#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yx6 n MET 2 N 0.00 0.44 -0.35 1.57 0.00 -1.26 -5.04 117.12 112.47 1yx6 n MET 2 Ca 0.00 -1.55 0.07 0.00 0.00 0.00 0.00 57.70 56.22 1yx6 n MET 2 Cb 0.00 1.55 0.23 0.00 0.00 0.00 0.00 33.22 35.00 1yx6 n MET 2 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 175.97 177.44 1yx6 n LEU 3 N 0.00 3.59 0.02 4.03 -0.00 -1.26 -3.90 117.00 119.47 1yx6 n LEU 3 Ca -0.00 -2.53 -0.20 0.00 -0.00 0.00 0.00 56.01 53.27 1yx6 n LEU 3 Cb 0.34 -0.42 -0.14 0.00 -0.00 0.00 0.00 43.42 43.20 1yx6 n LEU 3 CO 0.17 0.71 -0.18 1.23 -0.00 0.00 0.00 177.39 179.32 1yx6 h GLY 4 N 2.13 0.28 0.00 1.47 0.00 -2.01 -3.34 103.07 101.61 1yx6 h GLY 4 Ca 0.00 -0.72 -0.06 0.00 0.00 0.00 0.00 47.33 46.55 1yx6 h GLY 4 CO 0.13 0.63 -1.62 1.04 0.00 0.00 0.00 176.54 176.73 1yx6 n LEU 5 N -4.07 0.00 0.15 3.11 4.77 -1.26 -4.70 117.00 115.00 1yx6 n LEU 5 Ca -0.20 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.72 1yx6 n LEU 5 Cb 0.84 0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.98 1yx6 n LEU 5 CO 0.43 0.09 0.25 1.23 -1.33 0.00 0.00 177.39 178.06 1yx6 h GLY 6 N 2.19 -0.44 -5.47 -0.72 0.00 -1.78 -3.47 103.07 93.39 1yx6 h GLY 6 Ca -0.09 0.16 -0.41 0.00 0.00 0.00 0.00 47.33 46.99 1yx6 h GLY 6 CO 0.01 -0.16 -0.62 0.00 0.00 0.00 0.00 176.54 175.76 1yx6 n ALA 7 N -2.47 -1.10 0.00 3.60 0.00 -1.25 -4.53 120.51 114.76 1yx6 n ALA 7 Ca -0.05 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1yx6 n ALA 7 Cb 0.17 -3.43 0.00 0.00 0.00 0.00 0.00 19.45 16.19 1yx6 n ALA 7 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1yx6 n SER 8 N -2.47 0.00 -0.15 0.00 3.41 -1.26 -4.93 113.62 108.22 1yx6 n SER 8 Ca -0.02 0.00 0.28 0.00 -0.26 0.00 0.00 58.87 58.87 1yx6 n SER 8 Cb 0.55 0.00 0.72 0.00 -0.26 0.00 0.00 64.21 65.22 1yx6 n SER 8 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1yx6 h ASP 9 N 0.00 0.00 -3.89 4.04 3.32 -1.91 -3.21 116.42 114.77 1yx6 h ASP 9 Ca 0.00 0.00 -0.77 0.00 0.02 0.00 0.00 57.03 56.28 1yx6 h ASP 9 Cb 0.00 0.00 -0.28 0.00 0.22 0.00 0.00 39.33 39.27 1yx6 h ASP 9 CO 0.00 0.00 0.02 -0.36 -1.72 0.00 0.00 179.24 177.18 1yx6 s PHE 10 N -4.83 3.71 -1.05 4.55 0.08 -1.26 -4.96 117.98 114.22 1yx6 s PHE 10 Ca -0.05 -2.14 -0.04 0.00 0.12 0.00 0.00 56.93 54.83 1yx6 s PHE 10 Cb 0.20 -3.71 0.30 0.00 -0.57 0.00 0.00 43.02 39.24 1yx6 s PHE 10 CO 0.70 -0.96 1.35 -1.91 -0.10 0.00 0.00 175.22 174.30 1yx6 n GLU 11 N 3.85 4.14 -1.96 0.44 2.13 -1.22 -4.71 120.64 123.31 1yx6 n GLU 11 Ca 0.13 -4.55 -0.12 0.00 0.66 0.00 0.00 57.16 53.28 1yx6 n GLU 11 Cb 0.45 -2.50 -0.03 0.00 0.27 0.00 0.00 31.44 29.64 1yx6 n GLU 11 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1yx6 n PHE 12 N 1.54 -1.00 -2.41 4.31 3.72 -1.26 -4.81 117.46 117.55 1yx6 n PHE 12 Ca 0.26 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.41 1yx6 n PHE 12 Cb 0.35 -2.57 0.01 0.00 -0.94 0.00 0.00 39.48 36.32 1yx6 n PHE 12 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1yx6 n GLY 13 N -0.54 5.65 1.78 1.37 0.00 -1.26 -4.82 105.19 107.36 1yx6 n GLY 13 Ca -0.13 -2.60 0.00 0.00 0.00 0.00 0.00 46.02 43.29 1yx6 n GLY 13 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1yx6 n VAL 14 N -0.50 0.09 -3.59 1.61 0.31 -1.26 -5.07 118.33 109.93 1yx6 n VAL 14 Ca 0.37 0.03 -0.13 0.00 -0.01 0.00 0.00 64.34 64.60 1yx6 n VAL 14 Cb 0.74 -0.40 -0.05 0.00 -0.91 0.00 0.00 33.84 33.22 1yx6 n VAL 14 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1yx6 s ASP 15 N -4.55 -0.39 0.30 4.52 1.01 -1.26 -5.02 116.67 111.27 1yx6 s ASP 15 Ca 0.00 0.06 0.25 0.00 0.71 0.00 0.00 52.55 53.58 1yx6 s ASP 15 Cb 0.00 0.48 0.99 0.00 1.01 0.00 0.00 42.92 45.40 1yx6 s ASP 15 CO 0.00 -0.74 1.76 1.55 0.21 0.00 0.00 175.17 177.95 1yx6 h PRO 16 N 2.73 0.00 0.00 8.23 0.13 -1.96 -2.84 132.00 138.29 1yx6 h PRO 16 