.00 0.00 57.00 57.05 3du7 n GLN 84 Cb 0.08 -1.51 0.36 0.00 0.00 0.00 0.00 30.24 29.18 3du7 n GLN 84 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 3du7 n LYS 85 N -2.29 3.70 -0.05 3.69 4.76 0.54 -1.56 118.16 126.96 3du7 n LYS 85 Ca -0.06 -2.90 -0.06 0.00 -2.87 0.00 0.00 58.31 52.42 3du7 n LYS 85 Cb 0.61 -1.88 -0.05 0.00 -1.84 0.00 0.00 35.03 31.86 3du7 n LYS 85 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3du7 n ALA 86 N 1.21 1.78 0.28 7.82 0.00 -1.17 -2.24 120.51 128.20 3du7 n ALA 86 Ca 0.26 -0.48 0.15 0.00 0.00 0.00 0.00 53.44 53.37 3du7 n ALA 86 Cb 0.88 0.19 0.83 0.00 0.00 0.00 0.00 19.45 21.36 3du7 n ALA 86 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 3du7 h ILE 87 N 0.00 0.48 0.07 0.00 -0.00 -1.66 0.37 117.51 116.78 3du7 h ILE 87 Ca -0.23 -0.31 -0.29 0.00 -0.00 0.00 0.00 64.86 64.03 3du7 h ILE 87 Cb 1.41 1.21 -0.02 0.00 -0.00 0.00 0.00 36.82 39.42 3du7 h ILE 87 CO -0.02 0.06 -1.53 -0.33 -0.00 0.00 0.00 178.15 176.33 3du7 h GLU 88 N 0.00 0.15 -0.00 0.16 4.39 -1.43 -2.62 114.58 115.23 3du7 h GLU 88 Ca -0.00 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.43 3du7 h GLU 88 Cb 0.20 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 3du7 h GLU 88 CO 0.01 0.96 -0.01 -0.85 -1.16 0.00 0.00 179.01 177.96 3du7 n GLU 89 N -3.34 0.90 0.00 2.33 0.00 -0.95 -3.07 120.64 116.51 3du7 n GLU 89 Ca -0.15 -0.09 0.00 0.00 0.00 0.00 0.00 57.16 56.91 3du7 n GLU 89 Cb 1.03 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.97 3du7 n GLU 89 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 3du7 n ASN 90 N -0.97 3.93 0.08 -1.84 4.05 0.10 -4.42 115.26 116.19 3du7 n ASN 90 Ca 0.21 0.00 -0.15 0.00 0.45 0.00 0.00 54.58 55.09 3du7 n ASN 90 Cb 0.17 0.47 -0.08 0.00 1.23 0.00 0.00 39.78 41.57 3du7 n ASN 90 CO 0.00 0.00 0.00 0.78 -3.05 0.00 0.00 177.26 174.99 3du7 h ASN 91 N 0.00 -1.46 0.00 1.20 2.35 -1.60 -1.92 115.58 114.15 3du7 h ASN 91 Ca 0.00 0.16 -0.06 0.00 -0.55 0.00 0.00 56.30 55.86 3du7 h ASN 91 Cb 0.63 0.55 -0.02 0.00 0.05 0.00 0.00 38.32 39.53 3du7 h ASN 91 CO 0.00 -0.51 -0.00 -0.46 -1.65 0.00 0.00 177.43 174.81 3du7 n ASN 92 N -5.47 2.98 0.00 5.81 0.23 -1.17 -1.45 115.26 116.19 3du7 n ASN 92 Ca -0.07 -1.93 0.00 0.00 -0.53 0.00 0.00 54.58 52.04 3du7 n ASN 92 Cb 0.39 -0.73 0.00 0.00 -2.08 0.00 0.00 39.78 37.37 3du7 n ASN 92 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 3du7 n PHE 93 N 2.26 0.00 -0.09 -2.53 7.35 -0.73 -4.50 117.46 119.22 3du7 n PHE 93 Ca 0.13 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.84 3du7 n PHE 93 Cb 0.41 0.00 0.34 0.00 0.35 0.00 0.00 39.48 40.58 3du7 n PHE 93 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3du7 h ILE 94 N 0.00 1.15 0.00 -2.13 5.03 -1.18 -3.32 117.51 117.06 3du7 h ILE 94 Ca 0.00 -0.30 0.00 0.00 -0.12 0.00 0.00 64.86 64.44 3du7 h ILE 94 Cb 0.37 0.36 0.00 0.00 -3.03 0.00 0.00 36.82 34.52 3du7 h ILE 94 CO 0.00 0.15 0.00 0.29 -0.68 0.00 0.00 178.15 177.91 3du7 n LYS 95 N -4.44 0.00 0.00 2.37 5.02 -0.80 -3.77 118.16 116.55 3du7 n LYS 95 Ca 0.05 0.81 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 3du7 n LYS 95 Cb 0.06 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 3du7 n LYS 95 