#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 0.72 -0.59 -0.41 2.00 -1.26 -5.03 117.12 112.55 1yx6 n MET 2 Ca 0.00 -1.52 0.03 0.00 0.00 0.00 0.00 57.70 56.20 1yx6 n MET 2 Cb 0.00 1.99 0.22 0.00 0.00 0.00 0.00 33.22 35.44 1yx6 n MET 2 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1yx6 n LEU 3 N 0.00 3.93 -3.70 4.03 4.32 -1.26 -4.83 117.00 119.49 1yx6 n LEU 3 Ca -0.04 -3.36 -0.42 0.00 -0.02 0.00 0.00 56.01 52.18 1yx6 n LEU 3 Cb 0.51 -0.58 -0.00 0.00 -1.62 0.00 0.00 43.42 41.73 1yx6 n LEU 3 CO 0.21 0.93 2.45 0.61 -1.22 0.00 0.00 177.39 180.37 1yx6 n GLY 4 N -0.85 4.64 0.11 -0.72 0.00 -1.26 -4.61 105.19 102.49 1yx6 n GLY 4 Ca 0.27 -1.84 -0.16 0.00 0.00 0.00 0.00 46.02 44.29 1yx6 n GLY 4 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1yx6 h LEU 5 N 8.27 0.39 -8.43 0.99 3.38 -2.06 -3.48 115.31 114.38 1yx6 h LEU 5 Ca 0.55 -0.46 -0.20 0.00 0.09 0.00 0.00 57.88 57.87 1yx6 h LEU 5 Cb 0.55 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.09 1yx6 h LEU 5 CO 1.73 1.37 -0.20 -0.83 0.09 0.00 0.00 178.44 180.59 1yx6 s GLY 6 N -4.78 1.15 -0.45 0.83 0.00 -1.26 -5.04 107.32 97.78 1yx6 s GLY 6 Ca -0.06 -1.32 0.02 0.00 0.00 0.00 0.00 44.72 43.37 1yx6 s GLY 6 CO 0.87 -0.91 1.87 0.00 0.00 0.00 0.00 173.10 174.94 1yx6 n ALA 7 N -0.47 5.47 -0.81 3.20 0.00 -1.26 -4.36 120.51 122.27 1yx6 n ALA 7 Ca 0.00 -2.70 0.08 0.00 0.00 0.00 0.00 53.44 50.82 1yx6 n ALA 7 Cb 0.62 -1.48 0.39 0.00 0.00 0.00 0.00 19.45 18.98 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 -0.86 5.40 0.15 0.00 3.41 -1.26 -4.29 113.62 116.17 1yx6 n SER 8 Ca 0.54 -2.77 0.06 0.00 -0.26 0.00 0.00 58.87 56.44 1yx6 n SER 8 Cb 1.28 -0.65 0.06 0.00 -0.26 0.00 0.00 64.21 64.64 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 4.01 0.00 -1.53 4.04 5.19 -2.00 -3.45 116.42 122.69 1yx6 h ASP 9 Ca 0.00 0.00 0.14 0.00 -0.62 0.00 0.00 57.03 56.55 1yx6 h ASP 9 Cb 1.80 0.00 -0.23 0.00 0.18 0.00 0.00 39.33 41.08 1yx6 h ASP 9 CO 0.40 0.29 0.13 0.72 -3.12 0.00 0.00 179.24 177.66 1yx6 s PHE 10 N -3.08 -0.87 -0.35 4.55 -0.71 -1.26 -5.07 117.98 111.19 1yx6 s PHE 10 Ca 0.04 1.54 0.04 0.00 -1.04 0.00 0.00 56.93 57.51 1yx6 s PHE 10 Cb 0.07 0.52 0.19 0.00 -1.21 0.00 0.00 43.02 42.59 1yx6 s PHE 10 CO 0.73 -0.43 1.18 -0.85 -1.34 0.00 0.00 175.22 174.51 1yx6 n GLU 11 N 4.95 0.57 0.00 1.99 0.28 -1.26 -4.97 120.64 122.20 1yx6 n GLU 11 Ca -0.11 -1.13 0.00 0.00 -0.16 0.00 0.00 57.16 55.75 1yx6 n GLU 11 Cb 0.52 -0.03 0.00 0.00 1.43 0.00 0.00 31.44 33.36 1yx6 n GLU 11 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 1yx6 n PHE 12 N -0.52 0.00 -2.27 -1.84 1.16 -1.26 -4.94 117.46 107.79 1yx6 n PHE 12 Ca -0.18 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.38 1yx6 n PHE 12 Cb 0.73 0.00 0.07 0.00 -1.61 0.00 0.00 39.48 38.67 1yx6 n PHE 12 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1yx6 n GLY 13 N -0.51 3.32 0.59 4.97 0.00 -1.26 -4.15 105.19 108.15 1yx6 n GLY 13 Ca 0.00 -1.39 -0.14 0.00 0.00 0.00 0.00 46.02 44.49 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 -0.42 0.77 -0.67 1.61 0.31 -1.26 -4.91 118.33 113.76 1yx6 n VAL 14 Ca 0.17 -0.16 -0.30 0.00 -0.01 0.00 0.00 64.34 64.04 1yx6 n VAL 14 Cb 0.91 -1.70 0.27 0.00 -0.91 0.00 0.00 33.84 32.41 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 -6.20 -0.32 -0.84 4.52 1.01 -1.26 -4.69 116.67 108.90 1yx6 s ASP 15 Ca -0.19 0.73 -0.28 0.00 0.71 0.00 0.00 52.55 53.53 1yx6 s ASP 15 Cb 0.07 -1.02 -0.27 0.00 1.01 0.00 0.00 42.92 42.71 1yx6 s ASP 15 CO 0.23 -4.90 1.99 -0.81 0.21 0.00 0.00 175.17 171.90 1yx6 n PRO 16 N -5.30 0.07 -3.01 8.23 -0.04 -1.26 -2.74 135.00 130.95 1yx6 n PRO 16 Ca 0.13 -1.54 -0.12 0.00 -0.04 0.00 0.00 63.50 61.93 1yx6 n PRO 16 Cb 0.60 -3.61 0.05 0.00 -0.04 0.00 0.00 33.50 30.50 1yx6 n PRO 16 