#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yx4 n MET 2 N 0.00 -0.47 -0.70 -1.40 2.00 -1.26 -4.99 117.12 110.30 1yx4 n MET 2 Ca 0.00 -1.07 -0.01 0.00 0.00 0.00 0.00 57.70 56.62 1yx4 n MET 2 Cb 0.00 -0.61 0.22 0.00 0.00 0.00 0.00 33.22 32.83 1yx4 n MET 2 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1yx4 n LEU 3 N 0.00 4.14 0.00 4.03 4.32 -1.26 -4.95 117.00 123.28 1yx4 n LEU 3 Ca 0.08 -3.53 0.00 0.00 -0.02 0.00 0.00 56.01 52.54 1yx4 n LEU 3 Cb 0.28 -0.61 0.00 0.00 -1.62 0.00 0.00 43.42 41.47 1yx4 n LEU 3 CO 0.20 1.07 0.00 0.61 -1.22 0.00 0.00 177.39 178.05 1yx4 n GLY 4 N -0.95 0.64 0.04 -0.72 0.00 -1.26 -5.05 105.19 97.89 1yx4 n GLY 4 Ca 0.31 -0.14 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 1yx4 n GLY 4 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yx4 n LEU 5 N 0.00 0.00 -3.65 0.99 4.32 -1.26 -5.01 117.00 112.39 1yx4 n LEU 5 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 55.95 1yx4 n LEU 5 Cb 0.00 0.18 -0.06 0.00 -1.62 0.00 0.00 43.42 41.92 1yx4 n LEU 5 CO 0.00 0.18 0.27 -0.83 -1.22 0.00 0.00 177.39 175.79 1yx4 s GLY 6 N -3.88 -0.66 -0.41 -0.72 0.00 -1.26 -5.03 107.32 95.36 1yx4 s GLY 6 Ca -0.04 2.30 0.03 0.00 0.00 0.00 0.00 44.72 47.01 1yx4 s GLY 6 CO 0.33 2.74 1.83 0.00 0.00 0.00 0.00 173.10 178.00 1yx4 n ALA 7 N 5.00 5.31 -2.27 3.20 0.00 -1.26 -4.18 120.51 126.31 1yx4 n ALA 7 Ca -0.15 -2.61 0.01 0.00 0.00 0.00 0.00 53.44 50.69 1yx4 n ALA 7 Cb 0.53 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1yx4 n ALA 7 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1yx4 n SER 8 N -0.97 0.41 0.01 0.00 3.41 -1.26 -4.79 113.62 110.42 1yx4 n SER 8 Ca 0.54 -1.94 0.11 0.00 -0.26 0.00 0.00 58.87 57.32 1yx4 n SER 8 Cb 1.53 -0.18 -0.07 0.00 -0.26 0.00 0.00 64.21 65.23 1yx4 n SER 8 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1yx4 n ASP 9 N 0.27 0.59 -4.58 4.04 -0.08 -1.26 -4.71 116.55 110.82 1yx4 n ASP 9 Ca -0.00 -0.43 -0.40 0.00 -1.51 0.00 0.00 54.79 52.45 1yx4 n ASP 9 Cb 0.93 1.17 -0.01 0.00 2.34 0.00 0.00 41.12 45.55 1yx4 n ASP 9 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1yx4 s PHE 10 N -3.21 2.61 -0.13 -0.67 0.08 -1.26 -4.31 117.98 111.08 1yx4 s PHE 10 Ca 0.02 -1.18 0.05 0.00 0.12 0.00 0.00 56.93 55.94 1yx4 s PHE 10 Cb 0.15 -4.61 0.16 0.00 -0.57 0.00 0.00 43.02 38.15 1yx4 s PHE 10 CO 0.85 -1.70 1.04 -0.85 -0.10 0.00 0.00 175.22 174.46 1yx4 n GLU 11 N 8.40 0.54 0.00 0.44 0.28 -1.26 -4.93 120.64 124.11 1yx4 n GLU 11 Ca 0.47 -0.85 0.00 0.00 -0.16 0.00 0.00 57.16 56.63 1yx4 n GLU 11 Cb 0.46 0.41 0.00 0.00 1.43 0.00 0.00 31.44 33.74 1yx4 n GLU 11 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1yx4 n PHE 12 N -0.61 -0.53 0.53 -1.84 7.35 -1.26 -4.74 117.46 116.35 1yx4 n PHE 12 Ca -0.17 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.63 1yx4 n PHE 12 Cb 0.70 0.11 0.09 0.00 0.35 0.00 0.00 39.48 40.72 1yx4 n PHE 12 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1yx4 n GLY 13 N -1.10 -1.32 0.05 7.13 0.00 -1.26 -4.38 105.19 104.30 1yx4 n GLY 13 Ca 0.00 -0.32 -0.00 0.00 0.00 0.00 0.00 46.02 45.70 1yx4 n GLY 13 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1yx4 h VAL 14 N 0.00 0.00 -3.13 1.61 2.07 -1.91 -3.49 116.25 111.40 1yx4 h VAL 14 Ca 0.00 -0.94 -0.08 0.00 0.82 0.00 0.00 66.70 66.50 1yx4 h VAL 14 Cb 0.76 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.37 1yx4 h VAL 14 CO 0.00 0.00 -0.13 -1.81 0.02 0.00 0.00 177.57 175.65 1yx4 s ASP 15 N -5.42 -0.25 0.41 0.57 1.01 -1.26 -5.02 116.67 106.72 1yx4 s ASP 15 Ca -0.01 -0.08 0.29 0.00 0.71 0.00 0.00 52.55 53.46 1yx4 s ASP 15 Cb 0.00 0.42 1.15 0.00 1.01 0.00 0.00 42.92 45.50 1yx4 s ASP 15 CO 0.01 -0.68 1.85 1.55 0.21 0.00 0.00 175.17 178.11 1yx4 h PRO 16 N 2.97 0.00 0.00 8.23 0.13 -1.94 -2.86 132.00 138.53 