#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yx4 s MET 2 N 0.00 1.92 -0.24 -0.41 1.00 -1.26 -5.02 119.30 115.29 1yx4 s MET 2 Ca 0.00 -1.43 0.13 0.00 0.00 0.00 0.00 55.69 54.39 1yx4 s MET 2 Cb 0.00 -2.48 0.51 0.00 0.00 0.00 0.00 34.83 32.86 1yx4 s MET 2 CO 0.00 -1.22 1.45 1.28 0.00 0.00 0.00 175.02 176.53 1yx4 n LEU 3 N -2.58 4.05 -3.59 -0.03 4.77 -1.26 -4.79 117.00 113.56 1yx4 n LEU 3 Ca 0.16 -3.41 -0.41 0.00 -0.03 0.00 0.00 56.01 52.32 1yx4 n LEU 3 Cb 0.61 -0.60 -0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1yx4 n LEU 3 CO 0.41 0.97 2.19 0.61 -1.33 0.00 0.00 177.39 180.24 1yx4 n GLY 4 N -0.87 5.19 1.71 -0.72 0.00 -1.26 -4.32 105.19 104.92 1yx4 n GLY 4 Ca 0.28 -2.13 -0.02 0.00 0.00 0.00 0.00 46.02 44.16 1yx4 n GLY 4 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1yx4 n LEU 5 N 2.03 -0.16 -4.18 0.99 7.94 -1.26 -5.04 117.00 117.32 1yx4 n LEU 5 Ca 0.55 -2.37 -0.40 0.00 -1.11 0.00 0.00 56.01 52.68 1yx4 n LEU 5 Cb 0.28 0.08 -0.07 0.00 0.53 0.00 0.00 43.42 44.24 1yx4 n LEU 5 CO 0.71 1.19 0.19 -0.83 -1.11 0.00 0.00 177.39 177.53 1yx4 s GLY 6 N -1.70 2.58 -0.18 -3.96 0.00 -1.26 -4.88 107.32 97.91 1yx4 s GLY 6 Ca 0.15 -3.30 -0.19 0.00 0.00 0.00 0.00 44.72 41.38 1yx4 s GLY 6 CO -0.08 1.16 0.30 0.00 0.00 0.00 0.00 173.10 174.48 1yx4 h ALA 7 N 7.28 0.27 0.00 3.20 0.00 -1.96 -3.41 119.26 124.64 1yx4 h ALA 7 Ca 0.03 -1.19 -0.06 0.00 0.00 0.00 0.00 54.91 53.69 1yx4 h ALA 7 Cb 0.98 0.67 -0.01 0.00 0.00 0.00 0.00 17.79 19.44 1yx4 h ALA 7 CO 0.73 0.77 -1.53 -1.13 0.00 0.00 0.00 179.25 178.09 1yx4 n SER 8 N -4.25 2.65 0.15 0.00 3.41 -1.26 -4.51 113.62 109.81 1yx4 n SER 8 Ca -0.30 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 58.47 1yx4 n SER 8 Cb 0.75 1.23 0.73 0.00 -0.26 0.00 0.00 64.21 66.66 1yx4 n SER 8 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1yx4 h ASP 9 N 0.00 0.00 -2.77 4.04 5.19 -1.92 -3.37 116.42 117.59 1yx4 h ASP 9 Ca -0.09 0.00 -0.40 0.00 -0.62 0.00 0.00 57.03 55.92 1yx4 h ASP 9 Cb 0.84 0.00 -0.38 0.00 0.18 0.00 0.00 39.33 39.97 1yx4 h ASP 9 CO 0.00 0.00 -0.70 -0.36 -3.12 0.00 0.00 179.24 175.07 1yx4 s PHE 10 N -4.88 -0.02 -1.15 4.55 0.08 -1.26 -5.04 117.98 110.26 1yx4 s PHE 10 Ca -0.05 -0.13 -0.04 0.00 0.12 0.00 0.00 56.93 56.82 1yx4 s PHE 10 Cb 0.17 -0.56 0.16 0.00 -0.57 0.00 0.00 43.02 42.22 1yx4 s PHE 10 CO 0.64 -0.59 2.30 -1.91 -0.10 0.00 0.00 175.22 175.56 1yx4 n GLU 11 N 5.29 4.50 -2.25 0.44 2.13 -1.26 -4.71 120.64 124.79 1yx4 n GLU 11 Ca -0.06 -3.61 -0.13 0.00 0.66 0.00 0.00 57.16 54.02 1yx4 n GLU 11 Cb 0.49 -2.53 -0.01 0.00 0.27 0.00 0.00 31.44 29.65 1yx4 n GLU 11 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1yx4 n PHE 12 N 1.17 -1.22 -2.33 4.31 3.01 -1.26 -4.83 117.46 116.31 1yx4 n PHE 12 Ca 0.57 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.78 1yx4 n PHE 12 Cb 0.28 -2.76 0.01 0.00 -0.01 0.00 0.00 39.48 37.00 1yx4 n PHE 12 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1yx4 n GLY 13 N -0.71 6.07 0.07 1.37 0.00 -1.26 -4.70 105.19 106.02 1yx4 n GLY 13 Ca -0.15 -2.71 0.00 0.00 0.00 0.00 0.00 46.02 43.16 1yx4 n GLY 13 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1yx4 n VAL 14 N -0.55 0.00 -4.70 1.61 0.24 -1.26 -5.09 118.33 108.57 1yx4 n VAL 14 Ca 0.40 0.00 -0.25 0.00 -2.04 0.00 0.00 64.34 62.45 1yx4 n VAL 14 Cb 0.77 -0.03 -0.16 0.00 -1.47 0.00 0.00 33.84 32.95 1yx4 n VAL 14 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1yx4 s ASP 15 N -3.08 1.93 0.41 -1.34 -4.77 -1.26 -5.01 116.67 103.54 1yx4 s ASP 15 Ca 0.00 -0.32 0.22 0.00 -3.30 0.00 0.00 52.55 49.15 1yx4 s ASP 15 Cb 0.00 -0.65 0.82 0.00 -1.09 0.00 0.00 42.92 41.99 1yx4 s ASP 15 CO 0.00 0.10 1.79 1.55 0.70 0.00 0.00 175.17 179.31 1yx4 h PRO 16 N 6.51 0.00 0.00 2.11 0.13 -1.93 -2.87 132.00 135.95 1yx4 h PRO 16 Ca -0.32 