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1yx6 h PRO 16 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1yx6 h PRO 16 CO 0.42 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.62 1yx6 n SER 17 N -2.39 0.00 -0.82 1.44 7.64 -1.26 -2.58 113.62 115.65 1yx6 n SER 17 Ca 0.03 0.09 0.12 0.00 1.01 0.00 0.00 58.87 60.12 1yx6 n SER 17 Cb 0.28 -0.33 0.28 0.00 -1.01 0.00 0.00 64.21 63.43 1yx6 n SER 17 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1yx6 n ALA 18 N -1.33 2.49 -3.33 -0.43 0.00 -1.07 -4.82 120.51 112.01 1yx6 n ALA 18 Ca 0.09 -0.67 0.02 0.00 0.00 0.00 0.00 53.44 52.88 1yx6 n ALA 18 Cb 0.19 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.65 1yx6 n ALA 18 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yx6 s ASP 19 N -1.81 -1.29 0.20 0.00 1.01 -1.07 -5.00 116.67 108.71 1yx6 s ASP 19 Ca 0.34 1.13 0.22 0.00 0.71 0.00 0.00 52.55 54.94 1yx6 s ASP 19 Cb 0.20 2.21 0.90 0.00 1.01 0.00 0.00 42.92 47.24 1yx6 s ASP 19 CO 0.31 -0.24 1.66 -0.81 0.21 0.00 0.00 175.17 176.30 1yx6 n PRO 20 N 5.43 0.15 0.08 8.23 -0.04 -1.26 -1.93 135.00 145.66 1yx6 n PRO 20 Ca -0.05 0.37 -0.09 0.00 -0.04 0.00 0.00 63.50 63.69 1yx6 n PRO 20 Cb 0.50 -1.78 -0.09 0.00 -0.04 0.00 0.00 33.50 32.09 1yx6 n PRO 20 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1yx6 h GLU 21 N 0.00 0.09 0.00 0.54 4.81 -1.94 -2.53 114.58 115.56 1yx6 h GLU 21 Ca 0.00 -0.14 -0.19 0.00 -0.13 0.00 0.00 59.36 58.89 1yx6 h GLU 21 Cb 0.36 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1yx6 h GLU 21 CO 0.00 1.03 -1.43 -0.07 -0.73 0.00 0.00 179.01 177.81 1yx6 h LEU 22 N 0.03 0.00 -0.15 1.64 4.07 -1.81 -2.83 115.31 116.26 1yx6 h LEU 22 Ca -0.05 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.72 1yx6 h LEU 22 Cb 1.75 0.00 0.01 0.00 1.08 0.00 0.00 40.66 43.49 1yx6 h LEU 22 CO 0.15 0.67 -0.69 0.00 -1.08 0.00 0.00 178.44 177.49 1yx6 h ALA 23 N 1.33 0.28 0.00 1.53 0.00 -1.44 -1.85 119.26 119.11 1yx6 h ALA 23 Ca -0.18 -0.57 -0.18 0.00 0.00 0.00 0.00 54.91 53.98 1yx6 h ALA 23 Cb 1.67 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.42 1yx6 h ALA 23 CO 0.06 0.60 -0.87 1.25 0.00 0.00 0.00 179.25 180.28 1yx6 h LEU 24 N 0.43 0.00 -0.29 0.00 6.46 -1.59 -2.74 115.31 117.58 1yx6 h LEU 24 Ca -0.04 -0.00 -0.16 0.00 -0.12 0.00 0.00 57.88 57.55 1yx6 h LEU 24 Cb 1.32 -0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.25 1yx6 h LEU 24 CO 0.14 0.87 -0.46 0.00 -0.62 0.00 0.00 178.44 178.37 1yx6 h ALA 25 N 1.13 0.45 0.00 1.25 0.00 -1.49 -2.30 119.26 118.30 1yx6 h ALA 25 Ca -0.01 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1yx6 h ALA 25 Cb 1.53 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1yx6 h ALA 25 CO 0.11 0.60 -0.19 1.25 0.00 0.00 0.00 179.25 181.02 1yx6 h LEU 26 N 0.60 0.00 -0.07 0.00 6.46 -1.37 -2.78 115.31 118.15 1yx6 h LEU 26 Ca 0.02 0.00 -0.19 0.00 -0.12 0.00 0.00 57.88 57.60 1yx6 h LEU 26 Cb 1.07 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.97 1yx6 h LEU 26 CO 0.11 0.19 -0.89 0.03 -0.62 0.00 0.00 178.44 177.26 1yx6 h ARG 27 N 0.00 0.00 -0.00 1.25 3.08 -1.34 -2.83 114.38 114.54 1yx6 h ARG 27 Ca -0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 1yx6 h ARG 27 Cb 0.81 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1yx6 h ARG 27 CO 0.03 0.89 -0.81 0.28 -1.07 0.00 0.00 179.97 179.29 1yx6 h VAL 28 N 0.00 1.52 -0.13 2.04 2.07 -1.22 -2.85 116.25 117.69 1yx6 h VAL 28 Ca -0.01 -2.60 -0.16 0.00 0.82 0.00 0.00 66.70 64.74 1yx6 h VAL 28 Cb 1.65 2.42 0.01 0.00 -1.52 0.00 0.00 31.29 33.85 1yx6 h VAL 28 CO 0.12 0.75 -0.56 -1.28 0.02 0.00 0.00 177.57 176.62 1yx6 h SER 29 N 0.06 0.72 -0.75 0.57 0.87 -1.50 -2.22 113.55 111.29 1yx6 h SER 29 Ca -0.02 -0.63 -0.02 0.00 -1.23 0.00 0.00 61.79 59.89 1yx6 h SER 29 Cb 1.41 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 63.12 1yx6 h SER 29 CO 