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 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1yx4 h PRO 16 CO 0.44 0.00 0.00 0.77 -0.23 0.00 0.00 178.00 178.98 1yx4 h SER 17 N 0.00 0.00 -0.37 1.44 0.02 -1.97 -2.55 113.55 110.11 1yx4 h SER 17 Ca 0.00 0.00 0.11 0.00 -0.84 0.00 0.00 61.79 61.06 1yx4 h SER 17 Cb 0.47 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 1yx4 h SER 17 CO 0.00 0.00 0.28 0.00 -1.14 0.00 0.00 176.83 175.97 1yx4 h ALA 18 N 2.07 2.30 -1.09 3.77 0.00 -1.81 -3.41 119.26 121.09 1yx4 h ALA 18 Ca 0.00 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 55.06 1yx4 h ALA 18 Cb 0.16 0.03 -0.23 0.00 0.00 0.00 0.00 17.79 17.75 1yx4 h ALA 18 CO 0.00 -0.48 0.12 -0.51 0.00 0.00 0.00 179.25 178.38 1yx4 s ASP 19 N -6.31 -0.72 0.14 0.00 1.01 -0.96 -5.01 116.67 104.82 1yx4 s ASP 19 Ca -0.05 0.87 -0.04 0.00 0.71 0.00 0.00 52.55 54.04 1yx4 s ASP 19 Cb 0.18 1.77 -0.04 0.00 1.01 0.00 0.00 42.92 45.85 1yx4 s ASP 19 CO 0.69 -0.14 1.36 1.55 0.21 0.00 0.00 175.17 178.84 1yx4 h PRO 20 N 7.67 0.47 -0.92 8.23 0.13 -1.80 -2.92 132.00 142.86 1yx4 h PRO 20 Ca -0.16 -0.43 -0.01 0.00 -0.87 0.00 0.00 66.00 64.53 1yx4 h PRO 20 Cb 1.12 0.11 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 1yx4 h PRO 20 CO 0.08 1.07 0.54 0.93 -0.23 0.00 0.00 178.00 180.39 1yx4 h GLU 21 N 0.30 1.26 -0.05 0.86 5.08 -1.96 -0.50 114.58 119.57 1yx4 h GLU 21 Ca -0.06 -0.12 -0.14 0.00 -1.00 0.00 0.00 59.36 58.04 1yx4 h GLU 21 Cb 1.44 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 1yx4 h GLU 21 CO 0.15 0.89 -0.60 -0.07 -1.00 0.00 0.00 179.01 178.38 1yx4 h LEU 22 N 1.28 0.21 -0.19 1.33 4.07 -1.95 -0.94 115.31 119.11 1yx4 h LEU 22 Ca 0.33 -0.12 -0.13 0.00 0.08 0.00 0.00 57.88 58.04 1yx4 h LEU 22 Cb -0.03 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.65 1yx4 h LEU 22 CO -0.06 0.76 -0.40 0.00 -1.08 0.00 0.00 178.44 177.65 1yx4 h ALA 23 N 1.25 0.31 -0.13 1.53 0.00 -1.20 -1.78 119.26 119.23 1yx4 h ALA 23 Ca -0.01 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 1yx4 h ALA 23 Cb 1.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1yx4 h ALA 23 CO 0.09 0.41 -0.29 1.25 0.00 0.00 0.00 179.25 180.71 1yx4 h LEU 24 N 0.29 0.48 -1.37 0.00 7.12 -1.09 -2.43 115.31 118.30 1yx4 h LEU 24 Ca 0.00 -0.57 -0.02 0.00 0.13 0.00 0.00 57.88 57.43 1yx4 h LEU 24 Cb 1.01 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.97 1yx4 h LEU 24 CO 0.09 0.96 0.21 0.00 -0.13 0.00 0.00 178.44 179.57 1yx4 h ALA 25 N 0.53 1.51 0.00 1.25 0.00 -1.23 -1.22 119.26 120.10 1yx4 h ALA 25 Ca 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1yx4 h ALA 25 Cb 0.89 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1yx4 h ALA 25 CO 0.06 0.39 -0.10 1.25 0.00 0.00 0.00 179.25 180.85 1yx4 h LEU 26 N 0.63 0.00 0.02 0.00 5.85 -1.27 -2.64 115.31 117.90 1yx4 h LEU 26 Ca 0.16 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.66 1yx4 h LEU 26 Cb 0.09 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1yx4 h LEU 26 CO -0.02 0.10 -1.07 -0.09 -0.34 0.00 0.00 178.44 177.02 1yx4 h ARG 27 N 0.00 0.03 0.00 1.25 2.43 -0.74 -2.69 114.38 114.66 1yx4 h ARG 27 Ca -0.00 -0.06 -0.16 0.00 -0.81 0.00 0.00 59.98 58.96 1yx4 h ARG 27 Cb 0.84 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.38 1yx4 h ARG 27 CO 0.01 1.00 -0.75 0.28 -1.51 0.00 0.00 179.97 179.00 1yx4 h VAL 28 N 0.01 1.38 0.08 0.20 2.07 -1.27 -2.85 116.25 115.87 1yx4 h VAL 28 Ca -0.04 -2.71 -0.26 0.00 0.82 0.00 0.00 66.70 64.51 1yx4 h VAL 28 Cb 1.81 2.53 0.01 0.00 -1.52 0.00 0.00 31.29 34.11 1yx4 h VAL 28 CO 0.14 0.73 -1.13 0.28 0.02 0.00 0.00 177.57 177.61 1yx4 h SER 29 N 0.00 0.62 -0.19 0.57 0.02 -1.50 -2.81 113.55 110.26 1yx4 h SER 29 Ca -0.01 -0.56 -0.13 0.00 -0.84 0.00 0.00 61.79 60.25 1yx4 h SER 29 Cb 1.47 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 