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1yx4 h PRO 16 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1yx4 h PRO 16 CO 0.48 0.29 -0.01 0.77 -0.23 0.00 0.00 178.00 179.29 1yx4 h SER 17 N 0.00 0.00 0.29 1.44 0.02 -2.00 -1.11 113.55 112.19 1yx4 h SER 17 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1yx4 h SER 17 Cb 0.80 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.34 1yx4 h SER 17 CO 0.04 0.01 0.00 0.00 -1.14 0.00 0.00 176.83 175.74 1yx4 h ALA 18 N 1.99 1.00 -1.83 3.77 0.00 -1.91 -3.40 119.26 118.87 1yx4 h ALA 18 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1yx4 h ALA 18 Cb 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 17.63 1yx4 h ALA 18 CO 0.00 0.00 -0.26 0.16 0.00 0.00 0.00 179.25 179.15 1yx4 s ASP 19 N -4.56 -0.84 -0.00 0.00 1.47 -0.42 -5.04 116.67 107.28 1yx4 s ASP 19 Ca -0.01 1.09 -0.21 0.00 1.18 0.00 0.00 52.55 54.61 1yx4 s ASP 19 Cb 0.09 1.91 -0.22 0.00 -0.34 0.00 0.00 42.92 44.36 1yx4 s ASP 19 CO 0.33 -0.24 1.11 1.55 0.68 0.00 0.00 175.17 178.60 1yx4 h PRO 20 N 8.06 0.37 0.10 2.11 0.13 -1.78 -2.33 132.00 138.66 1yx4 h PRO 20 Ca -0.19 -0.37 -0.01 0.00 -0.87 0.00 0.00 66.00 64.57 1yx4 h PRO 20 Cb 1.12 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1yx4 h PRO 20 CO 0.17 1.04 -0.05 1.49 -0.23 0.00 0.00 178.00 180.42 1yx4 h GLU 21 N -0.16 -0.13 -0.03 0.86 4.81 -1.96 -2.42 114.58 115.54 1yx4 h GLU 21 Ca -0.06 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1yx4 h GLU 21 Cb 1.19 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.60 1yx4 h GLU 21 CO 0.10 -0.02 -0.14 -0.07 -0.73 0.00 0.00 179.01 178.15 1yx4 h LEU 22 N -0.22 0.04 0.39 1.64 3.38 -1.95 -2.14 115.31 116.44 1yx4 h LEU 22 Ca -0.01 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1yx4 h LEU 22 Cb 0.18 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1yx4 h LEU 22 CO 0.02 0.19 -0.19 0.00 0.09 0.00 0.00 178.44 178.55 1yx4 h ALA 23 N 1.82 -0.52 -0.60 1.53 0.00 -0.95 -0.55 119.26 119.99 1yx4 h ALA 23 Ca 0.01 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1yx4 h ALA 23 Cb 0.28 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1yx4 h ALA 23 CO 0.02 -0.74 0.19 -0.07 0.00 0.00 0.00 179.25 178.65 1yx4 h LEU 24 N -0.62 0.83 -1.29 0.00 -0.00 -1.29 -2.17 115.31 110.77 1yx4 h LEU 24 Ca -0.05 -0.13 -0.05 0.00 -0.00 0.00 0.00 57.88 57.64 1yx4 h LEU 24 Cb 0.45 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.88 1yx4 h LEU 24 CO 0.09 0.78 -0.07 0.00 -0.00 0.00 0.00 178.44 179.24 1yx4 h ALA 25 N 1.33 1.42 0.00 1.53 0.00 -1.19 -0.22 119.26 122.13 1yx4 h ALA 25 Ca 0.20 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1yx4 h ALA 25 Cb 0.25 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1yx4 h ALA 25 CO -0.01 0.40 -0.37 1.25 0.00 0.00 0.00 179.25 180.53 1yx4 h LEU 26 N 0.38 0.00 0.02 0.00 7.12 -0.48 -1.34 115.31 121.00 1yx4 h LEU 26 Ca 0.08 0.00 -0.26 0.00 0.13 0.00 0.00 57.88 57.82 1yx4 h LEU 26 Cb 0.36 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.46 1yx4 h LEU 26 CO 0.02 0.37 -1.41 -0.09 -0.13 0.00 0.00 178.44 177.19 1yx4 h ARG 27 N 0.00 0.05 0.00 1.25 2.43 -0.89 -2.86 114.38 114.36 1yx4 h ARG 27 Ca -0.00 -0.08 -0.18 0.00 -0.81 0.00 0.00 59.98 58.90 1yx4 h ARG 27 Cb 1.04 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.59 1yx4 h ARG 27 CO 0.05 0.81 -0.88 0.28 -1.51 0.00 0.00 179.97 178.72 1yx4 h VAL 28 N 0.01 1.38 0.04 0.20 2.07 -1.02 -2.84 116.25 116.10 1yx4 h VAL 28 Ca -0.18 -2.98 -0.11 0.00 0.82 0.00 0.00 66.70 64.26 1yx4 h VAL 28 Cb 1.92 2.68 0.01 0.00 -1.52 0.00 0.00 31.29 34.38 1yx4 h VAL 28 CO 0.11 0.79 -0.46 0.28 0.02 0.00 0.00 177.57 178.31 1yx4 h SER 29 N 0.00 0.33 -0.72 0.57 0.02 -1.34 -2.30 113.55 110.10 1yx4 h SER 29 Ca -0.02 -0.86 -0.05 0.00 -0.84 0.00 0.00 61.79 60.02 1yx4 h SER 29 Cb 1.65 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 