#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ws9 s LEU 3 N 0.00 3.40 0.28 0.99 1.43 -1.26 -4.90 118.68 118.62 1ws9 s LEU 3 Ca 0.00 1.76 -0.05 0.00 -1.03 0.00 0.00 54.13 54.82 1ws9 s LEU 3 Cb 0.00 -4.52 0.54 0.00 0.03 0.00 0.00 46.19 42.24 1ws9 s LEU 3 CO 0.00 -1.25 1.52 1.87 0.23 0.00 0.00 176.35 178.73 1ws9 n TRP 4 N -2.34 0.44 0.57 0.29 -0.00 -1.26 -0.03 117.44 115.11 1ws9 n TRP 4 Ca 0.08 1.19 0.11 0.00 -0.00 0.00 0.00 57.50 58.88 1ws9 n TRP 4 Cb 0.53 -1.12 0.44 0.00 -0.00 0.00 0.00 31.31 31.16 1ws9 n TRP 4 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 177.69 179.66 1ws9 n PHE 5 N -5.55 0.41 -2.91 5.87 1.16 -1.26 -4.79 117.46 110.39 1ws9 n PHE 5 Ca 0.18 0.15 -0.22 0.00 -1.87 0.00 0.00 57.45 55.68 1ws9 n PHE 5 Cb 0.57 -0.74 0.02 0.00 -1.61 0.00 0.00 39.48 37.72 1ws9 n PHE 5 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 1ws9 s GLU 6 N -3.12 2.93 -0.06 3.97 2.02 0.95 -5.04 118.70 120.37 1ws9 s GLU 6 Ca 0.08 -0.58 -0.30 0.00 0.02 0.00 0.00 54.97 54.19 1ws9 s GLU 6 Cb 0.11 -2.55 -0.03 0.00 0.10 0.00 0.00 34.13 31.76 1ws9 s GLU 6 CO 0.40 -0.37 1.23 -1.21 0.02 0.00 0.00 175.26 175.33 1ws9 s GLU 7 N -4.60 4.33 1.21 1.61 2.02 -1.26 -4.76 118.70 117.26 1ws9 s GLU 7 Ca 0.51 1.71 -0.20 0.00 0.02 0.00 0.00 54.97 57.01 1ws9 s GLU 7 Cb -0.10 -3.58 0.29 0.00 0.10 0.00 0.00 34.13 30.85 1ws9 s GLU 7 CO 0.38 -0.48 1.13 0.20 0.02 0.00 0.00 175.26 176.51 1ws9 s GLY 8 N 1.57 1.61 0.15 -1.39 0.00 -1.26 -4.69 107.32 103.31 1ws9 s GLY 8 Ca 0.57 -1.06 -0.16 0.00 0.00 0.00 0.00 44.72 44.07 1ws9 s GLY 8 CO 0.22 -0.14 1.80 0.00 0.00 0.00 0.00 173.10 174.98 1ws9 h ALA 9 N -2.60 0.49 -0.43 3.20 0.00 -1.95 -1.91 119.26 116.06 1ws9 h ALA 9 Ca -0.43 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 1ws9 h ALA 9 Cb 1.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1ws9 h ALA 9 CO 0.31 -0.10 0.09 1.49 0.00 0.00 0.00 179.25 181.04 1ws9 h GLU 10 N 0.47 0.69 -0.07 0.00 4.81 -2.00 -2.72 114.58 115.77 1ws9 h GLU 10 Ca 0.15 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1ws9 h GLU 10 Cb -0.01 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 1ws9 h GLU 10 CO -0.06 0.71 0.03 0.93 -0.73 0.00 0.00 179.01 179.88 1ws9 h GLU 11 N 0.56 0.06 0.00 1.92 5.08 -1.83 -2.90 114.58 117.47 1ws9 h GLU 11 Ca 0.13 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1ws9 h GLU 11 Cb 0.33 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1ws9 h GLU 11 CO 0.00 0.04 0.00 0.07 -1.00 0.00 0.00 179.01 178.13 1ws9 h ARG 12 N 0.07 0.00 0.00 2.33 0.11 -1.37 0.21 114.38 115.72 1ws9 h ARG 12 Ca 0.03 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.03 1ws9 h ARG 12 Cb 0.01 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.08 1ws9 h ARG 12 CO -0.02 0.00 -0.36 1.96 0.10 0.00 0.00 179.97 181.65 1ws9 h GLN 13 N 0.00 0.00 0.02 0.08 4.20 -1.29 -0.41 115.11 117.71 1ws9 h GLN 13 Ca 0.00 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.41 1ws9 h GLN 13 Cb 0.61 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.36 1ws9 h GLN 13 CO 0.00 0.36 -1.63 0.28 -0.67 0.00 0.00 178.83 177.16 1ws9 n VAL 14 N -3.44 1.57 0.19 -0.54 0.31 -0.93 -4.40 118.33 111.09 1ws9 n VAL 14 Ca 0.00 -0.20 0.04 0.00 -0.01 0.00 0.00 64.34 64.18 1ws9 n VAL 14 Cb 0.53 -1.95 0.38 0.00 -0.91 0.00 0.00 33.84 31.89 1ws9 n VAL 14 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1ws9 h LEU 15 N -0.81 0.00 0.99 7.52 3.38 -0.66 -2.71 115.31 123.01 1ws9 h LEU 15 Ca -0.43 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 1ws9 h LEU 15 Cb 1.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.24 1ws9 h LEU 15 CO -0.20 0.37 -0.49 1.23 0.09 0.00 0.00 178.44 179.44 1ws9 h GLY 16 N 1.38 -1.41 2.00 0.83 0.00 -1.27 0.11 103.07 104.71 1ws9 h GLY 16 Ca -0.00 0.53 -0.08 0.00 0.00 0.00 0.00 47.33 47.77 1ws9 h GLY 16 CO 0.05 -0.51 -0.40 -0.56 0.00 0.00 0.00 176.54 175.12 1ws9 h PRO 17 N -1.34 0.00 -0.43 4.80 0.13 -1.77 -2.42 132.00 130.98 1ws9 h PRO 17 Ca -0.14 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.98 1ws9 h PRO 17 Cb 1.03 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 1ws9 h PRO 17 CO 0.22 0.40 0.22 0.35 -0.23 0.00 0.00 178.00 178.95 1ws9 h PHE 18 N 0.00 0.61 -0.61 1.56 -0.00 -1.32 0.41 116.94 117.59 1ws9 h PHE 18 Ca -0.00 -0.02 -0.06 0.00 -0.00 0.00 0.00 57.97 57.88 1ws9 h PHE 18 Cb 0.74 -0.19 -0.03 0.00 -0.00 0.00 0.00 35.95 36.48 1ws9 h PHE 18 CO 0.00 0.49 0.14 0.00 -0.00 0.00 0.00 178.31 178.93 1ws9 h ARG 19 N 0.55 0.96 -0.48 1.11 3.08 -0.54 -0.70 114.38 118.37 1ws9 h ARG 19 Ca 0.15 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 1ws9 h ARG 19 Cb 0.10 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1ws9 h ARG 19 CO -0.02 0.87 0.21 0.93 -1.07 0.00 0.00 179.97 180.89 1ws9 h GLU 20 N 0.92 0.70 -0.57 0.04 4.39 -0.93 -0.29 114.58 118.85 1ws9 h GLU 20 Ca 0.20 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.78 1ws9 h GLU 20 Cb 0.35 