0.11 1.23 0.40 -0.03 -0.53 0.00 0.00 176.83 178.01 1yx6 h MET 30 N 0.25 1.06 -0.44 2.24 -1.53 -1.53 -1.50 114.93 113.48 1yx6 h MET 30 Ca -0.03 -0.13 -0.11 0.00 -3.44 0.00 0.00 59.70 55.98 1yx6 h MET 30 Cb 1.20 -0.20 -0.02 0.00 -0.55 0.00 0.00 31.60 32.03 1yx6 h MET 30 CO 0.12 0.79 -0.17 0.93 0.14 0.00 0.00 176.91 178.72 1yx6 h GLU 31 N 1.04 0.85 -0.24 0.39 5.08 -1.51 -2.27 114.58 117.91 1yx6 h GLU 31 Ca 0.26 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1yx6 h GLU 31 Cb 0.05 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1yx6 h GLU 31 CO -0.04 0.95 0.08 0.93 -1.00 0.00 0.00 179.01 179.93 1yx6 h GLU 32 N 0.75 0.37 -0.81 2.33 5.08 -0.95 -2.16 114.58 119.18 1yx6 h GLU 32 Ca 0.11 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1yx6 h GLU 32 Cb 0.69 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.85 1yx6 h GLU 32 CO 0.05 0.45 0.46 1.96 -1.00 0.00 0.00 179.01 180.93 1yx6 h GLN 33 N 0.23 1.12 -0.48 2.33 4.20 -1.21 -1.93 115.11 119.37 1yx6 h GLN 33 Ca 0.08 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 1yx6 h GLN 33 Cb 0.23 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1yx6 h GLN 33 CO -0.00 0.81 0.14 -0.09 -0.67 0.00 0.00 178.83 179.02 1yx6 h ARG 34 N 1.13 0.72 -0.28 1.46 1.12 -1.15 -1.31 114.38 116.07 1yx6 h ARG 34 Ca 0.29 -0.12 -0.05 0.00 -1.11 0.00 0.00 59.98 58.98 1yx6 h ARG 34 Cb 0.01 -0.12 -0.02 0.00 -0.01 0.00 0.00 29.97 29.83 1yx6 h ARG 34 CO -0.05 0.63 -0.05 0.37 -3.11 0.00 0.00 179.97 177.76 1yx6 h GLN 35 N 0.70 0.43 -0.01 0.20 5.75 -0.70 0.67 115.11 122.16 1yx6 h GLN 35 Ca 0.16 -0.10 -0.10 0.00 -0.15 0.00 0.00 58.65 58.46 1yx6 h GLN 35 Cb 0.22 -0.06 0.01 0.00 1.07 0.00 0.00 27.48 28.72 1yx6 h GLN 35 CO -0.01 0.51 -0.39 -0.09 -2.65 0.00 0.00 178.83 176.20 1yx6 h ARG 36 N 0.41 0.27 0.00 1.69 2.43 -1.10 0.21 114.38 118.30 1yx6 h ARG 36 Ca 0.09 -0.28 -0.06 0.00 -0.81 0.00 0.00 59.98 58.91 1yx6 h ARG 36 Cb 0.36 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1yx6 h ARG 36 CO 0.02 0.99 -0.29 1.96 -1.51 0.00 0.00 179.97 181.13 1yx6 h GLN 37 N -0.33 0.00 0.00 0.20 1.08 -1.12 -0.25 115.11 114.69 1yx6 h GLN 37 Ca -0.05 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 1yx6 h GLN 37 Cb 1.12 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.55 1yx6 h GLN 37 CO 0.08 0.29 -0.27 1.49 -0.95 0.00 0.00 178.83 179.47 1yx6 h GLU 38 N 0.00 0.00 -0.82 1.46 4.57 -0.88 0.65 114.58 119.56 1yx6 h GLU 38 Ca -0.00 0.00 0.20 0.00 -1.18 0.00 0.00 59.36 58.38 1yx6 h GLU 38 Cb 0.53 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.07 1yx6 h GLU 38 CO 0.04 0.31 0.56 1.49 -1.18 0.00 0.00 179.01 180.23 1yx6 h GLU 39 N -1.00 0.25 0.09 1.92 4.81 -0.60 0.28 114.58 120.32 1yx6 h GLU 39 Ca -0.04 -0.01 -0.29 0.00 -0.13 0.00 0.00 59.36 58.89 1yx6 h GLU 39 Cb 0.47 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1yx6 h GLU 39 CO -0.02 0.16 -1.46 1.49 -0.73 0.00 0.00 179.01 178.45 1yx6 h GLU 40 N 0.25 0.19 -0.06 1.92 4.81 -1.14 -2.69 114.58 117.86 1yx6 h GLU 40 Ca 0.41 -0.32 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1yx6 h GLU 40 Cb 1.22 0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.72 1yx6 h GLU 40 CO -0.10 1.03 0.02 0.00 -0.73 0.00 0.00 179.01 179.23 1yx6 h ALA 41 N 0.63 0.07 -0.09 2.92 0.00 0.18 -2.74 119.26 120.23 1yx6 h ALA 41 Ca -0.21 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 1yx6 h ALA 41 Cb 1.98 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.73 1yx6 h ALA 41 CO 0.15 -0.32 -0.38 0.07 0.00 0.00 0.00 179.25 178.77 1yx6 h ARG 42 N -0.11 0.19 -0.93 0.00 0.11 -0.76 -2.37 114.38 110.50 1yx6 h ARG 42 Ca 0.02 -0.08 0.13 0.00 0.10 0.00 0.00 59.98 60.15 1yx6 h ARG 42 Cb 0.22 -0.01 -0.08 0.00 1.11 0.00 0.00 29.97 31.21 1yx6 h ARG 42 CO -0.00 0.54 0.60 0.00 0.10 0.00 0.00 179.97 181.21 1yx6 h ARG 43 N 0.16 0.81 