#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tuz n ALA 2 N 0.00 4.29 -2.20 3.04 0.00 -1.26 -4.97 120.51 119.41 1tuz n ALA 2 Ca 0.00 -4.73 0.00 0.00 0.00 0.00 0.00 53.44 48.71 1tuz n ALA 2 Cb 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 19.45 17.89 1tuz n ALA 2 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1tuz n LYS 3 N 1.45 0.03 -0.05 0.00 3.00 -1.26 -5.11 118.16 116.23 1tuz n LYS 3 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.57 1tuz n LYS 3 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.40 1tuz n LYS 3 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1tuz n GLU 4 N 0.00 -0.14 -1.23 1.64 2.13 -1.26 -5.03 120.64 116.75 1tuz n GLU 4 Ca 0.00 0.11 -0.01 0.00 0.66 0.00 0.00 57.16 57.92 1tuz n GLU 4 Cb 0.00 -0.13 0.01 0.00 0.27 0.00 0.00 31.44 31.59 1tuz n GLU 4 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1tuz n ARG 5 N -1.48 0.15 -1.13 5.31 0.00 -1.26 -5.09 116.66 113.16 1tuz n ARG 5 Ca 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 57.85 57.63 1tuz n ARG 5 Cb 0.01 0.27 0.00 0.00 -0.00 0.00 0.00 32.46 32.74 1tuz n ARG 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1tuz n GLY 6 N -0.17 -2.32 0.72 2.89 0.00 -1.26 -5.13 105.19 99.91 1tuz n GLY 6 Ca -0.04 -0.51 -0.04 0.00 0.00 0.00 0.00 46.02 45.42 1tuz n GLY 6 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1tuz n LEU 7 N 0.00 0.00 -4.75 0.99 -0.00 -1.26 -5.08 117.00 106.91 1tuz n LEU 7 Ca 0.00 -0.71 -0.67 0.00 -0.00 0.00 0.00 56.01 54.63 1tuz n LEU 7 Cb 0.00 0.36 -0.10 0.00 -0.00 0.00 0.00 43.42 43.68 1tuz n LEU 7 CO 0.00 -0.12 1.16 2.30 -0.00 0.00 0.00 177.39 180.73 1tuz n ILE 8 N -0.15 0.02 -0.49 1.47 -5.35 -1.26 -4.86 119.36 108.74 1tuz n ILE 8 Ca 0.01 -0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.33 1tuz n ILE 8 Cb 0.14 -0.54 0.15 0.00 -1.74 0.00 0.00 39.64 37.65 1tuz n ILE 8 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1tuz n SER 9 N 4.09 -3.12 0.00 7.28 2.88 -1.26 -4.57 113.62 118.91 1tuz n SER 9 Ca 0.31 -0.44 0.12 0.00 -1.33 0.00 0.00 58.87 57.52 1tuz n SER 9 Cb -0.05 -0.76 0.67 0.00 -0.75 0.00 0.00 64.21 63.32 1tuz n SER 9 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1tuz n PRO 10 N -1.99 0.63 -0.02 -1.46 -0.04 -1.26 -2.61 135.00 128.25 1tuz n PRO 10 Ca 0.07 0.02 -0.16 0.00 -0.04 0.00 0.00 63.50 63.39 1tuz n PRO 10 Cb 0.32 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.14 1tuz n PRO 10 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1tuz h SER 11 N 0.00 0.20 -0.08 3.54 0.02 -1.98 -1.33 113.55 113.92 1tuz h SER 11 Ca 0.00 -0.96 -0.20 0.00 -0.84 0.00 0.00 61.79 59.79 1tuz h SER 11 Cb 0.06 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 62.55 1tuz h SER 11 CO 0.00 1.14 -0.73 0.44 -1.14 0.00 0.00 176.83 176.54 1tuz h ASP 12 N -0.71 0.78 -0.01 3.07 5.19 -1.85 -2.45 116.42 120.44 1tuz h ASP 12 Ca -0.05 -0.68 -0.07 0.00 -0.62 0.00 0.00 57.03 55.61 1tuz h ASP 12 Cb 1.23 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 40.49 1tuz h ASP 12 CO 0.06 1.34 -0.19 0.15 -3.12 0.00 0.00 179.24 177.48 1tuz h PHE 13 N 0.29 0.40 0.08 4.55 3.04 -1.64 -1.79 116.94 121.87 1tuz h PHE 13 Ca -0.07 -0.07 -0.00 0.00 3.98 0.00 0.00 57.97 61.81 1tuz h PHE 13 Cb 1.38 -0.10 0.00 0.00 2.56 0.00 0.00 35.95 39.79 1tuz h PHE 13 CO 0.11 0.54 -0.04 0.00 -2.02 0.00 0.00 178.31 176.90 1tuz h ALA 14 N 1.47 -0.11 0.16 2.41 0.00 -1.21 0.70 119.26 122.69 1tuz h ALA 14 Ca 0.06 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1tuz h ALA 14 Cb 0.53 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1tuz h ALA 14 CO 0.03 -0.39 -0.35 0.37 0.00 0.00 0.00 179.25 178.91 1tuz h GLN 15 N -0.45 -0.58 -0.84 0.00 5.75 -1.28 1.47 115.11 119.17 1tuz h GLN 15 Ca -0.01 0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.50 1tuz h GLN 15 Cb 0.38 0.13 -0.04 0.00 1.07 0.00 0.00 27.48 29.03 1tuz h GLN 15 CO 0.02 -0.39 0.44 -0.07 -2.65 0.00 0.00 178.83 