#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 0.00 -0.56 1.57 0.00 -1.26 -5.04 117.12 111.83 1yx4 n MET 2 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.70 57.73 1yx4 n MET 2 Cb 0.00 0.00 0.22 0.00 0.00 0.00 0.00 33.22 33.44 1yx4 n MET 2 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 1yx4 n LEU 3 N 0.00 3.78 0.00 -0.89 7.94 -1.26 -4.95 117.00 121.62 1yx4 n LEU 3 Ca 0.00 -3.37 0.00 0.00 -1.11 0.00 0.00 56.01 51.53 1yx4 n LEU 3 Cb 0.00 -0.57 0.00 0.00 0.53 0.00 0.00 43.42 43.38 1yx4 n LEU 3 CO 0.00 0.94 0.00 0.61 -1.11 0.00 0.00 177.39 177.83 1yx4 n GLY 4 N -0.90 0.33 0.21 -3.96 0.00 -1.26 -5.03 105.19 94.58 1yx4 n GLY 4 Ca 0.26 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 46.12 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 1.83 0.00 0.99 7.99 -1.26 -5.04 117.00 121.51 1yx4 n LEU 5 Ca 0.00 0.31 0.00 0.00 -0.01 0.00 0.00 56.01 56.31 1yx4 n LEU 5 Cb 0.00 -0.69 0.00 0.00 -0.11 0.00 0.00 43.42 42.62 1yx4 n LEU 5 CO 0.00 -0.30 0.00 0.61 -1.51 0.00 0.00 177.39 176.19 1yx4 n GLY 6 N 1.71 0.87 3.35 -0.72 0.00 -1.26 -5.13 105.19 104.01 1yx4 n GLY 6 Ca -0.13 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.91 1yx4 n GLY 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yx4 s ALA 7 N -2.45 -2.30 -1.33 4.61 0.00 -1.26 -4.76 121.76 114.26 1yx4 s ALA 7 Ca 0.00 2.02 0.00 0.00 0.00 0.00 0.00 51.96 53.98 1yx4 s ALA 7 Cb 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 21.08 1yx4 s ALA 7 CO 0.00 -1.17 0.00 0.45 0.00 0.00 0.00 175.76 175.04 1yx4 n SER 8 N 5.41 -3.85 0.04 0.00 2.88 -1.26 -4.78 113.62 112.07 1yx4 n SER 8 Ca -0.06 0.27 0.11 0.00 -1.33 0.00 0.00 58.87 57.85 1yx4 n SER 8 Cb 0.51 -3.44 -0.09 0.00 -0.75 0.00 0.00 64.21 60.44 1yx4 n SER 8 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1yx4 n ASP 9 N -1.08 0.43 -3.66 -3.46 8.00 -1.26 -4.74 116.55 110.78 1yx4 n ASP 9 Ca -0.15 0.17 -0.30 0.00 0.71 0.00 0.00 54.79 55.23 1yx4 n ASP 9 Cb 0.52 1.19 -0.14 0.00 -0.02 0.00 0.00 41.12 42.67 1yx4 n ASP 9 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1yx4 s PHE 10 N -3.41 1.43 -0.26 1.24 0.08 -1.26 -4.96 117.98 110.84 1yx4 s PHE 10 Ca -0.04 -1.75 -0.03 0.00 0.12 0.00 0.00 56.93 55.23 1yx4 s PHE 10 Cb 0.12 -1.52 0.11 0.00 -0.57 0.00 0.00 43.02 41.15 1yx4 s PHE 10 CO 0.85 -0.84 0.19 -1.83 -0.10 0.00 0.00 175.22 173.49 1yx4 s GLU 11 N 1.33 0.22 -1.54 0.44 -1.05 -1.26 -4.86 118.70 111.98 1yx4 s GLU 11 Ca 0.13 -0.22 0.00 0.00 -0.15 0.00 0.00 54.97 54.72 1yx4 s GLU 11 Cb -0.19 -1.09 0.00 0.00 -0.44 0.00 0.00 34.13 32.41 1yx4 s GLU 11 CO -0.18 -0.92 0.00 1.19 0.95 0.00 0.00 175.26 176.31 1yx4 n PHE 12 N 5.29 -0.50 -0.67 4.83 3.72 -1.26 -4.71 117.46 124.15 1yx4 n PHE 12 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 1yx4 n PHE 12 Cb 0.46 -2.89 0.00 0.00 -0.94 0.00 0.00 39.48 36.10 1yx4 n PHE 12 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1yx4 n GLY 13 N -0.42 -0.71 0.00 1.37 0.00 -1.26 -4.81 105.19 99.36 1yx4 n GLY 13 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1yx4 n GLY 13 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1yx4 n VAL 14 N -0.12 0.00 -0.81 1.61 3.14 -1.26 -4.95 118.33 115.94 1yx4 n VAL 14 Ca 0.00 0.00 -0.35 0.00 -2.96 0.00 0.00 64.34 61.03 1yx4 n VAL 14 Cb 0.35 -0.27 0.11 0.00 -1.06 0.00 0.00 33.84 32.98 1yx4 n VAL 14 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1yx4 n ASP 15 N -1.45 -2.85 0.13 6.55 9.92 -1.26 -4.80 116.55 122.78 1yx4 n ASP 15 Ca 0.00 0.00 0.12 0.00 -0.53 0.00 0.00 54.79 54.38 1yx4 n ASP 15 Cb 0.22 -0.85 0.49 0.00 -0.64 0.00 0.00 41.12 40.34 1yx4 n ASP 15 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 1yx4 n PRO 16 N -0.34 0.19 0.28 -0.24 -0.04 -1.26 -2.51 135.00 131.08 1yx4 n PRO 16 Ca 0.00 0.42 0.17 0.00 -0.04 0.00 0.00 63.50 64.05 1yx4 n PRO 16 Cb 0.64 -1.86 0.79 0.00 -0.04 0.00 0.00 33.50 33.03 1yx4 n PRO 16 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1yx4 h SER 17 N 0.00 0.00 -0.30 3.54 0.02 -1.99 -2.67 113.55 112.15 1yx4 h SER 17 Ca 0.00 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.00 1yx4 h SER 17 Cb 0.36 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 1yx4 h SER 17 CO 0.00 0.06 0.21 0.00 -1.14 0.00 0.00 176.83 175.95 1yx4 h ALA 18 N 1.94 2.05 -1.12 3.77 0.00 -1.80 -3.42 119.26 120.68 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 0.37 -0.04 -0.23 0.00 0.00 0.00 0.00 17.79 17.89 1yx4 h ALA 18 CO 0.01 -0.11 0.18 -0.51 0.00 0.00 0.00 179.25 178.82 1yx4 s ASP 19 N -6.67 -0.65 0.10 0.00 1.01 -1.00 -5.04 116.67 104.42 1yx4 s ASP 19 Ca -0.06 0.88 -0.11 0.00 0.71 0.00 0.00 52.55 53.98 1yx4 s ASP 19 Cb 0.18 1.74 -0.18 0.00 1.01 0.00 0.00 42.92 45.67 1yx4 s ASP 19 CO 0.71 -0.12 1.24 1.55 0.21 0.00 0.00 175.17 178.76 1yx4 h PRO 20 N 7.57 0.62 -0.18 8.23 0.13 -1.82 -3.01 132.00 143.55 1yx4 h PRO 20 Ca -0.16 -0.65 -0.00 0.00 -0.87 0.00 0.00 66.00 64.32 1yx4 h PRO 20 Cb 1.11 0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1yx4 h PRO 20 CO 0.08 1.25 0.10 1.49 -0.23 0.00 0.00 178.00 180.69 1yx4 h GLU 21 N 0.36 0.25 -0.05 0.86 4.81 -1.96 -2.26 114.58 116.59 1yx4 h GLU 21 Ca -0.10 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.07 1yx4 h GLU 21 Cb 1.62 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.95 1yx4 h GLU 21 CO 0.19 0.23 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.54 1yx4 h LEU 22 N 0.20 0.07 -0.81 1.64 4.07 -1.97 -2.22 115.31 116.29 1yx4 h LEU 22 Ca 0.06 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.96 1yx4 h LEU 22 Cb 0.05 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 41.74 1yx4 h LEU 22 CO -0.01 0.17 0.28 0.00 -1.08 0.00 0.00 178.44 177.81 1yx4 h ALA 23 N 1.84 1.04 -0.21 1.53 0.00 -1.27 -1.65 119.26 120.54 1yx4 h ALA 23 Ca 0.02 -0.21 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 1yx4 h ALA 23 Cb 0.21 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1yx4 h ALA 23 CO 0.01 0.66 -0.53 -0.07 0.00 0.00 0.00 179.25 179.32 1yx4 h LEU 24 N 1.13 0.83 -0.92 0.00 3.38 -1.15 -2.38 115.31 116.20 1yx4 h LEU 24 Ca 0.25 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1yx4 h LEU 24 Cb 0.25 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1yx4 h LEU 24 CO -0.02 1.25 0.55 0.00 0.09 0.00 0.00 178.44 180.32 1yx4 h ALA 25 N 0.60 1.18 0.00 1.53 0.00 -1.27 -0.68 119.26 120.61 1yx4 h ALA 25 Ca -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1yx4 h ALA 25 Cb 1.15 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1yx4 h ALA 25 CO 0.12 0.64 -0.10 1.25 0.00 0.00 0.00 179.25 181.16 1yx4 h LEU 26 N 1.28 0.00 0.00 0.00 7.12 -1.28 -2.79 115.31 119.64 1yx4 h LEU 26 Ca 0.33 0.00 -0.16 0.00 0.13 0.00 0.00 57.88 58.18 1yx4 h LEU 26 Cb -0.04 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.06 1yx4 h LEU 26 CO -0.06 0.10 -0.97 -0.09 -0.13 0.00 0.00 178.44 177.29 1yx4 h ARG 27 N 0.00 0.00 0.06 1.25 9.65 -0.71 -2.76 114.38 121.87 1yx4 h ARG 27 Ca -0.00 0.00 -0.25 0.00 -1.10 0.00 0.00 59.98 58.63 1yx4 h ARG 27 Cb 0.72 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.31 1yx4 h ARG 27 CO 0.01 0.54 -1.07 0.28 2.80 0.00 0.00 179.97 182.53 1yx4 h VAL 28 N 0.00 1.45 0.05 0.20 2.07 -0.98 -2.63 116.25 116.42 1yx4 h VAL 28 Ca -0.07 -2.73 -0.25 0.00 0.82 0.00 0.00 66.70 64.47 1yx4 h VAL 28 Cb 1.57 2.66 0.00 0.00 -1.52 0.00 0.00 31.29 34.01 1yx4 h VAL 28 CO 0.07 0.81 -1.06 0.28 0.02 0.00 0.00 177.57 177.69 1yx4 h SER 29 N 0.15 0.50 -0.32 0.57 0.02 -1.59 -2.70 113.55 110.17 1yx4 h SER 29 Ca -0.10 -0.45 -0.14 0.00 -0.84 0.00 0.00 61.79 60.27 1yx4 h SER 29 Cb 