#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yx5 n MET 2 N 0.00 2.01 -0.65 -0.41 1.56 -1.26 -5.04 117.12 113.33 1yx5 n MET 2 Ca 0.00 0.00 0.01 0.00 -0.27 0.00 0.00 57.70 57.44 1yx5 n MET 2 Cb 0.00 0.00 0.23 0.00 2.15 0.00 0.00 33.22 35.60 1yx5 n MET 2 CO 0.00 0.00 0.00 -0.11 -0.73 0.00 0.00 175.97 175.13 1yx5 n LEU 3 N 0.00 4.19 -0.07 -0.89 7.94 -1.26 -4.66 117.00 122.25 1yx5 n LEU 3 Ca 0.00 -3.37 -0.06 0.00 -1.11 0.00 0.00 56.01 51.48 1yx5 n LEU 3 Cb 0.00 -0.60 -0.02 0.00 0.53 0.00 0.00 43.42 43.33 1yx5 n LEU 3 CO 0.00 0.94 -0.43 0.61 -1.11 0.00 0.00 177.39 177.40 1yx5 n GLY 4 N -0.80 -0.83 2.66 -3.96 0.00 -1.26 -4.91 105.19 96.10 1yx5 n GLY 4 Ca 0.29 -0.21 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1yx5 n GLY 4 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1yx5 s LEU 5 N -8.05 1.19 0.00 0.99 2.96 -1.26 -5.11 118.68 109.40 1yx5 s LEU 5 Ca -0.18 -1.18 0.00 0.00 -0.22 0.00 0.00 54.13 52.54 1yx5 s LEU 5 Cb 0.03 -0.56 0.00 0.00 0.50 0.00 0.00 46.19 46.16 1yx5 s LEU 5 CO 0.27 -0.39 0.00 0.61 -1.32 0.00 0.00 176.35 175.53 1yx5 n GLY 6 N 5.08 4.57 2.24 7.98 0.00 -1.26 -4.86 105.19 118.94 1yx5 n GLY 6 Ca -0.06 -1.71 -0.16 0.00 0.00 0.00 0.00 46.02 44.09 1yx5 n GLY 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yx5 n ALA 7 N -3.00 4.25 -0.04 4.61 0.00 -1.26 -4.73 120.51 120.33 1yx5 n ALA 7 Ca 0.00 -3.46 -0.03 0.00 0.00 0.00 0.00 53.44 49.95 1yx5 n ALA 7 Cb 0.00 -0.49 -0.08 0.00 0.00 0.00 0.00 19.45 18.88 1yx5 n ALA 7 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1yx5 n SER 8 N -0.67 2.65 0.27 0.00 2.88 -1.26 -4.50 113.62 112.98 1yx5 n SER 8 Ca 0.32 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.97 1yx5 n SER 8 Cb 0.92 0.87 0.75 0.00 -0.75 0.00 0.00 64.21 65.99 1yx5 n SER 8 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1yx5 h ASP 9 N 0.00 0.00 -1.86 -3.46 5.19 -2.02 -3.41 116.42 110.85 1yx5 h ASP 9 Ca -0.21 0.00 0.10 0.00 -0.62 0.00 0.00 57.03 56.30 1yx5 h ASP 9 Cb 1.39 0.00 -0.22 0.00 0.18 0.00 0.00 39.33 40.68 1yx5 h ASP 9 CO 0.01 0.02 0.01 0.72 -3.12 0.00 0.00 179.24 176.88 1yx5 s PHE 10 N -4.81 -1.09 -0.25 4.55 -0.71 -1.26 -5.05 117.98 109.36 1yx5 s PHE 10 Ca -0.05 1.93 0.12 0.00 -1.04 0.00 0.00 56.93 57.89 1yx5 s PHE 10 Cb 0.16 0.66 0.34 0.00 -1.21 0.00 0.00 43.02 42.96 1yx5 s PHE 10 CO 0.62 -0.54 1.38 -1.91 -1.34 0.00 0.00 175.22 173.43 1yx5 n GLU 11 N 5.10 1.09 0.00 1.99 2.13 -1.26 -4.93 120.64 124.76 1yx5 n GLU 11 Ca -0.12 -1.43 0.00 0.00 0.66 0.00 0.00 57.16 56.27 1yx5 n GLU 11 Cb 0.51 0.22 0.00 0.00 0.27 0.00 0.00 31.44 32.45 1yx5 n GLU 11 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1yx5 n PHE 12 N -1.09 -0.66 -2.25 4.31 -0.00 -1.26 -4.97 117.46 111.54 1yx5 n PHE 12 Ca -0.17 0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 56.88 1yx5 n PHE 12 Cb 0.84 0.13 0.03 0.00 -0.00 0.00 0.00 39.48 40.48 1yx5 n PHE 12 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yx5 n GLY 13 N -1.21 5.78 1.90 7.13 0.00 -1.26 -4.53 105.19 113.00 1yx5 n GLY 13 Ca 0.00 -2.51 0.00 0.00 0.00 0.00 0.00 46.02 43.51 1yx5 n GLY 13 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1yx5 n VAL 14 N -0.24 0.08 -3.73 1.61 0.31 -1.26 -5.12 118.33 109.99 1yx5 n VAL 14 Ca 0.51 0.03 -0.10 0.00 -0.01 0.00 0.00 64.34 64.77 1yx5 n VAL 14 Cb 0.25 -0.43 -0.05 0.00 -0.91 0.00 0.00 33.84 32.70 1yx5 n VAL 14 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1yx5 s ASP 15 N -4.74 -0.16 0.52 4.52 1.11 -1.26 -5.03 116.67 111.64 1yx5 s ASP 15 Ca 0.00 -0.47 0.31 0.00 0.18 0.00 0.00 52.55 52.57 1yx5 s ASP 15 Cb 0.00 0.47 1.21 0.00 1.07 0.00 0.00 42.92 45.67 1yx5 s ASP 15 CO 0.00 -0.88 1.93 1.55 1.18 0.00 0.00 175.17 178.94 1yx5 h PRO 16 N 2.40 0.00 0.00 8.23 0.13 -1.92 -2.86 132.00 137.98 1yx5 h PRO 16 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1yx5 