#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 -3.81 -0.58 1.57 2.00 -1.26 -4.94 117.12 110.11 1yx5 n MET 2 Ca 0.00 -1.11 0.03 0.00 0.00 0.00 0.00 57.70 56.62 1yx5 n MET 2 Cb 0.00 -1.34 0.22 0.00 0.00 0.00 0.00 33.22 32.10 1yx5 n MET 2 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1yx5 n LEU 3 N 0.00 3.86 0.00 4.03 4.77 -1.26 -4.88 117.00 123.52 1yx5 n LEU 3 Ca 0.10 -3.38 0.00 0.00 -0.03 0.00 0.00 56.01 52.70 1yx5 n LEU 3 Cb 0.44 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1yx5 n LEU 3 CO 0.29 0.95 0.00 0.61 -1.33 0.00 0.00 177.39 177.91 1yx5 n GLY 4 N -0.88 0.84 1.43 -0.72 0.00 -1.26 -5.03 105.19 99.57 1yx5 n GLY 4 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1yx5 n GLY 4 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yx5 n LEU 5 N 0.00 0.41 0.00 0.99 4.77 -1.26 -5.16 117.00 116.75 1yx5 n LEU 5 Ca 0.00 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1yx5 n LEU 5 Cb 0.00 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1yx5 n LEU 5 CO 0.00 -0.70 0.00 0.61 -1.33 0.00 0.00 177.39 175.97 1yx5 n GLY 6 N 2.67 2.19 1.18 -0.72 0.00 -1.26 -5.05 105.19 104.20 1yx5 n GLY 6 Ca 0.00 -0.85 -0.02 0.00 0.00 0.00 0.00 46.02 45.15 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 3.78 -2.06 4.61 0.00 -1.26 -4.67 120.51 117.91 1yx5 n ALA 7 Ca 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 53.44 50.16 1yx5 n ALA 7 Cb 0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 19.45 19.03 1yx5 n ALA 7 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1yx5 n SER 8 N -0.79 0.06 -0.01 0.00 7.64 -1.26 -4.74 113.62 114.52 1yx5 n SER 8 Ca 0.23 -1.72 0.10 0.00 1.01 0.00 0.00 58.87 58.49 1yx5 n SER 8 Cb 0.82 -0.13 -0.14 0.00 -1.01 0.00 0.00 64.21 63.75 1yx5 n SER 8 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1yx5 n ASP 9 N 0.06 0.57 -2.63 6.43 8.00 -1.26 -4.71 116.55 123.00 1yx5 n ASP 9 Ca -0.01 -0.19 -0.05 0.00 0.71 0.00 0.00 54.79 55.26 1yx5 n ASP 9 Cb 0.69 1.72 0.11 0.00 -0.02 0.00 0.00 41.12 43.63 1yx5 n ASP 9 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1yx5 n PHE 10 N -2.04 -2.08 -1.07 1.24 -1.74 -1.26 -4.99 117.46 105.53 1yx5 n PHE 10 Ca -0.02 -1.68 -0.41 0.00 -0.56 0.00 0.00 57.45 54.78 1yx5 n PHE 10 Cb 0.47 1.52 -0.06 0.00 1.52 0.00 0.00 39.48 42.94 1yx5 n PHE 10 CO 0.00 0.00 0.00 -0.85 -0.56 0.00 0.00 176.76 175.35 1yx5 n GLU 11 N -0.94 1.47 -1.91 3.97 0.28 -1.26 -4.19 120.64 118.05 1yx5 n GLU 11 Ca -0.10 -1.75 -0.13 0.00 -0.16 0.00 0.00 57.16 55.01 1yx5 n GLU 11 Cb 0.83 -2.84 -0.03 0.00 1.43 0.00 0.00 31.44 30.83 1yx5 n GLU 11 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1yx5 n PHE 12 N 7.20 -0.89 -1.77 -1.84 3.72 -1.26 -4.79 117.46 117.82 1yx5 n PHE 12 Ca 0.48 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.76 1yx5 n PHE 12 Cb 0.37 -2.70 0.11 0.00 -0.94 0.00 0.00 39.48 36.33 1yx5 n PHE 12 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1yx5 n GLY 13 N -0.53 5.77 2.02 1.37 0.00 -1.26 -4.79 105.19 107.77 1yx5 n GLY 13 Ca -0.14 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 43.87 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 -0.91 0.00 -3.81 1.61 0.31 -1.26 -5.01 118.33 109.25 1yx5 n VAL 14 Ca 0.36 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.65 1yx5 n VAL 14 Cb 0.87 -0.21 0.02 0.00 -0.91 0.00 0.00 33.84 33.61 1yx5 n VAL 14 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1yx5 n ASP 15 N -3.01 -1.67 -4.40 4.52 9.92 -1.26 -4.97 116.55 115.68 1yx5 n ASP 15 Ca 0.00 -1.96 -0.21 0.00 -0.53 0.00 0.00 54.79 52.09 1yx5 n ASP 15 Cb 0.00 2.73 -0.11 0.00 -0.64 0.00 0.00 41.12 43.10 1yx5 n ASP 15 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 1yx5 n PRO 16 N -0.60 0.28 -2.92 -0.24 -0.04 -1.26 -2.73 135.00 127.48 1yx5 n PRO 16 Ca -0.03 -1.69 -0.11 0.00 -0.04 