#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 -1.13 -2.00 -5.12 0.00 -1.26 -4.43 120.51 106.57 1tuz n ALA 2 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1tuz n ALA 2 Cb 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 17.68 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 -3.48 0.00 0.00 0.00 3.00 -1.26 -5.18 118.16 111.24 1tuz n LYS 3 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.38 1tuz n LYS 3 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.50 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 0.00 -1.10 1.64 2.13 -1.26 -5.01 120.64 117.04 1tuz n GLU 4 Ca 0.00 0.00 -0.17 0.00 0.66 0.00 0.00 57.16 57.65 1tuz n GLU 4 Cb 0.00 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.66 1tuz n GLU 4 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1tuz n ARG 5 N -0.44 1.98 0.00 5.31 3.00 -1.26 -4.88 116.66 120.37 1tuz n ARG 5 Ca 0.00 -1.53 0.00 0.00 -0.00 0.00 0.00 57.85 56.32 1tuz n ARG 5 Cb 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 32.46 30.63 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 1.20 0.66 3.25 5.14 0.00 -1.26 -4.64 105.19 109.54 1tuz n GLY 6 Ca 0.37 0.35 -0.20 0.00 0.00 0.00 0.00 46.02 46.53 1tuz n GLY 6 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tuz n LEU 7 N 0.00 -3.22 -4.39 0.99 4.77 -1.26 -2.24 117.00 111.65 1tuz n LEU 7 Ca 0.00 -0.46 -0.36 0.00 -0.03 0.00 0.00 56.01 55.16 1tuz n LEU 7 Cb 0.00 -2.64 -0.08 0.00 -2.33 0.00 0.00 43.42 38.36 1tuz n LEU 7 CO 0.00 0.54 -0.31 2.30 -1.33 0.00 0.00 177.39 178.59 1tuz n ILE 8 N -4.56 -0.68 -1.13 -0.08 -5.35 -1.26 -3.89 119.36 102.40 1tuz n ILE 8 Ca -0.01 -0.27 0.13 0.00 -0.27 0.00 0.00 62.75 62.33 1tuz n ILE 8 Cb 0.56 -0.90 -0.05 0.00 -1.74 0.00 0.00 39.64 37.51 1tuz n ILE 8 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1tuz n SER 9 N -2.70 -5.94 0.00 7.28 7.64 -0.95 -2.29 113.62 116.65 1tuz n SER 9 Ca -0.12 0.67 0.12 0.00 1.01 0.00 0.00 58.87 60.54 1tuz n SER 9 Cb 0.59 -3.63 0.70 0.00 -1.01 0.00 0.00 64.21 60.86 1tuz n SER 9 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1tuz n PRO 10 N -3.51 0.75 -0.06 1.43 -0.04 -1.26 -2.50 135.00 129.81 1tuz n PRO 10 Ca -0.02 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.31 1tuz n PRO 10 Cb 0.63 -1.49 -0.12 0.00 -0.04 0.00 0.00 33.50 32.48 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 -0.00 -0.00 3.54 0.02 -1.88 -2.40 113.55 112.83 1tuz h SER 11 Ca 0.00 -0.90 -0.03 0.00 -0.84 0.00 0.00 61.79 60.01 1tuz h SER 11 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1tuz h SER 11 CO 0.00 0.93 -0.12 0.44 -1.14 0.00 0.00 176.83 176.94 1tuz h ASP 12 N -0.96 0.11 -0.51 3.07 5.19 -1.41 -3.03 116.42 118.87 1tuz h ASP 12 Ca -0.00 -0.78 0.10 0.00 -0.62 0.00 0.00 57.03 55.73 1tuz h ASP 12 Cb 0.91 -0.03 -0.03 0.00 0.18 0.00 0.00 39.33 40.35 1tuz h ASP 12 CO 0.00 0.87 0.35 0.15 -3.12 0.00 0.00 179.24 177.50 1tuz h PHE 13 N -0.64 0.31 0.59 4.55 3.04 -1.60 -0.47 116.94 122.72 1tuz h PHE 13 Ca -0.01 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 61.91 1tuz h PHE 13 Cb 0.89 -0.10 0.01 0.00 2.56 0.00 0.00 35.95 39.31 1tuz h PHE 13 CO 0.19 0.15 -0.29 0.00 -2.02 0.00 0.00 178.31 176.34 1tuz h ALA 14 N 1.74 -0.80 0.18 2.41 0.00 -1.44 0.22 119.26 121.58 1tuz h ALA 14 Ca 0.24 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1tuz h ALA 14 Cb 0.56 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 1tuz h ALA 14 CO -0.05 -0.86 -0.35 0.37 0.00 0.00 0.00 179.25 178.35 1tuz h GLN 15 N -0.97 -0.60 -0.24 0.00 5.75 -1.26 0.84 115.11 118.62 1tuz h GLN 15 Ca -0.08 0.04 0.06 0.00 -0.15 0.00 0.00 58.65 58.52 1tuz h GLN 15 Cb 0.66 0.14 -0.07 0.00 1.07 0.00 0.00 27.48 29.28 1tuz h GLN 15 CO 0.13 -0.40 -0.29 1.25 -2.65 0.00 0.00 178.83 176.87 1tuz h LEU 16 N -0.63 -0.93 0.54 -2.39 7.12 -1.12 1.08 115.31 118.98 1tuz h LEU 16 Ca 0.01 0.15 -0.02 0.00 0.13 0.00 0.00 57.88 58.16 1tuz h LEU 16 Cb 0.63 0.42 -0.02 0.00 -0.53 0.00 0.00 40.66 41.16 1tuz h LEU 16 CO -0.17 -0.32 -0.48 -0.61 -0.13 0.00 0.00 178.44 176.73 1tuz h GLN 17 N -0.30 -0.97 -0.13 1.25 4.15 -0.10 0.93 115.11 119.94 1tuz h GLN 17 Ca 0.13 0.07 0.04 0.00 0.77 0.00 0.00 58.65 59.66 1tuz h GLN 17 Cb 0.51 0.22 -0.07 0.00 0.21 0.00 0.00 27.48 28.36 1tuz h GLN 17 CO -0.41 -0.65 -0.44 -0.22 -1.93 0.00 0.00 178.83 175.18 1tuz h LYS 18 N -1.01 -0.49 -1.00 1.69 3.64 0.12 1.12 116.57 120.64 1tuz h LYS 18 Ca -0.06 0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.47 1tuz h LYS 18 Cb 0.86 0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 32.71 1tuz h LYS 18 CO -0.03 -0.33 0.63 1.88 -2.27 0.00 0.00 179.45 179.33 1tuz h TYR 19 N -0.51 1.14 -0.25 1.91 -1.99 0.14 -1.57 116.97 115.84 1tuz h TYR 19 Ca 0.07 0.03 -0.05 0.00 2.00 0.00 0.00 58.73 60.78 1tuz h TYR 19 Cb 0.64 -0.36 -0.01 0.00 2.00 0.00 0.00 36.73 39.00 1tuz h TYR 19 CO -0.50 0.44 -0.05 1.98 -0.00 0.00 0.00 178.16 180.03 1tuz h MET 20 N 0.98 0.47 -0.69 4.88 1.85 0.29 -3.07 114.93 119.64 1tuz h MET 20 Ca 0.50 -0.18 0.12 0.00 -0.61 0.00 0.00 59.70 59.54 1tuz h MET 20 Cb 0.51 -0.03 -0.13 0.00 0.43 0.00 0.00 31.60 32.38 1tuz h MET 20 CO -0.27 0.69 -0.31 0.93 -0.40 0.00 0.00 176.91 177.55 1tuz h GLU 21 N 0.22 -0.10 -0.21 0.39 5.08 0.22 1.12 114.58 121.31 1tuz h GLU 21 Ca 0.06 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.49 1tuz h GLU 21 Cb 0.52 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1tuz h GLU 21 CO 0.02 -0.06 0.16 -0.92 -1.00 0.00 0.00 179.01 177.21 1tuz h TYR 22 N -0.10 0.00 -4.01 4.33 5.03 -1.46 -3.42 116.97 117.34 1tuz h TYR 22 Ca 0.28 0.00 -0.48 0.00 2.58 0.00 0.00 58.73 61.11 1tuz h TYR 22 Cb 0.56 0.00 0.07 0.00 1.55 0.00 0.00 36.73 38.91 1tuz h TYR 22 CO -0.67 0.00 0.28 0.45 -1.32 0.00 0.00 178.16 176.90 1tuz s SER 23 N -6.62 5.36 0.00 -2.11 0.15 0.39 -5.01 113.70 105.86 1tuz s SER 23 Ca -0.05 0.82 0.00 0.00 0.70 0.00 0.00 55.95 57.42 1tuz s SER 23 Cb 0.18 -1.66 0.00 0.00 -1.71 0.00 0.00 66.02 62.82 1tuz s SER 23 CO 0.68 -1.29 0.74 1.07 1.20 0.00 0.00 173.24 175.64 1tuz n THR 24 N -2.82 0.00 -2.96 6.45 5.66 -1.26 -4.94 114.28 114.41 1tuz n THR 24 Ca 0.06 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 60.88 1tuz n THR 24 Cb 0.58 0.41 0.02 0.00 -1.55 0.00 0.00 70.33 69.78 1tuz n THR 24 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1tuz s LYS 25 N 0.00 2.79 -0.05 1.09 1.02 -1.26 -5.11 119.74 118.23 1tuz s LYS 25 Ca 0.00 -1.08 -0.01 0.00 0.02 0.00 0.00 55.97 54.90 1tuz s LYS 25 Cb 0.00 -2.69 -0.04 0.00 -0.52 0.00 0.00 37.83 34.58 1tuz s LYS 25 CO 0.00 -0.35 0.05 0.15 -0.92 0.00 0.00 175.35 174.28 1tuz s LYS 26 N -4.45 3.05 0.45 1.68 -0.14 -1.26 -4.99 119.74 114.08 1tuz s LYS 26 Ca 0.54 -0.43 0.17 0.00 -1.36 0.00 0.00 55.97 54.90 1tuz s LYS 26 Cb -0.10 -2.85 1.05 0.00 -1.68 0.00 0.00 37.83 34.25 1tuz s LYS 26 CO 0.34 0.68 1.97 -0.24 -0.76 0.00 0.00 175.35 177.35 1tuz h VAL 27 N 3.68 1.02 0.00 3.17 3.04 -1.96 -0.70 116.25 124.50 1tuz h VAL 27 Ca -0.50 -0.75 -0.02 0.00 -1.01 0.00 0.00 66.70 64.42 1tuz h VAL 27 Cb 1.19 1.42 -0.00 0.00 -2.01 0.00 0.00 31.29 31.89 1tuz h VAL 27 CO 0.58 0.21 -0.08 0.77 -1.01 0.00 0.00 177.57 178.04 1tuz h SER 28 N 0.00 0.00 -0.16 3.17 4.64 -1.94 0.23 113.55 119.49 1tuz h SER 28 Ca -0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 1tuz h SER 28 Cb 0.40 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.50 1tuz h SER 28 CO 0.03 0.08 -0.55 -0.78 -0.87 0.00 0.00 176.83 174.74 1tuz h ASP 29 N 0.00 0.76 0.44 4.97 3.58 -1.53 -2.78 116.42 121.85 1tuz h ASP 29 Ca -0.00 -0.60 -0.16 0.00 0.42 0.00 0.00 57.03 56.68 1tuz h ASP 29 Cb 0.35 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 1tuz h ASP 29 CO 0.01 1.23 -0.69 0.58 -2.88 0.00 0.00 179.24 177.49 1tuz h VAL 30 N 