h PRO 16 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1yx5 h PRO 16 CO 0.46 0.05 0.00 0.77 -0.23 0.00 0.00 178.00 179.05 1yx5 h SER 17 N 0.00 0.00 -0.02 1.44 0.02 -2.00 -2.20 113.55 110.79 1yx5 h SER 17 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1yx5 h SER 17 Cb 0.59 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 1yx5 h SER 17 CO 0.01 0.00 0.02 0.00 -1.14 0.00 0.00 176.83 175.71 1yx5 h ALA 18 N 2.04 1.60 -0.98 3.77 0.00 -1.90 -3.41 119.26 120.38 1yx5 h ALA 18 Ca 0.00 -0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.07 1yx5 h ALA 18 Cb 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 17.68 1yx5 h ALA 18 CO 0.00 -0.03 0.09 -0.51 0.00 0.00 0.00 179.25 178.81 1yx5 s ASP 19 N -6.23 -0.73 0.23 0.00 1.01 -0.83 -5.00 116.67 105.12 1yx5 s ASP 19 Ca -0.05 0.79 0.23 0.00 0.71 0.00 0.00 52.55 54.23 1yx5 s ASP 19 Cb 0.15 1.75 0.94 0.00 1.01 0.00 0.00 42.92 46.77 1yx5 s ASP 19 CO 0.56 -0.14 1.70 -0.81 0.21 0.00 0.00 175.17 176.69 1yx5 n PRO 20 N 5.20 0.18 0.11 8.23 -0.04 -1.26 -2.41 135.00 145.01 1yx5 n PRO 20 Ca -0.08 0.38 -0.04 0.00 -0.04 0.00 0.00 63.50 63.73 1yx5 n PRO 20 Cb 0.52 -1.83 0.08 0.00 -0.04 0.00 0.00 33.50 32.24 1yx5 n PRO 20 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1yx5 h GLU 21 N 0.00 0.06 0.00 0.54 5.08 -1.94 -1.78 114.58 116.54 1yx5 h GLU 21 Ca 0.00 -0.06 -0.26 0.00 -1.00 0.00 0.00 59.36 58.04 1yx5 h GLU 21 Cb 0.39 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 1yx5 h GLU 21 CO 0.00 0.76 -1.42 -0.07 -1.00 0.00 0.00 179.01 177.27 1yx5 h LEU 22 N 0.04 0.00 -0.57 1.33 3.38 -1.84 -2.70 115.31 114.95 1yx5 h LEU 22 Ca -0.01 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 1yx5 h LEU 22 Cb 1.28 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 1yx5 h LEU 22 CO 0.10 1.00 -0.48 0.00 0.09 0.00 0.00 178.44 179.15 1yx5 h ALA 23 N 1.00 0.75 0.03 1.53 0.00 -1.44 -1.99 119.26 119.14 1yx5 h ALA 23 Ca -0.17 -0.48 -0.22 0.00 0.00 0.00 0.00 54.91 54.04 1yx5 h ALA 23 Cb 1.92 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 1yx5 h ALA 23 CO 0.10 0.67 -0.99 1.25 0.00 0.00 0.00 179.25 180.28 1yx5 h LEU 24 N 0.47 0.20 -0.91 0.00 7.12 -1.42 -2.65 115.31 118.11 1yx5 h LEU 24 Ca 0.02 -0.18 -0.11 0.00 0.13 0.00 0.00 57.88 57.74 1yx5 h LEU 24 Cb 1.01 -0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 41.06 1yx5 h LEU 24 CO 0.09 1.07 -0.45 0.00 -0.13 0.00 0.00 178.44 179.02 1yx5 h ALA 25 N 0.91 1.08 0.00 1.25 0.00 -1.36 -2.25 119.26 118.90 1yx5 h ALA 25 Ca -0.05 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1yx5 h ALA 25 Cb 1.68 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1yx5 h ALA 25 CO 0.15 0.61 -0.39 1.25 0.00 0.00 0.00 179.25 180.87 1yx5 h LEU 26 N 0.17 0.00 0.00 0.00 5.85 -1.36 -2.77 115.31 117.20 1yx5 h LEU 26 Ca 0.01 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.57 1yx5 h LEU 26 Cb 0.86 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 1yx5 h LEU 26 CO 0.07 0.14 -0.85 -0.09 -0.34 0.00 0.00 178.44 177.37 1yx5 h ARG 27 N 0.00 0.00 0.00 1.25 2.43 -1.21 -2.81 114.38 114.04 1yx5 h ARG 27 Ca -0.01 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.00 1yx5 h ARG 27 Cb 1.12 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.64 1yx5 h ARG 27 CO 0.02 0.68 -1.06 0.28 -1.51 0.00 0.00 179.97 178.37 1yx5 h VAL 28 N 0.00 0.79 0.04 0.20 2.07 -1.44 -2.84 116.25 115.07 1yx5 h VAL 28 Ca -0.04 -2.29 -0.13 0.00 0.82 0.00 0.00 66.70 65.06 1yx5 h VAL 28 Cb 1.59 2.29 0.01 0.00 -1.52 0.00 0.00 31.29 33.67 1yx5 h VAL 28 CO 0.09 0.45 -0.54 -1.28 0.02 0.00 0.00 177.57 176.32 1yx5 h SER 29 N 0.00 0.41 0.12 0.57 0.87 -1.53 -2.36 113.55 111.63 1yx5 h SER 29 Ca -0.10 -0.83 -0.15 0.00 -1.23 0.00 0.00 61.79 59.48 1yx5 h SER 29 Cb 1.57 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 63.39 1yx5 h SER 29 CO 0.07 1.19 -0.56 0.24 -0.53 0.00 0.00 176.83 177.24 1yx5 h MET 30 N -0.32 0.46 -0.16 2.24 2.07 -1.64 -1.90 114.93 115.68 1yx5 h MET 30 Ca -0.08 -0.29 -0.14 0.00 -2.07 0.00 0.00 59.70 57.12 1yx5 h MET 30 Cb 1.31 0.03 -0.01 0.00 -1.87 0.00 0.00 31.60 31.06 1yx5 h MET 30 CO 0.10 0.89 -0.48 1.49 1.07 0.00 0.00 176.91 179.99 1yx5 h GLU 31 N 0.35 0.43 -0.06 1.72 4.81 -1.59 -1.94 114.58 118.31 1yx5 h GLU 31 Ca 0.00 -0.24 -0.11 0.00 -0.13 0.00 0.00 59.36 58.89 1yx5 h GLU 31 Cb 1.08 0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.48 1yx5 h GLU 31 CO 0.10 0.82 -0.38 0.93 -0.73 0.00 0.00 179.01 179.75 1yx5 h GLU 32 N 0.34 0.36 -0.22 1.92 4.39 -1.32 -1.88 114.58 118.17 1yx5 h GLU 32 Ca 0.02 -0.31 -0.01 0.00 0.34 0.00 0.00 59.36 59.40 1yx5 h GLU 32 Cb 0.97 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.68 1yx5 h GLU 32 CO 0.08 0.96 0.11 1.96 -1.16 0.00 0.00 179.01 180.97 1yx5 h GLN 33 N -0.14 0.31 -0.74 2.33 1.08 -1.35 -2.74 115.11 113.86 1yx5 h GLN 33 Ca -0.03 -0.04 -0.05 0.00 -1.45 0.00 0.00 58.65 57.08 1yx5 h GLN 33 Cb 1.05 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 28.39 1yx5 h GLN 33 CO 0.08 0.30 0.28 -0.09 -0.95 0.00 0.00 178.83 178.45 1yx5 h ARG 34 N 0.23 1.12 -0.94 1.46 9.65 -1.43 0.12 114.38 124.60 1yx5 h ARG 34 Ca 0.08 -0.21 0.14 0.00 -1.10 0.00 0.00 59.98 58.88 1yx5 h ARG 34 Cb 0.09 -0.18 -0.09 0.00 -1.39 0.00 0.00 29.97 28.41 1yx5 h ARG 34 CO -0.01 0.93 0.56 0.37 2.80 0.00 0.00 179.97 184.61 1yx5 h GLN 35 N 1.08 0.81 0.07 0.20 4.15 -1.08 0.86 115.11 121.19 1yx5 h GLN 35 Ca 0.25 -0.05 -0.14 0.00 0.77 0.00 0.00 58.65 59.47 1yx5 h GLN 35 Cb 0.24 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.75 1yx5 h GLN 35 CO -0.02 0.53 -0.70 0.00 -1.93 0.00 0.00 178.83 176.72 1yx5 h ARG 36 N 0.83 0.14 0.00 1.69 3.08 -1.19 -2.84 114.38 116.10 1yx5 h ARG 36 Ca 0.49 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 60.30 1yx5 h ARG 36 Cb 0.58 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.72 1yx5 h ARG 36 CO -0.31 1.11 -0.01 1.96 -1.07 0.00 0.00 179.97 181.66 1yx5 h GLN 37 N -0.67 0.00 0.00 0.04 1.08 -0.42 -0.34 115.11 114.80 1yx5 h GLN 37 Ca -0.15 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.05 1yx5 h GLN 37 Cb 1.39 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.82 1yx5 h GLN 37 CO 0.03 0.01 -0.09 1.49 -0.95 0.00 0.00 178.83 179.32 1yx5 h GLU 38 N 0.00 0.00 -0.44 1.46 4.57 0.68 -0.96 114.58 119.89 1yx5 h GLU 38 Ca -0.00 0.00 0.13 0.00 -1.18 0.00 0.00 59.36 58.31 1yx5 h GLU 38 Cb 0.19 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 1yx5 h GLU 38 CO 0.00 0.00 0.42 0.93 -1.18 0.00 0.00 179.01 179.19 1yx5 h GLU 39 N -0.41 0.00 0.01 1.92 5.08 -1.51 0.62 114.58 120.28 1yx5 h GLU 39 Ca 0.00 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.10 1yx5 h GLU 39 Cb 0.09 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 1yx5 h GLU 39 CO 0.00 0.00 -1.39 1.49 -1.00 0.00 0.00 179.01 178.11 1yx5 h GLU 40 N 0.00 0.02 0.00 2.33 4.81 -1.18 -2.85 114.58 117.72 1yx5 h GLU 40 Ca 0.21 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.32 1yx5 h GLU 40 Cb 1.06 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 1yx5 h GLU 40 CO -0.00 0.77 -0.72 0.00 -0.73 0.00 0.00 179.01 178.32 1yx5 h ALA 41 N 0.95 0.70 0.21 2.92 0.00 0.97 -2.84 119.26 122.17 1yx5 h ALA 41 Ca -0.16 -0.41 -0.34 0.00 0.00 0.00 0.00 54.91 54.00 1yx5 h ALA 41 Cb 1.91 0.04 0.02 0.00 0.00 0.00 0.00 17.79 19.76 1yx5 h ALA 41 CO 0.11 0.50 -1.57 0.00 0.00 0.00 0.00 179.25 178.29 1yx5 h ARG 42 N 0.00 0.45 -0.04 0.00 -0.00 -0.07 -2.83 114.38 111.88 1yx5 h ARG 42 Ca -0.04 -0.76 -0.18 0.00 -0.50 0.00 0.00 59.98 58.50 1yx5 h ARG 42 Cb 1.31 0.28 -0.01 0.00 0.00 0.00 0.00 29.97 31.56 1yx5 h ARG 42 CO 0.04 1.35 -0.76 -0.09 0.00 0.00 0.00 179.97 180.52 1yx5 h ARG 43 N 0.12 0.25 -0.12 0.04 2.43 -1.61 -1.01 