0.00 0.08 2.47 -1.19 0.17 114.38 116.88 1yx6 h ARG 43 Ca 0.02 -0.05 -0.19 0.00 -1.26 0.00 0.00 59.98 58.50 1yx6 h ARG 43 Cb 0.74 -0.18 -0.03 0.00 -1.65 0.00 0.00 29.97 28.85 1yx6 h ARG 43 CO 0.06 0.54 -0.91 0.00 0.56 0.00 0.00 179.97 180.21 1yx6 h ALA 44 N 1.57 0.43 0.00 0.04 0.00 -1.25 -2.85 119.26 117.21 1yx6 h ALA 44 Ca 0.46 -0.83 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1yx6 h ALA 44 Cb 0.59 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1yx6 h ALA 44 CO -0.23 1.14 -0.06 0.00 0.00 0.00 0.00 179.25 180.11 1yx6 h ALA 45 N 1.09 1.72 0.12 0.00 0.00 -0.20 0.12 119.26 122.11 1yx6 h ALA 45 Ca -0.01 -0.05 -0.35 0.00 0.00 0.00 0.00 54.91 54.50 1yx6 h ALA 45 Cb 1.68 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 1yx6 h ALA 45 CO 0.12 0.07 -1.86 0.00 0.00 0.00 0.00 179.25 177.58 1yx6 h ALA 46 N 1.94 0.40 -0.35 0.00 0.00 -1.27 -2.82 119.26 117.16 1yx6 h ALA 46 Ca -0.00 -1.32 -0.14 0.00 0.00 0.00 0.00 54.91 53.46 1yx6 h ALA 46 Cb 0.11 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1yx6 h ALA 46 CO 0.01 1.27 -0.33 0.00 0.00 0.00 0.00 179.25 180.19 1yx6 h ALA 47 N 0.24 0.76 0.04 0.00 0.00 -1.22 -2.72 119.26 116.35 1yx6 h ALA 47 Ca -0.37 -0.42 -0.23 0.00 0.00 0.00 0.00 54.91 53.89 1yx6 h ALA 47 Cb 2.05 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 19.73 1yx6 h ALA 47 CO 0.12 0.66 -0.91 1.03 0.00 0.00 0.00 179.25 180.14 1yx6 h SER 48 N 0.65 0.73 0.04 0.00 0.87 -0.93 0.73 113.55 115.64 1yx6 h SER 48 Ca 0.07 -0.78 -0.00 0.00 -1.23 0.00 0.00 61.79 59.84 1yx6 h SER 48 Cb 0.87 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 62.61 1yx6 h SER 48 CO 0.08 1.43 -0.01 0.00 -0.53 0.00 0.00 176.83 177.79 1yx6 h ALA 49 N 0.32 1.38 0.00 6.23 0.00 -1.50 -1.98 119.26 123.70 1yx6 h ALA 49 Ca -0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1yx6 h ALA 49 Cb 1.60 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1yx6 h ALA 49 CO 0.18 0.01 -0.67 0.00 0.00 0.00 0.00 179.25 178.77 1yx6 n ALA 50 N -2.26 3.60 -0.16 0.00 0.00 -1.03 -4.22 120.51 116.44 1yx6 n ALA 50 Ca -0.03 -0.36 -0.04 0.00 0.00 0.00 0.00 53.44 53.01 1yx6 n ALA 50 Cb 0.09 -0.47 0.06 0.00 0.00 0.00 0.00 19.45 19.13 1yx6 n ALA 50 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1yx6 h GLU 51 N 0.00 0.41 -0.42 0.00 4.81 -0.04 -0.79 114.58 118.55 1yx6 h GLU 51 Ca 0.00 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1yx6 h GLU 51 Cb 0.32 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1yx6 h GLU 51 CO 0.00 0.27 0.04 0.00 -0.73 0.00 0.00 179.01 178.59 1yx6 n ALA 52 N -2.37 3.57 -0.00 2.92 0.00 -1.25 -4.37 120.51 119.01 1yx6 n ALA 52 Ca 0.05 -2.31 -0.00 0.00 0.00 0.00 0.00 53.44 51.17 1yx6 n ALA 52 Cb 0.16 -0.89 -0.00 0.00 0.00 0.00 0.00 19.45 18.72 1yx6 n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yx6 n GLY 53 N -0.26 -0.01 2.33 0.00 0.00 -0.86 -4.93 105.19 101.46 1yx6 n GLY 53 Ca 0.27 -0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.03 1yx6 n GLY 53 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1yx6 n ILE 54 N -2.70 -1.03 -3.35 -0.61 -5.35 -0.36 -5.05 119.36 100.90 1yx6 n ILE 54 Ca -0.01 -3.62 -0.13 0.00 -0.27 0.00 0.00 62.75 58.72 1yx6 n ILE 54 Cb 0.51 -1.75 -0.08 0.00 -1.74 0.00 0.00 39.64 36.58 1yx6 n ILE 54 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1yx6 s ALA 55 N -0.34 -0.86 -0.09 -1.28 0.00 -1.26 -4.84 121.76 113.10 1yx6 s ALA 55 Ca 0.34 0.05 -0.28 0.00 0.00 0.00 0.00 51.96 52.06 1yx6 s ALA 55 Cb 0.08 -1.91 0.07 0.00 0.00 0.00 0.00 23.12 21.36 1yx6 s ALA 55 CO -0.17 -1.68 0.65 -0.08 0.00 0.00 0.00 175.76 174.48 1yx6 s THR 56 N 2.46 0.00 -0.58 0.00 -1.32 -1.26 -5.03 115.64 109.91 1yx6 s THR 56 Ca 0.10 -0.04 0.05 0.00 -1.21 0.00 0.00 61.69 60.59 1yx6 s THR 56 Cb -0.13 -0.96 0.19 0.00 -1.51 0.00 0.00 72.50 70.08 1yx6 s THR 56 CO -0.30 -0.02 