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3du7 n MET 96 N -2.59 0.00 0.00 1.97 0.00 -1.25 -4.35 117.12 110.90 3du7 n MET 96 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 3du7 n MET 96 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 3du7 n MET 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3du7 n ALA 97 N -3.00 0.75 0.04 3.17 0.00 -1.26 0.04 120.51 120.25 3du7 n ALA 97 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 3du7 n ALA 97 Cb 0.00 -0.60 0.09 0.00 0.00 0.00 0.00 19.45 18.94 3du7 n ALA 97 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3du7 n LYS 98 N -0.01 1.96 0.00 0.00 2.85 -1.25 -4.17 118.16 117.55 3du7 n LYS 98 Ca 0.00 -1.62 0.00 0.00 -1.05 0.00 0.00 58.31 55.64 3du7 n LYS 98 Cb 0.00 -1.20 0.00 0.00 -0.65 0.00 0.00 35.03 33.18 3du7 n LYS 98 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 3du7 n GLU 99 N 0.39 3.21 -0.40 -1.58 0.00 0.11 -4.68 120.64 117.67 3du7 n GLU 99 Ca 0.08 0.00 0.33 0.00 0.00 0.00 0.00 57.16 57.57 3du7 n GLU 99 Cb 0.33 -0.63 0.60 0.00 0.00 0.00 0.00 31.44 31.75 3du7 n GLU 99 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 3du7 h LYS 100 N 0.00 0.16 -0.47 5.31 1.79 -1.67 0.84 116.57 122.54 3du7 h LYS 100 Ca 0.00 -0.01 0.04 0.00 -2.18 0.00 0.00 60.65 58.50 3du7 h LYS 100 Cb 0.09 -0.04 -0.06 0.00 -1.58 0.00 0.00 32.23 30.65 3du7 h LYS 100 CO 0.00 0.11 -0.28 -0.11 -1.08 0.00 0.00 179.45 178.09 3du7 n LEU 101 N -4.72 -0.50 -0.17 2.94 0.00 -1.26 -1.48 117.00 111.81 3du7 n LEU 101 Ca 0.34 1.23 -0.11 0.00 0.00 0.00 0.00 56.01 57.47 3du7 n LEU 101 Cb 1.27 -0.30 0.01 0.00 0.00 0.00 0.00 43.42 44.40 3du7 n LEU 101 CO 0.20 -0.87 0.71 0.00 0.00 0.00 0.00 177.39 177.43 3du7 h ALA 102 N -0.16 0.74 -0.95 1.96 0.00 0.41 0.19 119.26 121.45 3du7 h ALA 102 Ca 0.07 -0.37 -0.59 0.00 0.00 0.00 0.00 54.91 54.02 3du7 h ALA 102 Cb 0.19 -0.18 -0.29 0.00 0.00 0.00 0.00 17.79 17.50 3du7 h ALA 102 CO -0.44 0.67 0.64 0.00 0.00 0.00 0.00 179.25 180.13 3du7 n GLN 103 N -4.13 2.56 0.00 0.00 10.64 -1.15 -1.55 117.38 123.76 3du7 n GLN 103 Ca 0.01 -3.26 0.00 0.00 -1.83 0.00 0.00 57.00 51.92 3du7 n GLN 103 Cb 0.43 -2.23 0.00 0.00 -0.86 0.00 0.00 30.24 27.58 3du7 n GLN 103 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 3du7 n LYS 104 N -0.99 0.00 0.00 2.61 4.81 -0.55 -4.47 118.16 119.58 3du7 n LYS 104 Ca 0.59 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 58.12 3du7 n LYS 104 Cb 1.02 -0.89 0.51 0.00 0.02 0.00 0.00 35.03 35.69 3du7 n LYS 104 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 3du7 n MET 105 N -2.42 0.44 -0.12 1.64 1.56 0.63 -2.30 117.12 116.56 3du7 n MET 105 Ca 0.00 0.05 -0.25 0.00 -0.27 0.00 0.00 57.70 57.23 3du7 n MET 105 Cb 0.43 -1.50 -0.11 0.00 2.15 0.00 0.00 33.22 34.19 3du7 n MET 105 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 3du7 n GLU 106 N -1.12 0.60 -0.00 2.12 4.07 -0.59 -3.96 120.64 121.75 3du7 n GLU 106 Ca 0.12 0.38 -0.00 0.00 -0.06 0.00 0.00 57.16 57.59 3du7 n GLU 106 Cb 0.10 -1.61 -0.00 0.00 -0.06 0.00 0.00 31.44 29.87 3du7 n GLU 106 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 3du7 n SER 107 N -4.20 0.02 0.04 4.31 2.88 -0.97 -0.89 113.62 114.81 3du7 n SER 107 Ca -0.44 -1.03 0.00 0.00 -1.33 0.00 0.00 58.87 56.07 3du7 n SER 107 Cb 0.83 -0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.28 3du7 n SER 107 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 3du7 n ASN 108 N 2.04 0.29 -0.32 -3.46 2.85 -1.12 -4.55 115.26 110.99 3du7 n ASN 108 Ca 0.00 0.14 0.19 0.00 -0.11 0.00 0.00 54.58 54.80 3du7 n ASN 108 Cb 0.00 -0.02 0.38 0.00 1.24 0.00 0.00 39.78 41.38 3du7 n ASN 108 CO 0.00 0.00 0.00 0.50 -2.11 0.00 0.00 177.26 175.65 3du7 h LYS 109 N 0.00 0.16 0.21 1.20 3.11 -1.18 0.28 116.57 120.35 3du7 h LYS 109 Ca 0.00 -0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 57.82 3du7 h LYS 109 Cb 0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.19 3du7 h LYS 109 CO 0.00 0.11 -0.19 0.93 -2.81 0.00 0.00 179.45 177.48 3du7 h GLU 110 N 0.16 -0.38 -0.10 1.90 4.39 -1.33 -2.14 114.58 117.08 3du7 h GLU 110 Ca 0.65 0.03 0.03 0.00 0.34 0.00 0.00 59.36 60.40 3du7 h GLU 110 Cb 1.43 0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 30.16 3du7 h GLU 110 CO -0.71 -0.26 0.10 -0.91 -1.16 0.00 0.00 179.01 176.08 3du7 h ASN 111 N -0.40 0.00 0.00 1.42 2.35 -0.80 -3.04 115.58 115.11 3du7 h ASN 111 Ca -0.03 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.62 3du7 h ASN 111 Cb 0.34 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 3du7 h ASN 111 CO -0.01 0.00 -0.82 0.08 -1.65 0.00 0.00 177.43 175.03 3du7 h ARG 112 N 0.00 0.00 0.00 0.81 -0.00 -0.92 -3.20 114.38 111.06 3du7 h ARG 112 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.03 3du7 h ARG 112 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.23 3du7 h ARG 112 CO -0.00 0.42 0.03 0.39 -0.00 0.00 0.00 179.97 180.81 3du7 n GLU 113 N -4.54 0.00 -0.06 0.08 4.71 -0.80 0.87 120.64 120.90 3du7 n GLU 113 Ca -0.18 0.36 -0.04 0.00 -0.01 0.00 0.00 57.16 57.29 3du7 n GLU 113 Cb 0.44 -1.53 -0.04 0.00 -1.01 0.00 0.00 31.44 29.30 3du7 n GLU 113 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3du7 h ALA 114 N 1.84 0.00 0.00 0.62 0.00 -1.67 -3.14 119.26 116.90 3du7 h ALA 114 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3du7 h ALA 114 Cb 0.06 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3du7 h ALA 114 CO 0.00 0.01 0.00 0.45 0.00 0.00 0.00 179.25 179.71 3du7 h HIS 115 N -1.00 0.00 0.00 0.00 3.86 0.49 -2.08 115.15 116.43 3du7 h HIS 115 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3du7 h HIS 115 Cb 0.29 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.76 3du7 h HIS 115 CO 0.08 0.00 0.00 1.28 0.86 0.00 0.00 177.93 180.15 3du7 n LEU 116 N -2.54 0.18 -0.06 2.43 4.77 0.82 -3.22 117.00 119.38 3du7 n LEU 116 Ca 0.02 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3du7 n LEU 116 Cb 0.29 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 3du7 n LEU 116 CO 0.24 -0.41 0.11 0.00 -1.33 0.00 0.00 177.39 176.00 3du7 n ALA 117 N -2.13 1.69 0.30 -1.18 0.00 -1.19 0.18 120.51 118.20 3du7 n ALA 117 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 3du7 n ALA 117 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 3du7 n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3du7 n ALA 118 N -0.39 2.81 0.85 0.00 0.00 -0.78 -3.82 120.51 119.17 3du7 n ALA 118 Ca 0.00 -0.22 0.12 0.00 