114.38 114.48 1yx5 h ARG 43 Ca -0.28 -0.22 -0.18 0.00 -0.81 0.00 0.00 59.98 58.49 1yx5 h ARG 43 Cb 2.12 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 31.72 1yx5 h ARG 43 CO 0.23 0.89 -0.68 0.00 -1.51 0.00 0.00 179.97 178.90 1yx5 h ALA 44 N 1.04 0.60 0.02 2.80 0.00 -1.61 -2.30 119.26 119.81 1yx5 h ALA 44 Ca -0.03 -0.58 -0.22 0.00 0.00 0.00 0.00 54.91 54.09 1yx5 h ALA 44 Cb 1.33 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 1yx5 h ALA 44 CO 0.12 0.73 -1.03 0.00 0.00 0.00 0.00 179.25 179.07 1yx5 h ALA 45 N 0.91 0.32 -0.22 0.00 0.00 -1.48 -2.56 119.26 116.24 1yx5 h ALA 45 Ca -0.02 -0.91 -0.18 0.00 0.00 0.00 0.00 54.91 53.81 1yx5 h ALA 45 Cb 1.25 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1yx5 h ALA 45 CO 0.12 1.22 -0.57 0.00 0.00 0.00 0.00 179.25 180.01 1yx5 h ALA 46 N 0.95 0.57 0.02 0.00 0.00 -1.16 -2.18 119.26 117.47 1yx5 h ALA 46 Ca -0.02 -0.52 -0.22 0.00 0.00 0.00 0.00 54.91 54.14 1yx5 h ALA 46 Cb 1.79 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 1yx5 h ALA 46 CO 0.14 0.69 -0.95 0.00 0.00 0.00 0.00 179.25 179.12 1yx5 h ALA 47 N 0.83 0.40 -0.22 0.00 0.00 -1.48 -2.53 119.26 116.26 1yx5 h ALA 47 Ca 0.00 -0.75 -0.13 0.00 0.00 0.00 0.00 54.91 54.04 1yx5 h ALA 47 Cb 1.15 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1yx5 h ALA 47 CO 0.12 0.90 -0.41 0.77 0.00 0.00 0.00 179.25 180.63 1yx5 h SER 48 N 0.14 0.55 1.20 0.00 0.02 -1.43 -1.66 113.55 112.38 1yx5 h SER 48 Ca -0.07 -0.24 -0.12 0.00 -0.84 0.00 0.00 61.79 60.51 1yx5 h SER 48 Cb 1.60 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.97 1yx5 h SER 48 CO 0.15 0.90 -0.59 0.00 -1.14 0.00 0.00 176.83 176.15 1yx5 h ALA 49 N 1.13 0.68 -0.52 3.77 0.00 -1.41 -0.59 119.26 122.32 1yx5 h ALA 49 Ca 0.04 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1yx5 h ALA 49 Cb 0.90 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1yx5 h ALA 49 CO 0.08 0.74 0.02 0.00 0.00 0.00 0.00 179.25 180.08 1yx5 n ALA 50 N -2.28 3.77 0.00 0.00 0.00 -0.95 -2.89 120.51 118.15 1yx5 n ALA 50 Ca 0.01 -2.04 0.00 0.00 0.00 0.00 0.00 53.44 51.41 1yx5 n ALA 50 Cb 0.73 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 19.13 1yx5 n ALA 50 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1yx5 n GLU 51 N 0.34 0.00 -0.65 0.00 4.07 -0.64 -4.81 120.64 118.95 1yx5 n GLU 51 Ca 0.27 0.00 0.09 0.00 -0.06 0.00 0.00 57.16 57.46 1yx5 n GLU 51 Cb 1.16 -0.18 0.35 0.00 -0.06 0.00 0.00 31.44 32.70 1yx5 n GLU 51 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1yx5 n ALA 52 N -2.07 3.24 -0.42 4.31 0.00 -0.23 -4.54 120.51 120.80 1yx5 n ALA 52 Ca 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 53.44 51.69 1yx5 n ALA 52 Cb 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1yx5 n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yx5 n GLY 53 N 0.78 -0.03 2.68 0.00 0.00 -1.22 -4.91 105.19 102.48 1yx5 n GLY 53 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 1yx5 n GLY 53 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1yx5 n ILE 54 N -1.88 4.35 -4.40 -0.61 -6.64 -1.14 -4.91 119.36 104.13 1yx5 n ILE 54 Ca 0.00 -3.87 -0.19 0.00 -1.77 0.00 0.00 62.75 56.92 1yx5 n ILE 54 Cb 0.00 -2.38 -0.15 0.00 -1.44 0.00 0.00 39.64 35.67 1yx5 n ILE 54 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1yx5 s ALA 55 N 0.85 0.80 -0.33 -1.28 0.00 -1.26 -4.73 121.76 115.82 1yx5 s ALA 55 Ca 0.48 -0.41 -0.01 0.00 0.00 0.00 0.00 51.96 52.02 1yx5 s ALA 55 Cb 0.14 -0.21 0.13 0.00 0.00 0.00 0.00 23.12 23.18 1yx5 s ALA 55 CO -0.04 0.19 0.21 0.95 0.00 0.00 0.00 175.76 177.07 1yx5 s THR 56 N -0.22 -0.03 0.00 0.00 -4.23 -1.26 -5.09 115.64 104.81 1yx5 s THR 56 Ca 0.04 -1.22 0.00 0.00 -1.18 0.00 0.00 61.69 59.33 1yx5 s THR 56 Cb -0.04 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.80 1yx5 s THR 56 CO -0.00 -0.81 0.00 1.07 -0.54 0.00 0.00 174.62 