0.33 1.42 0.07 2.25 2.07 -1.38 -2.90 116.25 118.11 1tuz h VAL 30 Ca -0.02 -2.18 0.02 0.00 0.82 0.00 0.00 66.70 65.34 1tuz h VAL 30 Cb 1.17 2.15 -0.03 0.00 -1.52 0.00 0.00 31.29 33.06 1tuz h VAL 30 CO 0.12 0.64 -0.23 0.25 0.02 0.00 0.00 177.57 178.36 1tuz h LEU 31 N 0.15 -0.67 -1.67 2.57 5.85 -0.91 0.94 115.31 121.56 1tuz h LEU 31 Ca -0.02 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.83 1tuz h LEU 31 Cb 1.23 0.26 -0.02 0.00 0.37 0.00 0.00 40.66 42.50 1tuz h LEU 31 CO 0.11 -0.31 0.29 0.07 -0.34 0.00 0.00 178.44 178.25 1tuz h LYS 32 N -0.41 0.41 -0.52 1.25 2.10 -1.49 0.11 116.57 118.02 1tuz h LYS 32 Ca 0.04 -0.02 -0.05 0.00 -2.00 0.00 0.00 60.65 58.61 1tuz h LYS 32 Cb 0.45 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.67 1tuz h LYS 32 CO -0.16 0.27 0.11 -0.07 -2.00 0.00 0.00 179.45 177.60 1tuz h LEU 33 N 0.42 0.75 0.00 7.07 3.38 -0.83 0.91 115.31 127.01 1tuz h LEU 33 Ca 0.18 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1tuz h LEU 33 Cb 0.19 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1tuz h LEU 33 CO -0.04 0.74 -0.07 0.49 0.09 0.00 0.00 178.44 179.65 1tuz n PHE 34 N -4.27 0.67 -0.07 1.13 3.01 0.21 -0.02 117.46 118.12 1tuz n PHE 34 Ca 0.04 0.19 -0.07 0.00 1.01 0.00 0.00 57.45 58.62 1tuz n PHE 34 Cb 0.23 -0.80 -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 0.17 -3.13 114.58 114.94 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 0.68 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 1tuz h GLU 35 CO 0.00 0.24 -1.28 -3.47 -1.16 0.00 0.00 179.01 173.34 1tuz n ASP 36 N -4.64 3.90 -3.22 1.42 2.03 0.19 -4.74 116.55 111.50 1tuz n ASP 36 Ca -0.09 -0.01 -0.09 0.00 0.52 0.00 0.00 54.79 55.13 1tuz n ASP 36 Cb 0.26 0.43 0.08 0.00 -0.72 0.00 0.00 41.12 41.18 1tuz n ASP 36 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1tuz n GLY 37 N 2.87 -2.24 0.24 0.27 0.00 0.97 -4.70 105.19 102.60 1tuz n GLY 37 Ca -0.07 -0.73 -0.03 0.00 0.00 0.00 0.00 46.02 45.18 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 0.47 0.00 1.61 4.39 -1.89 -2.16 114.58 117.00 1tuz h GLU 38 Ca -0.11 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.41 1tuz h GLU 38 Cb 0.38 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1tuz h GLU 38 CO 0.07 0.68 0.10 0.52 -1.16 0.00 0.00 179.01 179.22 1tuz h MET 39 N 0.42 0.00 0.00 2.33 2.86 -1.82 0.46 114.93 119.18 1tuz h MET 39 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1tuz h MET 39 Cb 0.65 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.31 1tuz h MET 39 CO 0.05 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.02 1tuz n ALA 40 N -1.75 2.32 0.15 6.32 0.00 -0.81 -2.63 120.51 124.10 1tuz n ALA 40 Ca -0.01 -0.13 -0.00 0.00 0.00 0.00 0.00 53.44 53.29 1tuz n ALA 40 Cb 0.13 -1.39 0.24 0.00 0.00 0.00 0.00 19.45 18.43 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 0.02 -0.73 0.00 2.10 -0.26 -3.00 116.57 114.71 1tuz h LYS 41 Ca 0.00 -0.01 -0.51 0.00 -2.00 0.00 0.00 60.65 58.13 1tuz h LYS 41 Cb 0.10 0.00 -0.33 0.00 -0.90 0.00 0.00 32.23 31.11 1tuz h LYS 41 CO 0.00 0.53 -0.25 0.66 -2.00 0.00 0.00 179.45 178.39 1tuz n TYR 42 N -3.93 2.53 -5.06 0.07 4.01 -1.08 -4.98 117.16 108.71 1tuz n TYR 42 Ca -0.01 -2.31 -0.28 0.00 -0.16 0.00 0.00 57.90 55.14 1tuz n TYR 42 Cb 0.53 -0.65 -0.16 0.00 -0.31 0.00 0.00 39.34 38.75 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 -4.40 1.70 -0.52 -0.72 1.01 -1.13 -4.52 120.40 111.82 1tuz s VAL 43 Ca 0.53 -0.92 -0.14 0.00 0.00 0.00 0.00 61.98 61.45 1tuz s VAL 43 Cb 0.43 -1.42 0.12 0.00 0.00 0.00 0.00 36.38 35.52 1tuz s VAL 43 CO 0.02 0.48 0.45 -1.10 0.00 0.00 0.00 175.10 174.95 1tuz s GLN 44 N -0.48 2.85 4.48 2.72 -0.21 0.11 -4.94 119.66 124.18 1tuz s GLN 44 Ca 0.08 -1.70 0.00 0.00 0.02 0.00 0.00 55.36 53.75 1tuz s GLN 44 Cb -0.09 -4.18 0.00 0.00 1.00 0.00 0.00 33.01 29.74 1tuz s GLN 44 CO -0.01 -1.27 0.00 