0.00 0.00 63.50 61.63 1yx5 n PRO 16 Cb 0.52 -3.69 0.04 0.00 -0.04 0.00 0.00 33.50 30.33 1yx5 n PRO 16 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1yx5 n SER 17 N 17.54 -3.24 -1.83 3.54 2.88 -1.26 -2.77 113.62 128.48 1yx5 n SER 17 Ca 0.43 -0.30 -0.04 0.00 -1.33 0.00 0.00 58.87 57.63 1yx5 n SER 17 Cb 0.46 -2.88 -0.01 0.00 -0.75 0.00 0.00 64.21 61.03 1yx5 n SER 17 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yx5 n ALA 18 N -3.26 -0.52 -3.22 -1.46 0.00 -1.11 -4.79 120.51 106.15 1yx5 n ALA 18 Ca -0.07 0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.46 1yx5 n ALA 18 Cb 0.56 -0.69 -0.02 0.00 0.00 0.00 0.00 19.45 19.30 1yx5 n ALA 18 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yx5 s ASP 19 N -1.68 -0.65 0.23 0.00 1.01 -1.12 -5.00 116.67 109.47 1yx5 s ASP 19 Ca 0.00 0.53 0.24 0.00 0.71 0.00 0.00 52.55 54.03 1yx5 s ASP 19 Cb 0.00 1.60 0.93 0.00 1.01 0.00 0.00 42.92 46.46 1yx5 s ASP 19 CO 0.00 -0.12 1.72 -0.81 0.21 0.00 0.00 175.17 176.16 1yx5 n PRO 20 N 5.33 0.20 0.06 8.23 -0.04 -1.26 -2.69 135.00 144.83 1yx5 n PRO 20 Ca -0.07 0.36 -0.13 0.00 -0.04 0.00 0.00 63.50 63.62 1yx5 n PRO 20 Cb 0.53 -1.83 -0.04 0.00 -0.04 0.00 0.00 33.50 32.11 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 0.43 0.00 0.54 5.08 -1.94 -2.11 114.58 116.57 1yx5 h GLU 21 Ca 0.00 -0.45 -0.19 0.00 -1.00 0.00 0.00 59.36 57.72 1yx5 h GLU 21 Cb 0.44 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 1yx5 h GLU 21 CO 0.00 1.11 -0.91 -0.07 -1.00 0.00 0.00 179.01 178.14 1yx5 h LEU 22 N 0.24 0.02 -0.58 1.33 3.38 -1.83 -1.72 115.31 116.16 1yx5 h LEU 22 Ca -0.08 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.73 1yx5 h LEU 22 Cb 1.57 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.30 1yx5 h LEU 22 CO 0.16 0.92 -0.45 0.00 0.09 0.00 0.00 178.44 179.16 1yx5 h ALA 23 N 1.08 0.75 0.00 1.53 0.00 -1.48 -2.68 119.26 118.46 1yx5 h ALA 23 Ca -0.01 -0.47 -0.19 0.00 0.00 0.00 0.00 54.91 54.24 1yx5 h ALA 23 Cb 1.61 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 1yx5 h ALA 23 CO 0.12 0.66 -0.88 1.25 0.00 0.00 0.00 179.25 180.41 1yx5 h LEU 24 N 0.50 0.04 -0.93 0.00 5.85 -1.36 -2.65 115.31 116.76 1yx5 h LEU 24 Ca 0.03 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1yx5 h LEU 24 Cb 0.98 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.97 1yx5 h LEU 24 CO 0.09 0.90 0.23 0.00 -0.34 0.00 0.00 178.44 179.31 1yx5 h ALA 25 N 1.10 1.14 0.00 1.25 0.00 -1.12 0.01 119.26 121.64 1yx5 h ALA 25 Ca -0.02 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1yx5 h ALA 25 Cb 1.55 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1yx5 h ALA 25 CO 0.12 0.60 -0.25 1.25 0.00 0.00 0.00 179.25 180.97 1yx5 h LEU 26 N 0.98 0.00 0.00 0.00 5.85 -1.47 -2.84 115.31 117.83 1yx5 h LEU 26 Ca 0.22 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.75 1yx5 h LEU 26 Cb 0.25 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 1yx5 h LEU 26 CO -0.01 0.21 -0.97 0.03 -0.34 0.00 0.00 178.44 177.36 1yx5 h ARG 27 N 0.00 0.00 0.00 1.25 2.47 -1.03 -2.85 114.38 114.22 1yx5 h ARG 27 Ca -0.00 0.00 -0.18 0.00 -1.26 0.00 0.00 59.98 58.54 1yx5 h ARG 27 Cb 1.17 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.46 1yx5 h ARG 27 CO 0.03 0.85 -0.86 0.28 0.56 0.00 0.00 179.97 180.83 1yx5 h VAL 28 N 0.00 1.49 -0.07 2.04 2.07 -1.01 -2.80 116.25 117.97 1yx5 h VAL 28 Ca -0.03 -3.07 -0.16 0.00 0.82 0.00 0.00 66.70 64.26 1yx5 h VAL 28 Cb 1.71 2.71 0.01 0.00 -1.52 0.00 0.00 31.29 34.20 1yx5 h VAL 28 CO 0.11 0.84 -0.58 0.77 0.02 0.00 0.00 177.57 178.74 1yx5 h SER 29 N 0.00 0.63 0.32 0.57 4.64 -1.53 -2.45 113.55 115.73 1yx5 h SER 29 Ca -0.01 -0.68 -0.10 0.00 -0.47 0.00 0.00 61.79 60.53 1yx5 h SER 29 Cb 1.65 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.54 1yx5 h SER 29 CO 0.11 1.21 -0.41 0.24 -0.87 0.00 0.00 176.83 177.12 1yx5 h MET 30 N 0.09 0.12 -0.05 4.77 2.07 -1.58 -2.57 114.93 117.78 1yx5 h MET 30 Ca -0.05 -0.05 -0.17 0.00 -2.07 0.00 0.00 59.70 57.35 1yx5 h MET 30 Cb 1.24 -0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.96 1yx5 h MET 30 CO 0.12 0.51 -0.72 0.93 1.07 0.00 0.00 176.91 178.82 1yx5 h GLU 31 N 0.10 0.28 -0.17 1.72 4.39 -1.50 -2.38 114.58 117.02 1yx5 h GLU 31 Ca 0.01 -0.23 -0.07 0.00 0.34 0.00 0.00 59.36 59.41 1yx5 h GLU 31 Cb 0.77 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.47 1yx5 h GLU 31 CO 0.06 0.88 -0.18 0.93 -1.16 0.00 0.00 179.01 179.54 1yx5 h GLU 32 N 0.19 0.43 -0.40 2.33 5.08 -1.21 -2.06 114.58 118.94 1yx5 h GLU 32 Ca -0.02 -0.23 -0.08 0.00 -1.00 0.00 0.00 59.36 58.03 1yx5 h GLU 32 Cb 1.28 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.52 1yx5 h GLU 32 CO 0.11 0.80 -0.07 1.96 -1.00 0.00 0.00 179.01 180.81 1yx5 h GLN 33 N 0.07 0.68 -0.37 2.33 1.08 -1.50 -2.73 115.11 114.67 1yx5 h GLN 33 Ca 0.03 -0.20 -0.08 0.00 -1.45 0.00 0.00 58.65 56.94 1yx5 h GLN 33 Cb 0.72 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.07 1yx5 h GLN 33 CO 0.04 0.75 -0.10 -0.09 -0.95 0.00 0.00 178.83 178.49 1yx5 h ARG 34 N 0.63 0.73 -0.83 1.46 9.65 -1.38 0.18 114.38 124.81 1yx5 h ARG 34 Ca 0.12 -0.28 0.03 0.00 -1.10 0.00 0.00 59.98 58.74 1yx5 h ARG 34 Cb 0.50 -0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 28.99 1yx5 h ARG 34 CO 0.03 0.88 0.54 1.96 2.80 0.00 0.00 179.97 186.17 1yx5 h GLN 35 N 0.53 1.03 0.15 0.20 4.20 -1.19 0.79 115.11 120.81 1yx5 h GLN 35 Ca 0.09 -0.06 -0.31 0.00 0.06 0.00 0.00 58.65 58.43 1yx5 h GLN 35 Cb 0.61 -0.23 0.03 0.00 0.30 0.00 0.00 27.48 28.19 1yx5 h GLN 35 CO 0.04 0.68 -1.31 0.00 -0.67 0.00 0.00 178.83 177.57 1yx5 h ARG 36 N 1.06 0.60 0.00 1.46 2.47 -1.38 -2.74 114.38 115.85 1yx5 h ARG 36 Ca 0.33 -0.85 -0.06 0.00 -1.26 0.00 0.00 59.98 58.13 1yx5 h ARG 36 Cb -0.02 0.29 -0.01 0.00 -1.65 0.00 0.00 29.97 28.58 1yx5 h ARG 36 CO -0.10 1.39 -0.29 1.96 0.56 0.00 0.00 179.97 183.50 1yx5 h GLN 37 N 0.25 0.00 0.07 0.04 4.20 -0.38 -2.85 115.11 116.44 1yx5 h GLN 37 Ca -0.20 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.50 1yx5 h GLN 37 Cb 1.98 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.76 1yx5 h GLN 37 CO 0.25 0.29 -0.03 1.49 -0.67 0.00 0.00 178.83 180.15 1yx5 h GLU 38 N 0.00 -0.09 -0.75 1.46 4.81 0.56 0.80 114.58 121.37 1yx5 h GLU 38 Ca -0.00 0.01 0.19 0.00 -0.13 0.00 0.00 59.36 59.42 1yx5 h GLU 38 Cb 0.90 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.26 1yx5 h GLU 38 CO 0.04 0.37 0.52 0.93 -0.73 0.00 0.00 179.01 180.13 1yx5 h GLU 39 N -0.96 0.19 0.08 1.92 5.08 -1.55 0.37 114.58 119.71 1yx5 h GLU 39 Ca -0.01 -0.01 -0.31 0.00 -1.00 0.00 0.00 59.36 58.03 1yx5 h GLU 39 Cb 0.50 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1yx5 h GLU 39 CO 0.02 0.13 -1.65 1.49 -1.00 0.00 0.00 179.01 177.99 1yx5 h GLU 40 N 0.20 0.16 0.06 2.33 4.81 -1.52 -2.87 114.58 117.75 1yx5 h GLU 40 Ca 0.37 -0.27 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1yx5 h GLU 40 Cb 1.15 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1yx5 h GLU 40 CO -0.07 0.94 -0.03 0.00 -0.73 0.00 0.00 179.01 179.12 1yx5 h ALA 41 N 0.59 -0.08 -0.35 2.92 0.00 0.28 -2.83 119.26 119.79 1yx5 h ALA 41 Ca -0.28 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 1yx5 h ALA 41 Cb 2.00 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.81 1yx5 h ALA 41 CO 0.12 -0.37 -0.17 0.00 0.00 0.00 0.00 179.25 178.83 1yx5 h ARG 42 N -0.44 0.65 -0.85 0.00 3.08 -0.55 -2.19 114.38 114.07 1yx5 h ARG 42 Ca -0.01 -0.23 0.07 0.00 0.07 0.00 0.00 59.98 59.89 1yx5 h ARG 42 Cb 0.39 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.34 1yx5 h ARG 42 CO 0.01 0.78 0.55 0.00 -1.07 0.00 0.00 179.97 180.25 1yx5 h ARG 43 N 0.58 0.89 