64.06 1yx4 h SER 29 CO 0.11 1.16 0.26 0.24 -1.14 0.00 0.00 176.83 177.45 1yx4 h MET 30 N -0.46 1.09 -0.10 3.45 2.07 -1.62 -2.06 114.93 117.31 1yx4 h MET 30 Ca -0.07 -0.21 -0.11 0.00 -2.07 0.00 0.00 59.70 57.24 1yx4 h MET 30 Cb 1.26 -0.17 -0.01 0.00 -1.87 0.00 0.00 31.60 30.81 1yx4 h MET 30 CO 0.09 0.91 -0.43 1.49 1.07 0.00 0.00 176.91 180.04 1yx4 h GLU 31 N 1.04 0.23 0.07 1.72 4.22 -1.59 -2.53 114.58 117.74 1yx4 h GLU 31 Ca 0.24 -0.11 -0.00 0.00 0.08 0.00 0.00 59.36 59.56 1yx4 h GLU 31 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1yx4 h GLU 31 CO -0.01 0.62 -0.03 0.93 -2.18 0.00 0.00 179.01 178.34 1yx4 h GLU 32 N 0.19 -0.08 -0.55 1.92 4.39 -0.96 -2.67 114.58 116.81 1yx4 h GLU 32 Ca 0.01 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1yx4 h GLU 32 Cb 0.85 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.49 1yx4 h GLU 32 CO 0.07 0.25 0.35 1.96 -1.16 0.00 0.00 179.01 180.48 1yx4 h GLN 33 N -0.43 0.73 -0.36 2.33 4.20 -1.37 -2.39 115.11 117.82 1yx4 h GLN 33 Ca -0.01 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 1yx4 h GLN 33 Cb 0.38 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1yx4 h GLN 33 CO 0.01 0.50 0.22 -0.09 -0.67 0.00 0.00 178.83 178.80 1yx4 h ARG 34 N 0.75 0.49 -0.54 1.46 1.12 -1.33 -1.02 114.38 115.31 1yx4 h ARG 34 Ca 0.20 -0.04 0.02 0.00 -1.11 0.00 0.00 59.98 59.05 1yx4 h ARG 34 Cb -0.06 -0.10 -0.03 0.00 -0.01 0.00 0.00 29.97 29.77 1yx4 h ARG 34 CO -0.04 0.36 0.36 1.96 -3.11 0.00 0.00 179.97 179.50 1yx4 h GLN 35 N 0.47 0.65 -0.15 0.20 4.20 -1.09 0.26 115.11 119.65 1yx4 h GLN 35 Ca 0.13 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.73 1yx4 h GLN 35 Cb -0.00 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.63 1yx4 h GLN 35 CO -0.02 0.43 -0.19 0.00 -0.67 0.00 0.00 178.83 178.37 1yx4 h ARG 36 N 0.67 0.40 0.00 1.46 3.08 -1.14 0.11 114.38 118.96 1yx4 h ARG 36 Ca 0.21 -0.23 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 1yx4 h ARG 36 Cb 0.02 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1yx4 h ARG 36 CO -0.05 0.80 -0.18 0.37 -1.07 0.00 0.00 179.97 179.84 1yx4 h GLN 37 N 0.03 0.00 0.00 0.04 4.15 -0.69 -2.39 115.11 116.24 1yx4 h GLN 37 Ca 0.02 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.42 1yx4 h GLN 37 Cb 0.75 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.44 1yx4 h GLN 37 CO 0.05 0.18 -0.26 1.49 -1.93 0.00 0.00 178.83 178.36 1yx4 h GLU 38 N 0.00 0.00 -0.81 1.69 4.81 -0.37 0.30 114.58 120.20 1yx4 h GLU 38 Ca -0.00 0.00 0.20 0.00 -0.13 0.00 0.00 59.36 59.43 1yx4 h GLU 38 Cb 0.72 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.05 1yx4 h GLU 38 CO 0.02 0.27 0.56 0.93 -0.73 0.00 0.00 179.01 180.05 1yx4 h GLU 39 N -1.00 0.22 0.05 1.92 5.08 -0.86 0.33 114.58 120.33 1yx4 h GLU 39 Ca -0.03 -0.01 -0.28 0.00 -1.00 0.00 0.00 59.36 58.04 1yx4 h GLU 39 Cb 0.43 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1yx4 h GLU 39 CO -0.02 0.14 -1.43 1.49 -1.00 0.00 0.00 179.01 178.20 1yx4 h GLU 40 N 0.22 0.12 0.15 2.33 4.22 -1.54 -2.75 114.58 117.34 1yx4 h GLU 40 Ca 0.40 -0.20 -0.01 0.00 0.08 0.00 0.00 59.36 59.64 1yx4 h GLU 40 Cb 1.24 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1yx4 h GLU 40 CO -0.09 0.93 -0.07 0.00 -2.18 0.00 0.00 179.01 177.59 1yx4 h ALA 41 N 0.76 -0.21 -0.10 2.92 0.00 0.17 -2.83 119.26 119.98 1yx4 h ALA 41 Ca -0.19 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1yx4 h ALA 41 Cb 1.94 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.80 1yx4 h ALA 41 CO 0.13 -0.46 -0.27 0.07 0.00 0.00 0.00 179.25 178.72 1yx4 h ARG 42 N -0.52 0.18 -0.33 0.00 0.11 -0.77 -2.50 114.38 110.55 1yx4 h ARG 42 Ca -0.02 -0.06 0.06 0.00 0.10 0.00 0.00 59.98 60.06 1yx4 h ARG 42 Cb 0.40 -0.02 -0.06 0.00 1.11 0.00 0.00 29.97 31.41 1yx4 h ARG 42 CO 0.03 0.44 -0.02 -0.09 0.10 0.00 0.00 179.97 180.44 