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1yx6 n SER 17 N 17.50 -3.30 -2.73 3.54 2.88 -1.26 -2.77 113.62 127.47 1yx6 n SER 17 Ca 0.42 -0.35 -0.05 0.00 -1.33 0.00 0.00 58.87 57.56 1yx6 n SER 17 Cb 0.46 -3.28 -0.01 0.00 -0.75 0.00 0.00 64.21 60.63 1yx6 n SER 17 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yx6 n ALA 18 N -3.44 -1.02 -3.22 -1.46 0.00 -1.11 -4.82 120.51 105.43 1yx6 n ALA 18 Ca -0.09 -0.02 0.03 0.00 0.00 0.00 0.00 53.44 53.36 1yx6 n ALA 18 Cb 0.57 -0.75 -0.01 0.00 0.00 0.00 0.00 19.45 19.25 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 -2.14 -1.33 0.16 0.00 1.01 -1.11 -4.99 116.67 108.26 1yx6 s ASP 19 Ca 0.10 0.97 0.22 0.00 0.71 0.00 0.00 52.55 54.55 1yx6 s ASP 19 Cb -0.06 2.17 0.88 0.00 1.01 0.00 0.00 42.92 46.93 1yx6 s ASP 19 CO 0.12 -0.25 1.67 -0.81 0.21 0.00 0.00 175.17 176.11 1yx6 n PRO 20 N 5.43 0.14 0.13 8.23 -0.04 -1.26 -2.55 135.00 145.08 1yx6 n PRO 20 Ca -0.03 0.32 -0.02 0.00 -0.04 0.00 0.00 63.50 63.73 1yx6 n PRO 20 Cb 0.51 -1.74 0.17 0.00 -0.04 0.00 0.00 33.50 32.40 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 0.06 0.00 0.54 4.81 -1.94 -2.21 114.58 115.84 1yx6 h GLU 21 Ca 0.00 -0.04 -0.28 0.00 -0.13 0.00 0.00 59.36 58.91 1yx6 h GLU 21 Cb 0.40 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.74 1yx6 h GLU 21 CO 0.00 0.64 -1.61 -0.07 -0.73 0.00 0.00 179.01 177.24 1yx6 h LEU 22 N 0.05 0.00 -0.54 1.64 3.38 -1.80 -2.83 115.31 115.21 1yx6 h LEU 22 Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1yx6 h LEU 22 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1yx6 h LEU 22 CO 0.08 1.00 -0.01 0.00 0.09 0.00 0.00 178.44 179.60 1yx6 h ALA 23 N 1.00 0.72 0.01 1.53 0.00 -1.43 -1.97 119.26 119.13 1yx6 h ALA 23 Ca -0.25 -0.30 -0.20 0.00 0.00 0.00 0.00 54.91 54.16 1yx6 h ALA 23 Cb 1.98 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.55 1yx6 h ALA 23 CO 0.09 0.55 -0.96 -0.07 0.00 0.00 0.00 179.25 178.85 1yx6 h LEU 24 N 0.82 0.07 -0.88 0.00 3.38 -1.53 -2.68 115.31 114.49 1yx6 h LEU 24 Ca 0.15 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 1yx6 h LEU 24 Cb 0.54 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1yx6 h LEU 24 CO 0.03 0.99 0.06 0.00 0.09 0.00 0.00 178.44 179.61 1yx6 h ALA 25 N 1.01 1.08 0.00 1.53 0.00 -1.31 -0.56 119.26 121.00 1yx6 h ALA 25 Ca -0.03 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 1yx6 h ALA 25 Cb 1.67 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 1yx6 h ALA 25 CO 0.13 0.59 -0.27 1.25 0.00 0.00 0.00 179.25 180.96 1yx6 h LEU 26 N 0.84 0.00 0.09 0.00 6.46 -1.39 -2.82 115.31 118.49 1yx6 h LEU 26 Ca 0.17 0.00 -0.26 0.00 -0.12 0.00 0.00 57.88 57.67 1yx6 h LEU 26 Cb 0.41 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.33 1yx6 h LEU 26 CO 0.01 0.15 -1.21 0.03 -0.62 0.00 0.00 178.44 176.80 1yx6 h ARG 27 N 0.00 0.19 0.00 1.25 3.08 -1.09 -2.54 114.38 115.28 1yx6 h ARG 27 Ca -0.01 -0.33 -0.16 0.00 0.07 0.00 0.00 59.98 59.55 1yx6 h ARG 27 Cb 1.12 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 31.27 1yx6 h ARG 27 CO 0.02 1.14 -0.78 0.28 -1.07 0.00 0.00 179.97 179.56 1yx6 h VAL 28 N 0.05 1.52 -0.03 2.04 2.07 -1.15 -2.87 116.25 117.89 1yx6 h VAL 28 Ca -0.11 -2.72 -0.23 0.00 0.82 0.00 0.00 66.70 64.46 1yx6 h VAL 28 Cb 1.92 2.48 0.02 0.00 -1.52 0.00 0.00 31.29 34.19 1yx6 h VAL 28 CO 0.18 0.77 -0.89 -1.28 0.02 0.00 0.00 177.57 176.37 1yx6 h SER 29 N 0.00 0.83 -0.42 0.57 0.87 -1.53 -2.76 113.55 111.11 1yx6 h SER 29 Ca -0.01 -0.72 -0.02 0.00 -1.23 0.00 0.00 61.79 59.81 1yx6 h SER 29 Cb 1.42 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 63.11 1yx6 h SER 29 CO 0.10 1.44 0.19 -0.03 -0.53 0.00 0.00 176.83 178.00 1yx6 h MET 30 N 0.30 0.61 -0.73 2.24 -1.53 -1.48 -2.02 114.93 112.31 1yx6 h MET 30 Ca -0.10 -0.10 -0.02 0.00 -3.44 0.00 0.00 59.70 56.03 1yx6 h MET 