0.41 -2.12 0.00 0.00 175.29 172.30 1tuz n GLY 45 N 5.15 0.55 0.07 3.09 0.00 -1.26 0.37 105.19 113.16 1tuz n GLY 45 Ca -0.12 0.59 0.07 0.00 0.00 0.00 0.00 46.02 46.56 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 8.98 2.15 -3.97 1.61 9.92 -1.26 -4.99 116.55 128.98 1tuz n ASP 46 Ca 0.00 -2.74 -0.20 0.00 -0.53 0.00 0.00 54.79 51.32 1tuz n ASP 46 Cb 0.00 -0.31 -0.16 0.00 -0.64 0.00 0.00 41.12 40.02 1tuz n ASP 46 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1tuz s ALA 47 N -2.25 0.77 0.10 2.24 0.00 0.16 -4.05 121.76 118.72 1tuz s ALA 47 Ca 0.22 -0.26 0.09 0.00 0.00 0.00 0.00 51.96 52.01 1tuz s ALA 47 Cb 0.19 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 1tuz s ALA 47 CO 0.02 0.10 -0.19 -1.50 0.00 0.00 0.00 175.76 174.20 1tuz s ILE 48 N 0.32 2.78 0.77 0.00 -1.16 -0.77 0.06 121.20 123.19 1tuz s ILE 48 Ca -0.05 -1.44 -0.05 0.00 -0.51 0.00 0.00 60.65 58.60 1tuz s ILE 48 Cb -0.09 -2.24 0.16 0.00 0.61 0.00 0.00 42.46 40.90 1tuz s ILE 48 CO 0.00 0.16 1.05 0.61 -2.81 0.00 0.00 174.94 173.95 1tuz n GLY 49 N 1.01 -0.05 0.19 1.50 0.00 -1.26 -1.15 105.19 105.43 1tuz n GLY 49 Ca -0.16 -1.92 0.05 0.00 0.00 0.00 0.00 46.02 43.99 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 -0.97 0.00 -0.18 1.61 3.20 -1.98 -2.92 116.97 115.72 1tuz h TYR 50 Ca -0.34 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.50 1tuz h TYR 50 Cb 1.14 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.41 1tuz h TYR 50 CO 0.00 0.37 0.01 1.49 -1.64 0.00 0.00 178.16 178.39 1tuz h GLU 51 N 0.00 0.32 -0.39 1.82 4.81 -1.93 -2.82 114.58 116.39 1tuz h GLU 51 Ca -0.00 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 1tuz h GLU 51 Cb 0.77 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.10 1tuz h GLU 51 CO 0.05 0.51 0.21 0.78 -0.73 0.00 0.00 179.01 179.83 1tuz h GLY 52 N 0.08 0.57 2.00 1.92 0.00 -1.77 -1.04 103.07 104.84 1tuz h GLY 52 Ca 0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 1tuz h GLY 52 CO 0.01 0.23 -0.07 0.74 0.00 0.00 0.00 176.54 177.45 1tuz h PHE 53 N 0.54 0.00 -0.47 5.60 0.04 -1.32 -2.24 116.94 119.10 1tuz h PHE 53 Ca 0.14 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.98 1tuz h PHE 53 Cb 0.02 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.11 1tuz h PHE 53 CO 0.00 0.07 0.15 1.96 -0.60 0.00 0.00 178.31 179.89 1tuz h GLN 54 N 0.00 0.30 0.00 1.51 1.08 -1.05 -0.60 115.11 116.35 1tuz h GLN 54 Ca -0.00 -0.02 -0.13 0.00 -1.45 0.00 0.00 58.65 57.05 1tuz h GLN 54 Cb 0.13 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.47 1tuz h GLN 54 CO 0.01 0.20 -0.62 1.96 -0.95 0.00 0.00 178.83 179.43 1tuz h GLN 55 N 0.31 0.00 -0.22 1.46 1.08 -1.53 -3.23 115.11 112.99 1tuz h GLN 55 Ca 0.23 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.45 1tuz h GLN 55 Cb 0.25 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.65 1tuz h GLN 55 CO -0.25 0.62 0.05 0.35 -0.95 0.00 0.00 178.83 178.65 1tuz h PHE 56 N 0.00 0.08 -0.09 2.96 3.04 -0.66 0.65 116.94 122.93 1tuz h PHE 56 Ca -0.01 0.01 0.02 0.00 3.98 0.00 0.00 57.97 61.98 1tuz h PHE 56 Cb 1.20 -0.01 -0.00 0.00 2.56 0.00 0.00 35.95 39.70 1tuz h PHE 56 CO 0.00 0.03 0.23 -0.07 -2.02 0.00 0.00 178.31 176.48 1tuz h LEU 57 N 0.14 0.00 0.54 0.59 3.38 -1.29 1.78 115.31 120.45 1tuz h LEU 57 Ca 0.10 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1tuz h LEU 57 Cb 0.09 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.84 1tuz h LEU 57 CO -0.12 0.00 -0.26 0.50 0.09 0.00 0.00 178.44 178.65 1tuz h LYS 58 N 0.00 -0.70 -0.16 1.13 1.63 -0.97 -2.97 116.57 114.54 1tuz h LYS 58 Ca 0.04 0.05 -0.13 0.00 -0.85 0.00 0.00 60.65 59.76 1tuz h LYS 58 Cb 0.51 0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.30 1tuz h LYS 58 CO -0.00 -0.47 -0.41 0.82 -3.45 0.00 0.00 179.45 175.94 1tuz h ILE 59 N -1.20 1.35 0.00 2.00 2.04 -1.01 0.55 117.51 121.23 1tuz h ILE 59 Ca -0.07 -1.68 0.00 0.00 1.00 0.00 0.00 64.86 64.10 1tuz h ILE 59 Cb 0.56 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.64 1tuz h ILE 59 CO 0.12 0.51 0.00 0.00 0.00 0.00 0.00 178.15 178.78 1tuz n TYR 60 N -4.27 0.00 1.57 1.37 9.36 0.60 -0.68 117.16 125.11 1tuz n TYR 60 Ca -0.07 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.30 1tuz n TYR 60 Cb 0.55 -0.37 0.61 0.00 -0.63 0.00 0.00 39.34 39.50 1tuz n TYR 60 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1tuz n LEU 61 N -2.48 1.00 0.00 2.98 4.32 -1.12 -4.79 117.00 116.92 1tuz n LEU 61 Ca 0.00 -0.31 0.00 0.00 -0.02 0.00 0.00 56.01 55.68 1tuz n LEU 61 Cb 0.00 -0.04 0.00 0.00 -1.62 0.00 0.00 43.42 41.76 1tuz n LEU 61 CO 0.00 0.17 0.00 -0.62 -1.22 0.00 0.00 177.39 175.72 1tuz n GLU 62 N -0.30 -1.00 -0.71 3.23 -0.58 0.17 -4.63 120.64 116.82 1tuz n GLU 62 Ca 0.19 0.25 -0.32 0.00 -0.42 0.00 0.00 57.16 56.86 1tuz n GLU 62 Cb 0.29 -4.15 0.16 0.00 -0.57 0.00 0.00 31.44 27.17 1tuz n GLU 62 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1tuz n VAL 63 N -2.30 0.00 1.00 2.62 0.24 0.18 -4.84 118.33 115.23 1tuz n VAL 63 Ca 0.00 -0.20 0.10 0.00 -2.04 0.00 0.00 64.34 62.20 1tuz n VAL 63 Cb 0.25 -0.73 -0.08 0.00 -1.47 0.00 0.00 33.84 31.81 1tuz n VAL 63 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1tuz n ASP 64 N -2.34 1.00 -3.25 -1.34 8.00 -1.26 -4.62 116.55 112.74 1tuz n ASP 64 Ca 0.06 -0.96 0.03 0.00 0.71 0.00 0.00 54.79 54.64 1tuz n ASP 64 Cb 0.55 0.91 -0.03 0.00 -0.02 0.00 0.00 41.12 42.53 1tuz n ASP 64 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1tuz s ASN 65 N -2.98 -0.38 0.02 -2.24 4.22 -1.26 -5.09 114.94 107.23 1tuz s ASN 65 Ca 0.09 0.41 -0.01 0.00 -2.14 0.00 0.00 52.86 51.21 1tuz s ASN 65 Cb 0.16 1.39 -0.04 0.00 1.28 0.00 0.00 41.25 44.04 1tuz s ASN 65 CO 0.84 -0.07 0.18 0.54 -2.04 0.00 0.00 177.10 176.55 1tuz s VAL 66 N 2.50 5.28 0.02 3.54 0.11 -1.26 -5.07 120.40 125.52 1tuz s VAL 66 Ca -0.01 -0.32 -0.30 0.00 -2.93 0.00 0.00 61.98 58.42 1tuz s VAL 66 Cb -0.06 -3.51 -0.05 0.00 -1.53 0.00 0.00 36.38 31.23 1tuz s VAL 66 CO -0.15 0.24 1.18 -2.16 -3.33 0.00 0.00 175.10 170.89 1tuz s PRO 67 N -2.17 4.42 0.44 1.54 0.04 -1.26 -4.92 135.00 133.09 1tuz s PRO 67 Ca 0.30 1.71 0.10 0.00 0.04 0.00 0.00 61.00 63.15 1tuz s PRO 67 Cb -0.13 -3.43 0.97 0.00 0.04 0.00 0.00 34.50 31.96 1tuz s PRO 67 CO 0.22 -0.30 2.06 0.07 0.04 0.00 0.00 177.00 179.08 1tuz h ARG 68 N 7.03 0.31 -0.58 4.56 0.11 -1.97 -1.36 114.38 122.48 1tuz h ARG 68 Ca -0.39 -0.03 0.09 0.00 0.10 0.00 0.00 59.98 59.76 1tuz h ARG 68 Cb 1.20 -0.06 -0.07 0.00 1.11 0.00 0.00 29.97 32.14 1tuz h ARG 68 CO 0.83 0.25 0.18 1.25 0.10 0.00 0.00 179.97 182.58 1tuz h HIS 69 N 0.31 0.30 -0.09 4.08 2.76 -1.99 0.74 115.15 121.27 1tuz h HIS 69 Ca 0.08 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.20 1tuz h HIS 69 Cb 0.05 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 28.96 1tuz h HIS 69 CO 0.00 0.05 -0.24 1.25 -1.30 0.00 0.00 177.93 177.69 1tuz h LEU 70 N 0.34 0.37 -2.20 0.26 5.85 -1.77 -2.63 115.31 115.53 1tuz h LEU 70 Ca 0.29 -0.59 0.06 0.00 0.84 0.00 0.00 57.88 58.48 1tuz h LEU 70 Cb 0.38 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1tuz h LEU 70 CO -0.33 0.90 0.21 -1.28 -0.34 0.00 0.00 178.44 177.60 1tuz h SER 71 N -0.14 0.00 -0.01 1.25 0.87 -0.45 1.46 113.55 116.53 1tuz h SER 71 Ca -0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 1tuz h SER 71 Cb 0.86 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.82 1tuz h SER 71 CO 0.05 0.00 -0.08 0.25 -0.53 0.00 0.00 176.83 176.52 1tuz h LEU 72 N 0.00 0.09 -0.73 2.23 5.85 0.67 -2.91 115.31 120.52 1tuz h LEU 72 Ca 0.09 -0.69 -0.14 0.00 0.84 0.00 0.00 57.88 57.99 1tuz h LEU 72 Cb 0.51 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1tuz h LEU 72 CO -0.00 0.77 -0.59 0.00 -0.34 0.00 0.00 178.44 178.28 1tuz h ALA 73 N 0.32 