0.00 0.00 0.00 53.44 53.34 3du7 n ALA 118 Cb 0.01 -0.24 0.27 0.00 0.00 0.00 0.00 19.45 19.49 3du7 n ALA 118 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 3du7 n MET 119 N -1.00 0.10 -0.02 0.00 0.00 0.48 -3.68 117.12 113.00 3du7 n MET 119 Ca 0.02 0.03 -0.07 0.00 0.00 0.00 0.00 57.70 57.67 3du7 n MET 119 Cb 0.11 -1.57 -0.13 0.00 0.00 0.00 0.00 33.22 31.63 3du7 n MET 119 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 3du7 n LEU 120 N -1.72 0.81 -0.39 -0.89 0.00 -0.41 -3.45 117.00 110.96 3du7 n LEU 120 Ca 0.05 0.38 0.14 0.00 0.00 0.00 0.00 56.01 56.59 3du7 n LEU 120 Cb 0.37 0.18 0.58 0.00 0.00 0.00 0.00 43.42 44.55 3du7 n LEU 120 CO 0.34 0.36 0.89 -0.62 0.00 0.00 0.00 177.39 178.37 3du7 n GLU 121 N -3.00 1.49 -0.07 1.96 1.02 -1.24 -3.41 120.64 117.38 3du7 n GLU 121 Ca -0.17 -0.77 -0.13 0.00 -0.02 0.00 0.00 57.16 56.07 3du7 n GLU 121 Cb 1.03 -1.48 -0.06 0.00 -0.02 0.00 0.00 31.44 30.90 3du7 n GLU 121 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3du7 n ARG 122 N -0.08 0.35 -0.10 3.49 1.74 -1.24 -4.37 116.66 116.44 3du7 n ARG 122 Ca 0.19 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 3du7 n ARG 122 Cb 0.32 -1.18 0.00 0.00 -1.02 0.00 0.00 32.46 30.57 3du7 n ARG 122 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3du7 n LEU 123 N -3.26 1.57 0.00 0.55 4.77 -1.22 -0.67 117.00 118.74 3du7 n LEU 123 Ca -0.28 -0.73 0.00 0.00 -0.03 0.00 0.00 56.01 54.97 3du7 n LEU 123 Cb 0.75 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 3du7 n LEU 123 CO 0.09 0.29 0.00 1.67 -1.33 0.00 0.00 177.39 178.11 3du7 n GLN 124 N 1.39 0.00 0.00 3.23 7.27 -1.22 -4.79 117.38 123.25 3du7 n GLN 124 Ca 0.00 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.18 3du7 n GLN 124 Cb 0.18 -0.06 0.03 0.00 2.41 0.00 0.00 30.24 32.80 3du7 n GLN 124 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 3du7 n GLU 125 N 0.00 1.60 -0.40 3.69 -0.58 0.16 -3.43 120.64 121.69 3du7 n GLU 125 Ca 0.00 -1.32 -0.04 0.00 -0.42 0.00 0.00 57.16 55.37 3du7 n GLU 125 Cb 0.06 -1.47 0.10 0.00 -0.57 0.00 0.00 31.44 29.56 3du7 n GLU 125 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 3du7 n LYS 126 N 0.46 1.82 0.02 3.49 4.81 -1.21 -2.88 118.16 124.67 3du7 n LYS 126 Ca 0.11 -1.11 -0.02 0.00 -0.87 0.00 0.00 58.31 56.43 3du7 n LYS 126 Cb 0.51 -1.56 -0.01 0.00 0.02 0.00 0.00 35.03 34.00 3du7 n LYS 126 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3du7 n ASP 127 N 0.03 1.25 -0.16 3.14 10.43 -1.22 -4.31 116.55 125.71 3du7 n ASP 127 Ca 0.17 0.17 -0.07 0.00 2.57 0.00 0.00 54.79 57.64 3du7 n ASP 127 Cb 0.80 -0.41 0.02 0.00 1.84 0.00 0.00 41.12 43.37 3du7 n ASP 127 CO 0.00 0.00 0.00 0.11 -1.07 0.00 0.00 177.20 176.24 3du7 h LYS 128 N -0.19 0.59 0.00 -1.24 1.57 -1.70 0.84 116.57 116.44 3du7 h LYS 128 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3du7 h LYS 128 Cb 0.19 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.36 3du7 h LYS 128 CO 0.00 0.39 0.00 1.25 -0.57 0.00 0.00 179.45 180.52 3du7 h HIS 129 N 0.60 0.00 0.00 -1.35 -0.00 -1.83 -0.18 115.15 112.40 3du7 h HIS 129 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.55 3du7 h HIS 129 Cb -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.38 