30 Cb 1.55 -0.11 -0.03 0.00 -0.55 0.00 0.00 31.60 32.46 1yx6 h MET 30 CO 0.18 0.55 0.37 0.93 0.14 0.00 0.00 176.91 179.07 1yx6 h GLU 31 N 0.53 1.04 -0.59 0.39 5.08 -1.57 -2.14 114.58 117.32 1yx6 h GLU 31 Ca 0.14 -0.13 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1yx6 h GLU 31 Cb 0.15 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1yx6 h GLU 31 CO -0.02 0.79 0.16 0.93 -1.00 0.00 0.00 179.01 179.88 1yx6 h GLU 32 N 1.04 0.90 -0.66 2.33 4.39 -1.16 -2.59 114.58 118.83 1yx6 h GLU 32 Ca 0.26 -0.18 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 1yx6 h GLU 32 Cb 0.08 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.56 1yx6 h GLU 32 CO -0.04 0.79 0.40 1.96 -1.16 0.00 0.00 179.01 180.96 1yx6 h GLN 33 N 0.87 0.90 -0.65 2.33 4.20 -0.71 -2.23 115.11 119.82 1yx6 h GLN 33 Ca 0.19 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.78 1yx6 h GLN 33 Cb 0.28 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 1yx6 h GLN 33 CO -0.01 0.65 0.26 -0.09 -0.67 0.00 0.00 178.83 178.97 1yx6 h ARG 34 N 0.90 0.95 -0.56 1.46 9.65 -1.22 -0.95 114.38 124.62 1yx6 h ARG 34 Ca 0.24 -0.15 -0.00 0.00 -1.10 0.00 0.00 59.98 58.96 1yx6 h ARG 34 Cb -0.02 -0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 28.37 1yx6 h ARG 34 CO -0.04 0.77 0.34 1.96 2.80 0.00 0.00 179.97 185.80 1yx6 h GLN 35 N 0.94 0.76 -0.27 0.20 4.20 -1.05 0.24 115.11 120.14 1yx6 h GLN 35 Ca 0.22 -0.07 -0.16 0.00 0.06 0.00 0.00 58.65 58.70 1yx6 h GLN 35 Cb 0.18 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1yx6 h GLN 35 CO -0.02 0.55 -0.47 0.00 -0.67 0.00 0.00 178.83 178.22 1yx6 h ARG 36 N 0.76 0.71 0.00 1.46 3.08 -1.10 -0.10 114.38 119.19 1yx6 h ARG 36 Ca 0.20 -0.41 -0.07 0.00 0.07 0.00 0.00 59.98 59.77 1yx6 h ARG 36 Cb -0.01 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1yx6 h ARG 36 CO -0.04 1.03 -0.35 0.37 -1.07 0.00 0.00 179.97 179.91 1yx6 h GLN 37 N 0.56 0.00 0.00 0.04 5.75 -0.82 -2.28 115.11 118.37 1yx6 h GLN 37 Ca 0.03 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.50 1yx6 h GLN 37 Cb 1.03 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.57 1yx6 h GLN 37 CO 0.10 0.35 -0.29 1.49 -2.65 0.00 0.00 178.83 177.83 1yx6 h GLU 38 N 0.00 0.00 -0.81 1.69 4.81 -0.33 0.58 114.58 120.52 1yx6 h GLU 38 Ca -0.00 0.00 0.22 0.00 -0.13 0.00 0.00 59.36 59.44 1yx6 h GLU 38 Cb 0.88 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.21 1yx6 h GLU 38 CO 0.05 0.30 0.57 0.93 -0.73 0.00 0.00 179.01 180.13 1yx6 h GLU 39 N -1.00 0.12 0.09 1.92 5.08 -1.10 0.30 114.58 119.99 1yx6 h GLU 39 Ca -0.04 -0.01 -0.30 0.00 -1.00 0.00 0.00 59.36 58.01 1yx6 h GLU 39 Cb 0.48 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1yx6 h GLU 39 CO -0.03 0.08 -1.58 1.49 -1.00 0.00 0.00 179.01 177.98 1yx6 h GLU 40 N 0.13 0.19 0.01 2.33 4.81 -1.51 -2.78 114.58 117.76 1yx6 h GLU 40 Ca 0.40 -0.33 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1yx6 h GLU 40 Cb 1.38 0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.88 1yx6 h GLU 40 CO -0.06 1.02 -0.00 0.00 -0.73 0.00 0.00 179.01 179.24 1yx6 h ALA 41 N 0.56 -0.01 -0.07 2.92 0.00 0.18 -2.63 119.26 120.21 1yx6 h ALA 41 Ca -0.25 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1yx6 h ALA 41 Cb 2.