1.75 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 64.12 1yx4 h SER 29 CO 0.18 1.28 -0.30 -0.03 -1.14 0.00 0.00 176.83 176.82 1yx4 h MET 30 N 0.17 0.84 -0.27 3.45 -1.53 -1.55 -2.01 114.93 114.03 1yx4 h MET 30 Ca -0.10 -0.39 -0.14 0.00 -3.44 0.00 0.00 59.70 55.63 1yx4 h MET 30 Cb 1.73 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 32.76 1yx4 h MET 30 CO 0.18 1.03 -0.42 1.49 0.14 0.00 0.00 176.91 179.33 1yx4 h GLU 31 N 0.71 0.65 0.07 0.39 4.81 -1.51 -2.43 114.58 117.26 1yx4 h GLU 31 Ca 0.08 -0.34 -0.00 0.00 -0.13 0.00 0.00 59.36 58.97 1yx4 h GLU 31 Cb 0.85 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.24 1yx4 h GLU 31 CO 0.07 0.95 -0.03 0.93 -0.73 0.00 0.00 179.01 180.20 1yx4 h GLU 32 N 0.53 -0.09 -0.66 1.92 4.39 -1.35 -2.45 114.58 116.87 1yx4 h GLU 32 Ca 0.04 0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.81 1yx4 h GLU 32 Cb 0.94 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.57 1yx4 h GLU 32 CO 0.09 0.26 0.44 0.37 -1.16 0.00 0.00 179.01 179.00 1yx4 h GLN 33 N -0.44 0.62 -0.22 2.33 4.15 -1.38 -2.04 115.11 118.13 1yx4 h GLN 33 Ca -0.01 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.35 1yx4 h GLN 33 Cb 0.38 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.92 1yx4 h GLN 33 CO 0.01 0.41 0.06 -0.09 -1.93 0.00 0.00 178.83 177.30 1yx4 h ARG 34 N 0.64 0.36 -0.28 1.69 1.12 -1.28 0.35 114.38 116.98 1yx4 h ARG 34 Ca 0.29 -0.08 0.06 0.00 -1.11 0.00 0.00 59.98 59.14 1yx4 h ARG 34 Cb 0.30 -0.05 -0.06 0.00 -0.01 0.00 0.00 29.97 30.15 1yx4 h ARG 34 CO -0.09 0.47 -0.14 1.96 -3.11 0.00 0.00 179.97 179.06 1yx4 h GLN 35 N 0.18 -0.10 0.00 0.20 4.20 -0.89 0.68 115.11 119.39 1yx4 h GLN 35 Ca 0.07 0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 1yx4 h GLN 35 Cb 0.27 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1yx4 h GLN 35 CO 0.00 -0.06 -0.00 -0.09 -0.67 0.00 0.00 178.83 178.01 1yx4 h ARG 36 N -0.10 -0.00 -0.06 1.46 2.43 -1.42 -2.80 114.38 113.88 1yx4 h ARG 36 Ca 0.15 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1yx4 h ARG 36 Cb 0.32 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1yx4 h ARG 36 CO -0.34 0.58 0.10 0.37 -1.51 0.00 0.00 179.97 179.16 1yx4 h GLN 37 N -0.58 0.00 0.20 0.20 5.75 -0.05 -1.17 115.11 119.45 1yx4 h GLN 37 Ca -0.00 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1yx4 h GLN 37 Cb 0.58 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.13 1yx4 h GLN 37 CO 0.00 0.00 -0.10 1.49 -2.65 0.00 0.00 178.83 177.57 1yx4 h GLU 38 N 0.00 -0.26 -0.93 1.69 4.81 0.50 0.94 114.58 121.32 1yx4 h GLU 38 Ca 0.03 0.02 0.27 0.00 -0.13 0.00 0.00 59.36 59.55 1yx4 h GLU 38 Cb 0.22 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 1yx4 h GLU 38 CO -0.00 -0.18 0.68 1.49 -0.73 0.00 0.00 179.01 180.28 1yx4 h GLU 39 N -0.67 0.00 0.00 1.92 4.81 -1.26 1.06 114.58 120.45 1yx4 h GLU 39 Ca -0.03 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.03 1yx4 h GLU 39 Cb 0.21 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1yx4 h GLU 39 CO 0.05 0.00 -1.11 1.49 -0.73 0.00 0.00 179.01 178.71 1yx4 h GLU 40 N 0.00 0.00 0.00 1.92 4.81 -1.19 -2.90 114.58 117.22 1yx4 h GLU 40 Ca 0.44 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.66 1yx4 h GLU 40 Cb 1.80 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.18 1yx4 h GLU 40 CO -0.00 0.49 -0.61 0.00 -0.73 0.00 0.00 179.01 178.16 1yx4 h ALA 41 N 1.32 0.71 0.19 2.92 0.00 0.82 -2.85 119.26 122.37 1yx4 h ALA 41 Ca -0.11 -0.05 -0.32 0.00 0.00 0.00 0.00 54.91 54.43 1yx4 h ALA 41 Cb 1.61 0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.42 1yx4 h ALA 41 CO 0.07 0.06 -1.52 0.00 0.00 0.00 0.00 179.25 177.86 1yx4 h ARG 42 N 0.00 0.39 -0.03 0.00 -0.00 0.62 -2.85 114.38 112.52 1yx4 h ARG 42 Ca -0.01 -0.67 -0.21 0.00 -0.50 