0.00 0.04 3.08 -1.46 0.25 114.38 117.76 1yx5 h ARG 43 Ca 0.09 -0.05 -0.13 0.00 0.07 0.00 0.00 59.98 59.96 1yx5 h ARG 43 Cb 0.62 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 1yx5 h ARG 43 CO 0.04 0.59 -0.68 0.00 -1.07 0.00 0.00 179.97 178.85 1yx5 h ALA 44 N 1.55 0.61 0.00 0.04 0.00 -1.24 -2.67 119.26 117.55 1yx5 h ALA 44 Ca 0.37 -0.59 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 1yx5 h ALA 44 Cb 0.27 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1yx5 h ALA 44 CO -0.14 0.78 -0.71 0.00 0.00 0.00 0.00 179.25 179.18 1yx5 h ALA 45 N 1.39 0.75 0.17 0.00 0.00 -0.55 -2.73 119.26 118.29 1yx5 h ALA 45 Ca -0.02 -0.65 -0.33 0.00 0.00 0.00 0.00 54.91 53.91 1yx5 h ALA 45 Cb 1.48 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 19.17 1yx5 h ALA 45 CO 0.08 0.89 -1.63 0.00 0.00 0.00 0.00 179.25 178.59 1yx5 h ALA 46 N 1.29 0.16 -0.19 0.00 0.00 -1.04 -2.86 119.26 116.62 1yx5 h ALA 46 Ca -0.01 -1.10 -0.08 0.00 0.00 0.00 0.00 54.91 53.73 1yx5 h ALA 46 Cb 1.32 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 1yx5 h ALA 46 CO 0.09 1.03 -0.22 0.00 0.00 0.00 0.00 179.25 180.15 1yx5 h ALA 47 N 0.27 1.28 0.03 0.00 0.00 -1.53 -2.72 119.26 116.59 1yx5 h ALA 47 Ca -0.29 -0.30 -0.23 0.00 0.00 0.00 0.00 54.91 54.09 1yx5 h ALA 47 Cb 2.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.74 1yx5 h ALA 47 CO 0.18 0.48 -1.06 1.03 0.00 0.00 0.00 179.25 179.88 1yx5 h SER 48 N 0.30 0.11 -0.58 0.00 0.87 -1.59 -2.97 113.55 109.69 1yx5 h SER 48 Ca 0.05 -0.11 -0.06 0.00 -1.23 0.00 0.00 61.79 60.44 1yx5 h SER 48 Cb 0.57 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 1yx5 h SER 48 CO 0.04 1.09 0.13 0.00 -0.53 0.00 0.00 176.83 177.56 1yx5 h ALA 49 N 0.90 0.76 0.00 6.23 0.00 -1.25 -2.59 119.26 123.31 1yx5 h ALA 49 Ca -0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1yx5 h ALA 49 Cb 1.82 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.39 1yx5 h ALA 49 CO 0.15 0.48 -0.09 0.00 0.00 0.00 0.00 179.25 179.78 1yx5 h ALA 50 N 1.02 0.96 -0.20 0.00 0.00 -1.57 -3.04 119.26 116.44 1yx5 h ALA 50 Ca 0.18 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.06 1yx5 h ALA 50 Cb 0.37 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1yx5 h ALA 50 CO 0.00 0.12 0.28 1.49 0.00 0.00 0.00 179.25 181.14 1yx5 h GLU 51 N 0.00 0.00 0.00 0.00 4.81 -1.29 -1.20 114.58 116.90 1yx5 h GLU 51 Ca -0.00 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 1yx5 h GLU 51 Cb 0.88 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.24 1yx5 h GLU 51 CO 0.01 0.00 -1.62 0.00 -0.73 0.00 0.00 179.01 176.67 1yx5 n ALA 52 N -2.25 2.04 -0.09 2.92 0.00 -1.20 -4.58 120.51 117.36 1yx5 n ALA 52 Ca 0.02 -0.50 -0.13 0.00 0.00 0.00 0.00 53.44 52.83 1yx5 n ALA 52 Cb 0.40 -0.15 -0.05 0.00 0.00 0.00 0.00 19.45 19.65 1yx5 n ALA 52 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1yx5 h GLY 53 N 2.05 0.70 -7.15 0.00 0.00 -1.27 -3.36 103.07 94.05 1yx5 h GLY 53 Ca -0.16 -0.73 -0.73 0.00 0.00 0.00 0.00 47.33 45.72 1yx5 h GLY 53 CO 0.01 0.66 0.09 4.51 0.00 0.00 0.00 176.54 181.80 1yx5 n ILE 54 N -4.31 3.59 0.02 2.60 3.06 -0.52 -4.47 119.36 119.34 1yx5 n ILE 54 Ca -0.04 -5.32 0.00 0.00 -2.50 0.00 0.00 62.75 54.89 1yx5 n ILE 54 Cb 0.46 -2.33 0.00 0.00 0.54 0.00 0.00 39.64 38.31 1yx5 n ILE 54 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1yx5 n ALA 55 N 2.01 0.00 -2.78 1.51 0.00 -1.26 -4.88 120.51 115.10 1yx5 n ALA 55 Ca 0.24 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.57 1yx5 n ALA 55 Cb 0.37 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.84 1yx5 n ALA 55 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1yx5 n THR 56 N -2.49 0.73 0.07 0.00 -2.24 -1.26 -4.82 114.28 104.27 1yx5 n THR 56 Ca 0.00 -3.42 0.00 0.00 -2.27 0.00 0.00 64.05 58.36 1yx5 n THR 56 Cb 0.00 