0.49 0.35 -2.21 0.00 0.00 174.62 172.93 1yx6 n THR 57 N 1.28 0.70 -3.22 5.08 -2.24 -1.26 -5.00 114.28 109.62 1yx6 n THR 57 Ca -0.18 -4.42 -0.01 0.00 -2.27 0.00 0.00 64.05 57.17 1yx6 n THR 57 Cb 0.57 -2.00 -0.02 0.00 -2.10 0.00 0.00 70.33 66.78 1yx6 n THR 57 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1yx6 s GLY 58 N -1.13 -1.06 -1.00 3.38 0.00 -1.26 -5.05 107.32 101.21 1yx6 s GLY 58 Ca 0.30 0.38 -0.16 0.00 0.00 0.00 0.00 44.72 45.24 1yx6 s GLY 58 CO -0.15 3.51 2.09 -0.37 0.00 0.00 0.00 173.10 178.18 1yx6 n THR 59 N 4.85 2.44 -3.57 0.90 5.66 -1.26 -4.74 114.28 118.57 1yx6 n THR 59 Ca 0.08 -1.90 -0.32 0.00 -3.05 0.00 0.00 64.05 58.85 1yx6 n THR 59 Cb 0.54 -2.36 -0.07 0.00 -1.55 0.00 0.00 70.33 66.89 1yx6 n THR 59 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1yx6 n GLU 60 N 5.98 2.64 0.00 1.09 0.00 -1.26 -4.63 120.64 124.45 1yx6 n GLU 60 Ca 0.51 -4.55 0.00 0.00 0.00 0.00 0.00 57.16 53.12 1yx6 n GLU 60 Cb 0.33 -2.35 0.00 0.00 0.00 0.00 0.00 31.44 29.42 1yx6 n GLU 60 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1yx6 n ASP 61 N 1.70 0.00 -3.59 4.31 -0.08 -1.26 -5.00 116.55 112.63 1yx6 n ASP 61 Ca 0.24 0.00 -0.34 0.00 -1.51 0.00 0.00 54.79 53.18 1yx6 n ASP 61 Cb 0.37 0.04 -0.03 0.00 2.34 0.00 0.00 41.12 43.84 1yx6 n ASP 61 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1yx6 n SER 62 N -1.31 5.18 -0.02 1.67 3.41 -1.26 -4.84 113.62 116.46 1yx6 n SER 62 Ca 0.00 -3.50 -0.10 0.00 -0.26 0.00 0.00 58.87 55.01 1yx6 n SER 62 Cb 0.00 -0.92 -0.08 0.00 -0.26 0.00 0.00 64.21 62.95 1yx6 n SER 62 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1yx6 h ASP 63 N 4.46 -0.07 0.83 4.04 1.82 -1.95 -2.73 116.42 122.83 1yx6 h ASP 63 Ca 0.23 -0.54 -0.16 0.00 -0.39 0.00 0.00 57.03 56.17 1yx6 h ASP 63 Cb 0.59 0.02 -0.02 0.00 0.68 0.00 0.00 39.33 40.59 1yx6 h ASP 63 CO 1.05 0.64 -0.74 0.44 -1.61 0.00 0.00 179.24 179.01 1yx6 h ASP 64 N -0.91 0.00 -0.51 2.28 3.32 -1.99 -2.89 116.42 115.72 1yx6 h ASP 64 Ca -0.01 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1yx6 h ASP 64 Cb 0.60 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 1yx6 h ASP 64 CO 0.01 0.74 0.29 0.00 -1.72 0.00 0.00 179.24 178.56 1yx6 h ALA 65 N 1.26 0.65 0.00 3.45 0.00 -1.91 0.52 119.26 123.23 1yx6 h ALA 65 Ca -0.01 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1yx6 h ALA 65 Cb 1.36 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1yx6 h ALA 65 CO 0.10 0.17 -0.23 1.25 0.00 0.00 0.00 179.25 180.53 1yx6 h LEU 66 N 0.68 0.00 -0.02 0.00 5.85 -1.44 0.62 115.31 121.00 1yx6 h LEU 66 Ca 0.18 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.64 1yx6 h LEU 66 Cb 0.04 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.08 1yx6 h LEU 66 CO -0.03 0.23 -1.10 0.25 -0.34 0.00 0.00 178.44 177.46 1yx6 h LEU 67 N 0.00 0.60 0.00 2.25 5.85 -0.94 -2.85 115.31 120.22 1yx6 h LEU 67 Ca -0.00 -0.54 -0.04 0.00 0.84 0.00 0.00 57.88 58.14 1yx6 h LEU 67 Cb 0.44 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1yx6 h LEU 67 CO 0.03 1.36 -0.33 0.11 -0.34 0.00 0.00 178.44 179.27 1yx6 h LYS 68 N 0.21 0.00 -0.88 1.25 6.56 0.50 -2.89 116.57 121.32 1yx6 h LYS 68 Ca -0.12 0.00 0.13 0.00 -1.06 0.00 0.00 60.65 59.60 1yx6 h LYS 68 Cb 1.77 0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 33.34 1yx6 h LYS 68 CO 0.19 0.43 0.49 0.52 -2.06 0.00 0.00 179.45 179.03 1yx6 h MET 69 N -1.00 0.73 -0.35 3.15 2.86 0.06 1.12 114.93 121.50 1yx6 h MET 69 Ca -0.06 -0.04 -0.16 0.00 -2.06 0.00 0.00 59.70 57.37 1yx6 h MET 69 Cb 0.60 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 32.09 1yx6 h MET 69 CO -0.04 0.48 -0.43 1.15 1.06 0.00 0.00 176.91 179.14 1yx6 h THR 70 N 0.75 1.27 0.00 2.22 2.02 -1.64 -2.86 112.91 114.68 1yx6 h THR 70 Ca 0.46 -1.60 0.00 0.00 0.77 0.00 0.00 66.41 66.03 1yx6 h THR 70 Cb 0.55 