1yx4 h ARG 43 N 0.16 0.07 0.00 0.08 2.43 -1.34 0.25 114.38 116.03 1yx4 h ARG 43 Ca 0.03 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.16 1yx4 h ARG 43 Cb 0.56 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1yx4 h ARG 43 CO 0.04 0.05 -0.17 0.00 -1.51 0.00 0.00 179.97 178.38 1yx4 h ALA 44 N 1.30 1.10 -0.17 2.80 0.00 -1.27 0.31 119.26 123.33 1yx4 h ALA 44 Ca 0.16 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 1yx4 h ALA 44 Cb 0.22 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1yx4 h ALA 44 CO -0.28 0.21 -0.45 0.00 0.00 0.00 0.00 179.25 178.73 1yx4 h ALA 45 N 1.83 0.93 0.11 0.00 0.00 -0.15 -1.99 119.26 119.99 1yx4 h ALA 45 Ca -0.00 -0.45 -0.36 0.00 0.00 0.00 0.00 54.91 54.09 1yx4 h ALA 45 Cb 0.58 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1yx4 h ALA 45 CO 0.02 0.64 -2.02 0.00 0.00 0.00 0.00 179.25 177.89 1yx4 n ALA 46 N -2.49 0.96 0.08 0.00 0.00 -0.18 -2.38 120.51 116.50 1yx4 n ALA 46 Ca -0.02 -0.64 0.03 0.00 0.00 0.00 0.00 53.44 52.81 1yx4 n ALA 46 Cb 0.52 -0.64 0.40 0.00 0.00 0.00 0.00 19.45 19.73 1yx4 n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yx4 h ALA 47 N 0.12 1.57 0.03 0.00 0.00 -1.00 -1.83 119.26 118.14 1yx4 h ALA 47 Ca -0.43 -0.14 -0.30 0.00 0.00 0.00 0.00 54.91 54.04 1yx4 h ALA 47 Cb 2.03 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.67 1yx4 h ALA 47 CO 0.07 0.32 -1.71 1.03 0.00 0.00 0.00 179.25 178.96 1yx4 h SER 48 N 0.34 0.08 -0.68 0.00 0.87 -1.51 0.94 113.55 113.60 1yx4 h SER 48 Ca 0.08 -0.18 -0.07 0.00 -1.23 0.00 0.00 61.79 60.39 1yx4 h SER 48 Cb 0.22 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.13 1yx4 h SER 48 CO 0.00 1.16 0.15 0.00 -0.53 0.00 0.00 176.83 177.62 1yx4 h ALA 49 N 0.83 0.98 0.00 6.23 0.00 -1.20 -3.26 119.26 122.83 1yx4 h ALA 49 Ca -0.29 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.21 1yx4 h ALA 49 Cb 2.01 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.50 1yx4 h ALA 49 CO 0.09 0.66 -1.94 0.00 0.00 0.00 0.00 179.25 178.05 1yx4 n ALA 50 N -2.46 2.05 -3.13 0.00 0.00 -0.71 -5.04 120.51 111.22 1yx4 n ALA 50 Ca 0.05 -0.76 -0.19 0.00 0.00 0.00 0.00 53.44 52.54 1yx4 n ALA 50 Cb 0.26 -0.30 0.02 0.00 0.00 0.00 0.00 19.45 19.44 1yx4 n ALA 50 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1yx4 n GLU 51 N -2.37 -2.14 -2.13 0.00 1.02 0.33 -2.12 120.64 113.22 1yx4 n GLU 51 Ca -0.16 1.80 -0.13 0.00 -0.02 0.00 0.00 57.16 58.65 1yx4 n GLU 51 Cb 0.76 -4.29 -0.02 0.00 -0.02 0.00 0.00 31.44 27.87 1yx4 n GLU 51 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1yx4 n ALA 52 N -0.43 -0.60 -0.13 0.62 0.00 -1.25 -4.81 120.51 113.91 1yx4 n ALA 52 Ca 0.02 0.13 -0.26 0.00 0.00 0.00 0.00 53.44 53.34 1yx4 n ALA 52 Cb 0.55 -1.49 -0.09 0.00 0.00 0.00 0.00 19.45 18.42 1yx4 n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yx4 n GLY 53 N -0.65 -0.55 0.09 0.00 0.00 -0.90 -4.58 105.19 98.60 1yx4 n GLY 53 Ca -0.15 -0.11 0.06 0.00 0.00 0.00 0.00 46.02 45.83 1yx4 n GLY 53 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1yx4 n ILE 54 N -4.32 0.78 -3.36 -0.61 0.13 -1.26 -4.73 119.36 105.99 1yx4 n ILE 54 Ca -0.45 -0.61 -0.45 0.00 -1.10 0.00 0.00 62.75 60.14 1yx4 n ILE 54 Cb 0.80 -0.44 -0.07 0.00 -0.84 0.00 0.00 39.64 39.09 1yx4 n ILE 54 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1yx4 s ALA 55 N -3.19 3.59 0.58 1.51 0.00 -1.26 -5.06 121.76 117.93 1yx4 s ALA 55 Ca -0.03 -2.26 -0.20 0.00 0.00 0.00 0.00 51.96 49.47 1yx4 s ALA 55 Cb 0.10 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 20.04 1yx4 s ALA 55 CO 0.82 -1.83 1.31 0.95 0.00 0.00 0.00 175.76 177.01 1yx4 s THR 56 N 1.63 2.18 -0.22 0.00 -4.23 -1.26 -4.66 115.64 109.09 1yx4 s THR 56 Ca 0.04 0.13 0.20 0.00 -1.18 0.00 0.00 61.69 60.87 1yx4 s THR 56 Cb -0.26 -3.06 0.48 0.00 1.34 0.00 0.00 72.50 71.00 1yx4 s THR 56 CO 0.05 -0.01 