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 1yx5 n THR 56 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1yx5 n THR 57 N 0.02 0.92 -2.73 4.28 -2.24 -1.26 -4.97 114.28 108.30 1yx5 n THR 57 Ca 0.13 0.30 -0.01 0.00 -2.27 0.00 0.00 64.05 62.20 1yx5 n THR 57 Cb 0.78 -1.31 0.08 0.00 -2.10 0.00 0.00 70.33 67.78 1yx5 n THR 57 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yx5 n GLY 58 N 3.01 1.81 3.27 3.38 0.00 -1.26 -5.02 105.19 110.38 1yx5 n GLY 58 Ca 0.00 -0.66 -0.43 0.00 0.00 0.00 0.00 46.02 44.93 1yx5 n GLY 58 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1yx5 n THR 59 N -0.91 3.81 -1.85 2.61 -2.24 -1.26 -4.82 114.28 109.63 1yx5 n THR 59 Ca -0.04 -3.79 -0.35 0.00 -2.27 0.00 0.00 64.05 57.60 1yx5 n THR 59 Cb 0.84 -2.44 -0.02 0.00 -2.10 0.00 0.00 70.33 66.61 1yx5 n THR 59 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1yx5 n GLU 60 N 7.38 3.76 0.09 -0.78 1.02 -1.26 -4.59 120.64 126.25 1yx5 n GLU 60 Ca 0.49 -3.13 -0.07 0.00 -0.02 0.00 0.00 57.16 54.43 1yx5 n GLU 60 Cb 0.43 -2.42 0.03 0.00 -0.02 0.00 0.00 31.44 29.47 1yx5 n GLU 60 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1yx5 h ASP 61 N 3.89 0.22 -3.09 1.62 3.58 -2.05 -3.35 116.42 117.24 1yx5 h ASP 61 Ca 0.57 -0.16 -0.80 0.00 0.42 0.00 0.00 57.03 57.06 1yx5 h ASP 61 Cb 0.45 -0.07 -0.29 0.00 1.72 0.00 0.00 39.33 41.15 1yx5 h ASP 61 CO 1.22 0.92 0.63 -1.20 -2.88 0.00 0.00 179.24 177.93 1yx5 n SER 62 N -3.70 6.03 -0.05 2.28 7.64 -1.26 -4.80 113.62 119.75 1yx5 n SER 62 Ca -0.03 -3.30 -0.11 0.00 1.01 0.00 0.00 58.87 56.44 1yx5 n SER 62 Cb 0.75 -1.28 0.02 0.00 -1.01 0.00 0.00 64.21 62.69 1yx5 n SER 62 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1yx5 h ASP 63 N 5.76 0.80 0.84 6.43 3.58 -1.97 -2.81 116.42 129.05 1yx5 h ASP 63 Ca 0.19 -0.40 -0.14 0.00 0.42 0.00 0.00 57.03 57.10 1yx5 h ASP 63 Cb 0.69 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.50 1yx5 h ASP 63 CO 1.22 1.15 -0.67 0.44 -2.88 0.00 0.00 179.24 178.49 1yx5 h ASP 64 N 0.59 0.00 -0.52 2.28 5.19 -1.95 -2.87 116.42 119.13 1yx5 h ASP 64 Ca 0.03 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.42 1yx5 h ASP 64 Cb 1.04 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.53 1yx5 h ASP 64 CO 0.10 0.67 0.25 0.00 -3.12 0.00 0.00 179.24 177.14 1yx5 h ALA 65 N 1.33 0.67 0.00 3.45 0.00 -1.90 0.34 119.26 123.14 1yx5 h ALA 65 Ca -0.01 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1yx5 h ALA 65 Cb 1.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1yx5 h ALA 65 CO 0.09 0.24 -0.23 1.25 0.00 0.00 0.00 179.25 180.60 1yx5 h LEU 66 N 0.70 0.00 -0.01 0.00 5.85 -1.43 0.85 115.31 121.27 1yx5 h LEU 66 Ca 0.18 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.79 1yx5 h LEU 66 Cb 0.12 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.16 1yx5 h LEU 66 CO -0.02 0.23 -0.43 0.25 -0.34 0.00 0.00 178.44 178.12 1yx5 h LEU 67 N 0.00 0.39 0.00 2.25 6.46 -0.97 -2.84 115.31 120.59 1yx5 h LEU 67 Ca -0.00 -0.76 -0.00 0.00 -0.12 0.00 0.00 57.88 57.00 1yx5 h LEU 67 Cb 0.44 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1yx5 h LEU 67 CO 0.03 1.10 -0.00 0.11 -0.62 0.00 0.00 178.44 179.06 1yx5 h LYS 68 N -0.28 0.00 -0.98 1.25 1.57 -0.12 -2.90 116.57 115.11 1yx5 h LYS 68 Ca -0.05 0.00 0.17 0.00 -1.87 0.00 0.00 60.65 58.90 1yx5 h LYS 68 Cb 1.16 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 33.37 1yx5 h LYS 68 CO 0.09 0.65 0.59 1.98 -0.57 0.00 0.00 179.45 182.19 1yx5 h MET 69 N -1.00 0.76 -0.36 3.15 4.05 0.55 1.28 114.93 123.37 1yx5 h MET 69 Ca -0.00 -0.05 -0.14 0.00 -0.28 0.00 0.00 59.70 59.24 1yx5 h MET 69 Cb 0.65 -0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 31.27 1yx5 h MET 69 CO -0.00 0.51 -0.31 1.15 0.23 0.00 0.00 176.91 178.49 1yx5 h THR 70 N 0.79 1.28 0.00 -0.77 2.02 -1.62 -2.83 112.91 111.78 1yx5 