0.00 0.00 59.98 58.59 1yx4 h ARG 42 Cb 1.04 0.25 -0.00 0.00 0.00 0.00 0.00 29.97 31.26 1yx4 h ARG 42 CO 0.00 1.30 -0.86 -0.09 0.00 0.00 0.00 179.97 180.32 1yx4 h ARG 43 N 0.11 0.39 -0.20 0.04 9.65 -1.61 -1.78 114.38 120.98 1yx4 h ARG 43 Ca -0.26 -0.38 -0.13 0.00 -1.10 0.00 0.00 59.98 58.11 1yx4 h ARG 43 Cb 2.09 0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 30.75 1yx4 h ARG 43 CO 0.21 1.04 -0.43 0.00 2.80 0.00 0.00 179.97 183.59 1yx4 h ALA 44 N 0.83 0.89 0.05 2.80 0.00 -1.61 -2.44 119.26 119.78 1yx4 h ALA 44 Ca -0.06 -0.45 -0.24 0.00 0.00 0.00 0.00 54.91 54.16 1yx4 h ALA 44 Cb 1.47 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1yx4 h ALA 44 CO 0.15 0.64 -1.05 0.00 0.00 0.00 0.00 179.25 178.99 1yx4 h ALA 45 N 1.15 0.28 0.09 0.00 0.00 -1.49 -2.80 119.26 116.48 1yx4 h ALA 45 Ca 0.03 -0.78 -0.00 0.00 0.00 0.00 0.00 54.91 54.16 1yx4 h ALA 45 Cb 0.92 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1yx4 h ALA 45 CO 0.08 0.88 -0.04 0.00 0.00 0.00 0.00 179.25 180.17 1yx4 h ALA 46 N 0.71 -0.11 0.00 0.00 0.00 -1.23 -0.13 119.26 118.49 1yx4 h ALA 46 Ca -0.10 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1yx4 h ALA 46 Cb 1.72 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.55 1yx4 h ALA 46 CO 0.18 -0.45 -0.17 0.00 0.00 0.00 0.00 179.25 178.81 1yx4 h ALA 47 N 0.55 1.58 -0.04 0.00 0.00 -1.54 -0.90 119.26 118.92 1yx4 h ALA 47 Ca -0.01 -0.15 -0.20 0.00 0.00 0.00 0.00 54.91 54.55 1yx4 h ALA 47 Cb 0.29 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1yx4 h ALA 47 CO 0.02 0.21 -0.74 1.03 0.00 0.00 0.00 179.25 179.77 1yx4 h SER 48 N 0.00 0.71 0.27 0.00 0.87 -1.21 -2.80 113.55 111.40 1yx4 h SER 48 Ca -0.00 -0.72 -0.14 0.00 -1.23 0.00 0.00 61.79 59.70 1yx4 h SER 48 Cb 0.33 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 1yx4 h SER 48 CO 0.02 1.33 -0.53 0.00 -0.53 0.00 0.00 176.83 177.12 1yx4 h ALA 49 N 0.40 0.91 0.00 6.23 0.00 -0.71 -2.68 119.26 123.40 1yx4 h ALA 49 Ca -0.08 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1yx4 h ALA 49 Cb 1.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1yx4 h ALA 49 CO 0.15 0.68 0.00 0.00 0.00 0.00 0.00 179.25 180.08 1yx4 n ALA 50 N -2.48 2.10 -0.08 0.00 0.00 -0.37 0.37 120.51 120.05 1yx4 n ALA 50 Ca -0.02 -0.05 -0.09 0.00 0.00 0.00 0.00 53.44 53.28 1yx4 n ALA 50 Cb 0.57 -1.41 -0.04 0.00 0.00 0.00 0.00 19.45 18.58 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 -1.74 0.49 0.00 0.00 2.13 -1.04 -4.20 120.64 116.28 1yx4 n GLU 51 Ca 0.05 0.47 0.11 0.00 0.66 0.00 0.00 57.16 58.46 1yx4 n GLU 51 Cb 0.31 -1.65 -0.05 0.00 0.27 0.00 0.00 31.44 30.32 1yx4 n GLU 51 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1yx4 n ALA 52 N -3.76 4.07 -1.26 4.31 0.00 -1.05 -4.17 120.51 118.64 1yx4 n ALA 52 Ca -0.14 -0.52 -0.13 0.00 0.00 0.00 0.00 53.44 52.65 1yx4 n ALA 52 Cb 0.39 -0.86 0.21 0.00 0.00 0.00 0.00 19.45 19.20 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 1.44 4.48 0.05 0.00 0.00 0.16 -4.38 105.19 106.94 1yx4 n GLY 53 Ca 0.03 -1.12 0.04 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.96 0.58 -2.80 -0.61 3.06 -1.18 -4.70 119.36 112.75 1yx4 n ILE 54 Ca 0.47 -0.63 -0.42 0.00 -2.50 0.00 0.00 62.75 59.67 1yx4 n ILE 54 Cb 1.39 -0.25 -0.03 0.00 0.54 0.00 0.00 39.64 41.29 1yx4 n ILE 54 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1yx4 s ALA 55 N -3.15 3.41 -0.80 1.51 0.00 -1.26 -4.99 121.76 116.46 1yx4 s ALA 55 Ca -0.07 0.25 -0.01 0.00 0.00 0.00 0.00 51.96 52.13 1yx4 s ALA 55 Cb 0.11 -3.30 0.20 0.00 0.00 0.00 0.00 23.12 20.12 1yx4 s ALA 55 CO 0.87 -0.52 0.66 0.95 0.00 0.00 0.00 175.76 177.71 1yx4 s THR 56 N 1.81 4.00 0.08 0.00 -4.23 -1.26 -5.03 115.64 111.02 1yx4 s THR 56 Ca 0.44 -3.71 0.01 0.00 -1.18 0.00 0.00 61.69 57.25 1yx4 s THR 56 Cb -0.18 -3.53 -0.00 0.00 1.34 0.00 0.00 72.50 70.13 1yx4 s THR 56 CO 0.17 -1.03 0.09 0.35 -0.54 0.00 0.00 174.62 173.67 1yx4 n THR 57 N 2.56 0.00 -2.97 3.99 -2.24 -1.26 -5.12 114.28 109.23 1yx4 n THR 57 Ca 0.18 -0.54 -0.13 0.00 -2.27 0.00 0.00 64.05 61.29 1yx4 n THR 57 Cb 0.37 0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 68.87 1yx4 n THR 57 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yx4 n GLY 58 N -0.15 0.62 2.79 3.38 0.00 -1.26 -5.05 105.19 105.52 1yx4 n GLY 58 Ca 0.01 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1yx4 n GLY 58 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1yx4 n THR 59 N 2.50 3.34 -2.02 2.61 -1.04 -1.26 -4.87 114.28 113.53 1yx4 n THR 59 Ca 0.20 -5.38 -0.32 0.00 -2.04 0.00 0.00 64.05 56.51 1yx4 n THR 59 Cb 0.55 -2.17 0.03 0.00 -1.82 0.00 0.00 70.33 66.92 1yx4 n THR 59 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1yx4 n GLU 60 N 1.41 3.13 0.05 -2.82 4.07 -1.26 -4.77 120.64 120.44 1yx4 n GLU 60 Ca 0.26 -3.93 -0.03 0.00 -0.06 0.00 0.00 57.16 53.40 1yx4 n GLU 60 Cb 0.37 -2.27 -0.01 0.00 -0.06 0.00 0.00 31.44 29.47 1yx4 n GLU 60 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 1yx4 h ASP 61 N 2.53 -0.17 -2.80 4.31 3.32 -2.07 -3.38 116.42 118.16 1yx4 h ASP 61 Ca 0.45 0.01 -0.78 0.00 0.02 0.00 0.00 57.03 56.73 1yx4 h ASP 61 Cb 0.75 0.04 -0.23 0.00 0.22 0.00 0.00 39.33 40.11 1yx4 h ASP 61 CO 1.14 0.19 0.95 -1.20 -1.72 0.00 0.00 179.24 178.61 1yx4 n SER 62 N -4.28 5.49 0.16 6.45 7.64 -1.26 -4.86 113.62 122.96 1yx4 n SER 62 Ca -0.03 -3.07 -0.06 0.00 1.01 0.00 0.00 58.87 56.72 1yx4 n SER 62 Cb 0.08 -1.44 -0.03 0.00 -1.01 0.00 0.00 64.21 61.81 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 6.58 -0.36 0.89 6.43 1.82 -1.94 -1.30 116.42 128.55 1yx4 h ASP 63 Ca 0.25 0.01 -0.16 0.00 -0.39 0.00 0.00 57.03 56.75 1yx4 h ASP 63 Cb 0.82 0.09 -0.02 0.00 0.68 0.00 0.00 39.33 40.90 1yx4 h ASP 63 CO 1.19 -0.16 -0.75 -2.24 -1.61 0.00 0.00 179.24 175.67 1yx4 h ASP 64 N -0.60 0.00 -0.67 2.28 2.03 -1.97 -2.90 116.42 114.59 1yx4 h ASP 64 Ca -0.04 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.24 1yx4 h ASP 64 Cb 0.32 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.79 1yx4 h ASP 64 CO 0.07 0.75 0.35 0.00 -1.03 0.00 0.00 179.24 179.38 1yx4 h ALA 65 N 1.25 1.32 -0.02 4.15 0.00 -1.92 0.47 119.26 124.50 1yx4 h ALA 65 Ca -0.01 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1yx4 h ALA 65 Cb 1.40 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1yx4 h ALA 65 CO 0.10 0.54 -0.53 1.25 0.00 0.00 0.00 179.25 180.61 1yx4 h LEU 66 N 0.97 0.07 -0.06 0.00 5.85 -1.13 0.59 115.31 121.61 1yx4 h LEU 66 Ca 0.24 -0.04 -0.25 0.00 0.84 0.00 0.00 57.88 58.67 1yx4 h LEU 66 Cb 0.07 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.09 1yx4 h LEU 66 CO -0.03 0.59 -1.02 0.25 -0.34 0.00 0.00 178.44 177.88 1yx4 h LEU 67 N 0.05 0.76 0.00 2.25 6.46 -0.93 -2.78 115.31 121.12 1yx4 h LEU 67 Ca -0.00 -0.62 -0.04 0.00 -0.12 0.00 0.00 57.88 57.10 1yx4 h LEU 67 Cb 0.95 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.65 1yx4 h LEU 67 CO 0.07 1.42 -0.31 0.11 -0.62 0.00 0.00 178.44 179.12 1yx4 h LYS 68 N 0.32 0.00 -0.82 1.25 6.56 0.02 -2.92 116.57 120.98 1yx4 h LYS 68 Ca -0.12 0.00 0.12 0.00 -1.06 0.00 0.00 60.65 59.60 1yx4 h LYS 68 Cb 1.67 0.00 -0.08 0.00 -0.57 0.00 0.00 32.23 33.25 1yx4 h LYS 68 CO 0.19 0.50 0.43 1.98 -2.06 0.00 0.00 179.45 180.49 1yx4 h MET 69 N -1.00 0.64 -0.39 3.15 4.05 0.03 1.15 114.93 122.55 1yx4 h MET 69 Ca -0.06 -0.04 -0.10 0.00 -0.28 0.00 0.00 59.70 59.22 1yx4 h MET 69 Cb 0.64 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.28 1yx4 h MET 69 CO -0.04 0.42 -0.15 1.15 0.23 0.00 0.00 176.91 178.53 1yx4 h THR 70 N 0.66 1.28 -0.00 -0.77 2.02 -1.62 -2.82 112.91 