1yx4 h SER 29 CO 0.10 1.39 -0.33 0.24 -1.14 0.00 0.00 176.83 177.08 1yx4 h MET 30 N 0.20 0.70 -0.41 3.45 2.07 -1.51 -2.66 114.93 116.77 1yx4 h MET 30 Ca -0.13 -0.33 -0.13 0.00 -2.07 0.00 0.00 59.70 57.04 1yx4 h MET 30 Cb 1.80 -0.01 -0.01 0.00 -1.87 0.00 0.00 31.60 31.51 1yx4 h MET 30 CO 0.20 0.93 -0.26 1.49 1.07 0.00 0.00 176.91 180.34 1yx4 h GLU 31 N 0.59 0.90 -0.50 1.72 4.57 -1.55 -2.81 114.58 117.50 1yx4 h GLU 31 Ca 0.06 -0.42 -0.00 0.00 -1.18 0.00 0.00 59.36 57.82 1yx4 h GLU 31 Cb 0.85 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.41 1yx4 h GLU 31 CO 0.07 1.08 0.30 0.93 -1.18 0.00 0.00 179.01 180.21 1yx4 h GLU 32 N 0.72 0.67 -0.31 1.92 5.08 -1.41 -1.65 114.58 119.61 1yx4 h GLU 32 Ca 0.08 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1yx4 h GLU 32 Cb 0.84 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 1yx4 h GLU 32 CO 0.07 0.48 0.18 0.37 -1.00 0.00 0.00 179.01 179.12 1yx4 h GLN 33 N 0.67 0.41 -0.20 2.33 4.15 -1.42 -1.87 115.11 119.18 1yx4 h GLN 33 Ca 0.18 -0.03 -0.17 0.00 0.77 0.00 0.00 58.65 59.40 1yx4 h GLN 33 Cb -0.02 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.58 1yx4 h GLN 33 CO -0.03 0.29 -0.57 -0.09 -1.93 0.00 0.00 178.83 176.50 1yx4 h ARG 34 N 0.42 0.63 -0.86 1.69 9.65 -1.09 -2.46 114.38 122.36 1yx4 h ARG 34 Ca 0.11 -0.41 0.02 0.00 -1.10 0.00 0.00 59.98 58.59 1yx4 h ARG 34 Cb -0.01 0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 28.58 1yx4 h ARG 34 CO -0.02 1.03 0.57 1.96 2.80 0.00 0.00 179.97 186.31 1yx4 h GLN 35 N 0.48 1.11 -0.15 0.20 4.20 -0.49 0.16 115.11 120.62 1yx4 h GLN 35 Ca 0.00 -0.07 -0.06 0.00 0.06 0.00 0.00 58.65 58.58 1yx4 h GLN 35 Cb 1.14 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 28.66 1yx4 h GLN 35 CO 0.11 0.74 -0.16 0.00 -0.67 0.00 0.00 178.83 178.85 1yx4 h ARG 36 N 1.15 0.36 0.00 1.46 2.47 -1.44 0.61 114.38 118.99 1yx4 h ARG 36 Ca 0.32 -0.20 -0.03 0.00 -1.26 0.00 0.00 59.98 58.82 1yx4 h ARG 36 Cb -0.10 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.23 1yx4 h ARG 36 CO -0.08 0.75 -0.12 0.37 0.56 0.00 0.00 179.97 181.45 1yx4 h GLN 37 N -0.01 0.00 0.00 0.04 4.15 -1.15 -1.06 115.11 117.08 1yx4 h GLN 37 Ca 0.02 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.43 1yx4 h GLN 37 Cb 0.69 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.38 1yx4 h GLN 37 CO 0.04 0.12 -0.23 1.49 -1.93 0.00 0.00 178.83 178.32 1yx4 h GLU 38 N 0.00 0.00 -0.88 1.69 4.57 -0.51 0.20 114.58 119.65 1yx4 h GLU 38 Ca -0.00 0.00 0.22 0.00 -1.18 0.00 0.00 59.36 58.40 1yx4 h GLU 38 Cb 0.35 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 28.88 1yx4 h GLU 38 CO 0.02 0.14 0.60 0.93 -1.18 0.00 0.00 179.01 179.52 1yx4 h GLU 39 N -1.00 0.26 0.08 1.92 5.08 -0.87 0.38 114.58 120.44 1yx4 h GLU 39 Ca -0.02 -0.02 -0.28 0.00 -1.00 0.00 0.00 59.36 58.05 1yx4 h GLU 39 Cb 0.32 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1yx4 h GLU 39 CO -0.01 0.17 -1.38 1.49 -1.00 0.00 0.00 179.01 178.28 1yx4 h GLU 40 N 0.27 0.17 0.34 2.33 4.57 -1.30 -2.43 114.58 118.53 1yx4 h GLU 40 Ca 0.45 -0.29 -0.02 0.00 -1.18 0.00 0.00 59.36 58.32 1yx4 h GLU 40 Cb 1.31 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 30.01 1yx4 h GLU 40 CO -0.12 1.03 -0.16 0.00 -1.18 0.00 0.00 179.01 178.58 1yx4 h ALA 41 N 0.68 -0.45 -0.03 2.92 0.00 0.18 -2.81 119.26 119.75 1yx4 h ALA 41 Ca -0.18 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 1yx4 h ALA 41 Cb 1.95 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 1yx4 h ALA 41 CO 0.15 -0.64 -0.28 0.07 0.00 0.00 0.00 179.25 178.55 1yx4 h ARG 42 N -0.67 0.05 -0.71 0.00 0.11 -0.81 -2.61 114.38 109.74 1yx4 h ARG 42 Ca -0.05 -0.01 0.11 0.00 0.10 0.00 0.00 59.98 60.13 1yx4 h ARG 42 Cb 0.47 -0.00 -0.08 0.00 1.11 0.00 0.00 29.97 31.47 1yx4 h ARG 42 CO 0.08 0.33 0.31 0.00 0.10 