1.14 0.41 -0.54 0.00 0.00 174.62 175.68 1yx4 n THR 57 N -1.32 1.36 -2.79 3.99 -1.04 -1.26 -4.89 114.28 108.32 1yx4 n THR 57 Ca 0.12 -2.87 -0.10 0.00 -2.04 0.00 0.00 64.05 59.16 1yx4 n THR 57 Cb 0.47 0.68 0.07 0.00 -1.82 0.00 0.00 70.33 69.73 1yx4 n THR 57 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1yx4 n GLY 58 N -0.47 0.92 2.48 3.41 0.00 -1.26 -5.01 105.19 105.26 1yx4 n GLY 58 Ca 0.15 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 1yx4 n GLY 58 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1yx4 n THR 59 N 0.53 4.41 -1.93 2.61 5.66 -1.26 -4.77 114.28 119.53 1yx4 n THR 59 Ca 0.09 -3.74 -0.37 0.00 -3.05 0.00 0.00 64.05 56.98 1yx4 n THR 59 Cb 0.68 -1.86 -0.01 0.00 -1.55 0.00 0.00 70.33 67.58 1yx4 n THR 59 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1yx4 n GLU 60 N 1.36 4.10 0.14 1.09 2.13 -1.26 -4.61 120.64 123.60 1yx4 n GLU 60 Ca 0.56 -3.31 -0.00 0.00 0.66 0.00 0.00 57.16 55.08 1yx4 n GLU 60 Cb 0.38 -2.49 0.17 0.00 0.27 0.00 0.00 31.44 29.77 1yx4 n GLU 60 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1yx4 h ASP 61 N 4.13 0.00 -2.48 4.31 5.19 -2.07 -3.34 116.42 122.16 1yx4 h ASP 61 Ca 0.61 0.00 -0.63 0.00 -0.62 0.00 0.00 57.03 56.39 1yx4 h ASP 61 Cb 0.40 0.00 -0.40 0.00 0.18 0.00 0.00 39.33 39.50 1yx4 h ASP 61 CO 1.30 0.60 -0.43 -1.20 -3.12 0.00 0.00 179.24 176.40 1yx4 n SER 62 N -3.65 3.93 0.26 6.45 7.64 -1.26 -4.88 113.62 122.10 1yx4 n SER 62 Ca -0.01 -3.39 0.10 0.00 1.01 0.00 0.00 58.87 56.58 1yx4 n SER 62 Cb 0.64 -0.77 0.69 0.00 -1.01 0.00 0.00 64.21 63.76 1yx4 n SER 62 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1yx4 h ASP 63 N 4.61 0.00 0.72 6.43 3.58 -1.96 -0.56 116.42 129.24 1yx4 h ASP 63 Ca 0.19 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.46 1yx4 h ASP 63 Cb 0.68 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.71 1yx4 h ASP 63 CO 0.87 0.00 -0.83 0.44 -2.88 0.00 0.00 179.24 176.84 1yx4 h ASP 64 N 0.00 0.09 -0.56 2.28 3.32 -1.95 -2.88 116.42 116.72 1yx4 h ASP 64 Ca 0.01 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1yx4 h ASP 64 Cb 0.03 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 1yx4 h ASP 64 CO -0.00 0.88 0.33 0.00 -1.72 0.00 0.00 179.24 178.73 1yx4 h ALA 65 N 1.11 0.71 -0.05 3.45 0.00 -1.50 0.48 119.26 123.47 1yx4 h ALA 65 Ca -0.02 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1yx4 h ALA 65 Cb 1.45 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1yx4 h ALA 65 CO 0.12 0.21 -0.15 -0.07 0.00 0.00 0.00 179.25 179.35 1yx4 h LEU 66 N 0.75 0.07 -0.13 0.00 3.38 -1.46 0.55 115.31 118.46 1yx4 h LEU 66 Ca 0.20 -0.01 -0.24 0.00 0.09 0.00 0.00 57.88 57.92 1yx4 h LEU 66 Cb 0.00 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.74 1yx4 h LEU 66 CO -0.04 0.23 -0.93 0.25 0.09 0.00 0.00 178.44 178.05 1yx4 h LEU 67 N 0.07 0.74 0.03 1.67 5.85 -0.87 -2.65 115.31 120.15 1yx4 h LEU 67 Ca 0.01 -0.56 -0.00 0.00 0.84 0.00 0.00 57.88 58.17 1yx4 h LEU 67 Cb 0.31 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1yx4 h LEU 67 CO 0.02 1.35 -0.01 0.50 -0.34 0.00 0.00 178.44 179.96 1yx4 h LYS 68 N 0.35 -0.04 -0.96 1.25 1.63 0.58 -2.89 116.57 116.50 1yx4 h LYS 68 Ca -0.09 0.00 0.20 0.00 -0.85 0.00 0.00 60.65 59.91 1yx4 h LYS 68 Cb 1.56 0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 33.12 1yx4 h LYS 68 CO 0.17 0.22 0.61 1.98 -3.45 0.00 0.00 179.45 178.99 1yx4 h MET 69 N -1.00 0.57 -0.28 1.90 4.05 -0.08 0.97 114.93 121.06 1yx4 h MET 69 Ca -0.00 -0.03 -0.08 0.00 -0.28 0.00 0.00 59.70 59.30 1yx4 h MET 69 Cb 0.28 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.95 1yx4 h MET 69 CO 0.01 0.37 -0.14 1.15 0.23 0.00 0.00 176.91 178.53 1yx4 h THR 70 N 0.58 1.30 0.00 -0.77 2.02 -1.58 -2.84 112.91 111.62 1yx4 h THR 70 Ca 0.52 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 66.47 1yx4 h THR 70 Cb 