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.79 1yx6 h ALA 41 CO 0.14 -0.42 -0.34 0.07 0.00 0.00 0.00 179.25 178.69 1yx6 h ARG 42 N -0.18 0.14 -0.99 0.00 0.11 -0.78 -2.55 114.38 110.13 1yx6 h ARG 42 Ca -0.00 -0.05 0.14 0.00 0.10 0.00 0.00 59.98 60.16 1yx6 h ARG 42 Cb 0.18 -0.01 -0.09 0.00 1.11 0.00 0.00 29.97 31.16 1yx6 h ARG 42 CO 0.00 0.47 0.62 -0.09 0.10 0.00 0.00 179.97 181.07 1yx6 h ARG 43 N 0.12 0.89 0.00 0.08 2.43 -1.17 0.42 114.38 117.14 1yx6 h ARG 43 Ca 0.01 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.02 1yx6 h ARG 43 Cb 0.67 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 1yx6 h ARG 43 CO 0.05 0.59 -0.55 0.00 -1.51 0.00 0.00 179.97 178.54 1yx6 h ALA 44 N 1.57 0.76 0.00 2.80 0.00 -1.23 -2.17 119.26 120.99 1yx6 h ALA 44 Ca 0.51 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1yx6 h ALA 44 Cb 0.60 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1yx6 h ALA 44 CO -0.28 0.69 -0.43 0.00 0.00 0.00 0.00 179.25 179.23 1yx6 h ALA 45 N 1.45 1.06 0.14 0.00 0.00 0.01 -2.54 119.26 119.38 1yx6 h ALA 45 Ca -0.01 -0.39 -0.34 0.00 0.00 0.00 0.00 54.91 54.17 1yx6 h ALA 45 Cb 1.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1yx6 h ALA 45 CO 0.07 0.54 -1.81 0.00 0.00 0.00 0.00 179.25 178.05 1yx6 h ALA 46 N 1.57 0.29 -0.08 0.00 0.00 -0.81 -2.79 119.26 117.44 1yx6 h ALA 46 Ca -0.00 -1.26 -0.03 0.00 0.00 0.00 0.00 54.91 53.62 1yx6 h ALA 46 Cb 0.89 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1yx6 h ALA 46 CO 0.06 1.12 -0.10 0.00 0.00 0.00 0.00 179.25 180.33 1yx6 h ALA 47 N 0.05 1.70 0.19 0.00 0.00 -1.41 0.51 119.26 120.30 1yx6 h ALA 47 Ca -0.38 -0.14 -0.35 0.00 0.00 0.00 0.00 54.91 54.05 1yx6 h ALA 47 Cb 2.00 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 19.75 1yx6 h ALA 47 CO 0.11 0.23 -1.68 1.03 0.00 0.00 0.00 179.25 178.93 1yx6 h SER 48 N 0.11 0.64 0.98 0.00 0.87 -1.58 -3.26 113.55 111.31 1yx6 h SER 48 Ca 0.02 -0.89 -0.13 0.00 -1.23 0.00 0.00 61.79 59.56 1yx6 h SER 48 Cb 0.25 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 1yx6 h SER 48 CO 0.01 1.74 -0.61 0.00 -0.53 0.00 0.00 176.83 177.45 1yx6 h ALA 49 N 0.16 0.76 0.00 6.23 0.00 -1.24 -3.00 119.26 122.17 1yx6 h ALA 49 Ca -0.32 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.04 1yx6 h ALA 49 Cb 2.11 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.80 1yx6 h ALA 49 CO 0.20 0.76 0.00 0.00 0.00 0.00 0.00 179.25 180.21 1yx6 n ALA 50 N -2.32 2.06 -3.00 0.00 0.00 0.18 0.11 120.51 117.54 1yx6 n ALA 50 Ca 0.00 -0.06 -0.44 0.00 0.00 0.00 0.00 53.44 52.94 1yx6 n ALA 50 Cb 0.69 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1yx6 n ALA 50 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1yx6 n GLU 51 N -1.64 3.74 -2.01 0.00 1.02 -1.13 -4.62 120.64 116.00 1yx6 n GLU 51 Ca 0.05 -4.18 -0.13 0.00 -0.02 0.00 0.00 57.16 52.88 1yx6 n GLU 51 Cb 0.29 -2.72 -0.03 0.00 -0.02 0.00 0.00 31.44 28.96 1yx6 n GLU 51 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1yx6 n ALA 52 N 3.29 -0.54 -1.75 0.62 0.00 -1.26 -4.75 120.51 116.12 1yx6 n ALA 52 Ca 0.30 0.15 0.04 0.00 0.00 0.00 0.00 53.44 53.93 1yx6 n ALA 52 Cb 0.38 -1.48 0.06 0.00 0.00 0.00 0.00 19.45 18.41 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 -0.59 2.25 0.09 0.00 0.00 -1.06 -4.57 105.19 101.32 1yx6 n GLY 53 Ca -0.14 -0.55 -0.08 0.00 0.00 0.00 0.00 46.02 45.25 1yx6 n GLY 53 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1yx6 h ILE 54 N 4.42 1.60 0.00 -0.61 6.09 0.55 -3.39 117.51 126.17 1yx6 h ILE 54 Ca -0.03 -3.04 -0.03 0.00 -1.37 0.00 0.00 64.86 60.40 1yx6 h ILE 54 Cb 1.31 2.70 -0.00 0.00 0.47 0.00 0.00 36.82 41.29 1yx6 h ILE 54 CO 0.01 0.87 -0.90 0.00 -3.07 0.00 0.00 178.15 175.07 1yx6 n ALA 55 N -2.41 0.73 -2.43 0.18 0.00 -1.26 -5.05 120.51 110.26 1yx6 n ALA 55 Ca -0.02 -0.67 -0.24 0.00 0.00 0.00 0.00 53.44 52.50 1yx6 n ALA 55 Cb 0.89 0.01 -0.08 0.00 0.00 0.00 0.00 19.45 20.27 1yx6 n ALA 55 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1yx6 s THR 56 N -2.63 0.29 -0.21 0.00 -4.23 -1.26 -5.14 115.64 102.46 1yx6 s THR 56 Ca -0.24 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.17 1yx6 s THR 56 Cb 0.04 -2.36 -0.05 0.00 1.34 0.00 0.00 72.50 71.47 1yx6 s THR 56 CO 0.36 0.00 0.14 0.42 -0.54 0.00 0.00 174.62 175.00 1yx6 s THR 57 N -3.25 5.39 -0.42 3.99 -4.23 -1.26 -4.32 115.64 111.53 1yx6 s THR 57 Ca 0.29 0.18 