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 1ws9 h GLU 20 CO 0.00 0.61 0.34 0.35 -1.16 0.00 0.00 179.01 179.15 1ws9 h PHE 21 N 0.63 0.75 -0.44 4.33 3.57 -0.54 -2.06 116.94 123.18 1ws9 h PHE 21 Ca 0.16 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 1ws9 h PHE 21 Cb 0.15 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 1ws9 h PHE 21 CO -0.00 0.52 0.23 -0.07 -2.23 0.00 0.00 178.31 176.76 1ws9 h LEU 22 N 0.77 0.56 -0.73 0.59 3.38 -0.76 0.21 115.31 119.32 1ws9 h LEU 22 Ca 0.20 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1ws9 h LEU 22 Cb -0.01 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1ws9 h LEU 22 CO -0.04 0.50 0.44 0.11 0.09 0.00 0.00 178.44 179.54 1ws9 h LYS 23 N 0.57 0.99 0.09 1.13 1.57 -0.87 0.25 116.57 120.30 1ws9 h LYS 23 Ca 0.15 -0.09 -0.29 0.00 -1.87 0.00 0.00 60.65 58.56 1ws9 h LYS 23 Cb 0.07 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1ws9 h LYS 23 CO -0.02 0.70 -1.42 0.00 -0.57 0.00 0.00 179.45 178.13 1ws9 h ALA 24 N 1.23 0.30 0.00 3.86 0.00 -1.21 -3.36 119.26 120.08 1ws9 h ALA 24 Ca 0.26 -1.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.04 1ws9 h ALA 24 Cb -0.04 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ws9 h ALA 24 CO -0.05 1.17 -1.61 0.39 0.00 0.00 0.00 179.25 179.15 1ws9 n GLU 25 N -3.42 0.85 -0.12 0.00 -0.58 0.71 -4.68 120.64 113.41 1ws9 n GLU 25 Ca -0.13 -0.08 -0.22 0.00 -0.42 0.00 0.00 57.16 56.31 1ws9 n GLU 25 Cb 1.03 -1.29 -0.09 0.00 -0.57 0.00 0.00 31.44 30.52 1ws9 n GLU 25 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1ws9 n VAL 26 N -2.05 1.29 -0.27 2.62 0.31 -0.32 -4.67 118.33 115.23 1ws9 n VAL 26 Ca -0.07 -0.39 0.02 0.00 -0.01 0.00 0.00 64.34 63.90 1ws9 n VAL 26 Cb 0.46 -1.62 0.15 0.00 -0.91 0.00 0.00 33.84 31.93 1ws9 n VAL 26 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ws9 h ALA 27 N -0.53 1.07 -0.97 3.52 0.00 -1.17 -3.08 119.26 118.11 1ws9 h ALA 27 Ca -0.56 0.05 0.14 0.00 0.00 0.00 0.00 54.91 54.54 1ws9 h ALA 27 Cb 1.62 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.24 1ws9 h ALA 27 CO -0.26 0.01 0.61 -1.35 0.00 0.00 0.00 179.25 178.26 1ws9 h PRO 28 N 0.68 0.81 -0.67 0.00 0.11 -1.83 -2.76 132.00 128.34 1ws9 h PRO 28 Ca 0.37 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.43 1ws9 h PRO 28 Cb 0.38 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.30 1ws9 h PRO 28 CO -0.26 0.54 0.00 0.41 -0.21 0.00 0.00 178.00 178.48 1ws9 n GLY 29 N -1.38 2.60 0.13 -0.55 0.00 -1.17 -4.57 105.19 100.26 1ws9 n GLY 29 Ca 0.19 -0.76 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 1ws9 n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ws9 h ALA 30 N 3.97 0.32 -0.74 4.61 0.00 -1.47 -0.52 119.26 125.43 1ws9 h ALA 30 Ca 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1ws9 h ALA 30 Cb 1.05 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1ws9 h ALA 30 CO 0.04 -0.14 0.37 0.00 0.00 0.00 0.00 179.25 179.52 1ws9 h ALA 31 N 1.01 0.95 -0.11 0.00 0.00 -1.80 -1.73 119.26 117.57 1ws9 h ALA 31 Ca 0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1ws9 h ALA 31 Cb 0.08 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ws9 h ALA 31 CO -0.01 0.50 -0.00 1.49 0.00 0.00 0.00 179.25 181.23 1ws9 h GLU 32 N 1.03 0.19 -0.51 0.00 4.81 -1.82 -2.72 114.58 115.55 1ws9 h GLU 32 Ca 0.25 -0.06 0.07 0.00 -0.13 0.00 0.00 59.36 59.49 1ws9 h GLU 32 Cb 0.10 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1ws9 h GLU 32 CO -0.03 0.44 0.34 0.00 -0.73 0.00 0.00 179.01 179.03 1ws9 h ARG 33 N -0.09 0.42 0.00 1.92 3.08 -0.96 0.23 114.38 118.98 1ws9 h ARG 33 Ca 0.03 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 1ws9 h ARG 33 Cb 0.35 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1ws9 h ARG 33 CO 0.01 0.28 -0.27 0.22 -1.07 0.00 0.00 179.97 179.13 1ws9 h ASP 34 N 0.43 0.00 0.14 7.04 1.82 -1.04 0.31 116.42 125.12 1ws9 h ASP 34 Ca 0.23 0.00 -0.35 0.00 -0.39 0.00 0.00 57.03 56.52 1ws9 h ASP 34 Cb 0.34 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.34 1ws9 h ASP 34 CO -0.06 0.27 -1.83 0.03 -1.61 0.00 0.00 179.24 176.04 1ws9 h ARG 35 N 0.00 0.30 0.00 0.28 3.08 -0.46 -3.41 114.38 114.18 1ws9 h ARG 35 Ca -0.00 -0.51 -0.29 0.00 0.07 0.00 0.00 59.98 59.24 1ws9 h ARG 35 Cb 0.54 0.19 -0.05 0.00 0.08 0.00 0.00 29.97 30.73 1ws9 h ARG 35 CO 0.04 1.25 -1.67 1.79 -1.07 0.00 0.00 179.97 180.30 1ws9 h THR 36 N 0.01 0.89 0.00 2.04 1.35 -0.69 -3.48 112.91 113.03 1ws9 h THR 36 Ca -0.38 -2.73 0.00 0.00 -0.55 0.00 0.00 66.41 62.74 1ws9 h THR 36 Cb 2.01 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 70.87 1ws9 h THR 36 CO 0.11 0.51 0.00 0.61 -0.25 0.00 0.00 175.52 176.50 1ws9 n GLY 37 N 1.55 0.41 3.63 5.82 0.00 0.11 -4.95 105.19 111.75 1ws9 n GLY 37 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1ws9 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ws9 s ALA 38 N -1.82 3.20 0.15 4.61 0.00 -1.26 -4.42 121.76 122.22 