0.00 0.00 179.97 180.79 1yx4 h ARG 43 N 0.04 0.50 0.00 0.08 3.08 -1.19 0.31 114.38 117.20 1yx4 h ARG 43 Ca 0.01 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 1yx4 h ARG 43 Cb 0.52 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1yx4 h ARG 43 CO 0.04 0.33 -0.32 0.00 -1.07 0.00 0.00 179.97 178.95 1yx4 h ALA 44 N 1.47 0.93 -0.25 0.04 0.00 -1.23 -1.83 119.26 118.39 1yx4 h ALA 44 Ca 0.37 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1yx4 h ALA 44 Cb 0.46 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1yx4 h ALA 44 CO -0.32 0.40 -0.27 0.00 0.00 0.00 0.00 179.25 179.06 1yx4 h ALA 45 N 1.68 1.06 0.15 0.00 0.00 -0.16 -1.79 119.26 120.22 1yx4 h ALA 45 Ca -0.00 -0.36 -0.35 0.00 0.00 0.00 0.00 54.91 54.20 1yx4 h ALA 45 Cb 0.94 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1yx4 h ALA 45 CO 0.04 0.57 -1.79 0.00 0.00 0.00 0.00 179.25 178.07 1yx4 h ALA 46 N 1.28 0.28 -0.62 0.00 0.00 -1.08 -2.80 119.26 116.32 1yx4 h ALA 46 Ca 0.06 -1.23 -0.03 0.00 0.00 0.00 0.00 54.91 53.72 1yx4 h ALA 46 Cb 0.70 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1yx4 h ALA 46 CO 0.05 1.15 0.28 0.00 0.00 0.00 0.00 179.25 180.74 1yx4 h ALA 47 N 0.19 1.33 0.07 0.00 0.00 -1.32 -0.11 119.26 119.42 1yx4 h ALA 47 Ca -0.35 -0.14 -0.25 0.00 0.00 0.00 0.00 54.91 54.17 1yx4 h ALA 47 Cb 2.07 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 1yx4 h ALA 47 CO 0.15 0.52 -1.17 1.03 0.00 0.00 0.00 179.25 179.77 1yx4 h SER 48 N 0.88 0.24 0.62 0.00 0.87 -1.45 -3.18 113.55 111.53 1yx4 h SER 48 Ca 0.22 -0.27 -0.10 0.00 -1.23 0.00 0.00 61.79 60.40 1yx4 h SER 48 Cb 0.12 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 1yx4 h SER 48 CO -0.03 1.21 -0.50 0.00 -0.53 0.00 0.00 176.83 176.99 1yx4 h ALA 49 N 0.75 1.07 -0.46 6.23 0.00 -1.18 0.27 119.26 125.95 1yx4 h ALA 49 Ca -0.09 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1yx4 h ALA 49 Cb 1.90 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1yx4 h ALA 49 CO 0.17 0.62 0.00 0.00 0.00 0.00 0.00 179.25 180.04 1yx4 n ALA 50 N -2.40 3.18 0.00 0.00 0.00 -0.09 -3.68 120.51 117.52 1yx4 n ALA 50 Ca -0.01 -1.26 0.00 0.00 0.00 0.00 0.00 53.44 52.17 1yx4 n ALA 50 Cb 0.54 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1yx4 n ALA 50 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1yx4 n GLU 51 N 0.65 0.00 0.16 0.00 0.00 -1.03 -4.14 120.64 116.28 1yx4 n GLU 51 Ca 0.20 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.38 1yx4 n GLU 51 Cb 0.80 -0.45 0.21 0.00 0.00 0.00 0.00 31.44 31.99 1yx4 n GLU 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1yx4 h ALA 52 N 0.00 0.87 -3.00 4.31 0.00 -1.14 -3.41 119.26 116.89 1yx4 h ALA 52 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1yx4 h ALA 52 Cb 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1yx4 h ALA 52 CO 0.00 0.62 0.00 0.41 0.00 0.00 0.00 179.25 180.28 1yx4 n GLY 53 N 0.53 1.38 0.41 0.00 0.00 -1.24 -5.04 105.19 101.23 1yx4 n GLY 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.00 0.00 -0.61 0.13 -1.26 -5.10 119.36 112.52 1yx4 n ILE 54 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 1yx4 n ILE 54 Cb 0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 39.64 38.70 1yx4 n ILE 54 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1yx4 n ALA 55 N -1.70 0.00 -3.49 1.51 0.00 -1.26 -4.86 120.51 110.71 1yx4 n ALA 55 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1yx4 n ALA 55 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1yx4 n ALA 55 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1yx4 n THR 56 N -1.34 0.00 -3.37 0.00 -2.24 -1.26 -4.16 114.28 101.91 1yx4 n THR 56 Ca 0.00 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.54 1yx4 n THR 56 Cb 0.00 -0.35 -0.10 0.00 -2.10 0.00 0.00 70.33 67.79 1yx4 n THR 56 