0.07 0.00 -1.18 0.00 0.00 61.69 61.06 1yx6 s THR 57 Cb 0.01 -3.47 0.25 0.00 1.34 0.00 0.00 72.50 70.63 1yx6 s THR 57 CO 0.21 0.41 0.62 0.61 -0.54 0.00 0.00 174.62 175.93 1yx6 n GLY 58 N 3.73 2.03 3.04 3.99 0.00 -1.26 -5.03 105.19 111.69 1yx6 n GLY 58 Ca -0.16 -1.07 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 1yx6 n GLY 58 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1yx6 n THR 59 N 1.51 2.04 -2.26 2.61 -2.24 -1.26 -4.67 114.28 110.01 1yx6 n THR 59 Ca 0.18 -1.77 -0.35 0.00 -2.27 0.00 0.00 64.05 59.83 1yx6 n THR 59 Cb 0.56 -2.36 0.02 0.00 -2.10 0.00 0.00 70.33 66.45 1yx6 n THR 59 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1yx6 n GLU 60 N 6.84 3.34 -0.09 -0.78 2.13 -1.26 -4.61 120.64 126.21 1yx6 n GLU 60 Ca 0.50 -4.08 -0.12 0.00 0.66 0.00 0.00 57.16 54.12 1yx6 n GLU 60 Cb 0.40 -2.29 -0.15 0.00 0.27 0.00 0.00 31.44 29.67 1yx6 n GLU 60 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1yx6 n ASP 61 N -0.44 0.61 -4.10 4.31 8.00 -1.26 -4.65 116.55 119.03 1yx6 n ASP 61 Ca 0.47 0.03 -0.39 0.00 0.71 0.00 0.00 54.79 55.61 1yx6 n ASP 61 Cb 0.38 0.49 -0.04 0.00 -0.02 0.00 0.00 41.12 41.93 1yx6 n ASP 61 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1yx6 n SER 62 N -2.93 4.89 0.00 -2.24 7.64 -1.26 -4.87 113.62 114.86 1yx6 n SER 62 Ca -0.34 -3.18 -0.04 0.00 1.01 0.00 0.00 58.87 56.32 1yx6 n SER 62 Cb 1.11 -1.14 -0.03 0.00 -1.01 0.00 0.00 64.21 63.13 1yx6 n SER 62 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1yx6 h ASP 63 N 5.92 -0.11 0.93 6.43 3.32 -1.94 -2.84 116.42 128.13 1yx6 h ASP 63 Ca 0.18 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 1yx6 h ASP 63 Cb 0.78 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 1yx6 h ASP 63 CO 0.98 0.44 -0.51 0.44 -1.72 0.00 0.00 179.24 178.87 1yx6 h ASP 64 N -1.02 0.00 -0.74 6.45 5.19 -1.99 -2.88 116.42 121.44 1yx6 h ASP 64 Ca -0.01 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.35 1yx6 h ASP 64 Cb 0.24 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.72 1yx6 h ASP 64 CO 0.02 0.51 0.29 0.00 -3.12 0.00 0.00 179.24 176.94 1yx6 h ALA 65 N 1.49 0.96 0.00 3.45 0.00 -1.93 0.44 119.26 123.68 1yx6 h ALA 65 Ca -0.01 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1yx6 h ALA 65 Cb 1.11 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1yx6 h ALA 65 CO 0.07 0.59 -0.35 1.25 0.00 0.00 0.00 179.25 180.81 1yx6 h LEU 66 N 1.07 0.00 0.11 0.00 5.85 -1.36 0.63 115.31 121.60 1yx6 h LEU 66 Ca 0.25 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.67 1yx6 h LEU 66 Cb 0.22 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.28 1yx6 h LEU 66 CO -0.02 0.35 -1.25 0.25 -0.34 0.00 0.00 178.44 177.43 1yx6 h LEU 67 N 0.00 0.75 0.00 2.25 6.46 -1.01 -2.83 115.31 120.93 1yx6 h LEU 67 Ca -0.00 -0.72 -0.06 0.00 -0.12 0.00 0.00 57.88 56.98 1yx6 h LEU 67 Cb 0.68 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 1yx6 h LEU 67 CO 0.05 1.54 -0.36 0.50 -0.62 0.00 0.00 178.44 179.54 1yx6 h LYS 68 N 0.21 0.00 -0.63 1.25 1.63 0.07 -2.90 116.57 116.20 1yx6 h LYS 68 Ca -0.18 0.00 0.06 0.00 -0.85 0.00 0.00 60.65 59.69 1yx6 h LYS 68 Cb 1.93 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 33.51 1yx6 h LYS 68 CO 0.23 0.74 0.33 1.98 -3.45 0.00 0.00 179.45 179.28 1yx6 h MET 69 N -1.00 0.58 -0.52 1.90 4.05 0.10 1.16 114.93 121.19 1yx6 h MET 69 Ca -0.09 -0.03 -0.12 0.00 -0.28 0.00 0.00 59.70 59.18 1yx6 h MET 69 Cb 0.86 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 31.52 1yx6 h MET 69 CO -0.05 0.38 -0.14 1.15 0.23 0.00 0.00 176.91 178.48 1yx6 h THR 70 N 0.60 1.27 0.00 -0.77 2.02 -1.63 -2.83 112.91 111.57 1yx6 h THR 70 Ca 0.29 -1.30 0.00 0.00 0.77 0.00 0.00 66.41 66.17 1yx6 h THR 70 Cb 0.22 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1yx6 h THR 70 CO -0.20 0.46 -0.30 -0.29 0.37 0.00 0.00 175.52 175.55 1yx6 h ILE 71 N 0.89 0.00 -0.12 3.11 6.09 -1.19 -2.77 117.51 123.52 1yx6 h ILE 71 Ca 0.13 -0.70 -0.11 0.00 -1.37 0.00 0.00 64.86 62.81 1yx6 h ILE 71 Cb 0.71 1.53 0.00 0.00 0.47 0.00 0.00 36.82 39.53 1yx6 h ILE 71 CO 0.05 0.00 -0.36 0.28 -3.07 0.00 0.00 178.15 175.06 1yx6 h SER 72 N 0.00 0.53 1.15 2.19 0.02 0.16 0.16 113.55 117.75 1yx6 h SER 72 Ca 0.00 -0.59 -0.18 0.00 -0.84 0.00 0.00 61.79 60.18 1yx6 h SER 72 Cb 0.85 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.21 1yx6 h SER 72 CO 0.00 1.03 -0.86 1.56 -1.14 0.00 0.00 176.83 177.43 1yx6 h GLN 73 N 0.06 0.00 0.05 3.45 7.50 -1.60 -2.68 115.11 121.88 1yx6 h GLN 73 Ca -0.01 0.00 -0.10 0.00 0.50 0.00 0.00 58.65 59.04 1yx6 h GLN 73 Cb 0.98 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.52 1yx6 h GLN 73 CO 0.08 0.84 -0.44 1.96 -1.50 0.00 0.00 178.83 179.77 1yx6 h GLN 74 N 0.00 0.21 -0.66 1.46 1.08 -1.51 -3.31 115.11 112.38 1yx6 h GLN 74 Ca -0.01 -0.29 -0.07 0.00 -1.45 0.00 0.00 58.65 56.83 1yx6 h GLN 74 Cb 1.66 0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 29.16 1yx6 h GLN 74 CO 0.11 1.08 0.14 1.49 -0.95 0.00 0.00 178.83 180.70 1yx6 h GLU 75 N -0.53 1.06 0.00 1.46 4.22 -0.80 -3.45 114.58 116.55 1yx6 h GLU 75 Ca -0.07 -0.26 0.00 0.00 0.08 0.00 0.00 59.36 59.11 1yx6 h GLU 75 Cb 1.28 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1yx6 h GLU 75 CO 0.08 0.96 0.00 0.34 -2.18 0.00 0.00 179.01 178.21 1yx6 n PHE 76 N -4.23 0.00 -3.39 0.92 7.35 -1.01 -4.74 117.46 112.35 1yx6 n PHE 76 Ca 0.05 0.00 -0.24 0.00 -0.76 0.00 0.00 57.45 56.49 1yx6 n PHE 76 Cb 0.27 0.00 0.05 0.00 0.35 0.00 0.00 39.48 40.15 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 0.00 -0.53 2.55 7.13 0.00 -1.26 -4.12 105.19 108.96 1yx6 n GLY 77 Ca 0.00 0.19 -0.03 0.00 0.00 0.00 0.00 46.02 46.17 1yx6 n GLY 77 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1yx6 n ARG 78 N -4.48 -4.36 -2.78 1.61 0.00 -1.26 -5.00 116.66 100.39 1yx6 n ARG 78 Ca -0.04 3.25 -0.01 0.00 -0.00 0.00 0.00 57.85 61.06 1yx6 n ARG 78 Cb 0.58 -4.45 0.07 0.00 0.00 0.00 0.00 32.46 28.66 1yx6 n ARG 78 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1yx6 n THR 79 N 1.85 0.89 -1.43 5.15 -1.04 -1.26 -4.97 114.28 113.48 1yx6 n THR 79 Ca -0.25 -2.37 -0.33 0.00 -2.04 0.00 0.00 64.05 59.05 1yx6 n THR 79 Cb 0.39 1.20 -0.05 0.00 -1.82 0.00 0.00 70.33 70.05 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 -0.85 4.25 3.47 3.41 0.00 -1.26 -4.81 105.19 109.40 1yx6 n GLY 80 Ca 0.00 -1.61 -0.17 0.00 0.00 0.00 0.00 46.02 44.24 1yx6 n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yx6 s LEU 81 N -0.62 -0.34 0.00 0.99 1.02 -1.26 -5.02 118.68 113.44 1yx6 s LEU 81 Ca 0.65 0.62 0.00 0.00 0.02 0.00 0.00 54.13 55.42 1yx6 s LEU 81 Cb 0.23 2.27 0.00 0.00 0.02 0.00 0.00 46.19 48.70 1yx6 s LEU 81 CO -0.07 -0.56 1.38 -0.81 0.02 0.00 0.00 176.35 176.31 1yx6 n PRO 82 N 1.08 0.88 -3.56 1.29 -0.04 -1.26 -4.78 135.00 128.60 1yx6 n PRO 82 Ca -0.19 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.03 1yx6 n PRO 82 Cb 0.57 -1.06 0.03 0.00 -0.04 0.00 0.00 33.50 33.00 1yx6 n PRO 82 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1yx6 n ASP 83 N 1.13 -5.79 -0.04 3.54 8.00 -1.26 -4.80 116.55 117.33 1yx6 n ASP 83 Ca 0.00 -0.82 -0.12 0.00 0.71 0.00 0.00 54.79 54.55 1yx6 n ASP 83 Cb 0.44 -3.56 -0.07 0.00 -0.02 0.00 0.00 41.12 37.91 1yx6 n ASP 83 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1yx6 h LEU 84 N -1.17 0.25 0.00 0.64 3.38 -1.97 -1.32 115.31 115.12 1yx6 h LEU 84 Ca -0.54 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.08 1yx6 h LEU 84 Cb 1.30 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1yx6 h LEU 84 CO 0.43 0.55 0.00 -0.24 0.09 0.00 0.00 178.44 179.26 1yx6 n SER 85 N -4.74 0.00 -0.24 -0.43 2.88 -1.26 -2.63 113.62 107.20 1yx6 n SER 85 Ca -0.06 -0.35 0.05 0.00 -1.33 0.00 0.00 58.87 57.18 1yx6 n SER 85 Cb 0.24 -0.15 0.01 0.00 -0.75 0.00 0.00 64.21 63.55 1yx6 n SER 85 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1yx6 n SER 86 N -1.15 1.27 -2.12 -3.46 2.88 -0.99 -5.01 113.62 105.04 1yx6 n SER 86 Ca 0.14 -1.14 0.00 0.00 -1.33 0.00 0.00 58.87 56.54 1yx6 n SER 86 Cb 0.13 0.38 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1yx6 n SER 86 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1yx6 n MET 87 N -0.12 0.95 -4.55 -1.46 2.00 -0.53 -5.08 117.12 108.32 1yx6 n MET 87 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 57.70 57.46 1yx6 n MET 87 Cb 0.20 0.00 -0.07 0.00 0.00 0.00 0.00 33.22 33.35 1yx6 n MET 87 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1yx6 n THR 88 N -0.79 0.00 0.21 2.03 -2.24 -1.26 -4.95 114.28 107.27 1yx6 n THR 88 Ca 0.00 -2.45 0.04 0.00 -2.27 0.00 0.00 64.05 59.37 1yx6 n THR 88 Cb 0.00 0.78 0.44 0.00 -2.10 0.00 0.00 70.33 69.44 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 0.00 0.17 -0.78 4.11 -1.98 0.26 114.58 116.36 1yx6 h GLU 89 Ca -0.36 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 58.79 1yx6 h GLU 89 Cb 1.27 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.54 1yx6 h GLU 89 CO 0.57 0.28 -1.31 0.93 0.07 0.00 0.00 179.01 179.55 1yx6 h GLU 90 N 0.00 0.37 -0.58 1.06 5.08 -1.97 0.69 114.58 119.23 1yx6 h GLU 90 Ca -0.00 -0.63 -0.03 0.00 -1.00 0.00 0.00 59.36 57.70 1yx6 h GLU 90 Cb 0.50 0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 1yx6 h GLU 90 CO 0.04 1.30 0.26 1.49 -1.00 0.00 0.00 179.01 181.10 1yx6 h GLU 91 N -0.13 0.85 -0.15 2.33 4.57 -1.89 0.39 114.58 120.55 1yx6 h GLU 91 Ca -0.25 -0.14 -0.13 0.00 -1.18 0.00 0.00 59.36 57.66 1yx6 h GLU 91 Cb 1.90 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 30.33 1yx6 h GLU 91 CO 0.17 0.71 -0.47 1.96 -1.18 0.00 0.00 179.01 180.20 1yx6 h GLN 92 N 0.80 0.37 -0.77 1.92 4.20 -0.57 -2.57 115.11 118.49 1yx6 h GLN 92 Ca 0.20 -0.20 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1yx6 h GLN 92 Cb 0.15 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.91 1yx6 h GLN 92 CO -0.02 0.77 0.37 0.82 -0.67 0.00 0.00 178.83 180.09 1yx6 h ILE 93 N 0.30 1.25 -0.34 2.54 2.04 0.26 -0.52 117.51 123.03 1yx6 h ILE 93 Ca 0.02 -0.69 0.06 0.00 1.00 0.00 0.00 64.86 65.25 1yx6 h ILE 93 Cb 0.94 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 1yx6 h ILE 93 CO 0.08 0.29 0.23 0.00 0.00 0.00 0.00 178.15 178.76 1yx6 h ALA 94 N 1.19 2.08 0.82 1.87 0.00 0.12 0.39 119.26 125.73 1yx6 h ALA 94 Ca 0.27 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1yx6 h ALA 94 Cb 0.12 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.88 1yx6 h ALA 94 CO -0.03 -0.15 -0.39 -0.92 0.00 0.00 0.00 179.25 177.75 1yx6 h TYR 95 N 0.19 -1.02 -0.12 0.00 3.20 -0.87 0.51 116.97 118.86 1yx6 h TYR 95 Ca 0.15 -0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.91 1yx6 h TYR 95 Cb 0.37 0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.96 1yx6 h TYR 95 CO -0.00 -0.62 -0.34 0.00 -1.64 0.00 0.00 178.16 175.56 1yx6 h ALA 96 N -1.10 1.21 0.00 1.82 0.00 -1.21 -2.18 119.26 117.80 1yx6 h ALA 96 Ca -0.11 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1yx6 h ALA 96 Cb 0.85 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1yx6 h ALA 96 CO 0.18 0.53 -0.04 0.52 0.00 0.00 0.00 179.25 180.44 1yx6 h MET 97 N 0.21 0.00 0.00 0.00 2.86 -0.12 -1.50 114.93 116.38 1yx6 h MET 97 Ca 0.03 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.49 1yx6 h MET 97 Cb 0.70 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.33 1yx6 h MET 97 CO 0.05 0.04 -0.82 1.96 1.06 0.00 0.00 176.91 179.20 1yx6 h GLN 98 N 0.00 0.00 -0.08 1.72 1.08 0.67 -2.61 115.11 115.89 1yx6 h GLN 98 