h THR 70 Ca 0.55 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 66.26 1yx5 h THR 70 Cb 0.79 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 1yx5 h THR 70 CO -0.36 0.49 -0.29 0.00 0.37 0.00 0.00 175.52 175.73 1yx5 n ILE 71 N -4.16 0.06 0.11 3.11 0.13 -0.41 -2.62 119.36 115.57 1yx5 n ILE 71 Ca -0.02 -0.04 -0.18 0.00 -1.10 0.00 0.00 62.75 61.41 1yx5 n ILE 71 Cb 0.50 -0.12 -0.14 0.00 -0.84 0.00 0.00 39.64 39.03 1yx5 n ILE 71 CO 0.00 0.00 0.00 -1.28 2.80 0.00 0.00 176.55 178.07 1yx5 h SER 72 N 0.00 0.53 0.87 9.51 0.87 0.17 -0.74 113.55 124.76 1yx5 h SER 72 Ca 0.00 -0.58 -0.11 0.00 -1.23 0.00 0.00 61.79 59.87 1yx5 h SER 72 Cb 0.53 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 1yx5 h SER 72 CO 0.00 1.45 -1.20 1.56 -0.53 0.00 0.00 176.83 178.11 1yx5 h GLN 73 N 0.09 0.00 0.12 2.24 1.08 -1.59 -2.64 115.11 114.42 1yx5 h GLN 73 Ca -0.17 0.00 -0.36 0.00 -1.45 0.00 0.00 58.65 56.67 1yx5 h GLN 73 Cb 2.03 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 29.44 1yx5 h GLN 73 CO 0.22 0.21 -1.93 0.37 -0.95 0.00 0.00 178.83 176.75 1yx5 h GLN 74 N 0.00 0.26 0.07 1.46 5.75 -1.60 -2.90 115.11 118.16 1yx5 h GLN 74 Ca -0.10 -0.44 -0.27 0.00 -0.15 0.00 0.00 58.65 57.68 1yx5 h GLN 74 Cb 1.38 0.17 -0.02 0.00 1.07 0.00 0.00 27.48 30.08 1yx5 h GLN 74 CO 0.03 1.21 -1.36 1.49 -2.65 0.00 0.00 178.83 177.55 1yx5 h GLU 75 N -0.00 0.16 -1.21 1.69 4.22 -1.30 -3.36 114.58 114.77 1yx5 h GLU 75 Ca -0.41 -0.27 -0.58 0.00 0.08 0.00 0.00 59.36 58.18 1yx5 h GLU 75 Cb 1.99 0.10 -0.42 0.00 0.50 0.00 0.00 28.75 30.92 1yx5 h GLU 75 CO 0.08 1.03 -0.68 0.34 -2.18 0.00 0.00 179.01 177.59 1yx5 n PHE 76 N -3.39 3.13 0.00 0.92 7.35 -0.99 -4.73 117.46 119.75 1yx5 n PHE 76 Ca -0.11 -2.73 -0.01 0.00 -0.76 0.00 0.00 57.45 53.84 1yx5 n PHE 76 Cb 1.01 -0.25 -0.00 0.00 0.35 0.00 0.00 39.48 40.59 1yx5 n PHE 76 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1yx5 n GLY 77 N -0.59 -0.02 3.47 7.13 0.00 -1.09 -4.72 105.19 109.37 1yx5 n GLY 77 Ca 0.42 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 46.00 1yx5 n GLY 77 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yx5 s ARG 78 N -2.02 3.19 -0.02 1.61 3.00 -1.26 -4.79 118.95 118.65 1yx5 s ARG 78 Ca -0.02 -0.69 0.10 0.00 -1.00 0.00 0.00 55.73 54.12 1yx5 s ARG 78 Cb 0.01 -4.06 0.17 0.00 0.00 0.00 0.00 34.95 31.06 1yx5 s ARG 78 CO 0.02 -1.23 1.08 2.41 0.00 0.00 0.00 175.30 177.58 1yx5 n THR 79 N 5.76 0.03 -1.08 4.11 -1.04 -1.26 -4.93 114.28 115.87 1yx5 n THR 79 Ca -0.04 -0.43 -0.26 0.00 -2.04 0.00 0.00 64.05 61.27 1yx5 n THR 79 Cb 0.46 0.70 0.10 0.00 -1.82 0.00 0.00 70.33 69.77 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 0.09 4.89 3.61 3.41 0.00 -1.26 -4.87 105.19 111.04 1yx5 n GLY 80 Ca -0.16 -1.56 -0.14 0.00 0.00 0.00 0.00 46.02 44.16 1yx5 n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yx5 s LEU 81 N -3.07 -0.67 -0.06 0.99 1.02 -1.26 -5.03 118.68 110.59 1yx5 s LEU 81 Ca 0.52 1.17 -0.05 0.00 0.02 0.00 0.00 54.13 55.80 1yx5 s LEU 81 Cb 0.42 2.38 -0.19 0.00 0.02 0.00 0.00 46.19 48.82 1yx5 s LEU 81 CO 0.03 -0.32 2.79 -0.81 0.02 0.00 0.00 176.35 178.06 1yx5 n PRO 82 N 2.16 1.54 -1.58 1.29 -0.04 -1.26 -4.87 135.00 132.23 1yx5 n PRO 82 Ca -0.15 -0.79 -0.34 0.00 -0.04 0.00 0.00 63.50 62.19 1yx5 n PRO 82 Cb 0.56 -1.91 -0.03 0.00 -0.04 0.00 0.00 33.50 32.08 1yx5 n PRO 82 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1yx5 s ASP 83 N 2.30 4.40 -0.10 3.54 1.11 -1.26 -4.71 116.67 121.95 1yx5 s ASP 83 Ca 0.49 0.92 0.19 0.00 0.18 0.00 0.00 52.55 54.33 1yx5 s ASP 83 Cb 0.23 -2.51 -0.28 0.00 1.07 0.00 0.00 42.92 41.44 1yx5 s ASP 83 CO -0.00 -2.98 0.26 0.18 1.18 0.00 0.00 175.17 173.81 1yx5 n LEU 84 N 16.11 0.00 0.13 1.23 4.32 -1.26 -4.03 117.00 133.51 1yx5 n LEU 84 Ca 0.37 0.00 0.17 0.00 -0.02 0.00 0.00 56.01 56.53 1yx5 n