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 1yx6 h THR 70 CO -0.31 0.53 -0.25 -0.29 0.37 0.00 0.00 175.52 175.58 1yx6 h ILE 71 N 0.71 0.00 -0.02 3.11 6.09 -1.11 -2.86 117.51 123.43 1yx6 h ILE 71 Ca 0.05 -0.54 -0.17 0.00 -1.37 0.00 0.00 64.86 62.83 1yx6 h ILE 71 Cb 1.03 1.38 0.01 0.00 0.47 0.00 0.00 36.82 39.71 1yx6 h ILE 71 CO 0.10 0.00 -0.66 -1.28 -3.07 0.00 0.00 178.15 173.24 1yx6 h SER 72 N 0.00 0.61 1.28 2.19 0.87 0.14 0.72 113.55 119.35 1yx6 h SER 72 Ca 0.00 -0.74 -0.13 0.00 -1.23 0.00 0.00 61.79 59.69 1yx6 h SER 72 Cb 0.77 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.53 1yx6 h SER 72 CO 0.00 1.26 -0.62 1.56 -0.53 0.00 0.00 176.83 178.50 1yx6 h GLN 73 N 0.01 0.00 0.08 2.24 1.08 -1.59 -2.86 115.11 114.06 1yx6 h GLN 73 Ca -0.08 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 56.94 1yx6 h GLN 73 Cb 1.35 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.78 1yx6 h GLN 73 CO 0.13 0.62 -0.91 0.37 -0.95 0.00 0.00 178.83 178.09 1yx6 h GLN 74 N 0.00 0.16 -0.65 1.46 4.15 -1.55 -2.54 115.11 116.15 1yx6 h GLN 74 Ca -0.01 -0.28 -0.02 0.00 0.77 0.00 0.00 58.65 59.11 1yx6 h GLN 74 Cb 1.43 0.10 -0.03 0.00 0.21 0.00 0.00 27.48 29.20 1yx6 h GLN 74 CO 0.08 1.13 0.33 1.49 -1.93 0.00 0.00 178.83 179.94 1yx6 h GLU 75 N -0.59 0.92 -1.49 1.69 4.57 -0.96 -3.06 114.58 115.66 1yx6 h GLU 75 Ca -0.20 -0.12 -0.65 0.00 -1.18 0.00 0.00 59.36 57.21 1yx6 h GLU 75 Cb 1.49 -0.17 -0.36 0.00 -0.16 0.00 0.00 28.75 29.54 1yx6 h GLU 75 CO 0.03 0.71 -0.01 0.34 -1.18 0.00 0.00 179.01 178.90 1yx6 n PHE 76 N -4.51 3.16 -0.05 0.92 7.35 -1.08 -4.63 117.46 118.63 1yx6 n PHE 76 Ca 0.05 -2.72 -0.09 0.00 -0.76 0.00 0.00 57.45 53.92 1yx6 n PHE 76 Cb 0.11 -0.62 -0.04 0.00 0.35 0.00 0.00 39.48 39.28 1yx6 n PHE 76 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1yx6 n GLY 77 N -0.58 -0.14 3.68 7.13 0.00 -0.96 -4.87 105.19 109.45 1yx6 n GLY 77 Ca 0.47 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 46.04 1yx6 n GLY 77 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yx6 s ARG 78 N -2.18 4.30 -0.35 1.61 3.52 -1.26 -4.92 118.95 119.68 1yx6 s ARG 78 Ca -0.13 0.80 0.14 0.00 -0.13 0.00 0.00 55.73 56.41 1yx6 s ARG 78 Cb 0.05 -3.54 0.42 0.00 -1.56 0.00 0.00 34.95 30.32 1yx6 s ARG 78 CO 0.18 -0.18 1.32 2.41 -0.81 0.00 0.00 175.30 178.22 1yx6 n THR 79 N 4.44 0.33 -2.32 4.11 -1.04 -1.26 -4.99 114.28 113.55 1yx6 n THR 79 Ca 0.00 -1.78 -0.40 0.00 -2.04 0.00 0.00 64.05 59.83 1yx6 n THR 79 Cb 0.50 0.99 0.02 0.00 -1.82 0.00 0.00 70.33 70.02 1yx6 n THR 79 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1yx6 n GLY 80 N -0.82 5.82 3.61 3.41 0.00 -1.26 -4.91 105.19 111.05 1yx6 n GLY 80 Ca -0.05 -2.49 -0.07 0.00 0.00 0.00 0.00 46.02 43.41 1yx6 n GLY 80 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1yx6 s LEU 81 N -4.04 -0.25 -0.90 0.99 2.34 -1.26 -5.03 118.68 110.53 1yx6 s LEU 81 Ca 0.45 0.33 -0.10 0.00 0.06 0.00 0.00 54.13 54.87 1yx6 s LEU 81 Cb 0.28 1.56 -0.08 0.00 -0.56 0.00 0.00 46.19 47.39 1yx6 s LEU 81 CO -0.23 -0.19 2.07 -0.81 -1.06 0.00 0.00 176.35 176.13 1yx6 n PRO 82 N 0.94 1.97 -1.55 1.48 -0.04 -1.26 -4.87 135.00 131.68 1yx6 n PRO 82 Ca -0.08 -1.58 -0.35 0.00 -0.04 0.00 0.00 63.50 61.45 1yx6 n PRO 82 Cb 0.58 -2.59 -0.03 0.00 -0.04 0.00 0.00 33.50 31.42 1yx6 n PRO 82 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1yx6 n ASP 83 N 5.05 2.24 -0.32 3.54 -0.08 -1.26 -4.79 116.55 120.93 1yx6 n ASP 83 Ca 0.46 -0.54 -0.04 0.00 -1.51 0.00 0.00 54.79 53.16 1yx6 n ASP 83 Cb 0.20 -1.58 0.08 0.00 2.34 0.00 0.00 41.12 42.17 1yx6 n ASP 83 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1yx6 h LEU 84 N 19.63 1.03 -1.75 -2.67 4.07 -1.90 -0.82 115.31 132.90 1yx6 h LEU 84 Ca -0.23 -0.06 0.01 0.00 0.08 0.00 0.00 57.88 57.68 1yx6 h LEU 84 Cb 1.26 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.73 