174.33 1yx5 n THR 57 N 4.55 0.00 -3.17 3.99 5.66 -1.26 -5.08 114.28 118.97 1yx5 n THR 57 Ca 0.05 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.08 1yx5 n THR 57 Cb 0.40 -1.16 -0.01 0.00 -1.55 0.00 0.00 70.33 68.02 1yx5 n THR 57 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1yx5 s GLY 58 N -0.81 -1.22 -1.53 1.09 0.00 -1.26 -5.04 107.32 98.54 1yx5 s GLY 58 Ca 0.00 0.84 -0.10 0.00 0.00 0.00 0.00 44.72 45.46 1yx5 s GLY 58 CO 0.00 3.64 2.67 -1.30 0.00 0.00 0.00 173.10 178.12 1yx5 n THR 59 N 5.22 4.26 -2.73 0.90 -2.24 -1.26 -4.38 114.28 114.05 1yx5 n THR 59 Ca 0.06 -3.00 -0.05 0.00 -2.27 0.00 0.00 64.05 58.79 1yx5 n THR 59 Cb 0.54 -2.53 0.05 0.00 -2.10 0.00 0.00 70.33 66.29 1yx5 n THR 59 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1yx5 n GLU 60 N 3.90 1.38 -1.54 -0.78 0.28 -1.26 -5.05 120.64 117.57 1yx5 n GLU 60 Ca 0.69 -3.11 -0.30 0.00 -0.16 0.00 0.00 57.16 54.27 1yx5 n GLU 60 Cb 0.27 -1.19 -0.07 0.00 1.43 0.00 0.00 31.44 31.89 1yx5 n GLU 60 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1yx5 n ASP 61 N -0.39 1.68 -4.22 -1.84 2.03 -1.26 -4.70 116.55 107.84 1yx5 n ASP 61 Ca 0.06 -0.65 -0.11 0.00 0.52 0.00 0.00 54.79 54.61 1yx5 n ASP 61 Cb 0.82 -1.45 -0.07 0.00 -0.72 0.00 0.00 41.12 39.70 1yx5 n ASP 61 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1yx5 n SER 62 N 15.25 -0.11 0.17 1.67 3.41 -1.26 -4.63 113.62 128.11 1yx5 n SER 62 Ca 0.45 -1.94 0.06 0.00 -0.26 0.00 0.00 58.87 57.18 1yx5 n SER 62 Cb 0.42 -1.07 0.52 0.00 -0.26 0.00 0.00 64.21 63.82 1yx5 n SER 62 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1yx5 h ASP 63 N 10.19 0.15 0.82 4.04 1.82 -2.01 -1.26 116.42 130.17 1yx5 h ASP 63 Ca 0.02 -0.01 -0.17 0.00 -0.39 0.00 0.00 57.03 56.49 1yx5 h ASP 63 Cb 0.93 -0.04 -0.02 0.00 0.68 0.00 0.00 39.33 40.88 1yx5 h ASP 63 CO 1.06 0.18 -0.79 0.44 -1.61 0.00 0.00 179.24 178.53 1yx5 h ASP 64 N 0.16 0.00 -0.50 2.28 3.32 -1.99 -2.89 116.42 116.81 1yx5 h ASP 64 Ca 0.04 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1yx5 h ASP 64 Cb 0.12 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1yx5 h ASP 64 CO 0.00 0.79 0.26 0.00 -1.72 0.00 0.00 179.24 178.57 1yx5 h ALA 65 N 1.21 0.64 0.00 3.45 0.00 -1.60 0.43 119.26 123.39 1yx5 h ALA 65 Ca -0.01 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1yx5 h ALA 65 Cb 1.41 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1yx5 h ALA 65 CO 0.10 0.17 -0.20 -0.07 0.00 0.00 0.00 179.25 179.25 1yx5 h LEU 66 N 0.66 0.00 -0.00 0.00 4.07 -1.46 0.68 115.31 119.25 1yx5 h LEU 66 Ca 0.17 0.00 -0.26 0.00 0.08 0.00 0.00 57.88 57.87 1yx5 h LEU 66 Cb 0.07 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.83 1yx5 h LEU 66 CO -0.03 0.20 -1.02 0.25 -1.08 0.00 0.00 178.44 176.77 1yx5 h LEU 67 N 0.00 0.90 0.00 1.67 5.85 -0.93 -2.79 115.31 120.01 1yx5 h LEU 67 Ca -0.00 -0.74 -0.02 0.00 0.84 0.00 0.00 57.88 57.96 1yx5 h LEU 67 Cb 0.38 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 1yx5 h LEU 67 CO 0.03 1.52 -0.16 0.11 -0.34 0.00 0.00 178.44 179.60 1yx5 h LYS 68 N 0.38 0.00 -0.86 1.25 1.79 0.27 -2.89 116.57 116.52 1yx5 h LYS 68 Ca -0.13 0.00 0.14 0.00 -2.18 0.00 0.00 60.65 58.49 1yx5 h LYS 68 Cb 1.68 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 32.23 1yx5 h LYS 68 CO 0.20 0.47 0.45 1.98 -1.08 0.00 0.00 179.45 181.47 1yx5 h MET 69 N -1.00 0.62 -0.36 3.15 4.05 0.19 1.25 114.93 122.84 1yx5 h MET 69 Ca -0.03 -0.04 -0.09 0.00 -0.28 0.00 0.00 59.70 59.26 1yx5 h MET 69 Cb 0.55 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.19 1yx5 h MET 69 CO -0.02 0.41 -0.14 1.15 0.23 0.00 0.00 176.91 178.54 1yx5 h THR 70 N 0.64 1.28 0.00 -0.77 2.02 -1.63 -2.83 112.91 111.62 1yx5 h THR 70 Ca 0.46 -1.24 0.00 0.00 0.77 0.00 0.00 66.41 66.40 1yx5 h THR 70 Cb 0.64 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 1yx5 h THR 