1.04 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.96 1yx4 h THR 70 CO -0.27 0.39 -0.16 -0.29 0.37 0.00 0.00 175.52 175.57 1yx4 h ILE 71 N 0.32 0.00 -0.20 3.11 6.09 -0.94 -2.85 117.51 123.04 1yx4 h ILE 71 Ca 0.06 -0.54 -0.16 0.00 -1.37 0.00 0.00 64.86 62.85 1yx4 h ILE 71 Cb 0.66 1.44 0.00 0.00 0.47 0.00 0.00 36.82 39.38 1yx4 h ILE 71 CO 0.04 0.00 -0.50 0.77 -3.07 0.00 0.00 178.15 175.39 1yx4 h SER 72 N 0.00 0.79 1.00 2.19 4.64 0.11 0.11 113.55 122.38 1yx4 h SER 72 Ca 0.00 -0.57 -0.20 0.00 -0.47 0.00 0.00 61.79 60.55 1yx4 h SER 72 Cb 0.77 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.60 1yx4 h SER 72 CO 0.00 1.22 -1.03 -0.61 -0.87 0.00 0.00 176.83 175.53 1yx4 h GLN 73 N 0.40 0.00 0.07 4.77 5.75 -1.57 -2.82 115.11 121.71 1yx4 h GLN 73 Ca -0.01 0.00 -0.24 0.00 -0.15 0.00 0.00 58.65 58.25 1yx4 h GLN 73 Cb 1.11 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.65 1yx4 h GLN 73 CO 0.11 0.85 -1.12 0.37 -2.65 0.00 0.00 178.83 176.39 1yx4 h GLN 74 N 0.00 0.17 -0.01 1.69 4.15 -1.51 -2.10 115.11 117.51 1yx4 h GLN 74 Ca -0.05 -0.28 -0.04 0.00 0.77 0.00 0.00 58.65 59.05 1yx4 h GLN 74 Cb 1.74 0.10 0.00 0.00 0.21 0.00 0.00 27.48 29.54 1yx4 h GLN 74 CO 0.11 1.12 -0.14 1.49 -1.93 0.00 0.00 178.83 179.48 1yx4 h GLU 75 N 0.05 0.11 -0.10 1.69 4.81 -0.85 -2.43 114.58 117.86 1yx4 h GLU 75 Ca -0.08 -0.11 -0.11 0.00 -0.13 0.00 0.00 59.36 58.93 1yx4 h GLU 75 Cb 1.85 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 31.24 1yx4 h GLU 75 CO 0.17 0.83 -0.42 0.35 -0.73 0.00 0.00 179.01 179.21 1yx4 h PHE 76 N -0.56 0.27 -0.02 0.92 3.57 -1.62 0.59 116.94 120.08 1yx4 h PHE 76 Ca -0.01 -0.07 -0.12 0.00 3.53 0.00 0.00 57.97 61.29 1yx4 h PHE 76 Cb 0.87 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.53 1yx4 h PHE 76 CO 0.17 0.62 -0.56 0.78 -2.23 0.00 0.00 178.31 177.09 1yx4 h GLY 77 N 1.23 0.08 0.29 2.40 0.00 -1.43 -3.30 103.07 102.34 1yx4 h GLY 77 Ca 0.02 -0.09 -0.34 0.00 0.00 0.00 0.00 47.33 46.91 1yx4 h GLY 77 CO 0.06 0.08 -1.94 -2.13 0.00 0.00 0.00 176.54 172.62 1yx4 n ARG 78 N -3.88 0.67 -2.07 4.80 0.63 -0.92 -4.94 116.66 110.95 1yx4 n ARG 78 Ca -0.02 0.33 -0.13 0.00 -0.92 0.00 0.00 57.85 57.12 1yx4 n ARG 78 Cb 0.57 -1.67 -0.02 0.00 0.45 0.00 0.00 32.46 31.79 1yx4 n ARG 78 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1yx4 n THR 79 N -3.78 -0.39 0.00 5.15 -1.04 0.20 -3.47 114.28 110.95 1yx4 n THR 79 Ca -0.37 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.64 1yx4 n THR 79 Cb 0.92 -1.60 0.00 0.00 -1.82 0.00 0.00 70.33 67.83 1yx4 n THR 79 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1yx4 n GLY 80 N -0.61 0.93 3.17 3.41 0.00 -1.26 -4.85 105.19 105.97 1yx4 n GLY 80 Ca -0.14 -0.74 0.05 0.00 0.00 0.00 0.00 46.02 45.19 1yx4 n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yx4 s LEU 81 N 0.00 -0.30 0.31 0.99 1.43 -1.23 -5.03 118.68 114.85 1yx4 s LEU 81 Ca 0.00 0.22 0.14 0.00 -1.03 0.00 0.00 54.13 53.47 1yx4 s LEU 81 Cb 0.00 1.27 0.43 0.00 0.03 0.00 0.00 46.19 47.92 1yx4 s LEU 81 CO 0.00 -0.06 1.63 1.55 0.23 0.00 0.00 176.35 179.70 1yx4 h PRO 82 N 7.86 0.00 -6.33 1.29 0.13 -1.89 -3.44 132.00 129.62 1yx4 h PRO 82 Ca -0.12 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.47 1yx4 h PRO 82 Cb 1.17 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.31 1yx4 h PRO 82 CO -0.11 0.53 1.23 0.34 -0.23 0.00 0.00 178.00 179.75 1yx4 s ASP 83 N -6.61 6.43 -0.12 1.44 2.15 -1.26 -4.87 116.67 113.82 1yx4 s ASP 83 Ca -0.00 2.60 -0.15 0.00 0.43 0.00 0.00 52.55 55.43 1yx4 s ASP 83 Cb 0.11 -2.53 -0.26 0.00 -0.30 0.00 0.00 42.92 39.95 1yx4 s ASP 83 CO 0.73 -1.08 0.46 -0.07 -0.17 0.00 0.00 175.17 175.04 1yx4 h LEU 84 N 10.77 0.32 -2.43 -1.34 4.07 -1.95 -3.34 115.31 121.41 1yx4 h LEU 84 Ca -0.48 -0.82 0.00 0.00 0.08 0.00 0.00 57.88 56.66 1yx4 h LEU 84 Cb 1.23 -0.11 -0.00 0.00 