176.18 1tuz h LEU 16 N -0.61 1.08 0.86 -2.39 4.07 -1.35 0.32 115.31 117.29 1tuz h LEU 16 Ca 0.02 -0.12 -0.04 0.00 0.08 0.00 0.00 57.88 57.82 1tuz h LEU 16 Cb 0.62 -0.28 0.01 0.00 1.08 0.00 0.00 40.66 42.09 1tuz h LEU 16 CO -0.18 0.89 -0.41 -0.61 -1.08 0.00 0.00 178.44 177.05 1tuz h GLN 17 N 1.19 -1.11 -0.29 1.13 4.15 0.13 0.35 115.11 120.66 1tuz h GLN 17 Ca 0.29 0.08 0.09 0.00 0.77 0.00 0.00 58.65 59.87 1tuz h GLN 17 Cb 0.07 0.25 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1tuz h GLN 17 CO -0.04 -0.74 0.22 -0.22 -1.93 0.00 0.00 178.83 176.12 1tuz h LYS 18 N -1.21 0.00 0.24 1.69 3.64 0.21 1.03 116.57 122.18 1tuz h LYS 18 Ca -0.12 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 1tuz h LYS 18 Cb 0.88 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 1tuz h LYS 18 CO 0.19 0.00 -0.12 1.88 -2.27 0.00 0.00 179.45 179.14 1tuz h TYR 19 N 0.00 -0.30 0.00 1.91 0.05 0.09 -3.17 116.97 115.55 1tuz h TYR 19 Ca 0.14 -0.01 -0.06 0.00 0.05 0.00 0.00 58.73 58.86 1tuz h TYR 19 Cb 0.58 0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.41 1tuz h TYR 19 CO 0.00 0.06 -0.27 0.00 -1.05 0.00 0.00 178.16 176.91 1tuz h MET 20 N -0.75 0.00 -0.50 4.88 -0.00 0.48 -2.94 114.93 116.09 1tuz h MET 20 Ca -0.03 0.00 0.10 0.00 -0.00 0.00 0.00 59.70 59.76 1tuz h MET 20 Cb 0.50 0.00 -0.08 0.00 -0.00 0.00 0.00 31.60 32.02 1tuz h MET 20 CO 0.05 0.27 0.01 0.93 -0.00 0.00 0.00 176.91 178.17 1tuz h GLU 21 N 0.00 0.12 0.00 -0.10 4.39 0.11 -0.73 114.58 118.37 1tuz h GLU 21 Ca -0.00 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.54 1tuz h GLU 21 Cb 0.84 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.44 1tuz h GLU 21 CO 0.03 0.08 -0.71 -0.92 -1.16 0.00 0.00 179.01 176.33 1tuz h TYR 22 N 0.12 0.00 -4.34 4.33 5.03 -1.56 -3.45 116.97 117.10 1tuz h TYR 22 Ca 0.25 0.00 -0.51 0.00 2.58 0.00 0.00 58.73 61.06 1tuz h TYR 22 Cb 0.38 0.00 0.06 0.00 1.55 0.00 0.00 36.73 38.72 1tuz h TYR 22 CO -0.31 0.71 0.41 0.45 -1.32 0.00 0.00 178.16 178.11 1tuz s SER 23 N -6.58 6.25 -0.00 -2.11 0.15 -0.28 -4.99 113.70 106.14 1tuz s SER 23 Ca 0.02 1.42 0.00 0.00 0.70 0.00 0.00 55.95 58.10 1tuz s SER 23 Cb 0.09 -2.47 0.01 0.00 -1.71 0.00 0.00 66.02 61.94 1tuz s SER 23 CO 0.77 -0.85 0.68 0.35 1.20 0.00 0.00 173.24 175.39 1tuz n THR 24 N -2.69 0.32 -0.96 6.45 -2.24 -1.26 -4.85 114.28 109.05 1tuz n THR 24 Ca 0.06 -0.33 -0.21 0.00 -2.27 0.00 0.00 64.05 61.30 1tuz n THR 24 Cb 0.54 0.80 0.18 0.00 -2.10 0.00 0.00 70.33 69.75 1tuz n THR 24 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1tuz n LYS 25 N -0.17 -2.40 -4.17 -0.78 5.02 -1.26 -5.08 118.16 109.31 1tuz n LYS 25 Ca 0.00 -1.28 -0.16 0.00 -2.02 0.00 0.00 58.31 54.86 1tuz n LYS 25 Cb 0.45 -1.16 -0.14 0.00 -0.02 0.00 0.00 35.03 34.16 1tuz n LYS 25 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1tuz s LYS 26 N -4.81 0.51 0.36 1.97 -0.14 -1.26 -5.03 119.74 111.34 1tuz s LYS 26 Ca 0.51 -0.36 0.06 0.00 -1.36 0.00 0.00 55.97 54.82 1tuz s LYS 26 Cb -0.05 -0.45 0.68 0.00 -1.68 0.00 0.00 37.83 36.33 1tuz s LYS 26 CO 0.39 0.11 1.91 -0.24 -0.76 0.00 0.00 175.35 176.77 1tuz h VAL 27 N 4.86 1.18 0.00 3.17 3.04 -1.97 -0.33 116.25 126.20 1tuz h VAL 27 Ca -0.31 -0.68 -0.02 0.00 -1.01 0.00 0.00 66.70 64.68 1tuz h VAL 27 Cb 1.19 0.91 -0.00 0.00 -2.01 0.00 0.00 31.29 31.38 1tuz h VAL 27 CO 0.48 0.24 -0.11 0.77 -1.01 0.00 0.00 177.57 177.93 1tuz h SER 28 N 0.47 0.00 -0.04 3.17 4.64 -1.95 0.22 113.55 120.06 1tuz h SER 28 Ca 0.10 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.35 1tuz h SER 28 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1tuz h SER 28 CO 0.01 0.11 -0.26 -0.78 -0.87 0.00 0.00 176.83 175.03 1tuz h ASP 29 N 0.00 0.29 0.59 4.97 3.58 -1.48 -2.94 116.42 121.44 1tuz h ASP 29 Ca -0.00 -0.69 -0.12 0.00 0.42 0.00 0.00 57.03 56.63 1tuz h ASP 29 Cb 0.45 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.40 1tuz h ASP 29 CO 0.01 0.94 -0.59 0.58 -2.88 0.00 0.00 179.24 177.30 1tuz h VAL 30 N -0.33 1.42 0.14 2.25 2.07 -1.14 -2.93 116.25 117.72 1tuz h VAL 30 Ca -0.02 -2.03 0.02 0.00 0.82 0.00 0.00 66.70 65.49 1tuz h VAL 30 Cb 0.95 2.09 -0.03 0.00 -1.52 0.00 0.00 31.29 32.78 1tuz h VAL 30 CO 0.05 0.58 -0.27 0.25 0.02 0.00 0.00 177.57 178.20 1tuz h LEU 31 N 0.00 -0.77 -1.54 2.57 5.85 -0.57 -0.33 115.31 120.53 1tuz h LEU 31 Ca -0.01 0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.85 1tuz h LEU 31 Cb 1.05 0.29 -0.03 0.00 0.37 0.00 0.00 40.66 42.34 1tuz h LEU 31 CO 0.08 -0.37 0.37 0.07 -0.34 0.00 0.00 178.44 178.25 1tuz h LYS 32 N -0.49 0.57 -0.70 1.25 2.10 -1.48 0.19 116.57 118.00 1tuz h LYS 32 Ca 0.03 -0.03 0.07 0.00 -2.00 0.00 0.00 60.65 58.71 1tuz h LYS 32 Cb 0.51 -0.13 -0.06 0.00 -0.90 0.00 0.00 32.23 31.66 1tuz h LYS 32 CO -0.15 0.38 0.39 -0.07 -2.00 0.00 0.00 179.45 178.00 1tuz h LEU 33 N 0.59 0.57 0.00 7.07 3.38 -0.92 0.81 115.31 126.81 1tuz h LEU 33 Ca 0.23 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1tuz h LEU 33 Cb 0.18 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1tuz h LEU 33 CO -0.06 0.36 -0.06 0.49 0.09 0.00 0.00 178.44 179.25 1tuz n PHE 34 N -4.78 0.61 -0.07 1.13 3.01 -0.26 0.03 117.46 117.13 1tuz n PHE 34 Ca 0.10 0.18 -0.07 0.00 1.01 0.00 0.00 57.45 58.67 1tuz n PHE 34 Cb 0.20 -0.77 -0.04 0.00 -0.01 0.00 0.00 39.48 38.86 1tuz n PHE 34 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1tuz h GLU 35 N 0.00 0.00 0.00 -1.08 4.39 0.11 -3.15 114.58 114.85 1tuz h GLU 35 Ca 0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 1tuz h GLU 35 Cb 0.66 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1tuz h GLU 35 CO 0.00 0.26 -1.27 -0.25 -1.16 0.00 0.00 179.01 176.59 1tuz n ASP 36 N -4.64 3.93 -3.22 1.42 8.00 0.26 -4.77 116.55 117.54 1tuz n ASP 36 Ca -0.09 -0.01 -0.08 0.00 0.71 0.00 0.00 54.79 55.32 1tuz n ASP 36 Cb 0.26 0.41 0.08 0.00 -0.02 0.00 0.00 41.12 41.86 1tuz n ASP 36 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tuz n GLY 37 N 2.90 -2.16 0.17 0.44 0.00 0.10 -4.73 105.19 101.92 1tuz n GLY 37 Ca -0.07 -0.70 0.03 0.00 0.00 0.00 0.00 46.02 45.27 1tuz n GLY 37 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1tuz h GLU 38 N 0.00 0.00 0.00 1.61 5.08 -1.89 -2.54 114.58 116.85 1tuz h GLU 38 Ca -0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1tuz h GLU 38 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1tuz h GLU 38 CO 0.06 0.46 0.00 -1.33 -1.00 0.00 0.00 179.01 177.21 1tuz n MET 39 N -3.75 0.05 0.00 2.33 2.81 -1.05 -0.62 117.12 116.88 1tuz n MET 39 Ca -0.01 0.47 0.14 0.00 -1.81 0.00 0.00 57.70 56.48 1tuz n MET 39 Cb 0.52 -1.62 0.78 0.00 -0.71 0.00 0.00 33.22 32.19 1tuz n MET 39 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1tuz n ALA 40 N -1.58 2.48 0.39 3.04 0.00 -0.96 -2.61 120.51 121.27 1tuz n ALA 40 Ca 0.01 -0.16 0.14 0.00 0.00 0.00 0.00 53.44 53.42 1tuz n ALA 40 Cb 0.06 -1.45 0.43 0.00 0.00 0.00 0.00 19.45 18.49 1tuz n ALA 40 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1tuz h LYS 41 N 0.00 0.00 -0.55 0.00 2.10 -1.08 -3.08 116.57 113.96 1tuz h LYS 41 Ca 0.00 0.00 -0.40 0.00 -2.00 0.00 0.00 60.65 58.25 1tuz h LYS 41 Cb 0.11 0.00 -0.33 0.00 -0.90 0.00 0.00 32.23 31.11 1tuz h LYS 41 CO 0.00 0.00 -0.77 0.66 -2.00 0.00 0.00 179.45 177.34 1tuz n TYR 42 N -2.67 2.01 -5.09 0.07 4.01 -1.07 -5.01 117.16 109.40 1tuz n TYR 42 Ca 0.03 -2.02 -0.29 0.00 -0.16 0.00 0.00 57.90 55.45 1tuz n TYR 42 Cb 0.38 -0.31 -0.16 0.00 -0.31 0.00 0.00 39.34 38.94 1tuz n TYR 42 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1tuz s VAL 43 N -4.17 1.80 -0.99 -0.72 1.01 -1.17 -4.36 120.40 111.79 1tuz s VAL 43 Ca 0.47 -0.93 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 1tuz s VAL 43 Cb 0.40 -1.53 0.25 0.00 0.00 0.00 0.00 36.38 35.50 1tuz s VAL 43 CO 0.01 0.51 0.93 -1.10 0.00 0.00 0.00 175.10 175.45 1tuz s GLN 44 N -0.12 3.75 4.63 2.72 -0.21 0.22 -4.95 119.66 