0.92 -0.65 1.25 0.00 -0.77 -2.31 119.26 118.03 1tuz h ALA 73 Ca -0.01 -0.53 0.09 0.00 0.00 0.00 0.00 54.91 54.46 1tuz h ALA 73 Cb 0.77 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 1tuz h ALA 73 CO 0.02 0.72 0.31 -0.07 0.00 0.00 0.00 179.25 180.23 1tuz h LEU 74 N 0.12 0.39 -0.25 0.00 3.38 0.19 0.79 115.31 119.92 1tuz h LEU 74 Ca -0.00 0.06 -0.20 0.00 0.09 0.00 0.00 57.88 57.82 1tuz h LEU 74 Cb 1.07 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1tuz h LEU 74 CO 0.09 0.23 -0.69 0.15 0.09 0.00 0.00 178.44 178.30 1tuz h PHE 75 N 0.54 1.00 0.00 1.13 3.57 -1.36 -3.01 116.94 118.80 1tuz h PHE 75 Ca 0.32 -0.41 -0.04 0.00 3.53 0.00 0.00 57.97 61.37 1tuz h PHE 75 Cb 0.33 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 1tuz h PHE 75 CO -0.12 1.23 -0.21 1.96 -2.23 0.00 0.00 178.31 178.93 1tuz h GLN 76 N 0.54 0.00 0.17 1.11 4.20 -0.71 -3.15 115.11 117.28 1tuz h GLN 76 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1tuz h GLN 76 Cb 1.30 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.05 1tuz h GLN 76 CO 0.14 0.21 -0.42 1.03 -0.67 0.00 0.00 178.83 179.12 1tuz h SER 77 N 0.00 -1.24 -1.72 1.46 0.87 0.70 -3.44 113.55 110.19 1tuz h SER 77 Ca -0.00 0.12 -0.54 0.00 -1.23 0.00 0.00 61.79 60.14 1tuz h SER 77 Cb 0.51 0.45 -0.07 0.00 -0.44 0.00 0.00 62.40 62.85 1tuz h SER 77 CO 0.03 -0.47 -0.49 0.12 -0.53 0.00 0.00 176.83 175.49 1tuz s PHE 78 N -5.22 2.68 -0.20 2.24 5.36 -1.19 -5.10 117.98 116.56 1tuz s PHE 78 Ca -0.13 -0.47 -0.34 0.00 -0.96 0.00 0.00 56.93 55.03 1tuz s PHE 78 Cb 0.04 -1.85 0.14 0.00 -0.34 0.00 0.00 43.02 41.02 1tuz s PHE 78 CO 0.48 0.20 1.21 -2.00 -1.46 0.00 0.00 175.22 173.65 1tuz s GLU 79 N -3.92 0.30 0.63 10.12 2.12 -1.26 -4.83 118.70 121.86 1tuz s GLU 79 Ca 0.41 -0.08 0.25 0.00 0.36 0.00 0.00 54.97 55.91 1tuz s GLU 79 Cb -0.01 0.14 1.25 0.00 0.26 0.00 0.00 34.13 35.77 1tuz s GLU 79 CO 0.24 -0.12 1.70 1.79 -0.54 0.00 0.00 175.26 178.32 1tuz h THR 80 N 2.05 0.13 0.00 -1.70 1.35 -1.98 -3.44 112.91 109.32 1tuz h THR 80 Ca -0.10 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 1tuz h THR 80 Cb 1.17 0.47 0.00 0.00 -1.73 0.00 0.00 68.15 68.05 1tuz h THR 80 CO 0.23 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.11 1tuz n GLY 81 N -1.43 2.77 3.52 5.82 0.00 -1.26 -5.01 105.19 109.60 1tuz n GLY 81 Ca 0.05 -0.68 -0.60 0.00 0.00 0.00 0.00 46.02 44.80 1tuz n GLY 81 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1tuz n HIS 82 N 0.00 0.72 -3.61 1.61 8.25 -1.26 -4.91 115.22 116.02 1tuz n HIS 82 Ca 0.00 1.07 -0.04 0.00 -0.26 0.00 0.00 57.72 58.49 1tuz n HIS 82 Cb 0.00 -2.10 -0.02 0.00 1.12 0.00 0.00 29.99 28.99 1tuz n HIS 82 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1tuz n LEU 84 N 0.04 -4.76 -2.35 0.00 7.99 -1.26 -4.87 117.00 111.79 1tuz n LEU 84 Ca 0.01 1.59 -0.04 0.00 -0.01 0.00 0.00 56.01 57.56 1tuz n LEU 84 Cb 0.58 -2.48 -0.04 0.00 -0.11 0.00 0.00 43.42 41.37 1tuz n LEU 84 CO 0.09 -2.47 -0.53 0.59 -1.51 0.00 0.00 177.39 173.56 1tuz n ASN 85 N 1.13 -1.43 -3.65 -1.43 4.13 -1.26 -5.09 115.26 107.66 1tuz n ASN 85 Ca -0.22 1.14 0.01 0.00 1.68 0.00 0.00 54.58 57.19 1tuz n ASN 85 Cb 0.33 -4.45 -0.06 0.00 -1.54 0.00 0.00 39.78 34.06 1tuz n ASN 85 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1tuz s GLU 86 N -0.75 0.05 -0.18 3.52 0.41 -1.26 -5.02 118.70 115.47 1tuz s GLU 86 Ca -0.21 0.08 0.16 0.00 -0.41 0.00 0.00 54.97 54.59 1tuz s GLU 86 Cb 0.01 0.02 0.77 0.00 -1.78 0.00 0.00 34.13 33.15 1tuz s GLU 86 CO 0.57 -0.01 1.69 -2.37 -0.49 0.00 0.00 175.26 174.65 1tuz n THR 87 N 2.59 2.35 -2.48 3.63 5.66 -1.26 -4.32 114.28 120.44 1tuz n THR 87 Ca -0.15 -1.34 -0.21 0.00 -3.05 0.00 0.00 64.05 59.30 1tuz n THR 87 Cb 0.56 -0.10 0.01 0.00 -1.55 0.00 0.00 70.33 69.26 1tuz n THR 87 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1tuz n ASN 88 N 0.78 3.79 -1.87 1.09 5.15 -1.26 -4.78 115.26 118.16 1tuz n ASN 88 Ca 0.27 -3.39 -0.21 0.00 -0.60 0.00 0.00 54.58 50.64 1tuz n ASN 88 Cb 1.05 -0.46 0.05 0.00 -0.53 0.00 0.00 39.78 39.89 1tuz n ASN 88 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1tuz n VAL 89 N -0.42 2.57 0.87 3.44 0.31 -1.26 -4.57 118.33 119.28 1tuz n VAL 89 Ca 0.31 -4.00 0.09 0.00 -0.01 0.00 0.00 64.34 60.73 1tuz n VAL 89 Cb 0.75 -1.03 -0.10 0.00 -0.91 0.00 0.00 33.84 32.55 1tuz n VAL 89 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1tuz n THR 90 N -0.78 0.00 -3.99 2.52 5.66 -1.26 -4.79 114.28 111.64 1tuz n THR 90 Ca 0.42 -0.08 -0.31 0.00 -3.05 0.00 0.00 64.05 61.04 1tuz n THR 90 Cb 0.92 1.01 -0.15 0.00 -1.55 0.00 0.00 70.33 70.57 1tuz n THR 90 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 1tuz s LYS 91 N -2.72 1.50 -0.91 1.09 0.00 -1.26 -5.05 119.74 112.40 1tuz s LYS 91 Ca 0.08 -1.70 -0.18 0.00 0.00 0.00 0.00 55.97 54.16 1tuz s LYS 91 Cb 0.14 -3.02 0.14 0.00 0.00 0.00 0.00 37.83 35.08 1tuz s LYS 91 CO 0.74 -0.89 1.09 -0.51 0.00 0.00 0.00 175.35 175.79 1tuz s ASP 92 N 1.02 6.62 0.24 0.03 1.01 -1.26 -4.95 116.67 119.37 1tuz s ASP 92 Ca 0.08 -2.06 -0.03 0.00 0.71 0.00 0.00 52.55 51.25 1tuz s ASP 92 Cb -0.19 -2.38 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 1tuz s ASP 92 CO -0.09 -1.04 0.26 0.68 0.21 0.00 0.00 175.17 175.19 1tuz s VAL 93 N 2.52 0.00 0.04 -1.27 -7.23 -1.26 -4.23 120.40 108.97 1tuz s VAL 93 Ca 0.31 -1.82 -0.10 0.00 -1.81 0.00 0.00 61.98 58.55 1tuz s VAL 93 Cb -0.06 -2.44 0.01 0.00 0.56 0.00 0.00 36.38 34.44 1tuz s VAL 93 CO -0.09 0.00 0.21 0.54 -0.31 0.00 0.00 175.10 175.45 1tuz s VAL 94 N -3.94 0.11 0.25 1.32 0.11 -0.30 -4.47 120.40 113.47 1tuz s VAL 94 Ca 0.35 -0.88 -0.30 0.00 -2.93 0.00 0.00 61.98 58.22 1tuz s VAL 94 Cb 0.04 -0.94 -0.09 0.00 -1.53 0.00 0.00 36.38 33.86 1tuz s VAL 94 CO 0.14 -0.48 1.09 0.00 -3.33 0.00 0.00 175.10 172.52 1tuz h LEU 96 N 4.25 0.26 -1.20 0.00 3.38 -1.96 -2.09 115.31 117.94 1tuz h LEU 96 Ca -0.46 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.27 1tuz h LEU 96 Cb 1.21 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1tuz h LEU 96 CO 0.69 0.87 -0.20 0.78 0.09 0.00 0.00 178.44 180.67 1tuz h ASN 97 N 0.15 0.29 -0.08 -0.43 2.35 -1.91 0.97 115.58 116.92 1tuz h ASN 97 Ca -0.02 -0.08 -0.24 0.00 -0.55 0.00 0.00 56.30 55.42 1tuz h ASN 97 Cb 1.24 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 39.55 1tuz h ASN 97 CO 0.11 0.51 -0.87 0.44 -1.65 0.00 0.00 177.43 175.97 1tuz h ASP 98 N 0.28 0.91 0.77 5.81 3.32 -1.90 -2.93 116.42 122.67 1tuz h ASP 98 Ca 0.05 -0.64 -0.15 0.00 0.02 0.00 0.00 57.03 56.31 1tuz h ASP 98 Cb 0.52 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1tuz h ASP 98 CO 0.03 1.44 -0.71 0.58 -1.72 0.00 0.00 179.24 178.87 1tuz h VAL 99 N 0.48 1.46 0.00 -1.35 2.07 -0.92 -2.79 116.25 115.21 1tuz h VAL 99 Ca -0.08 -2.45 -0.01 0.00 0.82 0.00 0.00 66.70 64.97 1tuz h VAL 99 Cb 1.50 2.34 -0.00 0.00 -1.52 0.00 0.00 31.29 33.61 1tuz h VAL 99 CO 0.17 0.69 -0.07 0.77 0.02 0.00 0.00 177.57 179.16 1tuz h SER 100 N 0.00 0.00 0.07 0.57 4.64 0.10 -0.81 113.55 118.12 1tuz h SER 100 Ca -0.01 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1tuz h SER 100 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1tuz h SER 100 CO 0.09 0.07 -0.03 0.00 -0.87 0.00 0.00 176.83 176.09 1tuz h TYR 102 N -0.96 0.47 -0.03 0.00 3.20 -1.42 0.34 116.97 118.58 1tuz h TYR 102 Ca -0.01 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 1tuz h TYR 102 Cb 0.50 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 1tuz h TYR 102 CO 0.12 0.14 -0.32 0.74 -1.64 0.00 0.00 178.16 177.19 1tuz h PHE 103 N 0.47 0.06 0.00 -3.82 0.04 -1.26 -2.04 116.94 110.39 1tuz h PHE 103 Ca 0.32 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 61.06 1tuz h PHE 103 Cb 0.38 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.51 