LEU 84 Cb 0.53 0.22 0.74 0.00 -1.62 0.00 0.00 43.42 43.30 1yx5 n LEU 84 CO 0.69 0.22 1.15 0.28 -1.22 0.00 0.00 177.39 178.51 1yx5 h SER 85 N 0.00 0.00 0.47 -1.43 0.02 -2.01 -0.62 113.55 109.97 1yx5 h SER 85 Ca -0.24 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.66 1yx5 h SER 85 Cb 1.52 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.05 1yx5 h SER 85 CO 0.01 0.00 -1.57 -0.24 -1.14 0.00 0.00 176.83 173.89 1yx5 n SER 86 N -4.14 0.43 -4.67 3.07 2.88 -1.26 -4.88 113.62 105.05 1yx5 n SER 86 Ca 0.04 0.17 -0.42 0.00 -1.33 0.00 0.00 58.87 57.33 1yx5 n SER 86 Cb 0.40 1.11 -0.03 0.00 -0.75 0.00 0.00 64.21 64.95 1yx5 n SER 86 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1yx5 s MET 87 N -3.32 4.24 0.00 -1.46 1.00 -0.24 -5.01 119.30 114.51 1yx5 s MET 87 Ca -0.05 1.91 0.00 0.00 0.00 0.00 0.00 55.69 57.56 1yx5 s MET 87 Cb 0.11 -3.75 0.00 0.00 0.00 0.00 0.00 34.83 31.19 1yx5 s MET 87 CO 0.85 -0.69 0.00 0.25 0.00 0.00 0.00 175.02 175.43 1yx5 n THR 88 N 5.12 0.00 0.17 2.05 -2.24 -1.26 -4.31 114.28 113.81 1yx5 n THR 88 Ca 0.14 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.94 1yx5 n THR 88 Cb 0.44 -1.31 0.30 0.00 -2.10 0.00 0.00 70.33 67.66 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 0.00 0.17 -0.78 4.11 -1.97 0.24 114.58 116.35 1yx5 h GLU 89 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.09 1yx5 h GLU 89 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1yx5 h GLU 89 CO 0.00 0.45 -1.66 0.93 0.07 0.00 0.00 179.01 178.80 1yx5 h GLU 90 N 0.00 0.35 -0.37 1.06 3.07 -1.97 -1.03 114.58 115.69 1yx5 h GLU 90 Ca -0.00 -0.60 -0.06 0.00 -0.50 0.00 0.00 59.36 58.19 1yx5 h GLU 90 Cb 0.82 0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.94 1yx5 h GLU 90 CO 0.06 1.25 -0.02 0.93 -1.40 0.00 0.00 179.01 179.83 1yx5 h GLU 91 N 0.10 0.67 -0.32 2.33 4.39 -1.83 -0.06 114.58 119.85 1yx5 h GLU 91 Ca -0.30 -0.22 -0.09 0.00 0.34 0.00 0.00 59.36 59.08 1yx5 h GLU 91 Cb 2.08 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 30.66 1yx5 h GLU 91 CO 0.18 0.79 -0.18 1.96 -1.16 0.00 0.00 179.01 180.60 1yx5 h GLN 92 N 0.48 0.58 -0.55 2.33 4.20 -0.62 -1.96 115.11 119.56 1yx5 h GLN 92 Ca 0.10 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1yx5 h GLN 92 Cb 0.50 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.21 1yx5 h GLN 92 CO 0.02 0.73 0.32 0.82 -0.67 0.00 0.00 178.83 180.05 1yx5 h ILE 93 N 0.52 1.16 -0.66 2.54 2.04 -0.55 0.54 117.51 123.10 1yx5 h ILE 93 Ca 0.09 -0.38 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 1yx5 h ILE 93 Cb 0.60 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1yx5 h ILE 93 CO 0.04 0.17 0.17 0.00 0.00 0.00 0.00 178.15 178.53 1yx5 h ALA 94 N 1.59 1.05 -0.09 1.87 0.00 -0.24 0.39 119.26 123.83 1yx5 h ALA 94 Ca 0.20 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1yx5 h ALA 94 Cb -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1yx5 h ALA 94 CO -0.04 0.63 -0.38 -0.92 0.00 0.00 0.00 179.25 178.54 1yx5 h TYR 95 N 0.99 0.56 -0.37 0.00 5.03 -1.06 0.10 116.97 122.21 1yx5 h TYR 95 Ca 0.21 -0.24 -0.10 0.00 2.58 0.00 0.00 58.73 61.18 1yx5 h TYR 95 Cb 0.34 -0.09 -0.02 0.00 1.55 0.00 0.00 36.73 38.51 1yx5 h TYR 95 CO 0.02 0.99 -0.20 0.00 -1.32 0.00 0.00 178.16 177.65 1yx5 h ALA 96 N 0.46 0.96 0.00 1.82 0.00 -0.78 -2.65 119.26 119.06 1yx5 h ALA 96 Ca -0.02 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.44 1yx5 h ALA 96 Cb 1.03 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1yx5 h ALA 96 CO 0.08 0.61 -0.45 0.52 0.00 0.00 0.00 179.25 180.01 1yx5 h MET 97 N 0.63 0.00 -0.36 0.00 2.86 -0.25 -2.85 114.93 114.96 1yx5 h MET 97 Ca 0.09 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.68 1yx5 h MET 97 Cb 0.68 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 1yx5 h MET 97 CO 0.05 0.45 0.02 1.96 1.06 