125.70 1tuz s GLN 44 Ca -0.03 -3.14 0.00 0.00 0.02 0.00 0.00 55.36 52.21 1tuz s GLN 44 Cb -0.12 -4.30 0.00 0.00 1.00 0.00 0.00 33.01 29.59 1tuz s GLN 44 CO 0.03 -1.25 0.00 0.41 -2.12 0.00 0.00 175.29 172.36 1tuz n GLY 45 N 2.72 1.71 0.24 3.09 0.00 -1.26 -2.13 105.19 109.55 1tuz n GLY 45 Ca 0.21 -0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.30 1tuz n GLY 45 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tuz n ASP 46 N 8.20 2.59 -3.95 1.61 8.00 -1.26 -4.99 116.55 126.75 1tuz n ASP 46 Ca 0.00 -2.80 -0.12 0.00 0.71 0.00 0.00 54.79 52.57 1tuz n ASP 46 Cb 0.00 -0.36 -0.13 0.00 -0.02 0.00 0.00 41.12 40.62 1tuz n ASP 46 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1tuz s ALA 47 N -2.40 0.22 0.15 2.24 0.00 -0.91 -3.81 121.76 117.27 1tuz s ALA 47 Ca 0.27 -0.33 0.11 0.00 0.00 0.00 0.00 51.96 52.01 1tuz s ALA 47 Cb 0.23 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 1tuz s ALA 47 CO 0.04 -0.02 -0.23 -1.50 0.00 0.00 0.00 175.76 174.05 1tuz s ILE 48 N -0.62 2.45 0.71 0.00 2.07 -0.17 0.69 121.20 126.33 1tuz s ILE 48 Ca -0.05 -1.81 -0.12 0.00 -1.41 0.00 0.00 60.65 57.26 1tuz s ILE 48 Cb -0.05 -2.13 0.17 0.00 0.13 0.00 0.00 42.46 40.58 1tuz s ILE 48 CO -0.00 0.00 0.91 0.61 -1.91 0.00 0.00 174.94 174.55 1tuz n GLY 49 N 0.60 -1.58 0.10 1.50 0.00 -1.26 0.46 105.19 105.02 1tuz n GLY 49 Ca -0.15 -1.67 -0.11 0.00 0.00 0.00 0.00 46.02 44.09 1tuz n GLY 49 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1tuz h TYR 50 N -1.66 -0.12 0.04 1.61 3.20 -1.96 -2.64 116.97 115.45 1tuz h TYR 50 Ca -0.30 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.59 1tuz h TYR 50 Cb 0.84 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.11 1tuz h TYR 50 CO 0.00 0.40 -0.19 1.49 -1.64 0.00 0.00 178.16 178.22 1tuz h GLU 51 N -0.81 -0.32 -0.55 1.82 4.22 -1.95 -0.81 114.58 116.18 1tuz h GLU 51 Ca -0.01 0.02 0.15 0.00 0.08 0.00 0.00 59.36 59.59 1tuz h GLU 51 Cb 0.58 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 1tuz h GLU 51 CO 0.02 -0.21 0.39 0.78 -2.18 0.00 0.00 179.01 177.81 1tuz h GLY 52 N -0.33 0.13 2.00 1.92 0.00 -1.86 0.29 103.07 105.23 1tuz h GLY 52 Ca 0.04 -0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 1tuz h GLY 52 CO -0.15 0.01 -0.20 -2.75 0.00 0.00 0.00 176.54 173.46 1tuz h PHE 53 N 0.08 0.00 -0.67 5.60 3.57 -0.76 -2.62 116.94 122.15 1tuz h PHE 53 Ca 0.26 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.84 1tuz h PHE 53 Cb 0.94 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.62 1tuz h PHE 53 CO -0.00 0.20 0.35 1.96 -2.23 0.00 0.00 178.31 178.58 1tuz h GLN 54 N 0.00 0.60 -0.42 1.11 1.08 -0.14 0.53 115.11 117.87 1tuz h GLN 54 Ca -0.00 -0.04 0.06 0.00 -1.45 0.00 0.00 58.65 57.23 1tuz h GLN 54 Cb 0.39 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.66 1tuz h GLN 54 CO 0.03 0.40 0.28 1.96 -0.95 0.00 0.00 178.83 180.55 1tuz h GLN 55 N 0.62 0.28 0.11 1.46 4.20 -1.56 -2.04 115.11 118.19 1tuz h GLN 55 Ca 0.31 -0.02 0.01 0.00 0.06 0.00 0.00 58.65 59.02 1tuz h GLN 55 Cb 0.26 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 1tuz h GLN 55 CO -0.22 0.19 -0.15 0.35 -0.67 0.00 0.00 178.83 178.32 1tuz h PHE 56 N 0.29 -0.40 0.00 2.96 3.04 -0.96 -0.19 116.94 121.69 1tuz h PHE 56 Ca 0.19 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.13 1tuz h PHE 56 Cb 0.36 0.16 -0.00 0.00 2.56 0.00 0.00 35.95 39.03 1tuz h PHE 56 CO -0.00 -0.23 -0.05 -0.07 -2.02 0.00 0.00 178.31 175.94 1tuz h LEU 57 N -0.31 0.00 0.56 0.59 3.38 -1.27 1.34 115.31 119.60 1tuz h LEU 57 Ca 0.02 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1tuz h LEU 57 Cb 0.32 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1tuz h LEU 57 CO -0.07 0.05 -0.27 0.50 0.09 0.00 0.00 178.44 178.74 1tuz h LYS 58 N 0.00 -0.72 -0.11 1.13 3.64 -0.61 -2.28 116.57 117.62 1tuz h LYS 58 Ca -0.00 0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 1tuz h LYS 58 Cb 0.17 