1ws9 s ALA 38 Ca 0.00 0.61 -0.32 0.00 0.00 0.00 0.00 51.96 52.24 1ws9 s ALA 38 Cb 0.00 -3.90 -0.12 0.00 0.00 0.00 0.00 23.12 19.10 1ws9 s ALA 38 CO 0.00 -2.08 1.73 0.34 0.00 0.00 0.00 175.76 175.75 1ws9 n PHE 39 N 8.96 2.57 -1.03 0.00 -0.00 -1.26 -4.87 117.46 121.83 1ws9 n PHE 39 Ca 0.21 0.03 -0.32 0.00 -0.00 0.00 0.00 57.45 57.38 1ws9 n PHE 39 Cb 0.45 -2.66 -0.03 0.00 -0.00 0.00 0.00 39.48 37.24 1ws9 n PHE 39 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1ws9 n PRO 40 N 4.52 2.39 -0.10 -7.13 -0.04 -1.26 -4.69 135.00 128.69 1ws9 n PRO 40 Ca 0.17 -1.80 0.12 0.00 -0.04 0.00 0.00 63.50 61.95 1ws9 n PRO 40 Cb 0.34 -2.70 0.49 0.00 -0.04 0.00 0.00 33.50 31.59 1ws9 n PRO 40 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1ws9 h TRP 41 N 6.31 0.47 -0.42 0.54 4.06 -2.00 -1.41 115.95 123.49 1ws9 h TRP 41 Ca 0.57 0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.54 1ws9 h TRP 41 Cb 0.33 -0.15 -0.02 0.00 -1.00 0.00 0.00 29.16 28.32 1ws9 h TRP 41 CO 1.76 0.22 0.28 0.38 -3.56 0.00 0.00 178.44 177.52 1ws9 h ASP 42 N 0.44 0.48 0.84 -3.49 -0.00 -2.00 -2.96 116.42 109.73 1ws9 h ASP 42 Ca 0.28 -0.01 -0.16 0.00 -0.00 0.00 0.00 57.03 57.14 1ws9 h ASP 42 Cb 0.53 -0.12 -0.02 0.00 -0.00 0.00 0.00 39.33 39.72 1ws9 h ASP 42 CO -0.08 0.35 -0.75 -0.07 -0.00 0.00 0.00 179.24 178.69 1ws9 h LEU 43 N 0.57 0.00 -0.08 0.15 3.38 -1.69 -3.25 115.31 114.39 1ws9 h LEU 43 Ca 0.16 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.14 1ws9 h LEU 43 Cb -0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1ws9 h LEU 43 CO -0.04 0.75 0.01 0.58 0.09 0.00 0.00 178.44 179.84 1ws9 h VAL 44 N 0.00 0.96 -0.41 1.22 2.07 -1.18 0.77 116.25 119.69 1ws9 h VAL 44 Ca -0.01 -0.01 0.08 0.00 0.82 0.00 0.00 66.70 67.58 1ws9 h VAL 44 Cb 1.37 0.92 -0.07 0.00 -1.52 0.00 0.00 31.29 31.99 1ws9 h VAL 44 CO 0.10 0.01 -0.04 -0.09 0.02 0.00 0.00 177.57 177.57 1ws9 h ARG 45 N 0.04 0.06 -0.48 1.57 2.43 -1.57 -0.50 114.38 115.94 1ws9 h ARG 45 Ca 0.03 -0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.08 1ws9 h ARG 45 Cb 0.03 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1ws9 h ARG 45 CO -0.05 0.04 -0.16 0.87 -1.51 0.00 0.00 179.97 179.17 1ws9 h LYS 46 N 0.06 0.93 -0.16 0.20 1.57 -1.52 -3.02 116.57 114.64 1ws9 h LYS 46 Ca 0.20 -0.36 -0.10 0.00 -1.87 0.00 0.00 60.65 58.52 1ws9 h LYS 46 Cb 0.29 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1ws9 h LYS 46 CO -0.37 1.02 -0.35 -0.07 -0.57 0.00 0.00 179.45 179.11 1ws9 h LEU 47 N 0.82 0.34 -1.35 2.94 3.38 -0.42 -2.79 115.31 118.23 1ws9 h LEU 47 Ca 0.12 -0.13 0.10 0.00 0.09 0.00 0.00 57.88 58.07 1ws9 h LEU 47 Cb 0.70 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.31 1ws9 h LEU 47 CO 0.05 0.67 0.52 0.00 0.09 0.00 0.00 178.44 179.77 1ws9 h ALA 48 N 1.36 1.78 -0.15 1.53 0.00 -0.97 -0.01 119.26 122.80 1ws9 h ALA 48 Ca 0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ws9 h ALA 48 Cb 0.75 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1ws9 h ALA 48 CO 0.06 0.04 0.03 0.93 0.00 0.00 0.00 179.25 180.31 1ws9 h GLU 49 N 0.71 0.21 -0.01 0.00 5.08 -1.52 0.16 114.58 119.21 1ws9 h GLU 49 Ca 0.37 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 1ws9 h GLU 49 Cb 0.49 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1ws9 h GLU 49 CO -0.15 0.21 0.00 1.19 -1.00 0.00 0.00 179.01 179.26 1ws9 n PHE 50 N -4.44 0.01 -1.15 4.33 3.01 -0.04 -4.84 117.46 114.35 1ws9 n PHE 50 Ca -0.01 -0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.40 1ws9 n PHE 50 Cb 0.14 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.59 1ws9 n PHE 50 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ws9 n GLY 51 N 0.84 0.76 0.27 1.37 0.00 0.55 -4.91 105.19 104.07 1ws9 n GLY 51 Ca 0.16 -0.58 0.13 0.00 0.00 0.00 0.00 46.02 45.73 1ws9 n GLY 51 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ws9 h VAL 52 N 0.00 0.48 -0.40 1.61 2.07 -1.62 0.66 116.25 119.05 1ws9 h VAL 52 Ca -0.10 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1ws9 h VAL 52 Cb 0.40 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 1ws9 h VAL 52 CO 0.15 0.11 0.00 0.49 0.02 0.00 0.00 177.57 178.34 1ws9 n PHE 53 N -3.53 0.52 -2.11 1.57 3.01 -1.26 -4.11 117.46 111.55 1ws9 n PHE 53 Ca -0.01 -0.26 -0.00 0.00 1.01 0.00 0.00 57.45 58.19 1ws9 n PHE 53 Cb 0.25 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.72 1ws9 n PHE 53 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ws9 n GLY 54 N 1.45 0.73 0.32 1.37 0.00 -1.04 -3.81 105.19 104.21 1ws9 n GLY 54 Ca 0.19 -0.19 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1ws9 n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ws9 h ALA 55 N 0.23 0.92 0.00 4.61 0.00 -1.02 -0.79 119.26 123.20 1ws9 h ALA 55 Ca -0.13 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ws9 h ALA 55 Cb 1.42 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.77 1ws9 h ALA 55 CO -0.02 -0.48 -0.81 1.28 0.00 0.00 0.00 