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1yx4 s THR 57 N -0.03 0.04 0.00 4.28 2.01 -1.26 -4.88 115.64 115.80 1yx4 s THR 57 Ca 0.00 -1.85 0.00 0.00 0.31 0.00 0.00 61.69 60.15 1yx4 s THR 57 Cb 0.00 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1yx4 s THR 57 CO 0.00 -0.94 0.00 0.61 -0.69 0.00 0.00 174.62 173.60 1yx4 n GLY 58 N 3.58 -1.60 2.76 4.40 0.00 -1.26 -5.09 105.19 107.99 1yx4 n GLY 58 Ca 0.19 0.44 -0.30 0.00 0.00 0.00 0.00 46.02 46.35 1yx4 n GLY 58 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yx4 s THR 59 N -0.36 0.97 -0.37 2.61 -4.23 -1.26 -5.00 115.64 108.00 1yx4 s THR 59 Ca 0.00 -1.36 0.13 0.00 -1.18 0.00 0.00 61.69 59.27 1yx4 s THR 59 Cb 0.00 -1.68 0.37 0.00 1.34 0.00 0.00 72.50 72.53 1yx4 s THR 59 CO 0.00 -0.59 0.77 -0.62 -0.54 0.00 0.00 174.62 173.64 1yx4 n GLU 60 N 4.82 1.04 0.03 3.99 4.71 -1.26 -4.93 120.64 129.04 1yx4 n GLU 60 Ca -0.03 -3.39 -0.19 0.00 -0.01 0.00 0.00 57.16 53.54 1yx4 n GLU 60 Cb 0.43 -1.65 -0.13 0.00 -1.01 0.00 0.00 31.44 29.07 1yx4 n GLU 60 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 1yx4 h ASP 61 N 3.00 0.46 -3.19 1.62 3.32 -2.04 -3.43 116.42 116.15 1yx4 h ASP 61 Ca 0.07 -0.89 -0.55 0.00 0.02 0.00 0.00 57.03 55.69 1yx4 h ASP 61 Cb 0.99 -0.15 -0.40 0.00 0.22 0.00 0.00 39.33 40.00 1yx4 h ASP 61 CO 0.51 1.30 -0.76 -0.44 -1.72 0.00 0.00 179.24 178.13 1yx4 s SER 62 N -6.84 3.43 0.46 6.45 0.01 -1.26 -4.99 113.70 110.96 1yx4 s SER 62 Ca -0.14 -1.19 0.21 0.00 1.31 0.00 0.00 55.95 56.14 1yx4 s SER 62 Cb 0.02 -0.70 1.19 0.00 0.21 0.00 0.00 66.02 66.74 1yx4 s SER 62 CO 0.82 -0.36 1.90 0.44 0.41 0.00 0.00 173.24 176.45 1yx4 h ASP 63 N 8.19 0.27 0.72 2.44 3.32 -1.98 0.23 116.42 129.62 1yx4 h ASP 63 Ca -0.16 0.02 -0.19 0.00 0.02 0.00 0.00 57.03 56.72 1yx4 h ASP 63 Cb 1.07 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.57 1yx4 h ASP 63 CO 0.40 0.12 -0.89 0.44 -1.72 0.00 0.00 179.24 177.60 1yx4 h ASP 64 N 0.28 0.14 -0.07 6.45 5.19 -1.98 -2.87 116.42 123.55 1yx4 h ASP 64 Ca 0.40 -0.12 0.00 0.00 -0.62 0.00 0.00 57.03 56.69 1yx4 h ASP 64 Cb 1.14 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 40.61 1yx4 h ASP 64 CO -0.10 0.95 0.05 0.00 -3.12 0.00 0.00 179.24 177.01 1yx4 h ALA 65 N 1.04 0.09 0.00 3.45 0.00 -0.96 0.63 119.26 123.51 1yx4 h ALA 65 Ca -0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1yx4 h ALA 65 Cb 1.53 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 1yx4 h ALA 65 CO 0.13 -0.40 -0.04 1.25 0.00 0.00 0.00 179.25 180.18 1yx4 h LEU 66 N 0.08 0.00 -0.13 0.00 6.46 -1.45 0.60 115.31 120.87 1yx4 h LEU 66 Ca 0.03 0.00 -0.23 0.00 -0.12 0.00 0.00 57.88 57.56 1yx4 h LEU 66 Cb 0.01 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 39.94 1yx4 h LEU 66 CO -0.01 0.04 -0.99 0.25 -0.62 0.00 0.00 178.44 177.11 1yx4 h LEU 67 N 0.00 0.36 0.00 2.25 6.46 -0.86 -2.79 115.31 120.73 1yx4 h LEU 67 Ca -0.00 -0.32 -0.02 0.00 -0.12 0.00 0.00 57.88 57.42 1yx4 h LEU 67 Cb 0.08 -0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 39.90 1yx4 h LEU 67 CO 0.01 1.16 -0.22 0.50 -0.62 0.00 0.00 178.44 179.26 1yx4 h LYS 68 N 0.13 0.00 -0.96 1.25 3.11 0.16 -2.92 116.57 117.34 1yx4 h LYS 68 Ca -0.07 0.00 0.18 0.00 -2.81 0.00 0.00 60.65 57.95 1yx4 h LYS 68 Cb 1.66 0.00 -0.09 0.00 -1.00 0.00 0.00 32.23 32.80 1yx4 h LYS 68 CO 0.16 0.33 0.61 0.52 -2.81 0.00 0.00 179.45 178.25 1yx4 h MET 69 N -1.00 0.65 -0.22 1.90 2.86 -0.02 0.88 114.93 119.97 1yx4 h MET 69 Ca -0.03 -0.04 -0.19 0.00 -2.06 0.00 0.00 59.70 57.37 1yx4 h MET 69 Cb 0.45 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.97 1yx4 h MET 69 CO -0.02 0.43 -0.63 0.00 1.06 0.00 0.00 176.91 177.75 1yx4 h THR 70 N 0.67 1.29 -0.00 2.22 1.03 -1.63 -2.82 112.91 113.66 1yx4 h THR 70 Ca 0.52 -1.84 0.00 0.00 -0.01 0.00 0.00 66.41 65.08 1yx4 h THR 70 Cb 0.92 1.78 