70 CO -0.36 0.41 -0.16 0.00 0.37 0.00 0.00 175.52 175.78 1yx5 n ILE 71 N -4.34 0.33 0.05 3.11 0.13 -0.62 -2.61 119.36 115.40 1yx5 n ILE 71 Ca -0.02 -0.18 -0.20 0.00 -1.10 0.00 0.00 62.75 61.26 1yx5 n ILE 71 Cb 0.38 -0.40 -0.10 0.00 -0.84 0.00 0.00 39.64 38.69 1yx5 n ILE 71 CO 0.00 0.00 0.00 0.28 2.80 0.00 0.00 176.55 179.63 1yx5 h SER 72 N 0.00 0.87 1.01 9.51 0.02 0.17 0.02 113.55 125.15 1yx5 h SER 72 Ca 0.00 -0.70 -0.17 0.00 -0.84 0.00 0.00 61.79 60.07 1yx5 h SER 72 Cb 0.65 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 1yx5 h SER 72 CO 0.00 1.51 -1.05 1.56 -1.14 0.00 0.00 176.83 177.71 1yx5 h GLN 73 N 0.37 0.00 0.12 3.45 4.20 -1.57 -2.82 115.11 118.86 1yx5 h GLN 73 Ca -0.13 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.36 1yx5 h GLN 73 Cb 1.70 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.49 1yx5 h GLN 73 CO 0.20 0.55 -1.08 0.37 -0.67 0.00 0.00 178.83 178.20 1yx5 h GLN 74 N 0.00 0.25 -0.35 1.46 4.15 -1.56 -3.36 115.11 115.71 1yx5 h GLN 74 Ca -0.09 -0.43 -0.15 0.00 0.77 0.00 0.00 58.65 58.75 1yx5 h GLN 74 Cb 1.62 0.16 -0.01 0.00 0.21 0.00 0.00 27.48 29.46 1yx5 h GLN 74 CO 0.08 1.21 -0.37 1.49 -1.93 0.00 0.00 178.83 179.30 1yx5 h GLU 75 N -0.39 0.82 -3.63 1.69 4.81 -1.13 -3.37 114.58 113.39 1yx5 h GLU 75 Ca -0.22 -0.42 -0.75 0.00 -0.13 0.00 0.00 59.36 57.84 1yx5 h GLU 75 Cb 1.66 0.01 -0.31 0.00 0.63 0.00 0.00 28.75 30.75 1yx5 h GLU 75 CO 0.09 1.06 -0.03 0.12 -0.73 0.00 0.00 179.01 179.51 1yx5 s PHE 76 N -4.37 3.73 0.00 0.92 5.36 -1.06 -4.64 117.98 117.92 1yx5 s PHE 76 Ca -0.10 -2.48 0.00 0.00 -0.96 0.00 0.00 56.93 53.39 1yx5 s PHE 76 Cb 0.12 -3.53 0.00 0.00 -0.34 0.00 0.00 43.02 39.26 1yx5 s PHE 76 CO 0.86 -0.90 0.00 0.41 -1.46 0.00 0.00 175.22 174.13 1yx5 n GLY 77 N 3.39 -1.29 0.17 13.12 0.00 -1.26 -4.66 105.19 114.66 1yx5 n GLY 77 Ca 0.14 0.32 -0.05 0.00 0.00 0.00 0.00 46.02 46.44 1yx5 n GLY 77 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1yx5 h ARG 78 N 0.00 0.22 -3.17 1.61 2.43 -1.85 -3.46 114.38 110.15 1yx5 h ARG 78 Ca 0.00 -0.15 -0.24 0.00 -0.81 0.00 0.00 59.98 58.78 1yx5 h ARG 78 Cb 0.00 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.54 1yx5 h ARG 78 CO 0.00 0.75 -0.28 2.41 -1.51 0.00 0.00 179.97 181.34 1yx5 n THR 79 N -3.87 -0.41 0.00 0.20 -1.04 -1.26 -3.47 114.28 104.43 1yx5 n THR 79 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1yx5 n THR 79 Cb 0.61 -1.55 0.00 0.00 -1.82 0.00 0.00 70.33 67.58 1yx5 n THR 79 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1yx5 n GLY 80 N -0.63 1.76 0.00 3.41 0.00 -1.26 -4.84 105.19 103.62 1yx5 n GLY 80 Ca -0.14 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1yx5 n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yx5 n LEU 81 N 0.00 0.00 -2.05 0.99 4.77 -1.23 -5.01 117.00 114.48 1yx5 n LEU 81 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.90 1yx5 n LEU 81 Cb 0.00 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 1yx5 n LEU 81 CO 0.00 0.00 1.30 -0.81 -1.33 0.00 0.00 177.39 176.55 1yx5 n PRO 82 N -0.15 1.47 -2.98 3.23 -0.04 -1.26 -4.84 135.00 130.43 1yx5 n PRO 82 Ca 0.00 -0.69 -0.43 0.00 -0.04 0.00 0.00 63.50 62.34 1yx5 n PRO 82 Cb 0.00 -1.80 -0.05 0.00 -0.04 0.00 0.00 33.50 31.61 1yx5 n PRO 82 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1yx5 s ASP 83 N 2.19 6.42 0.57 3.54 -1.08 -1.26 -4.90 116.67 122.16 1yx5 s ASP 83 Ca 0.46 -0.06 0.27 0.00 -0.52 0.00 0.00 52.55 52.69 1yx5 s ASP 83 Cb 0.22 -2.38 1.61 0.00 -1.46 0.00 0.00 42.92 40.91 1yx5 s ASP 83 CO 0.00 -0.88 2.14 -0.07 0.52 0.00 0.00 175.17 176.88 1yx5 h LEU 84 N 10.04 0.00 -0.88 -1.34 4.07 -1.96 0.10 115.31 125.35 1yx5 h LEU 84 Ca -0.25 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.71 1yx5 h LEU 84 Cb 1.09 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.83 1yx5 h LEU 84 CO 0.95 0.00 0.00 -0.24 -1.08 0.00 0.00 178.44 178.07 1yx5 n SER 85 N -3.99 0.61 -0.28 -0.43 2.88 -1.26 -2.04 113.62 109.11 1yx5 n SER 85 Ca 0.00 0.69 0.06 0.00 -1.33 0.00 0.00 58.87 58.29 1yx5 n SER 85 Cb 0.25 -0.80 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 1yx5 n SER 85 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1yx5 n SER 86 N -2.22 1.37 -1.08 -3.46 2.88 0.34 -5.00 113.62 106.46 1yx5 n SER 86 Ca 0.01 -1.19 0.00 0.00 -1.33 0.00 0.00 58.87 56.36 1yx5 n SER 86 Cb 0.17 0.43 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 1yx5 n SER 86 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1yx5 n MET 87 N -0.15 1.97 -1.50 -1.46 2.00 -0.87 -5.06 117.12 112.06 1yx5 n MET 87 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.75 1yx5 n MET 87 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.47 1yx5 n MET 87 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1yx5 n THR 88 N -0.43 0.00 0.09 2.03 -2.24 -1.26 -4.94 114.28 107.53 1yx5 n THR 88 Ca 0.00 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.74 1yx5 n THR 88 Cb 0.00 0.00 0.14 0.00 -2.10 0.00 0.00 70.33 68.37 1yx5 n THR 88 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1yx5 h GLU 89 N 0.00 0.21 0.16 -0.78 4.11 -1.97 0.57 114.58 116.88 1yx5 h GLU 89 Ca 0.00 -0.14 -0.33 0.00 0.07 0.00 0.00 59.36 58.96 1yx5 h GLU 89 Cb 0.00 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1yx5 h GLU 89 CO 0.00 0.73 -1.68 0.93 0.07 0.00 0.00 179.01 179.06 1yx5 h GLU 90 N 0.16 0.33 -0.43 1.06 5.08 -1.97 -1.50 114.58 117.30 1yx5 h GLU 90 Ca -0.00 -0.57 -0.06 0.00 -1.00 0.00 0.00 59.36 57.73 1yx5 h GLU 90 Cb 1.06 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.50 1yx5 h GLU 90 CO 0.09 1.22 0.03 1.49 -1.00 0.00 0.00 179.01 180.84 1yx5 h GLU 91 N 0.09 0.75 -0.26 2.33 4.57 -1.92 0.23 114.58 120.36 1yx5 h GLU 91 Ca -0.31 -0.22 -0.11 0.00 -1.18 0.00 0.00 59.36 57.54 1yx5 h GLU 91 Cb 2.07 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 30.57 1yx5 h GLU 91 CO 0.17 0.80 -0.30 1.96 -1.18 0.00 0.00 179.01 180.46 1yx5 h GLN 92 N 0.59 0.53 -0.59 1.92 4.20 -0.99 -2.43 115.11 118.34 1yx5 h GLN 92 Ca 0.13 -0.22 -0.05 0.00 0.06 0.00 0.00 58.65 58.56 1yx5 h GLN 92 Cb 0.45 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 1yx5 h GLN 92 CO 0.02 0.77 0.16 0.82 -0.67 0.00 0.00 178.83 179.93 1yx5 h ILE 93 N 0.46 1.24 -0.29 2.54 2.04 -0.63 -1.88 117.51 120.99 1yx5 h ILE 93 Ca 0.06 -0.84 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 1yx5 h ILE 93 Cb 0.75 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 1yx5 h ILE 93 CO 0.06 0.32 0.05 0.00 0.00 0.00 0.00 178.15 178.58 1yx5 h ALA 94 N 1.29 1.56 -0.00 1.87 0.00 -0.08 0.37 119.26 124.27 1yx5 h ALA 94 Ca 0.19 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.79 1yx5 h ALA 94 Cb 0.30 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1yx5 h ALA 94 CO -0.00 0.33 -0.83 -0.92 0.00 0.00 0.00 179.25 177.82 1yx5 h TYR 95 N 0.41 0.18 0.06 0.00 5.03 -1.14 0.33 116.97 121.83 1yx5 h TYR 95 Ca 0.10 -0.09 -0.26 0.00 2.58 0.00 0.00 58.73 61.06 1yx5 h TYR 95 Cb 0.19 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.43 1yx5 h TYR 95 CO 0.01 0.89 -1.27 0.00 -1.32 0.00 0.00 178.16 176.46 1yx5 h ALA 96 N 1.08 0.33 0.00 1.82 0.00 -0.62 -2.84 119.26 119.03 1yx5 h ALA 96 Ca -0.03 -1.03 -0.23 0.00 0.00 0.00 0.00 54.91 53.62 1yx5 h ALA 96 Cb 1.44 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.27 1yx5 h ALA 96 CO 0.12 1.21 -1.23 0.52 0.00 0.00 0.00 179.25 179.87 1yx5 h MET 97 N 0.03 0.00 -0.00 0.00 2.86 -0.32 -2.85 114.93 114.65 1yx5 h MET 97 Ca -0.13 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.34 1yx5 h MET 97 Cb 1.90 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.55 1yx5 h MET 97 CO 0.15 0.80 -0.79 0.37 1.06 0.00 0.00 176.91 178.50 1yx5 h GLN 98 N 0.00 0.08 0.13 1.72 