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1yx6 h GLN 98 Cb 0.78 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.21 1yx6 h GLN 98 CO 0.01 0.82 0.00 -1.33 -0.95 0.00 0.00 178.83 177.38 1yx6 n MET 99 N -3.33 1.91 -0.00 1.46 2.81 -1.08 -4.35 117.12 114.54 1yx6 n MET 99 Ca 0.01 -1.79 0.04 0.00 -1.81 0.00 0.00 57.70 54.15 1yx6 n MET 99 Cb 0.86 -1.40 -0.06 0.00 -0.71 0.00 0.00 33.22 31.91 1yx6 n MET 99 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1yx6 n SER 100 N 1.17 2.39 0.27 7.83 2.88 -0.58 -4.53 113.62 123.05 1yx6 n SER 100 Ca 0.13 -0.19 0.14 0.00 -1.33 0.00 0.00 58.87 57.62 1yx6 n SER 100 Cb 0.52 1.26 0.86 0.00 -0.75 0.00 0.00 64.21 66.09 1yx6 n SER 100 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1yx6 h LEU 101 N 0.00 0.00 0.38 2.46 7.12 -1.66 -2.85 115.31 120.77 1yx6 h LEU 101 Ca 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 57.99 1yx6 h LEU 101 Cb 0.31 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.44 1yx6 h LEU 101 CO 0.00 0.00 -0.18 1.56 -0.13 0.00 0.00 178.44 179.69 1yx6 h GLN 102 N 0.00 -0.50 0.00 1.25 4.20 -1.85 -3.50 115.11 114.72 1yx6 h GLN 102 Ca 0.02 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1yx6 h GLN 102 Cb 0.08 0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1yx6 h GLN 102 CO -0.00 -0.20 0.00 0.41 -0.67 0.00 0.00 178.83 178.37 1yx6 n GLY 103 N 0.07 1.09 3.03 3.46 0.00 -1.08 -5.03 105.19 106.73 1yx6 n GLY 103 Ca -0.09 -1.09 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 1yx6 n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yx6 s ALA 104 N 0.00 3.34 -0.12 4.61 0.00 -1.26 -4.95 121.76 123.38 1yx6 s ALA 104 Ca 0.00 -3.09 -0.12 0.00 0.00 0.00 0.00 51.96 48.76 1yx6 s ALA 104 Cb 0.00 -2.35 -0.10 0.00 0.00 0.00 0.00 23.12 20.67 1yx6 s ALA 104 CO 0.00 -1.98 0.31 1.49 0.00 0.00 0.00 175.76 175.58 1yx6 h GLU 105 N 7.02 -0.00 0.00 0.00 4.57 -2.03 -3.48 114.58 120.66 1yx6 h GLU 105 Ca -0.06 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1yx6 h GLU 105 Cb 0.95 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.54 1yx6 h GLU 105 CO 0.68 0.40 0.00 0.34 -1.18 0.00 0.00 179.01 179.25 1yx6 n PHE 106 N -4.71 -0.93 0.00 0.92 -0.00 -1.26 -5.07 117.46 106.41 1yx6 n PHE 106 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.41 1yx6 n PHE 106 Cb 0.19 0.19 0.00 0.00 -0.00 0.00 0.00 39.48 39.86 1yx6 n PHE 106 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yx6 n GLY 107 N -1.38 0.69 3.34 7.13 0.00 -1.26 -4.98 105.19 108.73 1yx6 n GLY 107 Ca 0.00 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 45.26 1yx6 n GLY 107 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1yx6 n GLN 108 N 0.00 1.50 -2.94 1.61 1.13 -1.26 -4.43 117.38 112.99 1yx6 n GLN 108 Ca 0.00 -2.11 -0.03 0.00 -1.94 0.00 0.00 57.00 52.92 1yx6 n GLN 108 Cb 0.00 -3.28 0.00 0.00 0.11 0.00 0.00 30.24 27.07 1yx6 n GLN 108 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1yx6 n ALA 109 N 10.75 -2.89 0.04 -1.58 0.00 -1.26 -5.00 120.51 120.57 1yx6 n ALA 109 Ca 0.47 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.31 1yx6 n ALA 109 Cb 0.43 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1yx6 n ALA 109 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1yx6 n GLU 110 N 0.74 0.00 -2.41 0.00 0.00 -1.26 -4.84 120.64 112.87 1yx6 n GLU 110 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 57.16 56.76 1yx6 n GLU 110 Cb 0.25 -0.44 0.03 0.00 0.00 0.00 0.00 31.44 31.28 1yx6 n GLU 110 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1yx6 n SER 111 N -3.31 7.41 0.00 4.31 2.88 -1.26 -5.25 113.62 118.41 1yx6 n SER 111 Ca 0.00 -3.74 0.07 0.00 -1.33 0.00 0.00 58.87 53.87 1yx6 n SER 111 Cb 0.15 -1.14 0.42 0.00 -0.75 0.00 0.00 64.21 62.90 1yx6 n SER 111 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81