179.25 179.22 1ws9 n LEU 56 N -5.46 0.63 -4.72 0.00 4.77 -1.26 0.17 117.00 111.13 1ws9 n LEU 56 Ca 0.18 -0.02 -0.42 0.00 -0.03 0.00 0.00 56.01 55.72 1ws9 n LEU 56 Cb 0.60 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 1ws9 n LEU 56 CO -0.03 0.07 1.06 -0.69 -1.33 0.00 0.00 177.39 176.46 1ws9 s VAL 57 N -3.12 3.31 0.46 4.08 1.01 -0.39 -4.64 120.40 121.11 1ws9 s VAL 57 Ca 0.07 0.95 -0.24 0.00 0.00 0.00 0.00 61.98 62.76 1ws9 s VAL 57 Cb 0.15 -3.61 -0.07 0.00 0.00 0.00 0.00 36.38 32.85 1ws9 s VAL 57 CO 0.77 0.08 1.24 -2.16 0.00 0.00 0.00 175.10 175.02 1ws9 s PRO 58 N 1.05 3.72 0.46 2.72 0.04 -1.26 -0.69 135.00 141.04 1ws9 s PRO 58 Ca 0.64 1.98 0.25 0.00 0.04 0.00 0.00 61.00 63.91 1ws9 s PRO 58 Cb -0.37 -2.50 1.27 0.00 0.04 0.00 0.00 34.50 32.94 1ws9 s PRO 58 CO 0.31 -0.64 1.82 0.93 0.04 0.00 0.00 177.00 179.45 1ws9 h GLU 59 N 2.16 0.23 -0.35 4.56 5.08 -1.86 0.93 114.58 125.33 1ws9 h GLU 59 Ca -0.50 -0.01 0.10 0.00 -1.00 0.00 0.00 59.36 57.95 1ws9 h GLU 59 Cb 1.26 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1ws9 h GLU 59 CO 0.60 0.15 0.33 0.00 -1.00 0.00 0.00 179.01 179.10 1ws9 h ALA 60 N 1.56 2.11 -0.39 3.43 0.00 -1.90 0.33 119.26 124.39 1ws9 h ALA 60 Ca 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1ws9 h ALA 60 Cb 1.64 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1ws9 h ALA 60 CO -0.15 -0.52 0.00 0.66 0.00 0.00 0.00 179.25 179.24 1ws9 n TYR 61 N -3.93 0.91 -1.04 0.00 4.01 0.28 -4.94 117.16 112.45 1ws9 n TYR 61 Ca 0.06 -0.67 0.00 0.00 -0.16 0.00 0.00 57.90 57.13 1ws9 n TYR 61 Cb 0.50 -0.19 0.00 0.00 -0.31 0.00 0.00 39.34 39.34 1ws9 n TYR 61 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ws9 n GLY 62 N 0.30 1.01 3.16 2.72 0.00 0.12 -2.64 105.19 109.86 1ws9 n GLY 62 Ca 0.19 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 1ws9 n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ws9 n GLY 63 N -1.26 2.90 0.14 -0.02 0.00 -0.92 -4.60 105.19 101.43 1ws9 n GLY 63 Ca 0.00 -2.29 0.12 0.00 0.00 0.00 0.00 46.02 43.85 1ws9 n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ws9 h ALA 64 N 0.75 0.74 -2.59 4.61 0.00 -0.93 -3.21 119.26 118.63 1ws9 h ALA 64 Ca -0.30 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.22 1ws9 h ALA 64 Cb 1.06 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.80 1ws9 h ALA 64 CO 0.47 0.00 -0.46 0.41 0.00 0.00 0.00 179.25 179.67 1ws9 n GLY 65 N 1.19 0.14 3.82 0.00 0.00 0.13 -4.77 105.19 105.70 1ws9 n GLY 65 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1ws9 n GLY 65 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ws9 s LEU 66 N -5.58 2.58 0.67 0.99 1.43 0.13 -4.95 118.68 113.94 1ws9 s LEU 66 Ca 0.00 1.23 -0.08 0.00 -1.03 0.00 0.00 54.13 54.25 1ws9 s LEU 66 Cb 0.00 -3.84 0.03 0.00 0.03 0.00 0.00 46.19 42.42 1ws9 s LEU 66 CO 0.00 -1.94 1.01 -0.94 0.23 0.00 0.00 176.35 174.70 1ws9 s SER 67 N -4.00 5.19 0.19 2.29 1.04 -1.26 -4.53 113.70 112.62 1ws9 s SER 67 Ca 0.61 0.72 -0.09 0.00 0.48 0.00 0.00 55.95 57.67 1ws9 s SER 67 Cb -0.14 -1.51 0.08 0.00 0.10 0.00 0.00 66.02 64.56 1ws9 s SER 67 CO 0.54 -1.39 1.66 0.74 0.98 0.00 0.00 173.24 175.77 1ws9 h THR 68 N -0.51 1.27 -0.00 2.02 2.02 -1.96 -2.49 112.91 113.26 1ws9 h THR 68 Ca -0.45 -1.13 0.02 0.00 0.77 0.00 0.00 66.41 65.62 1ws9 h THR 68 Cb 1.28 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 1ws9 h THR 68 CO 0.62 0.41 -0.10 -0.09 0.37 0.00 0.00 175.52 176.73 1ws9 h ARG 69 N 1.00 -0.16 -0.58 6.66 2.43 -1.93 0.72 114.38 122.52 1ws9 h ARG 69 Ca 0.18 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 1ws9 h ARG 69 Cb 0.53 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 1ws9 h ARG 69 CO 0.03 -0.11 0.13 1.25 -1.51 0.00 0.00 179.97 179.75 1ws9 h LEU 70 N -0.17 0.89 -0.54 3.80 5.85 -1.94 -2.03 115.31 121.17 1ws9 h LEU 70 Ca 0.04 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.48 1ws9 h LEU 70 Cb 0.22 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1ws9 h LEU 70 CO -0.11 0.90 0.18 0.15 -0.34 0.00 0.00 178.44 179.22 1ws9 h PHE 71 N 0.84 0.86 -0.68 1.25 3.57 -1.27 -0.82 116.94 120.69 1ws9 h PHE 71 Ca 0.18 -0.08 0.06 0.00 3.53 0.00 0.00 57.97 61.66 1ws9 h PHE 71 Cb 0.37 -0.25 -0.06 0.00 2.79 0.00 0.00 35.95 38.80 1ws9 h PHE 71 CO 0.03 0.73 0.37 0.00 -2.23 0.00 0.00 178.31 177.21 1ws9 h ALA 72 N 1.04 0.92 -0.14 2.41 0.00 -0.64 0.65 119.26 123.50 1ws9 h ALA 72 Ca 0.18 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 1ws9 h ALA 72 Cb 0.27 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ws9 h ALA 72 CO -0.01 0.04 -0.31 0.00 0.00 0.00 0.00 179.25 178.97 1ws9 h ARG 73 N 0.68 0.27 -0.22 0.00 3.08 -0.98 -1.83 114.38 115.38 1ws9 h ARG 73 Ca 0.31 -0.10 -0.12 0.00 0.07 0.00 0.00 59.98 60.14 1ws9 h ARG 73 Cb 0.22 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1ws9 h ARG 73 CO -0.20 0.55 -0.36 0.52 -1.07 0.00 0.00 179.97 179.42 1ws9 h MET 74 N 0.23 0.47 -0.44 0.04 2.86 0.30 -1.35 114.93 117.03 1ws9 h MET 74 Ca 0.03 -0.22 -0.12 0.00 -2.06 0.00 0.00 59.70 57.33 1ws9 h MET 74 Cb 0.67 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 1ws9 h MET 74 CO 0.05 0.76 -0.22 0.28 1.06 0.00 0.00 176.91 178.85 1ws9 h VAL 75 N 0.40 1.27 -0.69 -2.22 2.07 -0.52 -1.46 116.25 115.09 1ws9 h VAL 75 Ca 0.04 -1.36 -0.06 0.00 0.82 0.00 0.00 66.70 66.14 1ws9 h VAL 75 Cb 0.82 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 1ws9 h VAL 75 CO 0.07 0.46 0.18 -0.08 0.02 0.00 0.00 177.57 178.22 1ws9 h GLU 76 N 0.78 1.10 -0.68 1.57 4.81 -1.02 -0.69 114.58 120.45 1ws9 h GLU 76 Ca 0.10 -0.26 -0.08 0.00 -0.13 0.00 0.00 59.36 59.00 1ws9 h GLU 76 Cb 0.77 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.97 1ws9 h GLU 76 CO 0.06 0.97 0.12 0.00 -0.73 0.00 0.00 179.01 179.44 1ws9 h ALA 77 N 1.08 0.90 0.36 2.92 0.00 -1.06 -2.23 119.26 121.22 1ws9 h ALA 77 Ca 0.22 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1ws9 h ALA 77 Cb 0.36 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ws9 h ALA 77 CO 0.00 0.66 -0.17 0.82 0.00 0.00 0.00 179.25 180.56 1ws9 h ILE 78 N 1.04 0.65 -0.96 0.00 2.04 -0.90 -3.05 117.51 116.33 1ws9 h ILE 78 Ca 0.21 -0.39 0.24 0.00 1.00 0.00 0.00 64.86 65.92 1ws9 h ILE 78 Cb 0.43 0.84 -0.07 0.00 -0.74 0.00 0.00 36.82 37.28 1ws9 h ILE 78 CO 0.01 0.07 0.64 0.00 0.00 0.00 0.00 178.15 178.88 1ws9 h ALA 79 N -0.15 2.37 -0.81 1.87 0.00 -1.08 0.10 119.26 121.57 1ws9 h ALA 79 Ca -0.05 0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.00 1ws9 h ALA 79 Cb 0.49 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1ws9 h ALA 79 CO 0.08 -0.69 0.53 -0.92 0.00 0.00 0.00 179.25 178.25 1ws9 h TYR 80 N 0.32 0.74 0.00 0.00 3.20 -1.28 -3.11 116.97 116.83 1ws9 h TYR 80 Ca 0.51 0.02 -0.19 0.00 3.14 0.00 0.00 58.73 62.21 1ws9 h TYR 80 Cb 1.43 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 39.42 1ws9 h TYR 80 CO -0.00 0.32 -1.93 0.66 -1.64 0.00 0.00 178.16 175.57 1ws9 n TYR 81 N -4.52 0.00 -3.29 -3.82 4.02 0.12 -4.77 117.16 104.91 1ws9 n TYR 81 Ca 0.14 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.98 1ws9 n TYR 81 Cb 0.39 -0.62 -0.06 0.00 -0.02 0.00 0.00 39.34 39.04 1ws9 n TYR 81 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1ws9 s ASP 82 N -4.53 -0.16 0.15 7.72 2.15 0.10 -4.70 116.67 117.40 1ws9 s ASP 82 Ca -0.07 0.18 -0.16 0.00 0.43 0.00 0.00 52.55 52.93 1ws9 s ASP 82 Cb 0.06 1.38 0.01 0.00 -0.30 0.00 0.00 42.92 44.08 1ws9 s ASP 82 CO 0.63 -0.31 1.77 1.23 -0.17 0.00 0.00 175.17 178.32 1ws9 h GLY 83 N 8.13 0.62 0.98 2.66 0.00 -1.80 -2.43 103.07 111.22 1ws9 h GLY 83 Ca -0.16 -0.27 0.01 0.00 0.00 0.00 0.00 47.33 46.91 1ws9 h GLY 83 CO 0.26 0.26 0.34 0.00 0.00 0.00 0.00 176.54 177.40 1ws9 h ALA 84 N 1.10 0.67 -0.66 3.60 0.00 -1.93 -1.13 119.26 120.91 1ws9 h ALA 84 Ca 0.15 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1ws9 h ALA 84 Cb 0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1ws9 h ALA 84 CO -0.03 0.09 0.27 1.25 0.00 0.00 0.00 179.25 180.84 1ws9 h LEU 85 N 0.70 0.88 -0.57 0.00 5.85 -1.89 0.10 115.31 120.39 1ws9 h LEU 85 Ca 0.20 -0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.71 1ws9 h LEU 85 Cb -0.06 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 1ws9 h LEU 85 CO -0.05 0.79 0.02 0.00 -0.34 0.00 0.00 178.44 178.86 1ws9 h ALA 86 N 1.34 0.77 -0.77 1.25 0.00 -0.92 0.20 119.26 121.12 1ws9 h ALA 86 Ca 0.22 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1ws9 h ALA 86 Cb 0.18 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1ws9 h ALA 86 CO -0.02 0.58 0.29 1.25 0.00 0.00 0.00 179.25 181.35 1ws9 h LEU 87 N 0.88 1.07 -0.27 0.00 5.85 -0.85 0.37 115.31 122.38 1ws9 h LEU 87 Ca 0.16 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.74 1ws9 h LEU 87 Cb 0.52 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1ws9 h LEU 87 CO 0.03 0.96 0.04 0.74 -0.34 0.00 0.00 178.44 179.87 1ws9 h THR 88 N 1.12 0.86 0.04 1.05 2.02 -0.53 -0.61 112.91 116.87 1ws9 h THR 88 Ca 0.25 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.38 1ws9 h THR 88 Cb 0.24 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 67.36 1ws9 h THR 88 CO -0.02 0.03 -0.02 0.58 0.37 0.00 0.00 175.52 176.46 1ws9 h VAL 89 N 0.14 1.26 -0.35 3.16 2.07 -0.76 -2.24 116.25 119.52 1ws9 h VAL 89 Ca 0.12 -1.00 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1ws9 h VAL 89 Cb 0.13 1.