0.00 0.00 176.91 180.45 1yx5 h GLN 98 N 0.00 0.62 0.00 1.72 4.20 -0.45 -1.65 115.11 119.55 1yx5 h GLN 98 Ca -0.00 -0.19 -0.10 0.00 0.06 0.00 0.00 58.65 58.41 1yx5 h GLN 98 Cb 1.31 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.02 1yx5 h GLN 98 CO 0.06 0.72 -0.50 0.52 -0.67 0.00 0.00 178.83 178.96 1yx5 h MET 99 N 0.44 0.00 0.00 1.46 2.86 -1.55 -3.12 114.93 115.01 1yx5 h MET 99 Ca 0.10 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.62 1yx5 h MET 99 Cb 0.43 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 1yx5 h MET 99 CO 0.01 0.50 -0.61 1.03 1.06 0.00 0.00 176.91 178.90 1yx5 h SER 100 N 0.00 0.00 -0.22 1.22 0.87 -1.28 -2.86 113.55 111.28 1yx5 h SER 100 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1yx5 h SER 100 Cb 1.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 1yx5 h SER 100 CO 0.06 0.61 0.00 0.18 -0.53 0.00 0.00 176.83 177.16 1yx5 n LEU 101 N -3.67 1.47 0.01 2.23 4.32 -0.64 -4.02 117.00 116.69 1yx5 n LEU 101 Ca -0.01 -0.68 -0.05 0.00 -0.02 0.00 0.00 56.01 55.25 1yx5 n LEU 101 Cb 0.64 -0.14 0.16 0.00 -1.62 0.00 0.00 43.42 42.46 1yx5 n LEU 101 CO 0.42 0.34 0.68 1.56 -1.22 0.00 0.00 177.39 179.17 1yx5 h GLN 102 N 1.75 0.51 0.00 3.23 1.08 -1.52 -3.47 115.11 116.69 1yx5 h GLN 102 Ca 0.00 -0.22 0.00 0.00 -1.45 0.00 0.00 58.65 56.98 1yx5 h GLN 102 Cb 0.39 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.81 1yx5 h GLN 102 CO 0.00 0.76 0.00 0.41 -0.95 0.00 0.00 178.83 179.05 1yx5 n GLY 103 N -0.24 0.52 2.70 3.46 0.00 -1.26 -4.95 105.19 105.42 1yx5 n GLY 103 Ca -0.01 -0.88 -0.06 0.00 0.00 0.00 0.00 46.02 45.08 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 0.00 -2.37 0.05 4.61 0.00 -1.26 -5.00 120.51 116.55 1yx5 n ALA 104 Ca 0.00 -0.82 -0.20 0.00 0.00 0.00 0.00 53.44 52.42 1yx5 n ALA 104 Cb 0.15 -2.34 -0.14 0.00 0.00 0.00 0.00 19.45 17.12 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 3.00 0.31 0.00 0.00 5.08 -1.92 -3.35 114.58 117.69 1yx5 h GLU 105 Ca -0.21 -0.53 -0.02 0.00 -1.00 0.00 0.00 59.36 57.60 1yx5 h GLU 105 Cb 1.15 0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 1yx5 h GLU 105 CO 0.04 1.20 -0.87 0.35 -1.00 0.00 0.00 179.01 178.73 1yx5 h PHE 106 N 0.09 0.00 -0.66 4.33 3.57 -2.00 -3.44 116.94 118.83 1yx5 h PHE 106 Ca -0.34 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.05 1yx5 h PHE 106 Cb 2.06 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.81 1yx5 h PHE 106 CO 0.08 0.07 0.42 0.20 -2.23 0.00 0.00 178.31 176.85 1yx5 s GLY 107 N -4.39 -0.74 -0.54 2.40 0.00 -1.26 -4.78 107.32 98.01 1yx5 s GLY 107 Ca 0.01 -0.59 0.07 0.00 0.00 0.00 0.00 44.72 44.20 1yx5 s GLY 107 CO 0.77 4.22 0.74 -1.06 0.00 0.00 0.00 173.10 177.77 1yx5 n GLN 108 N 8.87 2.11 -3.36 2.90 1.13 -1.26 -5.02 117.38 122.75 1yx5 n GLN 108 Ca 0.44 -4.25 0.02 0.00 -1.94 0.00 0.00 57.00 51.27 1yx5 n GLN 108 Cb 0.46 -1.96 -0.03 0.00 0.11 0.00 0.00 30.24 28.82 1yx5 n GLN 108 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1yx5 s ALA 109 N -2.39 -2.51 -0.43 -1.58 0.00 -1.26 -5.11 121.76 108.47 1yx5 s ALA 109 Ca 0.41 1.98 0.02 0.00 0.00 0.00 0.00 51.96 54.37 1yx5 s ALA 109 Cb 0.20 -2.08 0.13 0.00 0.00 0.00 0.00 23.12 21.37 1yx5 s ALA 109 CO -0.07 -1.14 0.21 -1.21 0.00 0.00 0.00 175.76 173.56 1yx5 s GLU 110 N 2.78 1.32 0.21 0.00 8.01 -1.26 -5.10 118.70 124.66 1yx5 s GLU 110 Ca 0.04 -1.96 0.02 0.00 0.01 0.00 0.00 54.97 53.07 1yx5 s GLU 110 Cb -0.11 -2.48 -0.01 0.00 -4.31 0.00 0.00 34.13 27.22 1yx5 s GLU 110 CO -0.18 -1.12 0.08 -1.13 0.01 0.00 0.00 175.26 172.92 1yx5 n SER 111 N 3.69 1.06 -0.86 -0.19 3.41 -1.26 -5.36 113.62 114.11 1yx5 n SER 111 Ca 0.06 -2.11 0.12 0.00 -0.26 0.00 0.00 58.87 56.69 1yx5 n SER 111 Cb 0.35 0.53 0.19 0.00 -0.26 0.00 0.00 64.21 65.02 1yx5 n SER 111 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88