1yx6 h LEU 84 CO 1.16 0.79 0.18 0.28 -1.08 0.00 0.00 178.44 179.77 1yx6 h SER 85 N 1.18 0.30 0.86 -0.43 0.02 -2.01 -1.94 113.55 111.53 1yx6 h SER 85 Ca 0.31 -0.01 -0.23 0.00 -0.84 0.00 0.00 61.79 61.02 1yx6 h SER 85 Cb -0.05 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.38 1yx6 h SER 85 CO -0.06 0.21 -1.19 -1.28 -1.14 0.00 0.00 176.83 173.38 1yx6 h SER 86 N 0.35 0.02 -3.06 3.07 0.87 -1.74 -3.43 113.55 109.63 1yx6 h SER 86 Ca 0.10 -0.03 -0.57 0.00 -1.23 0.00 0.00 61.79 60.06 1yx6 h SER 86 Cb -0.02 -0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 61.88 1yx6 h SER 86 CO -0.02 1.02 0.91 -0.04 -0.53 0.00 0.00 176.83 178.17 1yx6 s MET 87 N -2.68 4.09 0.00 2.24 1.00 -0.39 -5.00 119.30 118.56 1yx6 s MET 87 Ca -0.01 1.41 0.00 0.00 0.00 0.00 0.00 55.69 57.09 1yx6 s MET 87 Cb 0.09 -3.79 0.00 0.00 0.00 0.00 0.00 34.83 31.13 1yx6 s MET 87 CO 0.82 -0.88 0.00 0.25 0.00 0.00 0.00 175.02 175.21 1yx6 n THR 88 N 5.75 0.00 0.11 2.05 -2.24 -1.26 -4.39 114.28 114.30 1yx6 n THR 88 Ca 0.14 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.91 1yx6 n THR 88 Cb 0.46 -1.99 0.25 0.00 -2.10 0.00 0.00 70.33 66.94 1yx6 n THR 88 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1yx6 h GLU 89 N 0.00 0.20 0.13 -0.78 4.11 -1.97 0.32 114.58 116.59 1yx6 h GLU 89 Ca 0.00 -0.09 -0.32 0.00 0.07 0.00 0.00 59.36 59.02 1yx6 h GLU 89 Cb 0.00 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1yx6 h GLU 89 CO 0.00 0.57 -1.65 1.05 0.07 0.00 0.00 179.01 179.05 1yx6 h GLU 90 N 0.17 0.27 -0.12 1.06 4.11 -1.97 -1.49 114.58 116.60 1yx6 h GLU 90 Ca 0.02 -0.47 -0.02 0.00 0.07 0.00 0.00 59.36 58.96 1yx6 h GLU 90 Cb 0.79 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.21 1yx6 h GLU 90 CO 0.06 1.14 -0.00 1.49 0.07 0.00 0.00 179.01 181.77 1yx6 h GLU 91 N 0.07 0.21 -0.30 1.06 4.57 -1.85 -0.88 114.58 117.47 1yx6 h GLU 91 Ca -0.29 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 57.78 1yx6 h GLU 91 Cb 2.04 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 30.59 1yx6 h GLU 91 CO 0.15 0.46 0.02 1.96 -1.18 0.00 0.00 179.01 180.42 1yx6 h GLN 92 N -0.06 0.45 -0.72 1.92 4.20 -0.48 -0.27 115.11 120.15 1yx6 h GLN 92 Ca 0.03 -0.08 0.05 0.00 0.06 0.00 0.00 58.65 58.72 1yx6 h GLN 92 Cb 0.36 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.03 1yx6 h GLN 92 CO 0.01 0.47 0.47 0.82 -0.67 0.00 0.00 178.83 179.93 1yx6 h ILE 93 N 0.44 1.05 -0.32 2.54 2.04 -0.57 0.19 117.51 122.87 1yx6 h ILE 93 Ca 0.10 -0.27 -0.04 0.00 1.00 0.00 0.00 64.86 65.65 1yx6 h ILE 93 Cb 0.26 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1yx6 h ILE 93 CO 0.01 0.14 0.02 0.00 0.00 0.00 0.00 178.15 178.32 1yx6 h ALA 94 N 1.60 1.44 -0.18 1.87 0.00 0.34 0.81 119.26 125.15 1yx6 h ALA 94 Ca 0.30 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1yx6 h ALA 94 Cb 0.20 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1yx6 h ALA 94 CO -0.10 0.40 -0.18 -0.92 0.00 0.00 0.00 179.25 178.45 1yx6 h TYR 95 N 0.47 0.53 0.00 0.00 3.20 -0.48 0.34 116.97 121.02 1yx6 h TYR 95 Ca 0.10 -0.16 -0.13 0.00 3.14 0.00 0.00 58.73 61.69 1yx6 h TYR 95 Cb 0.28 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 1yx6 h TYR 95 CO 0.01 0.81 -0.78 0.00 -1.64 0.00 0.00 178.16 176.56 1yx6 h ALA 96 N 0.63 0.64 0.02 1.82 0.00 -0.98 -2.75 119.26 118.64 1yx6 h ALA 96 Ca 0.03 -0.58 -0.25 0.00 0.00 0.00 0.00 54.91 54.10 1yx6 h ALA 96 Cb 0.73 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1yx6 h ALA 96 CO 0.05 0.74 -1.32 1.98 0.00 0.00 0.00 179.25 180.69 1yx6 h MET 97 N 0.00 0.04 0.00 0.00 1.85 0.61 -2.49 114.93 114.95 1yx6 h MET 97 Ca -0.05 -0.07 -0.16 0.00 -0.61 0.00 0.00 59.70 58.81 1yx6 h MET 97 Cb 1.46 0.03 -0.03 0.00 0.43 0.00 0.00 31.60 33.49 1yx6 h MET 97 CO 0.06 0.85 -0.93 0.37 -0.40 0.00 0.00 176.91 176.86 1yx6 h GLN 98 N 0.01 0.00 0.00 