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.77 1ws9 h VAL 89 CO -0.17 0.25 0.07 0.00 0.02 0.00 0.00 177.57 177.74 1ws9 h ALA 90 N 0.43 0.37 -0.11 1.67 0.00 -0.21 -1.89 119.26 119.53 1ws9 h ALA 90 Ca -0.01 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ws9 h ALA 90 Cb 0.45 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1ws9 h ALA 90 CO 0.01 -0.33 -0.04 0.66 0.00 0.00 0.00 179.25 179.55 1ws9 h SER 91 N 0.19 0.22 -0.39 0.00 4.64 -1.19 -0.73 113.55 116.30 1ws9 h SER 91 Ca 0.17 -0.39 0.08 0.00 -0.47 0.00 0.00 61.79 61.18 1ws9 h SER 91 Cb 0.19 -0.06 -0.08 0.00 -0.31 0.00 0.00 62.40 62.13 1ws9 h SER 91 CO -0.22 0.56 -0.17 -0.74 -0.87 0.00 0.00 176.83 175.39 1ws9 h HIS 92 N -0.12 -0.42 -0.12 4.77 2.76 -1.27 -0.13 115.15 120.61 1ws9 h HIS 92 Ca 0.03 0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.19 1ws9 h HIS 92 Cb 0.47 0.25 -0.00 0.00 1.55 0.00 0.00 27.41 29.67 1ws9 h HIS 92 CO 0.06 -0.25 -0.10 -0.91 -1.30 0.00 0.00 177.93 175.43 1ws9 h ASN 93 N -0.10 0.30 -0.10 3.26 2.35 -1.34 -2.89 115.58 117.07 1ws9 h ASN 93 Ca 0.19 -0.46 -0.15 0.00 -0.55 0.00 0.00 56.30 55.34 1ws9 h ASN 93 Cb 0.39 -0.08 0.01 0.00 0.05 0.00 0.00 38.32 38.69 1ws9 h ASN 93 CO -0.46 0.69 -0.52 0.28 -1.65 0.00 0.00 177.43 175.78 1ws9 h SER 94 N -0.09 0.62 0.00 5.81 0.02 -0.91 0.03 113.55 119.03 1ws9 h SER 94 Ca 0.02 -0.65 0.00 0.00 -0.84 0.00 0.00 61.79 60.32 1ws9 h SER 94 Cb 0.60 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.95 1ws9 h SER 94 CO 0.03 1.17 0.00 0.18 -1.14 0.00 0.00 176.83 177.07 1ws9 n LEU 95 N -4.22 1.47 0.17 5.07 4.77 -0.08 -3.50 117.00 120.67 1ws9 n LEU 95 Ca -0.08 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.73 1ws9 n LEU 95 Cb 0.61 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.60 1ws9 n LEU 95 CO 0.46 0.00 0.52 0.00 -1.33 0.00 0.00 177.39 177.04 1ws9 h ALA 96 N -2.00 -1.05 0.46 -1.18 0.00 -1.71 0.14 119.26 113.92 1ws9 h ALA 96 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1ws9 h ALA 96 Cb 0.00 0.84 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1ws9 h ALA 96 CO 0.00 -1.14 -0.22 1.15 0.00 0.00 0.00 179.25 179.04 1ws9 h THR 97 N -0.83 0.54 -0.58 0.00 2.02 -1.67 -2.45 112.91 109.94 1ws9 h THR 97 Ca -0.03 -0.07 0.13 0.00 0.77 0.00 0.00 66.41 67.21 1ws9 h THR 97 Cb 0.78 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 1ws9 h THR 97 CO -0.20 0.01 0.40 1.23 0.37 0.00 0.00 175.52 177.33 1ws9 h GLY 98 N -0.66 0.36 1.22 2.16 0.00 -0.94 0.14 103.07 105.34 1ws9 h GLY 98 Ca -0.06 -0.10 -0.22 0.00 0.00 0.00 0.00 47.33 46.95 1ws9 h GLY 98 CO 0.10 0.05 -0.78 0.84 0.00 0.00 0.00 176.54 176.76 1ws9 h HIS 99 N 0.23 1.04 -0.25 5.60 6.17 -0.78 -1.60 115.15 125.57 1ws9 h HIS 99 Ca 0.28 -0.46 -0.16 0.00 0.71 0.00 0.00 60.37 60.74 1ws9 h HIS 99 Cb 0.77 -0.16 -0.01 0.00 2.52 0.00 0.00 27.41 30.54 1ws9 h HIS 99 CO -0.00 1.29 -0.50 0.82 0.71 0.00 0.00 177.93 180.25 1ws9 h ILE 100 N 0.52 1.30 -0.28 6.26 2.04 -0.83 -1.33 117.51 125.19 1ws9 h ILE 100 Ca -0.05 -1.71 -0.06 0.00 1.00 0.00 0.00 64.86 64.05 1ws9 h ILE 100 Cb 1.40 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 39.11 1ws9 h ILE 100 CO 0.16 0.54 -0.08 0.25 0.00 0.00 0.00 178.15 179.02 1ws9 h LEU 101 N 0.54 0.43 0.08 1.44 5.85 -0.99 0.25 115.31 122.91 1ws9 h LEU 101 Ca 0.02 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1ws9 h LEU 101 Cb 1.05 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.97 1ws9 h LEU 101 CO 0.10 0.55 -0.04 0.25 -0.34 0.00 0.00 178.44 178.97 1ws9 h LEU 102 N 0.43 -0.09 -0.22 2.25 5.85 -1.01 -3.40 115.31 119.11 1ws9 h LEU 102 Ca 0.09 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.34 1ws9 h LEU 102 Cb 0.40 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1ws9 h LEU 102 CO 0.02 0.57 -0.57 0.00 -0.34 0.00 0.00 178.44 178.12 1ws9 n ALA 103 N -2.61 3.65 -1.75 1.25 0.00 -0.53 -5.03 120.51 115.49 1ws9 n ALA 103 Ca -0.07 -0.43 -0.38 0.00 0.00 0.00 0.00 53.44 52.56 1ws9 n ALA 103 Cb 0.27 -0.51 0.03 0.00 0.00 0.00 0.00 19.45 19.24 1ws9 n ALA 103 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ws9 s GLY 104 N -2.19 2.86 0.69 0.00 0.00 0.08 -3.61 107.32 105.15 1ws9 s GLY 104 Ca 0.07 1.25 -0.11 0.00 0.00 0.00 0.00 44.72 45.93 1ws9 s GLY 104 CO 0.53 1.75 1.07 -1.35 0.00 0.00 0.00 173.10 175.10 1ws9 s SER 105 N -1.04 5.49 0.26 1.64 1.04 -1.26 -4.75 113.70 115.07 1ws9 s SER 105 Ca 0.70 1.36 -0.02 0.00 0.48 0.00 0.00 55.95 58.47 1ws9 s SER 105 Cb -0.38 -2.24 0.54 0.00 0.10 0.00 0.00 66.02 64.04 1ws9 s SER 105 CO 0.45 -1.34 1.73 -0.08 0.98 0.00 0.00 173.24 174.98 1ws9 h GLU 106 N -0.65 0.46 -0.67 4.02 4.57 -1.98 0.13 114.58 120.46 1ws9 h GLU 106 Ca -0.45 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 57.68 1ws9 h GLU 106 Cb 1.23 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.68 1ws9 h GLU 106 CO 0.61 0.31 0.30 0.00 -1.18 0.00 0.00 179.01 179.05 1ws9 h ALA 107 N 1.59 0.86 -0.42 2.92 0.00 -1.99 -1.45 119.26 120.77 1ws9 h ALA 107 Ca 0.46 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1ws9 h ALA 107 Cb 0.73 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1ws9 h ALA 107 CO -0.42 0.45 -0.23 1.96 0.00 0.00 0.00 179.25 181.00 1ws9 h GLN 108 N 0.93 0.85 -0.44 0.00 4.20 -1.36 -2.10 115.11 117.19 1ws9 h GLN 108 Ca 0.23 -0.36 -0.11 0.00 0.06 0.00 0.00 58.65 58.47 1ws9 h GLN 108 Cb 0.15 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 1ws9 h GLN 108 CO -0.03 0.99 -0.15 0.87 -0.67 0.00 0.00 