3du7 h HIS 129 CO -0.06 0.00 -1.07 0.00 -0.00 0.00 0.00 177.93 176.81 3du7 n ALA 130 N -1.94 4.37 -0.07 5.26 0.00 -1.06 -3.96 120.51 123.11 3du7 n ALA 130 Ca 0.03 -0.55 -0.14 0.00 0.00 0.00 0.00 53.44 52.77 3du7 n ALA 130 Cb 0.35 -0.72 -0.05 0.00 0.00 0.00 0.00 19.45 19.02 3du7 n ALA 130 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3du7 n GLU 131 N -1.57 0.31 0.00 0.00 0.28 0.27 -3.98 120.64 115.96 3du7 n GLU 131 Ca 0.03 0.12 0.13 0.00 -0.16 0.00 0.00 57.16 57.28 3du7 n GLU 131 Cb 0.34 -1.08 0.68 0.00 1.43 0.00 0.00 31.44 32.81 3du7 n GLU 131 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 3du7 n GLU 132 N -3.45 0.42 -0.55 3.44 0.00 -0.10 -2.03 120.64 118.37 3du7 n GLU 132 Ca -0.27 0.03 0.07 0.00 0.00 0.00 0.00 57.16 56.98 3du7 n GLU 132 Cb 0.72 -1.50 0.16 0.00 0.00 0.00 0.00 31.44 30.81 3du7 n GLU 132 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3du7 n VAL 133 N -1.26 1.74 -0.03 3.84 0.31 -1.25 -4.58 118.33 117.09 3du7 n VAL 133 Ca 0.13 -2.53 -0.04 0.00 -0.01 0.00 0.00 64.34 61.90 3du7 n VAL 133 Cb 0.20 -0.05 -0.03 0.00 -0.91 0.00 0.00 33.84 33.05 3du7 n VAL 133 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3du7 n ARG 134 N -0.96 1.31 -0.23 5.55 0.00 -1.11 -4.44 116.66 116.78 3du7 n ARG 134 Ca 0.16 0.02 -0.03 0.00 -0.00 0.00 0.00 57.85 58.00 3du7 n ARG 134 Cb 0.73 -1.12 -0.04 0.00 0.00 0.00 0.00 32.46 32.03 3du7 n ARG 134 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 3du7 n LYS 135 N -2.49 0.46 -0.03 -0.14 5.02 -0.86 -1.82 118.16 118.30 3du7 n LYS 135 Ca -0.10 -0.22 -0.02 0.00 -2.02 0.00 0.00 58.31 55.95 3du7 n LYS 135 Cb 0.63 -1.60 -0.05 0.00 -0.02 0.00 0.00 35.03 33.99 3du7 n LYS 135 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3du7 n ASN 136 N 2.82 3.43 0.00 4.39 5.03 -1.26 -4.39 115.26 125.28 3du7 n ASN 136 Ca 0.10 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.55 3du7 n ASN 136 Cb 0.21 0.77 0.00 0.00 -1.02 0.00 0.00 39.78 39.74 3du7 n ASN 136 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3du7 n LYS 137 N -2.15 0.00 0.27 3.52 4.76 -0.75 0.75 118.16 124.56 3du7 n LYS 137 Ca -0.09 0.00 0.18 0.00 -2.87 0.00 0.00 58.31 55.53 3du7 n LYS 137 Cb 0.62 -1.38 0.81 0.00 -1.84 0.00 0.00 35.03 33.24 3du7 n LYS 137 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 3du7 h GLU 138 N 0.00 0.00 0.00 1.97 -0.00 -1.82 -3.27 114.58 111.46 3du7 h GLU 138 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 3du7 h GLU 138 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 3du7 h GLU 138 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 179.01 180.29 3du7 n LEU 139 N -2.93 0.00 -1.97 3.06 4.77 0.23 -5.05 117.00 115.11 3du7 n LEU 139 Ca -0.00 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 3du7 n LEU 139 Cb 0.21 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 3du7 n LEU 139 CO 0.23 0.00 -0.30 0.29 -1.33 0.00 0.00 177.39 176.28 3du7 n LYS 140 N -0.32 -3.46 0.00 3.23 4.76 -1.24 -5.19 118.16 115.94 3du7 n LYS 140 Ca 0.00 2.45 0.00 0.00 -2.87 0.00 0.00 58.31 57.89 3du7 n LYS 140 Cb 0.00 -2.95 0.00 0.00 -1.84 0.00 0.00 35.03 30.24 3du7 n LYS 140 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42