5.75 -1.02 -2.84 115.11 118.93 1yx5 h GLN 98 Ca -0.10 -0.08 -0.29 0.00 -0.15 0.00 0.00 58.65 58.03 1yx5 h GLN 98 Cb 1.84 0.02 0.02 0.00 1.07 0.00 0.00 27.48 30.43 1yx5 h GLN 98 CO 0.11 0.83 -1.24 1.98 -2.65 0.00 0.00 178.83 177.85 1yx5 h MET 99 N 0.05 0.48 0.00 1.69 4.05 -1.58 0.51 114.93 120.13 1yx5 h MET 99 Ca -0.02 -0.69 -0.06 0.00 -0.28 0.00 0.00 59.70 58.66 1yx5 h MET 99 Cb 1.39 0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 32.42 1yx5 h MET 99 CO 0.11 1.30 -0.28 1.03 0.23 0.00 0.00 176.91 179.31 1yx5 h SER 100 N 0.19 0.00 0.00 1.39 0.87 -1.53 -1.24 113.55 113.23 1yx5 h SER 100 Ca -0.17 0.00 -0.37 0.00 -1.23 0.00 0.00 61.79 60.02 1yx5 h SER 100 Cb 1.93 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 63.82 1yx5 h SER 100 CO 0.22 0.28 -2.40 0.18 -0.53 0.00 0.00 176.83 174.58 1yx5 n LEU 101 N -3.97 0.46 -2.98 2.23 7.99 -1.07 -4.61 117.00 115.05 1yx5 n LEU 101 Ca -0.02 -0.02 -0.26 0.00 -0.01 0.00 0.00 56.01 55.71 1yx5 n LEU 101 Cb 0.35 0.28 -0.04 0.00 -0.11 0.00 0.00 43.42 43.90 1yx5 n LEU 101 CO 0.36 0.57 0.09 1.67 -1.51 0.00 0.00 177.39 178.57 1yx5 n GLN 102 N -2.83 2.89 -0.05 3.23 7.27 0.18 -4.86 117.38 123.22 1yx5 n GLN 102 Ca -0.35 -4.63 -0.05 0.00 0.07 0.00 0.00 57.00 52.04 1yx5 n GLN 102 Cb 1.13 -2.16 -0.02 0.00 2.41 0.00 0.00 30.24 31.61 1yx5 n GLN 102 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1yx5 n GLY 103 N -0.17 -0.46 2.60 1.69 0.00 -0.47 -4.57 105.19 103.81 1yx5 n GLY 103 Ca 0.30 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 1yx5 n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yx5 n ALA 104 N -3.63 -0.24 -0.03 4.61 0.00 -1.26 -4.87 120.51 115.09 1yx5 n ALA 104 Ca -0.08 -1.87 -0.00 0.00 0.00 0.00 0.00 53.44 51.49 1yx5 n ALA 104 Cb 0.28 -1.21 -0.00 0.00 0.00 0.00 0.00 19.45 18.52 1yx5 n ALA 104 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1yx5 h GLU 105 N 4.66 -0.00 0.00 0.00 3.07 -1.92 -3.45 114.58 116.93 1yx5 h GLU 105 Ca 0.04 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 1yx5 h GLU 105 Cb 1.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.93 1yx5 h GLU 105 CO 0.24 -0.00 -0.78 0.34 -1.40 0.00 0.00 179.01 177.40 1yx5 n PHE 106 N -3.82 0.00 0.00 4.33 7.35 -1.26 -5.06 117.46 119.00 1yx5 n PHE 106 Ca -0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1yx5 n PHE 106 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.84 1yx5 n PHE 106 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1yx5 n GLY 107 N 3.05 2.79 3.43 7.13 0.00 -1.26 -5.05 105.19 115.27 1yx5 n GLY 107 Ca 0.00 -0.34 -0.44 0.00 0.00 0.00 0.00 46.02 45.24 1yx5 n GLY 107 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yx5 s GLN 108 N 0.00 3.90 0.00 1.61 -1.52 -1.26 -4.41 119.66 117.98 1yx5 s GLN 108 Ca 0.00 -2.42 0.00 0.00 -1.95 0.00 0.00 55.36 50.99 1yx5 s GLN 108 Cb 0.00 -4.87 0.00 0.00 -0.22 0.00 0.00 33.01 27.92 1yx5 s GLN 108 CO 0.00 -1.64 0.00 0.00 -0.25 0.00 0.00 175.29 173.40 1yx5 n ALA 109 N 5.29 0.11 -1.31 6.09 0.00 -1.26 -4.95 120.51 124.48 1yx5 n ALA 109 Ca 0.28 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.55 1yx5 n ALA 109 Cb 0.45 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.08 1yx5 n ALA 109 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1yx5 n GLU 110 N -2.34 2.11 -4.35 0.00 4.07 -1.26 -4.96 120.64 113.91 1yx5 n GLU 110 Ca 0.00 -3.08 -0.23 0.00 -0.06 0.00 0.00 57.16 53.80 1yx5 n GLU 110 Cb 0.00 -2.06 -0.11 0.00 -0.06 0.00 0.00 31.44 29.21 1yx5 n GLU 110 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 1yx5 s SER 111 N -1.73 2.84 0.00 4.31 1.04 -1.26 -5.19 113.70 113.72 1yx5 s SER 111 Ca 0.53 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 56.09 1yx5 s SER 111 Cb 0.46 -0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.40 1yx5 s SER 111 CO 0.07 -0.01 0.00 0.00 0.98 0.00 0.00 173.24 174.28