178.83 179.84 1ws9 h LYS 109 N 0.74 0.84 -0.06 1.46 1.57 -0.61 0.44 116.57 120.95 1ws9 h LYS 109 Ca 0.10 -0.31 -0.12 0.00 -1.87 0.00 0.00 60.65 58.45 1ws9 h LYS 109 Cb 0.77 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 1ws9 h LYS 109 CO 0.06 0.93 -0.51 0.93 -0.57 0.00 0.00 179.45 180.30 1ws9 h GLU 110 N 0.74 0.17 0.24 3.15 5.08 -1.18 -1.44 114.58 121.34 1ws9 h GLU 110 Ca 0.11 -0.10 -0.32 0.00 -1.00 0.00 0.00 59.36 58.06 1ws9 h GLU 110 Cb 0.67 0.01 0.04 0.00 0.50 0.00 0.00 28.75 29.96 1ws9 h GLU 110 CO 0.05 0.64 -1.40 0.00 -1.00 0.00 0.00 179.01 177.30 1ws9 h ALA 111 N 1.35 -0.15 0.00 3.43 0.00 -1.11 -3.40 119.26 119.37 1ws9 h ALA 111 Ca 0.00 -0.84 -0.26 0.00 0.00 0.00 0.00 54.91 53.82 1ws9 h ALA 111 Cb 0.94 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 1ws9 h ALA 111 CO 0.07 0.65 -1.56 1.19 0.00 0.00 0.00 179.25 179.61 1ws9 n PHE 112 N -3.77 0.58 -0.21 0.00 3.01 0.12 -4.62 117.46 112.57 1ws9 n PHE 112 Ca -0.16 0.25 -0.01 0.00 1.01 0.00 0.00 57.45 58.54 1ws9 n PHE 112 Cb 1.07 -0.97 0.06 0.00 -0.01 0.00 0.00 39.48 39.63 1ws9 n PHE 112 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1ws9 h LEU 113 N -1.00 -0.61 -0.80 4.37 3.38 -1.43 -2.02 115.31 117.20 1ws9 h LEU 113 Ca -0.39 0.19 0.14 0.00 0.09 0.00 0.00 57.88 57.91 1ws9 h LEU 113 Cb 1.27 0.40 -0.09 0.00 0.09 0.00 0.00 40.66 42.33 1ws9 h LEU 113 CO -0.23 -0.21 0.38 -0.65 0.09 0.00 0.00 178.44 177.81 1ws9 h PRO 114 N -0.01 0.55 -0.03 1.13 0.11 -1.66 0.34 132.00 132.43 1ws9 h PRO 114 Ca 0.30 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 66.17 1ws9 h PRO 114 Cb 0.47 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.45 1ws9 h PRO 114 CO -0.65 0.36 -0.85 0.87 -0.21 0.00 0.00 178.00 177.52 1ws9 h LYS 115 N 0.56 0.37 -0.06 1.05 1.57 -1.70 -2.83 116.57 115.53 1ws9 h LYS 115 Ca 0.43 -0.36 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1ws9 h LYS 115 Cb 0.60 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 1ws9 h LYS 115 CO -0.36 1.03 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.44 1ws9 h LEU 116 N 0.22 0.13 -2.12 2.94 3.38 -0.71 -1.58 115.31 117.58 1ws9 h LEU 116 Ca -0.06 -0.43 0.08 0.00 0.09 0.00 0.00 57.88 57.56 1ws9 h LEU 116 Cb 1.47 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.17 1ws9 h LEU 116 CO 0.14 0.53 0.23 0.00 0.09 0.00 0.00 178.44 179.44 1ws9 h ALA 117 N 0.61 2.04 -0.00 1.53 0.00 -0.39 -1.59 119.26 121.46 1ws9 h ALA 117 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ws9 h ALA 117 Cb 0.48 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1ws9 h ALA 117 CO 0.01 -0.37 -0.58 -1.13 0.00 0.00 0.00 179.25 177.18 1ws9 n SER 118 N -4.07 0.62 0.00 0.00 3.41 -1.07 -3.19 113.62 109.32 1ws9 n SER 118 Ca 0.03 -0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.22 1ws9 n SER 118 Cb 0.38 0.38 0.00 0.00 -0.26 0.00 0.00 64.21 64.71 1ws9 n SER 118 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ws9 n GLY 119 N 1.49 1.44 0.14 5.00 0.00 -0.60 -4.82 105.19 107.84 1ws9 n GLY 119 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 1ws9 n GLY 119 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ws9 h GLU 120 N 3.04 -0.10 -4.85 1.61 5.08 -1.71 -3.37 114.58 114.28 1ws9 h GLU 120 Ca 0.00 0.01 -0.68 0.00 -1.00 0.00 0.00 59.36 57.69 1ws9 h GLU 120 Cb 0.00 0.02 -0.31 0.00 0.50 0.00 0.00 28.75 28.96 1ws9 h GLU 120 CO 0.00 -0.06 -0.71 0.00 -1.00 0.00 0.00 179.01 177.24 1ws9 s ALA 121 N -6.18 2.81 0.42 3.43 0.00 -0.63 -4.86 121.76 116.76 1ws9 s ALA 121 Ca -0.14 -1.54 -0.22 0.00 0.00 0.00 0.00 51.96 50.06 1ws9 s ALA 121 Cb 0.09 -1.86 -0.10 0.00 0.00 0.00 0.00 23.12 21.25 1ws9 s ALA 121 CO 0.67 -0.96 0.99 -0.51 0.00 0.00 0.00 175.76 175.95 1ws9 s LEU 122 N 1.34 4.02 -0.17 0.00 1.43 -1.26 -4.00 118.68 120.04 1ws9 s LEU 122 Ca -0.01 1.83 -0.07 0.00 -1.03 0.00 0.00 54.13 54.85 1ws9 s LEU 122 Cb -0.18 -4.40 -0.04 0.00 0.03 0.00 0.00 46.19 41.60 1ws9 s LEU 122 CO -0.02 -0.43 0.08 -0.83 0.23 0.00 0.00 176.35 175.38 1ws9 s GLY 123 N -1.94 1.97 -0.07 -3.19 0.00 -1.26 -0.59 107.32 102.23 1ws9 s GLY 123 Ca 0.61 -0.72 0.02 0.00 0.00 0.00 0.00 44.72 44.62 1ws9 s GLY 123 CO 0.19 -0.04 -0.11 0.00 0.00 0.00 0.00 173.10 173.14 1ws9 s ALA 124 N 0.06 2.80 -0.25 3.20 0.00 -0.41 -4.54 121.76 122.62 1ws9 s ALA 124 Ca 0.07 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.12 1ws9 s ALA 124 Cb -0.12 -1.14 0.06 0.00 0.00 0.00 0.00 23.12 21.92 1ws9 s ALA 124 CO 0.00 0.50 -0.08 -0.46 0.00 0.00 0.00 175.76 175.73 1ws9 s TRP 125 N -0.55 2.85 -0.49 0.00 -0.00 -1.26 -0.89 118.94 118.60 1ws9 s TRP 125 Ca 0.08 -2.07 -0.13 0.00 -0.00 0.00 0.00 56.10 53.98 1ws9 s TRP 125 Cb -0.12 -1.79 0.11 0.00 -0.00 0.00 0.00 33.47 31.67 1ws9 s TRP 125 CO 0.02 -0.83 0.40 0.20 -0.00 0.00 0.00 176.95 176.74 1ws9 s GLY 126 N 1.24 2.05 -0.03 5.86 0.00 0.18 -4.75 107.32 111.88 1ws9 s GLY 126 Ca -0.07 -2.38 -0.04 0.00 0.00 0.00 0.00 44.72 42.24 1ws9 s GLY 126 