0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1tuz h LYS 58 CO 0.01 -0.46 -0.15 0.82 -2.27 0.00 0.00 179.45 177.40 1tuz h ILE 59 N -1.18 1.37 -0.00 2.00 2.04 -0.77 0.46 117.51 121.43 1tuz h ILE 59 Ca -0.08 -1.36 0.00 0.00 1.00 0.00 0.00 64.86 64.42 1tuz h ILE 59 Cb 0.59 2.01 -0.00 0.00 -0.74 0.00 0.00 36.82 38.69 1tuz h ILE 59 CO 0.13 0.39 -0.00 0.22 0.00 0.00 0.00 178.15 178.89 1tuz h TYR 60 N -0.12 -0.00 -0.11 1.37 3.20 0.17 0.17 116.97 121.65 1tuz h TYR 60 Ca 0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1tuz h TYR 60 Cb 0.70 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.97 1tuz h TYR 60 CO 0.10 -0.00 0.00 1.28 -1.64 0.00 0.00 178.16 177.90 1tuz n LEU 61 N -2.79 0.69 -1.84 2.82 4.77 -0.86 -4.85 117.00 114.94 1tuz n LEU 61 Ca -0.00 -0.32 -0.08 0.00 -0.03 0.00 0.00 56.01 55.58 1tuz n LEU 61 Cb 0.00 -0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 1tuz n LEU 61 CO -0.00 0.16 -0.09 -1.84 -1.33 0.00 0.00 177.39 174.29 1tuz n GLU 62 N -0.21 -1.84 -1.68 3.23 0.28 0.13 -4.88 120.64 115.66 1tuz n GLU 62 Ca 0.09 0.42 -0.30 0.00 -0.16 0.00 0.00 57.16 57.20 1tuz n GLU 62 Cb 0.14 -4.77 0.06 0.00 1.43 0.00 0.00 31.44 28.29 1tuz n GLU 62 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 1tuz s VAL 63 N -2.02 3.72 -1.75 3.84 -7.23 0.74 -4.91 120.40 112.78 1tuz s VAL 63 Ca 0.00 0.56 0.23 0.00 -1.81 0.00 0.00 61.98 60.96 1tuz s VAL 63 Cb 0.00 -3.40 0.01 0.00 0.56 0.00 0.00 36.38 33.55 1tuz s VAL 63 CO 0.00 -0.73 1.18 -0.67 -0.31 0.00 0.00 175.10 174.57 1tuz n ASP 64 N -3.14 1.56 -3.23 4.85 -0.08 -1.26 -4.62 116.55 110.64 1tuz n ASP 64 Ca 0.07 -1.23 0.04 0.00 -1.51 0.00 0.00 54.79 52.16 1tuz n ASP 64 Cb 0.55 0.48 -0.03 0.00 2.34 0.00 0.00 41.12 44.46 1tuz n ASP 64 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1tuz s ASN 65 N -2.60 -0.28 0.10 1.67 4.22 -1.26 -5.11 114.94 111.67 1tuz s ASN 65 Ca 0.18 0.32 -0.05 0.00 -2.14 0.00 0.00 52.86 51.16 1tuz s ASN 65 Cb 0.18 1.29 -0.05 0.00 1.28 0.00 0.00 41.25 43.95 1tuz s ASN 65 CO 0.62 -0.05 0.34 0.54 -2.04 0.00 0.00 177.10 176.51 1tuz s VAL 66 N 2.45 5.20 0.16 3.54 0.11 -1.26 -5.06 120.40 125.54 1tuz s VAL 66 Ca -0.02 0.08 -0.30 0.00 -2.93 0.00 0.00 61.98 58.81 1tuz s VAL 66 Cb -0.05 -3.62 -0.07 0.00 -1.53 0.00 0.00 36.38 31.11 1tuz s VAL 66 CO -0.14 0.15 1.12 -2.16 -3.33 0.00 0.00 175.10 170.74 1tuz s PRO 67 N -2.36 4.56 0.48 1.54 0.04 -1.26 -4.92 135.00 133.08 1tuz s PRO 67 Ca 0.37 1.74 0.24 0.00 0.04 0.00 0.00 61.00 63.39 1tuz s PRO 67 Cb -0.13 -3.28 1.21 0.00 0.04 0.00 0.00 34.50 32.34 1tuz s PRO 67 CO 0.22 0.01 1.97 0.00 0.04 0.00 0.00 177.00 179.24 1tuz h ARG 68 N 5.33 0.00 -0.00 4.56 3.08 -1.97 -1.97 114.38 123.40 1tuz h ARG 68 Ca -0.44 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.62 1tuz h ARG 68 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.26 1tuz h ARG 68 CO 0.74 0.18 -0.02 0.45 -1.07 0.00 0.00 179.97 180.25 1tuz h HIS 69 N 0.00 -0.06 -0.37 3.04 3.86 -1.99 0.18 115.15 119.81 1tuz h HIS 69 Ca -0.00 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.08 1tuz h HIS 69 Cb 0.49 0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.98 1tuz h HIS 69 CO 0.00 -0.04 -0.27 1.25 0.86 0.00 0.00 177.93 179.73 1tuz h LEU 70 N -0.04 0.88 -1.71 2.43 5.85 -1.91 -2.44 115.31 118.36 1tuz h LEU 70 Ca 0.01 -0.44 0.10 0.00 0.84 0.00 0.00 57.88 58.40 1tuz h LEU 70 Cb 0.06 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1tuz h LEU 70 CO -0.03 1.13 0.38 0.28 -0.34 0.00 0.00 178.44 179.86 1tuz h SER 71 N 0.63 0.30 -0.08 1.25 0.02 -1.01 1.43 113.55 116.09 1tuz h SER 71 Ca 0.07 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.99 1tuz h SER 71 Cb 0.84 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.33 1tuz h SER 71 CO 0.07 0.18 -0.12 -0.07 -1.14 0.00 0.00 176.83 175.75 1tuz h LEU 72 N 0.33 0.24 -1.20 5.07 -0.00 -0.32 -1.91 115.31 117.52 1tuz h LEU 72 Ca 0.26 -0.54 -0.00 0.00 -0.00 0.00 0.00 57.88 57.60 1tuz