111.65 1yx4 h THR 70 Ca 0.43 -1.26 0.00 0.00 0.77 0.00 0.00 66.41 66.34 1yx4 h THR 70 Cb 0.53 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1yx4 h THR 70 CO -0.32 0.42 -0.17 0.00 0.37 0.00 0.00 175.52 175.82 1yx4 n ILE 71 N -4.29 0.00 -0.05 3.11 0.13 -0.68 -2.55 119.36 115.02 1yx4 n ILE 71 Ca -0.01 -0.02 -0.15 0.00 -1.10 0.00 0.00 62.75 61.47 1yx4 n ILE 71 Cb 0.39 -0.17 -0.13 0.00 -0.84 0.00 0.00 39.64 38.89 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 0.16 0.07 1.69 9.51 0.87 0.16 -1.85 113.55 124.15 1yx4 h SER 72 Ca 0.00 -0.97 -0.04 0.00 -1.23 0.00 0.00 61.79 59.55 1yx4 h SER 72 Cb 0.45 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 1yx4 h SER 72 CO 0.00 1.08 -0.32 1.56 -0.53 0.00 0.00 176.83 178.62 1yx4 h GLN 73 N -0.90 0.00 0.13 2.24 4.20 -1.62 -2.83 115.11 116.31 1yx4 h GLN 73 Ca -0.04 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.40 1yx4 h GLN 73 Cb 1.11 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.89 1yx4 h GLN 73 CO 0.01 0.15 -1.37 0.37 -0.67 0.00 0.00 178.83 177.33 1yx4 h GLN 74 N 0.00 0.27 -0.24 1.46 5.75 -1.62 -3.37 115.11 117.36 1yx4 h GLN 74 Ca -0.01 -0.46 -0.10 0.00 -0.15 0.00 0.00 58.65 57.93 1yx4 h GLN 74 Cb 1.13 0.17 -0.00 0.00 1.07 0.00 0.00 27.48 29.85 1yx4 h GLN 74 CO 0.02 1.22 -0.26 1.49 -2.65 0.00 0.00 178.83 178.65 1yx4 h GLU 75 N -0.27 0.59 -3.57 1.69 4.81 -1.45 -3.31 114.58 113.08 1yx4 h GLU 75 Ca -0.29 -0.32 -0.54 0.00 -0.13 0.00 0.00 59.36 58.08 1yx4 h GLU 75 Cb 1.78 0.02 0.02 0.00 0.63 0.00 0.00 28.75 31.19 1yx4 h GLU 75 CO 0.08 0.92 2.96 0.34 -0.73 0.00 0.00 179.01 182.58 1yx4 n PHE 76 N -4.34 2.00 0.04 0.92 -0.00 -1.07 -4.02 117.46 110.99 1yx4 n PHE 76 Ca -0.05 -2.36 0.00 0.00 -0.00 0.00 0.00 57.45 55.04 1yx4 n PHE 76 Cb 0.45 -2.01 0.00 0.00 -0.00 0.00 0.00 39.48 37.92 1yx4 n PHE 76 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yx4 n GLY 77 N 3.89 -0.21 3.70 7.13 0.00 -1.25 -4.92 105.19 113.53 1yx4 n GLY 77 Ca 0.55 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.19 1yx4 n GLY 77 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1yx4 s ARG 78 N -1.32 4.28 -0.26 1.61 1.70 -1.26 -4.96 118.95 118.76 1yx4 s ARG 78 Ca 0.00 0.45 0.13 0.00 -0.47 0.00 0.00 55.73 55.84 1yx4 s ARG 78 Cb 0.00 -3.49 0.47 0.00 -0.57 0.00 0.00 34.95 31.36 1yx4 s ARG 78 CO 0.00 0.03 1.17 2.41 -1.08 0.00 0.00 175.30 177.83 1yx4 n THR 79 N 4.03 2.03 -1.26 4.99 -1.04 -1.26 -4.78 114.28 116.98 1yx4 n THR 79 Ca -0.06 -3.59 -0.23 0.00 -2.04 0.00 0.00 64.05 58.13 1yx4 n THR 79 Cb 0.51 -0.29 0.17 0.00 -1.82 0.00 0.00 70.33 68.91 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 -0.67 4.63 3.52 3.41 0.00 -1.26 -4.86 105.19 109.96 1yx4 n GLY 80 Ca 0.29 -1.19 -0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 -3.33 -0.69 -0.02 0.99 0.05 -1.26 -5.13 118.68 109.29 1yx4 s LEU 81 Ca 0.56 0.98 -0.30 0.00 0.05 0.00 0.00 54.13 55.43 1yx4 s LEU 81 Cb 0.48 1.84 -0.04 0.00 -2.05 0.00 0.00 46.19 46.41 1yx4 s LEU 81 CO 0.09 -0.14 1.28 -2.16 -0.55 0.00 0.00 176.35 174.87 1yx4 s PRO 82 N 2.22 4.33 -1.33 1.48 0.04 -1.26 -4.94 135.00 135.54 1yx4 s PRO 82 Ca -0.05 1.80 -0.14 0.00 0.04 0.00 0.00 61.00 62.65 1yx4 s PRO 82 Cb -0.06 -3.54 0.10 0.00 0.04 0.00 0.00 34.50 31.03 1yx4 s PRO 82 CO -0.17 -0.48 1.86 -0.40 0.04 0.00 0.00 177.00 177.85 1yx4 n ASP 83 N 5.16 4.68 0.25 6.66 5.75 -1.26 -4.74 116.55 133.05 1yx4 n ASP 83 Ca 0.12 -2.94 0.09 0.00 -0.01 0.00 0.00 54.79 52.04 1yx4 n ASP 83 Cb 0.45 -1.64 0.64 0.00 -1.03 0.00 0.00 41.12 39.54 1yx4 n ASP 83 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1yx4 h LEU 84 N 10.36 0.00 -1.35 -2.12 3.38 -1.97 -1.61 115.31 122.00 1yx4 h LEU 84 Ca 0.45 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.36 1yx4 h LEU 84 Cb 0.75 