1.08 0.00 0.00 40.66 42.87 1yx4 h LEU 84 CO 0.94 1.64 0.02 0.77 -1.08 0.00 0.00 178.44 180.73 1yx4 h SER 85 N -0.34 0.00 -0.90 -0.43 4.64 -2.00 -2.09 113.55 112.43 1yx4 h SER 85 Ca -0.33 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.42 1yx4 h SER 85 Cb 1.74 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.60 1yx4 h SER 85 CO 0.02 0.00 0.72 -1.20 -0.87 0.00 0.00 176.83 175.50 1yx4 n SER 86 N -3.88 7.25 -3.73 4.97 7.64 -1.25 -4.88 113.62 119.73 1yx4 n SER 86 Ca -0.03 -3.53 -0.13 0.00 1.01 0.00 0.00 58.87 56.19 1yx4 n SER 86 Cb 0.10 -1.02 -0.10 0.00 -1.01 0.00 0.00 64.21 62.17 1yx4 n SER 86 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1yx4 s MET 87 N -3.10 0.43 1.32 1.43 1.00 -0.79 -5.00 119.30 114.60 1yx4 s MET 87 Ca 0.53 0.57 -0.19 0.00 0.00 0.00 0.00 55.69 56.60 1yx4 s MET 87 Cb 0.41 0.17 0.33 0.00 0.00 0.00 0.00 34.83 35.75 1yx4 s MET 87 CO -0.05 -0.07 0.98 0.95 0.00 0.00 0.00 175.02 176.83 1yx4 s THR 88 N 0.42 1.52 0.43 2.05 -4.23 -1.26 -4.60 115.64 109.96 1yx4 s THR 88 Ca -0.02 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 60.58 1yx4 s THR 88 Cb -0.04 -2.10 0.26 0.00 1.34 0.00 0.00 72.50 71.96 1yx4 s THR 88 CO -0.02 0.00 2.07 1.05 -0.54 0.00 0.00 174.62 177.18 1yx4 h GLU 89 N -3.09 0.45 0.11 3.99 4.11 -2.00 -2.23 114.58 115.92 1yx4 h GLU 89 Ca -0.50 -0.03 -0.28 0.00 0.07 0.00 0.00 59.36 58.62 1yx4 h GLU 89 Cb 1.34 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 1yx4 h GLU 89 CO 0.37 0.30 -1.32 0.93 0.07 0.00 0.00 179.01 179.36 1yx4 h GLU 90 N 0.46 0.24 0.51 1.06 3.07 -1.98 -2.89 114.58 115.06 1yx4 h GLU 90 Ca 0.12 -0.41 -0.01 0.00 -0.50 0.00 0.00 59.36 58.56 1yx4 h GLU 90 Cb -0.04 0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 28.00 1yx4 h GLU 90 CO -0.03 1.16 -0.46 0.93 -1.40 0.00 0.00 179.01 179.21 1yx4 h GLU 91 N 0.07 -0.93 -0.08 2.33 4.39 -1.72 0.40 114.58 119.03 1yx4 h GLU 91 Ca -0.16 0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.58 1yx4 h GLU 91 Cb 1.97 0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 30.83 1yx4 h GLU 91 CO 0.18 -0.62 -0.05 1.96 -1.16 0.00 0.00 179.01 179.33 1yx4 h GLN 92 N -0.97 0.12 -0.58 2.33 4.20 -1.63 -1.92 115.11 116.67 1yx4 h GLN 92 Ca -0.06 -0.02 -0.11 0.00 0.06 0.00 0.00 58.65 58.53 1yx4 h GLN 92 Cb 0.83 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.57 1yx4 h GLN 92 CO -0.03 0.18 -0.05 0.82 -0.67 0.00 0.00 178.83 179.07 1yx4 h ILE 93 N 0.12 1.27 -0.36 2.54 2.04 -1.07 -0.74 117.51 121.30 1yx4 h ILE 93 Ca 0.03 -1.21 -0.00 0.00 1.00 0.00 0.00 64.86 64.67 1yx4 h ILE 93 Cb 0.17 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1yx4 h ILE 93 CO 0.01 0.44 0.22 0.00 0.00 0.00 0.00 178.15 178.81 1yx4 h ALA 94 N 0.96 0.46 -0.61 1.87 0.00 0.57 0.34 119.26 122.84 1yx4 h ALA 94 Ca 0.16 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1yx4 h ALA 94 Cb 0.62 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1yx4 h ALA 94 CO 0.04 -0.05 0.02 -0.92 0.00 0.00 0.00 179.25 178.34 1yx4 h TYR 95 N 0.47 1.14 -0.42 0.00 3.20 -1.35 0.61 116.97 120.63 1yx4 h TYR 95 Ca 0.13 -0.19 -0.15 0.00 3.14 0.00 0.00 58.73 61.66 1yx4 h TYR 95 Cb -0.00 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 37.96 1yx4 h TYR 95 CO -0.04 1.00 -0.33 0.00 -1.64 0.00 0.00 178.16 177.15 1yx4 h ALA 96 N 1.04 0.60 0.00 1.82 0.00 -0.73 -2.82 119.26 119.17 1yx4 h ALA 96 Ca 0.18 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.49 1yx4 h ALA 96 Cb 0.53 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1yx4 h ALA 96 CO 0.03 0.67 -0.77 0.52 0.00 0.00 0.00 179.25 179.70 1yx4 h MET 97 N 0.79 0.00 -0.38 0.00 2.86 -0.17 -2.85 114.93 115.18 1yx4 h MET 97 Ca 0.08 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1yx4 h MET 97 Cb 0.92 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.56 1yx4 h MET 97 CO 0.09 0.77 0.06 0.37 1.06 0.00 0.00 176.91 179.25 1yx4 h GLN 98 N 0.00 0.57 0.00 1.72 4.15 0.35 0.10 115.11 122.00 1yx4 h GLN 98 Ca -0.01 -0.11 -0.20 0.00 0.77 0.00 0.00 58.65 59.11 1yx4 h GLN 98 Cb 1.56 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 29.13 1yx4 h GLN 98 CO 0.10 0.55 -1.05 0.52 -1.93 0.00 0.00 178.83 177.02 1yx4 h MET 99 N 0.55 0.00 -0.58 1.69 2.86 -1.50 -3.26 114.93 114.70 1yx4 h MET 99 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1yx4 h MET 99 Cb 0.