h LEU 72 Cb 0.58 -0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1tuz h LEU 72 CO -0.06 0.73 -0.01 0.00 -0.00 0.00 0.00 178.44 179.10 1tuz h ALA 73 N 0.52 1.00 0.03 1.53 0.00 -0.72 -1.82 119.26 119.80 1tuz h ALA 73 Ca 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tuz h ALA 73 Cb 0.68 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1tuz h ALA 73 CO 0.03 0.01 -0.01 -0.07 0.00 0.00 0.00 179.25 179.20 1tuz h LEU 74 N 0.00 -0.03 -0.52 0.00 3.38 0.21 -2.59 115.31 115.76 1tuz h LEU 74 Ca -0.00 -0.49 -0.08 0.00 0.09 0.00 0.00 57.88 57.40 1tuz h LEU 74 Cb 0.60 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1tuz h LEU 74 CO 0.00 0.49 0.01 0.15 0.09 0.00 0.00 178.44 179.18 1tuz h PHE 75 N -0.57 0.99 -0.84 1.13 3.57 -1.23 -2.72 116.94 117.27 1tuz h PHE 75 Ca -0.00 -0.17 0.13 0.00 3.53 0.00 0.00 57.97 61.46 1tuz h PHE 75 Cb 0.53 -0.26 -0.06 0.00 2.79 0.00 0.00 35.95 38.94 1tuz h PHE 75 CO 0.10 0.91 0.55 1.96 -2.23 0.00 0.00 178.31 179.60 1tuz h GLN 76 N 0.78 0.66 -0.14 1.11 4.20 -1.37 -1.58 115.11 118.77 1tuz h GLN 76 Ca 0.15 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.87 1tuz h GLN 76 Cb 0.51 -0.15 -0.06 0.00 0.30 0.00 0.00 27.48 28.08 1tuz h GLN 76 CO 0.02 0.44 -0.25 0.77 -0.67 0.00 0.00 178.83 179.14 1tuz h SER 77 N 0.68 -0.77 -3.61 1.46 0.02 -1.12 -3.42 113.55 106.79 1tuz h SER 77 Ca 0.41 0.12 -0.34 0.00 -0.84 0.00 0.00 61.79 61.15 1tuz h SER 77 Cb 0.63 0.34 -0.32 0.00 0.14 0.00 0.00 62.40 63.19 1tuz h SER 77 CO -0.17 -0.30 -0.75 -0.36 -1.14 0.00 0.00 176.83 174.11 1tuz s PHE 78 N -6.07 0.37 0.00 3.45 0.08 -0.60 -5.13 117.98 110.08 1tuz s PHE 78 Ca -0.15 -0.05 0.00 0.00 0.12 0.00 0.00 56.93 56.85 1tuz s PHE 78 Cb 0.11 -0.37 0.00 0.00 -0.57 0.00 0.00 43.02 42.18 1tuz s PHE 78 CO 0.67 -0.09 0.00 -1.91 -0.10 0.00 0.00 175.22 173.79 1tuz n GLU 79 N 3.73 0.00 0.00 0.44 2.13 -1.24 -4.65 120.64 121.05 1tuz n GLU 79 Ca -0.22 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.60 1tuz n GLU 79 Cb 0.53 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.24 1tuz n GLU 79 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1tuz n THR 80 N 0.00 0.00 0.00 6.31 5.66 -1.26 -4.82 114.28 120.17 1tuz n THR 80 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1tuz n THR 80 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1tuz n THR 80 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1tuz n GLY 81 N -0.26 0.85 3.50 1.09 0.00 -1.26 -4.34 105.19 104.77 1tuz n GLY 81 Ca 0.00 -0.46 -0.11 0.00 0.00 0.00 0.00 46.02 45.45 1tuz n GLY 81 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1tuz s HIS 82 N 0.00 0.67 -0.29 1.61 3.76 -1.26 -4.99 115.29 114.79 1tuz s HIS 82 Ca 0.00 -0.98 -0.24 0.00 -0.15 0.00 0.00 55.06 53.69 1tuz s HIS 82 Cb 0.00 0.00 0.14 0.00 1.11 0.00 0.00 32.58 33.83 1tuz s HIS 82 CO 0.00 -0.98 1.09 0.00 -0.85 0.00 0.00 174.74 174.01 1tuz n LEU 84 N 2.35 6.50 -2.18 0.00 7.99 -1.26 -3.75 117.00 126.65 1tuz n LEU 84 Ca -0.13 -3.53 -0.02 0.00 -0.01 0.00 0.00 56.01 52.32 1tuz n LEU 84 Cb 0.56 -1.10 -0.00 0.00 -0.11 0.00 0.00 43.42 42.76 1tuz n LEU 84 CO 0.02 1.37 0.48 -3.20 -1.51 0.00 0.00 177.39 174.55 1tuz n ASN 85 N 0.46 -0.67 -3.60 -1.43 5.15 -1.26 -5.14 115.26 108.77 1tuz n ASN 85 Ca 0.36 -1.39 -0.02 0.00 -0.60 0.00 0.00 54.58 52.93 1tuz n ASN 85 Cb 0.58 0.57 -0.06 0.00 -0.53 0.00 0.00 39.78 40.34 1tuz n ASN 85 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 1tuz s GLU 86 N 0.02 0.42 -0.66 1.20 2.56 -1.25 -5.05 118.70 115.95 1tuz s GLU 86 Ca 0.02 0.80 0.01 0.00 0.00 0.00 0.00 54.97 55.79 1tuz s GLU 86 Cb 0.05 0.19 0.40 0.00 2.00 0.00 0.00 34.13 36.76 1tuz s GLU 86 CO -0.01 -0.10 1.71 2.41 -0.56 0.00 0.00 175.26 178.70 1tuz n THR 87 N 4.10 3.18 -3.55 -1.70 -1.04 -1.26 -4.76 114.28 109.24 1tuz n THR 87 Ca -0.17 -4.24 -0.29 0.00 -2.04 0.00 0.00 64.05 57.32 1tuz n THR 87 Cb 0.57 -1.23 -0.12 0.00 -1.82 0.00 0.00 70.33 67.73 1tuz n