0.00 0.00 -1.07 0.00 0.00 68.15 69.78 1yx4 h THR 70 CO -0.28 0.59 -0.23 0.00 -0.01 0.00 0.00 175.52 175.59 1yx4 n ILE 71 N -3.97 0.00 0.07 0.00 0.13 -0.30 -2.05 119.36 113.25 1yx4 n ILE 71 Ca -0.05 -0.03 -0.23 0.00 -1.10 0.00 0.00 62.75 61.34 1yx4 n ILE 71 Cb 0.67 -0.04 -0.15 0.00 -0.84 0.00 0.00 39.64 39.27 1yx4 n ILE 71 CO 0.00 0.00 0.00 -1.28 2.80 0.00 0.00 176.55 178.07 1yx4 h SER 72 N 0.27 0.63 0.74 9.51 0.87 0.84 -2.28 113.55 124.13 1yx4 h SER 72 Ca 0.00 -0.94 -0.01 0.00 -1.23 0.00 0.00 61.79 59.61 1yx4 h SER 72 Cb 0.46 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1yx4 h SER 72 CO 0.00 1.79 -1.26 0.00 -0.53 0.00 0.00 176.83 176.82 1yx4 n GLN 73 N -3.61 0.62 -0.05 2.24 6.02 -1.08 -2.52 117.38 119.01 1yx4 n GLN 73 Ca -0.25 0.05 -0.12 0.00 -0.01 0.00 0.00 57.00 56.67 1yx4 n GLN 73 Cb 1.07 -1.75 -0.14 0.00 1.02 0.00 0.00 30.24 30.44 1yx4 n GLN 73 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1yx4 n GLN 74 N -2.59 0.67 -0.02 -1.09 7.27 -0.87 -4.15 117.38 116.61 1yx4 n GLN 74 Ca -0.02 0.20 -0.15 0.00 0.07 0.00 0.00 57.00 57.11 1yx4 n GLN 74 Cb 0.57 -1.69 -0.14 0.00 2.41 0.00 0.00 30.24 31.40 1yx4 n GLN 74 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1yx4 n GLU 75 N -3.09 0.70 -3.81 3.69 0.00 -0.86 -4.61 120.64 112.67 1yx4 n GLU 75 Ca -0.27 0.26 -0.31 0.00 0.00 0.00 0.00 57.16 56.84 1yx4 n GLU 75 Cb 1.07 -1.73 -0.10 0.00 0.00 0.00 0.00 31.44 30.68 1yx4 n GLU 75 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.13 177.25 1yx4 s PHE 76 N -2.57 3.67 0.07 4.31 5.36 -1.05 -4.79 117.98 122.98 1yx4 s PHE 76 Ca -0.15 -3.21 0.00 0.00 -0.96 0.00 0.00 56.93 52.61 1yx4 s PHE 76 Cb 0.07 -2.92 0.00 0.00 -0.34 0.00 0.00 43.02 39.83 1yx4 s PHE 76 CO 0.79 -0.63 0.00 0.41 -1.46 0.00 0.00 175.22 174.33 1yx4 n GLY 77 N 2.19 -1.78 3.33 13.12 0.00 -1.26 -4.50 105.19 116.29 1yx4 n GLY 77 Ca 0.19 0.42 -0.41 0.00 0.00 0.00 0.00 46.02 46.23 1yx4 n GLY 77 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yx4 s ARG 78 N -1.14 2.74 0.00 1.61 6.06 -1.26 -4.85 118.95 122.11 1yx4 s ARG 78 Ca 0.00 -1.23 0.00 0.00 -2.50 0.00 0.00 55.73 52.00 1yx4 s ARG 78 Cb 0.00 -3.76 0.00 0.00 0.06 0.00 0.00 34.95 31.25 1yx4 s ARG 78 CO 0.00 -0.81 0.76 2.41 -2.50 0.00 0.00 175.30 175.16 1yx4 n THR 79 N 4.97 0.00 0.13 4.11 -1.04 -1.26 -4.83 114.28 116.36 1yx4 n THR 79 Ca -0.11 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 61.97 1yx4 n THR 79 Cb 0.45 0.56 0.24 0.00 -1.82 0.00 0.00 70.33 69.76 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 0.00 1.81 2.99 3.41 0.00 -1.26 -4.70 105.19 107.44 1yx4 n GLY 80 Ca 0.00 -0.58 0.04 0.00 0.00 0.00 0.00 46.02 45.48 1yx4 n GLY 80 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1yx4 s LEU 81 N -1.34 -0.41 -0.42 0.99 0.05 -1.26 -5.11 118.68 111.17 1yx4 s LEU 81 Ca 0.35 -0.06 -0.28 0.00 0.05 0.00 0.00 54.13 54.19 1yx4 s LEU 81 Cb 0.22 0.93 -0.00 0.00 -2.05 0.00 0.00 46.19 45.28 1yx4 s LEU 81 CO 0.18 -0.06 1.57 -2.16 -0.55 0.00 0.00 176.35 175.33 1yx4 s PRO 82 N 2.51 3.39 -1.36 1.48 0.04 -1.26 -4.92 135.00 134.88 1yx4 s PRO 82 Ca 0.22 1.00 -0.14 0.00 0.04 0.00 0.00 61.00 62.12 1yx4 s PRO 82 Cb 0.00 -4.12 0.09 0.00 0.04 0.00 0.00 34.50 30.51 1yx4 s PRO 82 CO -0.19 -1.80 1.96 -0.25 0.04 0.00 0.00 177.00 176.76 1yx4 n ASP 83 N 9.70 4.51 0.29 6.66 8.00 -1.26 -4.73 116.55 139.72 1yx4 n ASP 83 Ca 0.18 -2.93 0.14 0.00 0.71 0.00 0.00 54.79 52.89 1yx4 n ASP 83 Cb 0.48 -1.63 0.87 0.00 -0.02 0.00 0.00 41.12 40.82 1yx4 n ASP 83 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1yx4 h LEU 84 N 10.07 0.00 -1.74 0.64 3.38 -1.97 -1.69 115.31 124.01 1yx4 h LEU 84 Ca 0.48 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.49 1yx4 h LEU 84 Cb 0.71 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1yx4 h LEU 84 CO 1.67 0.01 0.25 