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1yx4 h MET 99 CO 0.00 0.72 0.00 0.43 1.06 0.00 0.00 176.91 179.13 1yx4 n SER 100 N -3.22 3.18 0.06 1.22 7.64 -0.93 -4.14 113.62 117.43 1yx4 n SER 100 Ca -0.03 -2.08 -0.07 0.00 1.01 0.00 0.00 58.87 57.70 1yx4 n SER 100 Cb 0.90 -0.41 -0.11 0.00 -1.01 0.00 0.00 64.21 63.58 1yx4 n SER 100 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1yx4 h LEU 101 N 3.26 0.00 -6.56 -3.43 5.85 -0.85 -3.38 115.31 110.20 1yx4 h LEU 101 Ca 0.00 0.00 -0.68 0.00 0.84 0.00 0.00 57.88 58.04 1yx4 h LEU 101 Cb 0.85 0.00 -0.37 0.00 0.37 0.00 0.00 40.66 41.51 1yx4 h LEU 101 CO 0.04 0.97 -0.08 0.00 -0.34 0.00 0.00 178.44 179.03 1yx4 n GLN 102 N -3.30 3.19 -0.05 1.25 1.13 -1.26 -4.90 117.38 113.44 1yx4 n GLN 102 Ca -0.02 -4.62 0.00 0.00 -1.94 0.00 0.00 57.00 50.42 1yx4 n GLN 102 Cb 0.94 -2.36 0.00 0.00 0.11 0.00 0.00 30.24 28.93 1yx4 n GLN 102 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1yx4 n GLY 103 N 1.16 0.39 3.15 1.08 0.00 -1.26 -5.12 105.19 104.59 1yx4 n GLY 103 Ca 0.28 -0.91 0.05 0.00 0.00 0.00 0.00 46.02 45.43 1yx4 n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yx4 s ALA 104 N 0.00 -3.06 -0.36 4.61 0.00 -1.26 -4.70 121.76 116.99 1yx4 s ALA 104 Ca 0.00 1.36 0.21 0.00 0.00 0.00 0.00 51.96 53.53 1yx4 s ALA 104 Cb 0.00 -2.55 0.25 0.00 0.00 0.00 0.00 23.12 20.81 1yx4 s ALA 104 CO 0.00 -1.75 1.51 1.05 0.00 0.00 0.00 175.76 176.57 1yx4 h GLU 105 N 7.78 0.00 0.00 0.00 4.11 -2.00 -3.44 114.58 121.03 1yx4 h GLU 105 Ca -0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.33 1yx4 h GLU 105 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1yx4 h GLU 105 CO 0.05 0.10 0.00 0.34 0.07 0.00 0.00 179.01 179.57 1yx4 n PHE 106 N -3.08 -3.16 0.00 2.06 -0.00 -1.26 -5.18 117.46 106.84 1yx4 n PHE 106 Ca 0.03 0.76 0.00 0.00 -0.00 0.00 0.00 57.45 58.24 1yx4 n PHE 106 Cb 0.57 1.48 0.00 0.00 -0.00 0.00 0.00 39.48 41.54 1yx4 n PHE 106 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yx4 n GLY 107 N 0.76 2.51 2.70 7.13 0.00 -1.26 -4.84 105.19 112.19 1yx4 n GLY 107 Ca 0.00 -2.04 -0.39 0.00 0.00 0.00 0.00 46.02 43.59 1yx4 n GLY 107 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1yx4 n GLN 108 N -0.09 4.84 -3.70 1.61 7.27 -1.26 -4.88 117.38 121.16 1yx4 n GLN 108 Ca 0.00 -4.52 -0.30 0.00 0.07 0.00 0.00 57.00 52.25 1yx4 n GLN 108 Cb 0.00 -2.42 -0.15 0.00 2.41 0.00 0.00 30.24 30.09 1yx4 n GLN 108 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1yx4 s ALA 109 N -4.21 1.52 -0.27 1.69 0.00 -1.26 -4.96 121.76 114.27 1yx4 s ALA 109 Ca 0.42 -1.78 0.12 0.00 0.00 0.00 0.00 51.96 50.72 1yx4 s ALA 109 Cb 0.24 -1.64 0.64 0.00 0.00 0.00 0.00 23.12 22.36 1yx4 s ALA 109 CO -0.17 -1.75 1.62 -1.91 0.00 0.00 0.00 175.76 173.55 1yx4 n GLU 110 N 4.63 3.25 -3.59 0.00 4.07 -1.26 -4.98 120.64 122.76 1yx4 n GLU 110 Ca 0.00 -3.03 -0.05 0.00 -0.06 0.00 0.00 57.16 54.01 1yx4 n GLU 110 Cb 0.41 -2.04 -0.02 0.00 -0.06 0.00 0.00 31.44 29.73 1yx4 n GLU 110 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 1yx4 s SER 111 N -1.57 -0.24 0.00 4.31 0.01 -1.26 -5.33 113.70 109.62 1yx4 s SER 111 Ca 0.49 -0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.66 1yx4 s SER 111 Cb 0.40 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.96 1yx4 s SER 111 CO 0.10 -0.55 0.00 0.00 0.41 0.00 0.00 173.24 173.20