0.39 5.75 -1.02 -2.86 115.11 117.39 1yx6 h GLN 98 Ca -0.14 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.36 1yx6 h GLN 98 Cb 1.89 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.44 1yx6 h GLN 98 CO 0.12 0.60 -1.00 -0.12 -2.65 0.00 0.00 178.83 175.77 1yx6 n MET 99 N -3.18 0.44 -0.02 1.69 1.56 -1.04 -4.12 117.12 112.46 1yx6 n MET 99 Ca -0.03 0.05 -0.04 0.00 -0.27 0.00 0.00 57.70 57.42 1yx6 n MET 99 Cb 0.84 -1.70 -0.12 0.00 2.15 0.00 0.00 33.22 34.39 1yx6 n MET 99 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 1yx6 n SER 100 N -2.29 0.60 0.26 6.12 7.64 -0.94 -2.89 113.62 122.12 1yx6 n SER 100 Ca 0.01 0.28 0.13 0.00 1.01 0.00 0.00 58.87 60.30 1yx6 n SER 100 Cb 0.49 0.42 0.80 0.00 -1.01 0.00 0.00 64.21 64.91 1yx6 n SER 100 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1yx6 h LEU 101 N 0.00 0.00 0.00 -3.43 6.46 -1.66 -3.34 115.31 113.35 1yx6 h LEU 101 Ca -0.28 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.48 1yx6 h LEU 101 Cb 1.82 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.75 1yx6 h LEU 101 CO 0.05 0.00 0.00 0.00 -0.62 0.00 0.00 178.44 177.87 1yx6 n GLN 102 N -4.12 0.00 -1.06 1.25 1.13 -1.26 -5.08 117.38 108.25 1yx6 n GLN 102 Ca -0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 1yx6 n GLN 102 Cb 0.14 -0.35 0.00 0.00 0.11 0.00 0.00 30.24 30.14 1yx6 n GLN 102 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1yx6 n GLY 103 N 2.07 0.60 2.89 1.08 0.00 -1.14 -5.02 105.19 105.67 1yx6 n GLY 103 Ca 0.00 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 1yx6 n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yx6 n ALA 104 N -0.93 4.37 -0.05 4.61 0.00 -1.26 -4.85 120.51 122.40 1yx6 n ALA 104 Ca 0.00 -4.72 -0.03 0.00 0.00 0.00 0.00 53.44 48.68 1yx6 n ALA 104 Cb 0.35 -1.73 -0.01 0.00 0.00 0.00 0.00 19.45 18.06 1yx6 n ALA 104 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1yx6 h GLU 105 N 5.32 0.00 0.00 0.00 4.57 -1.98 -3.49 114.58 119.01 1yx6 h GLU 105 Ca 0.19 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.37 1yx6 h GLU 105 Cb 0.70 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.29 1yx6 h GLU 105 CO 1.02 0.00 0.00 1.19 -1.18 0.00 0.00 179.01 180.04 1yx6 n PHE 106 N -4.05 0.00 -2.22 0.92 3.72 -1.26 -5.01 117.46 109.56 1yx6 n PHE 106 Ca -0.05 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.15 1yx6 n PHE 106 Cb 0.18 0.13 -0.03 0.00 -0.94 0.00 0.00 39.48 38.83 1yx6 n PHE 106 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1yx6 n GLY 107 N 2.03 0.04 2.68 1.37 0.00 -1.26 -4.94 105.19 105.10 1yx6 n GLY 107 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1yx6 n GLY 107 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1yx6 s GLN 108 N -4.75 0.79 -0.36 1.61 0.74 -1.26 -4.95 119.66 111.48 1yx6 s GLN 108 Ca 0.00 -1.30 0.05 0.00 0.05 0.00 0.00 55.36 54.16 1yx6 s GLN 108 Cb 0.00 -1.92 0.24 0.00 1.10 0.00 0.00 33.01 32.44 1yx6 s GLN 108 CO 0.00 -1.06 1.22 0.00 -0.55 0.00 0.00 175.29 174.89 1yx6 n ALA 109 N 4.45 -1.09 -2.21 1.58 0.00 -1.26 -4.99 120.51 116.99 1yx6 n ALA 109 Ca 0.02 -0.85 -0.02 0.00 0.00 0.00 0.00 53.44 52.59 1yx6 n ALA 109 Cb 0.39 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 1yx6 n ALA 109 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1yx6 n GLU 110 N -0.28 0.00 -3.79 0.00 0.28 -1.26 -5.13 120.64 110.47 1yx6 n GLU 110 Ca -0.12 -1.42 -0.04 0.00 -0.16 0.00 0.00 57.16 55.42 1yx6 n GLU 110 Cb 0.74 0.29 -0.01 0.00 1.43 0.00 0.00 31.44 33.88 1yx6 n GLU 110 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 1yx6 s SER 111 N -1.42 -0.17 0.00 -1.84 0.01 -1.26 -5.33 113.70 103.69 1yx6 s SER 111 Ca 0.14 -0.51 0.21 0.00 1.31 0.00 0.00 55.95 57.11 1yx6 s SER 111 Cb 0.16 0.56 1.27 0.00 0.21 0.00 0.00 66.02 68.22 1yx6 s SER 111 CO -0.07 -1.05 1.65 0.00 0.41 0.00 0.00 173.24 174.18