0.28 0.09 0.00 0.00 178.44 180.74 1yx4 h SER 85 N 0.00 0.30 -1.15 -0.43 0.02 -2.02 -2.64 113.55 107.63 1yx4 h SER 85 Ca -0.00 -0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 1yx4 h SER 85 Cb 0.04 -0.07 -0.42 0.00 0.14 0.00 0.00 62.40 62.09 1yx4 h SER 85 CO 0.00 0.20 -0.71 -0.24 -1.14 0.00 0.00 176.83 174.95 1yx4 n SER 86 N -4.48 4.93 -4.57 3.07 2.88 -0.64 -5.03 113.62 109.77 1yx4 n SER 86 Ca 0.04 -3.74 -0.34 0.00 -1.33 0.00 0.00 58.87 53.50 1yx4 n SER 86 Cb 0.18 -0.42 -0.11 0.00 -0.75 0.00 0.00 64.21 63.11 1yx4 n SER 86 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1yx4 s MET 87 N -3.58 2.72 0.97 -1.46 1.00 -1.00 -5.02 119.30 112.92 1yx4 s MET 87 Ca 0.50 -0.56 -0.13 0.00 0.00 0.00 0.00 55.69 55.49 1yx4 s MET 87 Cb 0.41 -2.57 0.17 0.00 0.00 0.00 0.00 34.83 32.84 1yx4 s MET 87 CO -0.08 0.66 1.13 0.95 0.00 0.00 0.00 175.02 177.68 1yx4 s THR 88 N -0.81 1.97 0.43 2.05 -4.23 -1.26 -4.76 115.64 109.03 1yx4 s THR 88 Ca 0.12 0.00 0.13 0.00 -1.18 0.00 0.00 61.69 60.77 1yx4 s THR 88 Cb -0.11 -2.67 0.32 0.00 1.34 0.00 0.00 72.50 71.38 1yx4 s THR 88 CO 0.01 0.00 1.99 1.05 -0.54 0.00 0.00 174.62 177.14 1yx4 h GLU 89 N -1.72 0.40 0.09 3.99 4.11 -2.00 -1.43 114.58 118.02 1yx4 h GLU 89 Ca -0.51 -0.02 -0.26 0.00 0.07 0.00 0.00 59.36 58.63 1yx4 h GLU 89 Cb 1.33 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1yx4 h GLU 89 CO 0.57 0.26 -1.22 0.93 0.07 0.00 0.00 179.01 179.63 1yx4 h GLU 90 N 0.41 0.20 0.47 1.06 5.08 -1.98 -2.99 114.58 116.84 1yx4 h GLU 90 Ca 0.25 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1yx4 h GLU 90 Cb 0.46 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1yx4 h GLU 90 CO -0.07 1.14 -0.39 1.49 -1.00 0.00 0.00 179.01 180.18 1yx4 h GLU 91 N 0.05 -0.81 0.00 2.33 4.57 -1.59 0.37 114.58 119.49 1yx4 h GLU 91 Ca -0.12 0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1yx4 h GLU 91 Cb 1.93 0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 30.70 1yx4 h GLU 91 CO 0.18 -0.54 -0.03 1.96 -1.18 0.00 0.00 179.01 179.40 1yx4 h GLN 92 N -0.85 0.00 -0.17 1.92 4.20 -1.65 -2.01 115.11 116.56 1yx4 h GLN 92 Ca -0.06 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.53 1yx4 h GLN 92 Cb 0.71 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.49 1yx4 h GLN 92 CO -0.01 0.03 -0.37 0.82 -0.67 0.00 0.00 178.83 178.63 1yx4 h ILE 93 N 0.00 1.34 -0.01 2.54 2.04 -1.12 0.24 117.51 122.55 1yx4 h ILE 93 Ca -0.00 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.23 1yx4 h ILE 93 Cb 0.07 1.95 -0.00 0.00 -0.74 0.00 0.00 36.82 38.10 1yx4 h ILE 93 CO 0.00 0.49 -0.04 0.00 0.00 0.00 0.00 178.15 178.60 1yx4 h ALA 94 N 0.57 1.91 0.07 1.87 0.00 0.44 0.62 119.26 124.75 1yx4 h ALA 94 Ca 0.00 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.65 1yx4 h ALA 94 Cb 0.97 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1yx4 h ALA 94 CO 0.08 0.07 -1.14 -0.92 0.00 0.00 0.00 179.25 177.34 1yx4 h TYR 95 N 0.01 0.26 0.00 0.00 3.20 -1.36 -2.75 116.97 116.33 1yx4 h TYR 95 Ca 0.00 -0.19 -0.07 0.00 3.14 0.00 0.00 58.73 61.61 1yx4 h TYR 95 Cb 0.09 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 1yx4 h TYR 95 CO 0.00 1.45 -0.33 0.00 -1.64 0.00 0.00 178.16 177.64 1yx4 h ALA 96 N -0.15 1.15 0.00 1.82 0.00 -0.31 -2.81 119.26 118.97 1yx4 h ALA 96 Ca -0.26 -0.30 -0.22 0.00 0.00 0.00 0.00 54.91 54.13 1yx4 h ALA 96 Cb 1.53 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 1yx4 h ALA 96 CO -0.02 0.41 -1.16 1.98 0.00 0.00 0.00 179.25 180.46 1yx4 h MET 97 N 0.00 0.00 -0.13 0.00 1.85 0.13 -2.63 114.93 114.14 1yx4 h MET 97 Ca -0.00 0.00 -0.11 0.00 -0.61 0.00 0.00 59.70 58.98 1yx4 h MET 97 Cb 0.73 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.75 1yx4 h MET 97 CO 0.04 0.78 -0.40 0.37 -0.40 0.00 0.00 176.91 177.31 1yx4 h GLN 98 N 0.00 0.29 0.00 0.39 