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 1yx4 h LEU 84 CO 1.59 0.09 -0.33 0.77 0.09 0.00 0.00 178.44 180.65 1yx4 h SER 85 N 0.00 0.00 -0.99 -0.43 4.64 -2.03 -2.73 113.55 112.01 1yx4 h SER 85 Ca -0.00 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.71 1yx4 h SER 85 Cb 0.17 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 61.96 1yx4 h SER 85 CO 0.01 0.33 0.76 -0.24 -0.87 0.00 0.00 176.83 176.82 1yx4 n SER 86 N -4.07 5.97 -4.22 4.97 2.88 -0.61 -4.92 113.62 113.63 1yx4 n SER 86 Ca -0.02 -3.71 -0.32 0.00 -1.33 0.00 0.00 58.87 53.49 1yx4 n SER 86 Cb 0.38 -0.91 -0.17 0.00 -0.75 0.00 0.00 64.21 62.76 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 -3.60 2.94 1.08 -1.46 1.00 -1.03 -5.04 119.30 113.19 1yx4 s MET 87 Ca 0.61 -0.86 -0.16 0.00 0.00 0.00 0.00 55.69 55.28 1yx4 s MET 87 Cb 0.50 -2.25 0.23 0.00 0.00 0.00 0.00 34.83 33.31 1yx4 s MET 87 CO 0.04 0.20 1.14 0.95 0.00 0.00 0.00 175.02 177.35 1yx4 s THR 88 N 0.29 1.81 0.56 2.05 -4.23 -1.26 -4.70 115.64 110.16 1yx4 s THR 88 Ca -0.17 0.00 0.25 0.00 -1.18 0.00 0.00 61.69 60.58 1yx4 s THR 88 Cb -0.17 -2.61 0.34 0.00 1.34 0.00 0.00 72.50 71.39 1yx4 s THR 88 CO 0.08 0.00 2.13 1.05 -0.54 0.00 0.00 174.62 177.34 1yx4 h GLU 89 N -2.13 0.00 0.12 3.99 4.11 -2.00 -1.61 114.58 117.06 1yx4 h GLU 89 Ca -0.48 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 58.64 1yx4 h GLU 89 Cb 1.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.54 1yx4 h GLU 89 CO 0.44 0.00 -1.56 0.93 0.07 0.00 0.00 179.01 178.89 1yx4 h GLU 90 N 0.00 0.26 0.43 1.06 3.07 -1.98 -3.06 114.58 114.36 1yx4 h GLU 90 Ca 0.07 -0.44 -0.01 0.00 -0.50 0.00 0.00 59.36 58.48 1yx4 h GLU 90 Cb 0.35 0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 1yx4 h GLU 90 CO -0.00 1.12 -0.39 0.93 -1.40 0.00 0.00 179.01 179.27 1yx4 h GLU 91 N 0.07 -0.78 -0.08 2.33 3.07 -1.61 0.30 114.58 117.88 1yx4 h GLU 91 Ca -0.26 0.05 0.02 0.00 -0.50 0.00 0.00 59.36 58.68 1yx4 h GLU 91 Cb 2.02 0.18 -0.00 0.00 -0.84 0.00 0.00 28.75 30.11 1yx4 h GLU 91 CO 0.16 -0.52 0.06 1.96 -1.40 0.00 0.00 179.01 179.27 1yx4 h GLN 92 N -0.81 0.00 -0.20 2.33 4.20 -1.68 -1.75 115.11 117.20 1yx4 h GLN 92 Ca -0.06 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 1yx4 h GLN 92 Cb 0.69 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 1yx4 h GLN 92 CO -0.03 0.00 0.03 0.82 -0.67 0.00 0.00 178.83 178.98 1yx4 h ILE 93 N 0.00 1.23 -0.07 2.54 2.04 -1.17 -1.52 117.51 120.56 1yx4 h ILE 93 Ca 0.04 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.15 1yx4 h ILE 93 Cb 0.15 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1yx4 h ILE 93 CO -0.00 0.24 0.09 0.00 0.00 0.00 0.00 178.15 178.48 1yx4 h ALA 94 N 0.82 1.57 0.12 1.87 0.00 0.47 0.39 119.26 124.50 1yx4 h ALA 94 Ca 0.06 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 1yx4 h ALA 94 Cb 0.33 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.15 1yx4 h ALA 94 CO 0.01 -0.13 -0.71 -0.92 0.00 0.00 0.00 179.25 177.50 1yx4 h TYR 95 N 0.00 0.49 0.00 0.00 3.20 -1.15 -2.37 116.97 117.13 1yx4 h TYR 95 Ca 0.03 -0.35 -0.16 0.00 3.14 0.00 0.00 58.73 61.40 1yx4 h TYR 95 Cb 0.21 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 1yx4 h TYR 95 CO 0.00 1.26 -0.75 0.00 -1.64 0.00 0.00 178.16 177.03 1yx4 h ALA 96 N 0.09 0.72 0.00 1.82 0.00 -0.53 -2.83 119.26 118.53 1yx4 h ALA 96 Ca -0.12 -0.68 -0.08 0.00 0.00 0.00 0.00 54.91 54.02 1yx4 h ALA 96 Cb 1.55 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 1yx4 h ALA 96 CO 0.13 0.94 -0.40 1.98 0.00 0.00 0.00 179.25 181.91 1yx4 h MET 97 N 0.00 0.00 0.00 0.00 1.85 -0.35 -2.78 114.93 113.64 1yx4 h MET 97 Ca -0.01 0.00 -0.18 0.00 -0.61 0.00 0.00 59.70 58.90 1yx4 h MET 97 Cb 1.36 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 33.37 1yx4 h MET 97 CO 0.10 0.40 -0.88 1.96 -0.40 0.00 0.00 176.91 178.08 1yx4 h GLN 98 N 0.00 0.00 0.00 0.39 1.08 -1.35 -2.51 115.11 112.73 1yx4 h GLN 98 Ca -0.00 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 1yx4 h GLN 98 Cb 1.28 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.71 1yx4 h GLN 98 CO 0.05 0.88 -0.64 0.52 -0.95 0.00 0.00 178.83 178.69 1yx4 h MET 99 N 0.00 0.00 0.00 1.46 2.86 -1.51 -3.12 114.93 114.62 1yx4 h MET 99 Ca -0.01 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.40 1yx4 h MET 99 Cb 1.68 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 33.30 1yx4 h MET 99 CO 0.11 0.10 -1.58 -1.13 1.06 0.00 0.00 176.91 175.48 1yx4 n SER 100 N -2.92 0.84 0.13 1.22 3.41 -1.05 -4.05 113.62 111.20 1yx4 n SER 100 Ca 0.00 0.39 0.05 0.00 -0.26 0.00 0.00 58.87 59.05 1yx4 n SER 100 Cb 0.60 0.08 0.03 0.00 -0.26 0.00 0.00 64.21 64.67 1yx4 n SER 100 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1yx4 h LEU 101 N 0.00 0.00 -1.03 1.04 3.38 -1.56 -3.25 115.31 113.89 1yx4 h LEU 101 Ca -0.23 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 1yx4 h LEU 101 Cb 1.80 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.55 1yx4 h LEU 101 CO 0.06 0.36 -0.08 0.06 0.09 0.00 0.00 178.44 178.93 1yx4 h GLN 102 N 0.00 0.00 0.00 1.13 3.07 -1.68 -3.48 115.11 114.14 1yx4 h GLN 102 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.71 1yx4 h GLN 102 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.86 1yx4 h GLN 102 CO 0.04 0.08 0.00 0.41 0.09 0.00 0.00 178.83 179.45 1yx4 n GLY 103 N 0.32 3.41 2.75 0.06 0.00 -1.23 -5.05 105.19 105.46 1yx4 n GLY 103 Ca 0.01 -1.33 -0.29 0.00 0.00 0.00 0.00 46.02 44.42 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 2.74 -0.39 4.61 0.00 -1.26 -4.92 121.76 122.54 1yx4 s ALA 104 Ca 0.00 -3.08 0.11 0.00 0.00 0.00 0.00 51.96 48.99 1yx4 s ALA 104 Cb 0.00 -1.97 0.38 0.00 0.00 0.00 0.00 23.12 21.53 1yx4 s ALA 104 CO 0.00 -2.05 1.08 0.39 0.00 0.00 0.00 175.76 175.18 1yx4 n GLU 105 N 2.84 1.09 -0.00 0.00 4.71 -1.26 -4.91 120.64 123.12 1yx4 n GLU 105 Ca 0.15 -2.47 -0.00 0.00 -0.01 0.00 0.00 57.16 54.83 1yx4 n GLU 105 Cb 0.37 -0.89 -0.00 0.00 -1.01 0.00 0.00 31.44 29.90 1yx4 n GLU 105 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1yx4 n PHE 106 N -0.05 0.01 -1.12 -0.32 3.01 -1.26 -4.70 117.46 113.04 1yx4 n PHE 106 Ca 0.07 0.01 0.04 0.00 1.01 0.00 0.00 57.45 58.58 1yx4 n PHE 106 Cb 0.77 -0.10 0.25 0.00 -0.01 0.00 0.00 39.48 40.38 1yx4 n PHE 106 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1yx4 n GLY 107 N 1.58 4.23 2.88 1.37 0.00 -1.26 -4.70 105.19 109.29 1yx4 n GLY 107 Ca -0.00 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.65 3.55 0.02 1.61 7.27 -1.26 -4.71 117.38 123.21 1yx4 n GLN 108 Ca 0.26 -4.83 0.00 0.00 0.07 0.00 0.00 57.00 52.50 1yx4 n GLN 108 Cb 0.98 -2.28 0.00 0.00 2.41 0.00 0.00 30.24 31.35 1yx4 n GLN 108 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1yx4 n ALA 109 N -0.17 0.00 -1.42 1.69 0.00 -1.26 -4.92 120.51 114.43 1yx4 n ALA 109 Ca 0.33 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.41 1yx4 n ALA 109 Cb 0.37 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.78 1yx4 n ALA 109 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1yx4 n GLU 110 N -2.46 3.67 -4.09 0.00 2.13 -1.26 -4.91 120.64 113.71 1yx4 n GLU 110 Ca 0.00 -2.33 -0.31 0.00 0.66 0.00 0.00 57.16 55.18 1yx4 n GLU 110 Cb 0.00 -2.66 -0.07 0.00 0.27 0.00 0.00 31.44 28.98 1yx4 n GLU 110 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1yx4 s SER 111 N 1.73 5.35 0.00 4.31 1.04 -1.26 -5.14 113.70 119.73 1yx4 s SER 111 Ca 0.66 -0.06 0.00 0.00 0.48 0.00 0.00 55.95 57.04 1yx4 s SER 111 Cb 0.20 -1.39 0.00 0.00 0.10 0.00 0.00 66.02 64.93 1yx4 s SER 111 CO -0.07 0.18 0.00 0.00 0.98 0.00 0.00 173.24 174.34