THR 87 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1tuz s ASN 88 N -2.10 3.01 -0.62 8.00 2.47 -1.26 -4.96 114.94 119.47 1tuz s ASN 88 Ca 0.53 -2.55 -0.01 0.00 0.42 0.00 0.00 52.86 51.26 1tuz s ASN 88 Cb 0.44 -0.66 0.47 0.00 -1.45 0.00 0.00 41.25 40.05 1tuz s ASN 88 CO -0.25 -0.26 1.98 0.52 -3.72 0.00 0.00 177.10 175.37 1tuz n VAL 89 N 3.59 3.53 -2.02 -5.21 0.31 -1.26 -4.98 118.33 112.29 1tuz n VAL 89 Ca 0.14 -2.89 -0.30 0.00 -0.01 0.00 0.00 64.34 61.28 1tuz n VAL 89 Cb 0.38 -1.08 0.02 0.00 -0.91 0.00 0.00 33.84 32.25 1tuz n VAL 89 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1tuz s THR 90 N -4.64 4.45 -0.37 2.52 -1.32 -1.26 -4.43 115.64 110.58 1tuz s THR 90 Ca 0.63 0.65 -0.33 0.00 -1.21 0.00 0.00 61.69 61.43 1tuz s THR 90 Cb 0.50 -3.77 0.05 0.00 -1.51 0.00 0.00 72.50 67.77 1tuz s THR 90 CO 0.01 -0.96 0.55 2.29 -2.21 0.00 0.00 174.62 174.29 1tuz n LYS 91 N -2.71 -1.57 -3.24 7.08 2.85 -1.26 -4.85 118.16 114.45 1tuz n LYS 91 Ca 0.05 1.16 -0.40 0.00 -1.05 0.00 0.00 58.31 58.08 1tuz n LYS 91 Cb 0.55 -1.63 -0.07 0.00 -0.65 0.00 0.00 35.03 33.23 1tuz n LYS 91 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1tuz s ASP 92 N -1.19 6.49 0.28 -5.58 1.01 -1.26 -5.06 116.67 111.36 1tuz s ASP 92 Ca 0.32 0.59 0.08 0.00 0.71 0.00 0.00 52.55 54.24 1tuz s ASP 92 Cb -0.03 -2.28 -0.04 0.00 1.01 0.00 0.00 42.92 41.58 1tuz s ASP 92 CO 0.72 -0.24 0.16 0.68 0.21 0.00 0.00 175.17 176.70 1tuz s VAL 93 N 2.01 3.84 0.03 -1.27 -7.23 -1.26 -3.36 120.40 113.16 1tuz s VAL 93 Ca 0.22 -1.55 0.01 0.00 -1.81 0.00 0.00 61.98 58.85 1tuz s VAL 93 Cb -0.15 -3.17 -0.02 0.00 0.56 0.00 0.00 36.38 33.59 1tuz s VAL 93 CO 0.09 -0.30 -0.05 0.54 -0.31 0.00 0.00 175.10 175.08 1tuz s VAL 94 N -2.25 0.29 0.19 1.32 0.11 0.17 -4.25 120.40 115.99 1tuz s VAL 94 Ca 0.35 -0.89 -0.30 0.00 -2.93 0.00 0.00 61.98 58.21 1tuz s VAL 94 Cb -0.06 -0.39 -0.08 0.00 -1.53 0.00 0.00 36.38 34.32 1tuz s VAL 94 CO 0.24 -0.39 1.11 0.00 -3.33 0.00 0.00 175.10 172.73 1tuz h LEU 96 N 4.95 0.82 -1.76 0.00 4.07 -1.97 -2.97 115.31 118.45 1tuz h LEU 96 Ca -0.45 -0.83 0.04 0.00 0.08 0.00 0.00 57.88 56.72 1tuz h LEU 96 Cb 1.21 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.67 1tuz h LEU 96 CO 0.72 1.64 0.24 -1.13 -1.08 0.00 0.00 178.44 178.83 1tuz h ASN 97 N 0.18 0.27 -0.15 -0.43 -1.24 -1.92 1.42 115.58 113.72 1tuz h ASN 97 Ca -0.22 -0.00 -0.07 0.00 0.71 0.00 0.00 56.30 56.72 1tuz h ASN 97 Cb 2.07 -0.06 -0.00 0.00 0.73 0.00 0.00 38.32 41.05 1tuz h ASN 97 CO 0.26 0.18 -0.17 0.44 -1.29 0.00 0.00 177.43 176.85 1tuz h ASP 98 N 0.31 0.40 0.07 1.15 3.32 -1.96 -1.61 116.42 118.10 1tuz h ASP 98 Ca 0.15 -0.49 -0.14 0.00 0.02 0.00 0.00 57.03 56.56 1tuz h ASP 98 Cb 0.21 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1tuz h ASP 98 CO -0.03 0.82 -0.49 0.58 -1.72 0.00 0.00 179.24 178.40 1tuz h VAL 99 N 0.00 1.32 0.00 -1.35 2.07 -1.07 -2.01 116.25 115.21 1tuz h VAL 99 Ca 0.02 -1.71 -0.03 0.00 0.82 0.00 0.00 66.70 65.80 1tuz h VAL 99 Cb 0.71 1.71 -0.00 0.00 -1.52 0.00 0.00 31.29 32.19 1tuz h VAL 99 CO 0.04 0.53 -0.15 0.77 0.02 0.00 0.00 177.57 178.77 1tuz h SER 100 N 0.39 0.00 0.06 0.57 4.64 0.20 0.13 113.55 119.54 1tuz h SER 100 Ca 0.02 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1tuz h SER 100 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1tuz h SER 100 CO 0.09 0.15 -0.03 0.00 -0.87 0.00 0.00 176.83 176.18 1tuz h TYR 102 N -0.93 0.53 -0.11 0.00 3.20 -1.13 -0.70 116.97 117.84 1tuz h TYR 102 Ca -0.01 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.79 1tuz h TYR 102 Cb 0.58 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1tuz h TYR 102 CO 0.14 0.20 -0.36 0.74 -1.64 0.00 0.00 178.16 177.24 1tuz h PHE 103 N 0.53 0.25 -0.08 -3.82 -1.00 -0.84 -2.38 116.94 109.61 1tuz h PHE 103 Ca 0.30 -0.06 0.02 0.00 2.81 0.00 0.00 57.97 61.04 1tuz h PHE 103 Cb 0.29 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.79 1tuz