4.15 -1.24 -1.75 115.11 116.94 1yx4 h GLN 98 Ca -0.09 -0.13 -0.04 0.00 0.77 0.00 0.00 58.65 59.15 1yx4 h GLN 98 Cb 1.79 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.47 1yx4 h GLN 98 CO 0.11 0.64 -0.85 0.52 -1.93 0.00 0.00 178.83 177.32 1yx4 h MET 99 N 0.24 0.00 0.00 1.69 2.86 -1.57 -3.33 114.93 114.82 1yx4 h MET 99 Ca 0.02 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.47 1yx4 h MET 99 Cb 0.81 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.44 1yx4 h MET 99 CO 0.06 0.10 -0.99 1.03 1.06 0.00 0.00 176.91 178.18 1yx4 h SER 100 N 0.00 0.00 -0.86 1.22 0.87 -1.26 -3.28 113.55 110.24 1yx4 h SER 100 Ca -0.03 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1yx4 h SER 100 Cb 1.15 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.07 1yx4 h SER 100 CO 0.01 0.85 0.50 -0.07 -0.53 0.00 0.00 176.83 177.59 1yx4 h LEU 101 N 0.00 1.06 -4.18 2.23 3.38 -1.43 -2.64 115.31 113.72 1yx4 h LEU 101 Ca -0.05 -0.08 -0.67 0.00 0.09 0.00 0.00 57.88 57.18 1yx4 h LEU 101 Cb 1.69 -0.27 -0.32 0.00 0.09 0.00 0.00 40.66 41.85 1yx4 h LEU 101 CO 0.10 0.83 0.48 0.00 0.09 0.00 0.00 178.44 179.95 1yx4 n GLN 102 N -4.35 2.93 0.00 1.13 6.02 -1.24 -4.89 117.38 116.98 1yx4 n GLN 102 Ca 0.09 -3.59 0.00 0.00 -0.01 0.00 0.00 57.00 53.50 1yx4 n GLN 102 Cb 0.08 -2.28 0.00 0.00 1.02 0.00 0.00 30.24 29.06 1yx4 n GLN 102 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1yx4 n GLY 103 N -0.78 0.57 2.80 1.08 0.00 -1.00 -5.06 105.19 102.81 1yx4 n GLY 103 Ca 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.55 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 -2.92 -2.44 -1.47 4.61 0.00 -1.26 -5.04 121.76 113.24 1yx4 s ALA 104 Ca 0.00 -0.22 -0.09 0.00 0.00 0.00 0.00 51.96 51.66 1yx4 s ALA 104 Cb 0.00 -2.76 0.02 0.00 0.00 0.00 0.00 23.12 20.39 1yx4 s ALA 104 CO 0.00 -2.27 2.59 0.39 0.00 0.00 0.00 175.76 176.46 1yx4 n GLU 105 N 3.06 3.96 -3.12 0.00 4.71 -1.26 -4.21 120.64 123.78 1yx4 n GLU 105 Ca 0.16 -2.83 -0.09 0.00 -0.01 0.00 0.00 57.16 54.40 1yx4 n GLU 105 Cb 0.57 -2.79 -0.03 0.00 -1.01 0.00 0.00 31.44 28.18 1yx4 n GLU 105 CO 0.00 0.00 0.00 0.12 0.09 0.00 0.00 177.13 177.34 1yx4 s PHE 106 N 0.85 -0.98 0.00 -0.32 2.19 -1.26 -4.95 117.98 113.51 1yx4 s PHE 106 Ca 0.59 -0.62 0.00 0.00 0.33 0.00 0.00 56.93 57.23 1yx4 s PHE 106 Cb 0.17 -0.02 0.00 0.00 -1.31 0.00 0.00 43.02 41.86 1yx4 s PHE 106 CO -0.07 -1.12 0.00 0.41 1.83 0.00 0.00 175.22 176.27 1yx4 n GLY 107 N 3.67 2.32 2.62 13.12 0.00 -1.26 -4.78 105.19 120.88 1yx4 n GLY 107 Ca 0.16 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 1yx4 n GLY 107 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1yx4 n GLN 108 N 0.00 3.16 -0.05 1.61 3.00 -1.26 -4.46 117.38 119.38 1yx4 n GLN 108 Ca 0.00 -3.07 -0.15 0.00 -0.01 0.00 0.00 57.00 53.77 1yx4 n GLN 108 Cb 0.00 -2.29 -0.14 0.00 0.00 0.00 0.00 30.24 27.81 1yx4 n GLN 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1yx4 n ALA 109 N 0.54 1.27 -0.78 -1.58 0.00 -1.26 -4.78 120.51 113.93 1yx4 n ALA 109 Ca 0.52 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1yx4 n ALA 109 Cb 0.39 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.29 1yx4 n ALA 109 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1yx4 n GLU 110 N -3.19 0.00 -2.64 0.00 1.02 -1.26 -4.72 120.64 109.86 1yx4 n GLU 110 Ca -0.30 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.45 1yx4 n GLU 110 Cb 1.06 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 32.42 1yx4 n GLU 110 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1yx4 s SER 111 N -3.35 7.38 0.00 1.62 0.15 -1.26 -5.23 113.70 113.01 1yx4 s SER 111 Ca 0.00 2.05 0.02 0.00 0.70 0.00 0.00 55.95 58.72 1yx4 s SER 111 Cb 0.00 -2.61 0.01 0.00 -1.71 0.00 0.00 66.02 61.71 1yx4 s SER 111 CO 0.00 -0.05 0.55 0.00 1.20 0.00 0.00 173.24 174.95