1tuz h PHE 103 CO -0.15 0.37 -0.12 1.03 -0.60 0.00 0.00 178.31 178.84 1tuz h SER 104 N 0.05 0.00 -0.02 2.17 0.87 -0.13 -1.27 113.55 115.22 1tuz h SER 104 Ca 0.00 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.43 1tuz h SER 104 Cb 0.60 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 1tuz h SER 104 CO 0.04 0.12 -0.44 -0.07 -0.53 0.00 0.00 176.83 175.96 1tuz h LEU 105 N 0.00 0.59 0.64 2.23 4.07 -0.88 1.46 115.31 123.43 1tuz h LEU 105 Ca -0.00 -0.28 -0.03 0.00 0.08 0.00 0.00 57.88 57.65 1tuz h LEU 105 Cb 0.28 -0.17 0.01 0.00 1.08 0.00 0.00 40.66 41.86 1tuz h LEU 105 CO 0.02 0.95 -0.31 -0.07 -1.08 0.00 0.00 178.44 177.95 1tuz h LEU 106 N 0.45 -0.73 -1.15 1.67 -0.00 -1.25 -2.95 115.31 111.35 1tuz h LEU 106 Ca 0.03 0.03 0.19 0.00 -0.00 0.00 0.00 57.88 58.12 1tuz h LEU 106 Cb 0.95 0.19 -0.09 0.00 -0.00 0.00 0.00 40.66 41.71 1tuz h LEU 106 CO 0.08 -0.48 0.61 1.05 -0.00 0.00 0.00 178.44 179.71 1tuz h GLU 107 N -0.94 0.67 0.00 1.13 4.11 -1.54 -3.45 114.58 114.56 1tuz h GLU 107 Ca -0.09 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.30 1tuz h GLU 107 Cb 0.66 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1tuz h GLU 107 CO 0.14 0.44 0.00 0.41 0.07 0.00 0.00 179.01 180.08 1tuz n GLY 108 N -1.39 0.36 2.33 1.06 0.00 -0.46 -5.10 105.19 102.00 1tuz n GLY 108 Ca 0.22 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.47 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 0.00 3.94 3.74 -0.02 0.00 0.49 -4.94 105.19 108.40 1tuz n GLY 109 Ca 0.00 -1.91 -0.37 0.00 0.00 0.00 0.00 46.02 43.74 1tuz n GLY 109 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1tuz s ARG 110 N -2.51 2.71 0.62 1.61 1.70 -1.26 -4.33 118.95 117.48 1tuz s ARG 110 Ca 0.41 2.08 -0.14 0.00 -0.47 0.00 0.00 55.73 57.62 1tuz s ARG 110 Cb 0.32 -1.94 -0.03 0.00 -0.57 0.00 0.00 34.95 32.73 1tuz s ARG 110 CO -0.09 -1.48 1.05 -1.25 -1.08 0.00 0.00 175.30 172.45 1tuz s PRO 111 N -3.27 3.25 0.22 3.89 0.04 -1.26 -4.97 135.00 132.89 1tuz s PRO 111 Ca 0.80 1.10 0.15 0.00 0.04 0.00 0.00 61.00 63.09 1tuz s PRO 111 Cb -0.38 -2.03 -0.00 0.00 0.04 0.00 0.00 34.50 32.13 1tuz s PRO 111 CO 0.41 -0.86 1.29 0.93 0.04 0.00 0.00 177.00 178.81 1tuz h GLU 112 N 0.09 0.00 0.00 4.56 5.08 -2.07 -3.45 114.58 118.79 1tuz h GLU 112 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1tuz h GLU 112 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1tuz h GLU 112 CO 0.58 0.49 0.00 -3.47 -1.00 0.00 0.00 179.01 175.61 1tuz n ASP 113 N -3.16 0.00 -4.89 1.42 -0.08 -1.26 -5.17 116.55 103.40 1tuz n ASP 113 Ca -0.01 0.00 -0.29 0.00 -1.51 0.00 0.00 54.79 52.98 1tuz n ASP 113 Cb 0.77 0.00 0.03 0.00 2.34 0.00 0.00 41.12 44.26 1tuz n ASP 113 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1tuz s LYS 114 N 0.00 3.09 0.53 -0.67 -0.14 -1.26 -5.09 119.74 116.19 1tuz s LYS 114 Ca 0.00 0.33 0.08 0.00 -1.36 0.00 0.00 55.97 55.01 1tuz s LYS 114 Cb 0.00 -2.16 0.05 0.00 -1.68 0.00 0.00 37.83 34.04 1tuz s LYS 114 CO 0.00 -0.75 0.56 -0.51 -0.76 0.00 0.00 175.35 173.89 1tuz s LEU 115 N -5.14 3.03 -0.10 3.17 1.02 -1.26 -5.14 118.68 114.26 1tuz s LEU 115 Ca 0.55 -0.96 -0.05 0.00 0.02 0.00 0.00 54.13 53.69 1tuz s LEU 115 Cb -0.11 -1.59 0.05 0.00 0.02 0.00 0.00 46.19 44.56 1tuz s LEU 115 CO 0.49 -1.10 0.23 -1.61 0.02 0.00 0.00 176.35 174.38 1tuz s GLU 116 N -4.41 0.18 -0.94 1.70 8.01 -1.26 -5.07 118.70 116.91 1tuz s GLU 116 Ca 0.48 0.53 -0.02 0.00 0.01 0.00 0.00 54.97 55.98 1tuz s GLU 116 Cb -0.04 -0.13 0.28 0.00 -4.31 0.00 0.00 34.13 29.93 1tuz s GLU 116 CO 0.30 -0.18 1.14 0.91 0.01 0.00 0.00 175.26 177.44 1tuz n TRP 117 N 4.39 3.22 -0.40 1.61 8.01 -1.26 -5.38 117.44 127.64 1tuz n TRP 117 Ca -0.23 -3.37 0.00 0.00 -1.31 0.00 0.00 57.50 52.59 1tuz n TRP 117 Cb 0.52 -1.10 0.00 0.00 -2.01 0.00 0.00 31.31 28.73 1tuz n TRP 117 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13