h PHE 103 CO -0.12 0.56 0.08 1.03 -1.61 0.00 0.00 178.31 178.25 1tuz h SER 104 N 0.19 0.00 -0.20 2.17 0.87 -0.03 -0.60 113.55 115.94 1tuz h SER 104 Ca 0.02 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.49 1tuz h SER 104 Cb 0.73 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.69 1tuz h SER 104 CO 0.06 0.00 -0.23 0.25 -0.53 0.00 0.00 176.83 176.38 1tuz h LEU 105 N 0.00 0.55 0.00 2.23 6.46 -1.13 0.94 115.31 124.37 1tuz h LEU 105 Ca 0.04 -0.49 0.01 0.00 -0.12 0.00 0.00 57.88 57.31 1tuz h LEU 105 Cb 0.19 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 39.95 1tuz h LEU 105 CO -0.00 0.93 -0.19 -0.07 -0.62 0.00 0.00 178.44 178.49 1tuz h LEU 106 N 0.18 -0.57 -1.34 2.25 4.07 -1.16 -1.07 115.31 117.67 1tuz h LEU 106 Ca 0.03 0.06 0.13 0.00 0.08 0.00 0.00 57.88 58.19 1tuz h LEU 106 Cb 0.79 0.22 -0.06 0.00 1.08 0.00 0.00 40.66 42.68 1tuz h LEU 106 CO 0.06 -0.18 0.55 1.05 -1.08 0.00 0.00 178.44 178.84 1tuz h GLU 107 N -0.24 0.64 0.00 1.13 4.11 -1.60 -3.46 114.58 115.17 1tuz h GLU 107 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.39 1tuz h GLU 107 Cb 0.25 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1tuz h GLU 107 CO -0.12 0.43 0.00 0.41 0.07 0.00 0.00 179.01 179.79 1tuz n GLY 108 N -1.45 -2.29 0.00 1.06 0.00 -0.33 -5.13 105.19 97.06 1tuz n GLY 108 Ca 0.16 0.77 0.00 0.00 0.00 0.00 0.00 46.02 46.95 1tuz n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tuz n GLY 109 N -0.43 1.31 3.11 -0.02 0.00 0.31 -4.30 105.19 105.18 1tuz n GLY 109 Ca 0.00 0.37 -0.36 0.00 0.00 0.00 0.00 46.02 46.03 1tuz n GLY 109 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1tuz s ARG 110 N -0.12 2.25 0.97 1.61 3.52 -1.25 -4.94 118.95 120.99 1tuz s ARG 110 Ca 0.00 -2.10 -0.14 0.00 -0.13 0.00 0.00 55.73 53.36 1tuz s ARG 110 Cb 0.00 -3.66 0.17 0.00 -1.56 0.00 0.00 34.95 29.90 1tuz s ARG 110 CO 0.00 -1.12 1.16 -1.25 -0.81 0.00 0.00 175.30 173.28 1tuz s PRO 111 N 0.67 0.66 0.00 5.12 0.04 -1.26 -4.92 135.00 135.32 1tuz s PRO 111 Ca 0.12 0.11 0.00 0.00 0.04 0.00 0.00 61.00 61.27 1tuz s PRO 111 Cb -0.22 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1tuz s PRO 111 CO -0.04 -2.49 0.00 -1.91 0.04 0.00 0.00 177.00 172.61 1tuz n GLU 112 N -3.93 0.00 0.00 4.56 2.13 -1.26 -5.11 120.64 117.03 1tuz n GLU 112 Ca 0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.91 1tuz n GLU 112 Cb 0.59 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.30 1tuz n GLU 112 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1tuz n ASP 113 N 0.00 0.00 -4.85 4.31 2.03 -1.26 -5.16 116.55 111.62 1tuz n ASP 113 Ca 0.00 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 54.99 1tuz n ASP 113 Cb 0.00 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.34 1tuz n ASP 113 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 1tuz s LYS 114 N 0.00 4.01 0.72 -0.67 -2.85 -1.26 -5.08 119.74 114.61 1tuz s LYS 114 Ca 0.00 0.75 -0.03 0.00 -1.00 0.00 0.00 55.97 55.69 1tuz s LYS 114 Cb 0.00 -2.35 0.12 0.00 -2.06 0.00 0.00 37.83 33.53 1tuz s LYS 114 CO 0.00 0.06 1.00 -0.51 0.10 0.00 0.00 175.35 176.00 1tuz s LEU 115 N -3.24 2.97 -0.13 2.77 1.02 -1.26 -5.12 118.68 115.70 1tuz s LEU 115 Ca 0.56 -0.18 -0.07 0.00 0.02 0.00 0.00 54.13 54.46 1tuz s LEU 115 Cb -0.10 -2.23 0.05 0.00 0.02 0.00 0.00 46.19 43.93 1tuz s LEU 115 CO 0.20 -1.83 0.31 -1.61 0.02 0.00 0.00 176.35 173.44 1tuz s GLU 116 N -5.17 0.27 -0.94 1.70 2.02 -1.26 -5.07 118.70 110.25 1tuz s GLU 116 Ca 0.65 0.64 -0.01 0.00 0.02 0.00 0.00 54.97 56.27 1tuz s GLU 116 Cb -0.06 -0.08 0.28 0.00 0.10 0.00 0.00 34.13 34.37 1tuz s GLU 116 CO 0.44 -0.17 1.20 0.91 0.02 0.00 0.00 175.26 177.67 1tuz n TRP 117 N 4.30 2.97 0.60 1.61 8.01 -1.26 -5.35 117.44 128.32 1tuz n TRP 117 Ca -0.24 -3.22 0.05 0.00 -1.31 0.00 0.00 57.50 52.78 1tuz n TRP 117 Cb 0.54 -1.07 0.28 0.00 -2.01 0.00 0.00 31.31 29.05 1tuz n TRP 117 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13