CO -0.06 1.11 -0.08 -0.10 0.00 0.00 0.00 173.10 173.97 1ws9 n LEU 127 N 5.11 0.81 -4.76 0.66 7.94 -1.26 -1.71 117.00 123.78 1ws9 n LEU 127 Ca -0.12 0.12 -0.39 0.00 -1.11 0.00 0.00 56.01 54.51 1ws9 n LEU 127 Cb 0.41 -0.29 0.01 0.00 0.53 0.00 0.00 43.42 44.08 1ws9 n LEU 127 CO 0.48 -0.18 0.99 -0.89 -1.11 0.00 0.00 177.39 176.67 1ws9 s THR 128 N -2.16 2.42 0.20 1.96 2.01 -1.26 -4.92 115.64 113.90 1ws9 s THR 128 Ca -0.08 0.36 0.03 0.00 0.31 0.00 0.00 61.69 62.31 1ws9 s THR 128 Cb 0.02 -3.21 -0.05 0.00 0.01 0.00 0.00 72.50 69.28 1ws9 s THR 128 CO 0.11 0.04 -0.01 -1.61 -0.69 0.00 0.00 174.62 172.46 1ws9 s GLU 129 N -2.43 1.23 0.36 4.92 2.02 -0.83 -0.29 118.70 123.67 1ws9 s GLU 129 Ca 0.61 -1.60 0.14 0.00 0.02 0.00 0.00 54.97 54.13 1ws9 s GLU 129 Cb -0.39 -0.47 1.00 0.00 0.10 0.00 0.00 34.13 34.37 1ws9 s GLU 129 CO 0.50 -0.10 1.74 -1.35 0.02 0.00 0.00 175.26 176.07 1ws9 h PRO 130 N 2.58 0.47 -0.13 0.39 0.11 -1.90 -1.99 132.00 131.53 1ws9 h PRO 130 Ca -0.37 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1ws9 h PRO 130 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1ws9 h PRO 130 CO 0.63 0.31 0.00 0.41 -0.21 0.00 0.00 178.00 179.14 1ws9 n GLY 131 N -1.39 1.10 3.41 -0.55 0.00 -1.26 -4.91 105.19 101.59 1ws9 n GLY 131 Ca 0.27 -0.68 -0.07 0.00 0.00 0.00 0.00 46.02 45.53 1ws9 n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ws9 s SER 132 N -1.86 -0.64 0.00 1.61 1.04 -0.75 -5.00 113.70 108.10 1ws9 s SER 132 Ca 0.32 1.17 0.00 0.00 0.48 0.00 0.00 55.95 57.92 1ws9 s SER 132 Cb 0.21 1.34 0.00 0.00 0.10 0.00 0.00 66.02 67.67 1ws9 s SER 132 CO 0.31 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.92 1ws9 n GLY 133 N 4.82 0.15 0.28 7.32 0.00 -1.26 -1.98 105.19 114.52 1ws9 n GLY 133 Ca -0.16 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 1ws9 n GLY 133 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ws9 h SER 134 N 0.00 0.85 -1.14 1.61 0.02 -1.98 -3.00 113.55 109.91 1ws9 h SER 134 Ca 0.00 -0.06 -0.75 0.00 -0.84 0.00 0.00 61.79 60.14 1ws9 h SER 134 Cb 0.00 -0.21 -0.13 0.00 0.14 0.00 0.00 62.40 62.20 1ws9 h SER 134 CO 0.00 0.66 2.31 -0.67 -1.14 0.00 0.00 176.83 177.99 1ws9 n ASP 135 N -4.54 5.88 -0.15 3.07 2.03 -1.26 -4.79 116.55 116.79 1ws9 n ASP 135 Ca 0.06 -3.07 0.05 0.00 0.52 0.00 0.00 54.79 52.35 1ws9 n ASP 135 Cb 0.06 -1.47 0.35 0.00 -0.72 0.00 0.00 41.12 39.34 1ws9 n ASP 135 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ws9 h ALA 136 N 5.45 1.66 0.00 -1.67 0.00 -1.82 -1.72 119.26 121.15 1ws9 h ALA 136 Ca 0.51 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1ws9 h ALA 136 Cb 0.53 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1ws9 h ALA 136 CO 1.62 0.26 0.00 0.00 0.00 0.00 0.00 179.25 181.13 1ws9 n ALA 137 N -2.45 2.08 -0.00 0.00 0.00 -1.26 -2.14 120.51 116.73 1ws9 n ALA 137 Ca 0.09 -0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.54 1ws9 n ALA 137 Cb 0.16 -1.19 0.27 0.00 0.00 0.00 0.00 19.45 18.69 1ws9 n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ws9 n ALA 138 N -0.85 2.64 -1.70 0.00 0.00 -0.65 -4.52 120.51 115.44 1ws9 n ALA 138 Ca 0.09 -1.13 -0.39 0.00 0.00 0.00 0.00 53.44 52.01 1ws9 n ALA 138 Cb 0.04 -0.98 0.04 0.00 0.00 0.00 0.00 19.45 18.55 1ws9 n ALA 138 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1ws9 n LEU 139 N 1.09 4.81 -0.00 0.00 -0.00 -0.91 -4.84 117.00 117.14 1ws9 n LEU 139 Ca 0.20 0.93 0.08 0.00 -0.00 0.00 0.00 56.01 57.23 1ws9 n LEU 139 Cb 0.60 -1.51 -0.10 0.00 -0.00 0.00 0.00 43.42 42.41 1ws9 n LEU 139 CO 0.16 -1.01 -0.22 0.29 -0.00 0.00 0.00 177.39 176.61 1ws9 n LYS 140 N -0.94 1.32 -1.69 1.47 4.76 -1.26 -4.86 118.16 116.96 1ws9 n LYS 140 Ca 0.11 -0.04 -0.43 0.00 -2.87 0.00 0.00 58.31 55.08 1ws9 n LYS 140 Cb 0.45 -1.30 -0.01 0.00 -1.84 0.00 0.00 35.03 32.32 1ws9 n LYS 140 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1ws9 n THR 141 N -1.57 1.75 -4.32 -0.18 -1.04 -1.26 -4.86 114.28 102.79 1ws9 n THR 141 Ca 0.01 -0.44 -0.24 0.00 -2.04 0.00 0.00 64.05 61.35 1ws9 n THR 141 Cb 0.30 -1.52 -0.12 0.00 -1.82 0.00 0.00 70.33 67.17 1ws9 n THR 141 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1ws9 s LYS 142 N -1.50 1.22 -0.27 -2.82 -2.85 0.30 -0.90 119.74 112.91 1ws9 s LYS 142 Ca 0.59 -1.28 0.02 0.00 -1.00 0.00 0.00 55.97 54.30 1ws9 s LYS 142 Cb -0.59 -1.43 0.07 0.00 -2.06 0.00 0.00 37.83 33.82 1ws9 s LYS 142 CO 0.59 0.32 -0.05 0.00 0.10 0.00 0.00 175.35 176.31 1ws9 s ALA 143 N -1.50 2.36 -0.10 0.59 0.00 -0.33 -1.25 121.76 121.54 1ws9 s ALA 143 Ca 0.11 -1.76 -0.21 0.00 0.00 0.00 0.00 51.96 50.10 1ws9 s ALA 143 Cb -0.08 -1.61 -0.04 0.00 0.00 0.00 0.00 23.12 21.39 1ws9 s ALA 143 CO 0.05 -1.32 0.60 -1.21 0.00 0.00 0.00 175.76 173.89 1ws9 s GLU 144 N 1.20 4.37 -0.08 0.00 2.02 0.20 -4.49 118.70 121.93 1ws9 s GLU 144 Ca -0.03 0.67 -0.30 0.00 0.02 0.00 0.00 54.97 55.33 1ws9 s GLU 144 Cb -0.19 -3.46 -0.04 0.00 0.10 0.00 0.00 34.13 30.54 1ws9 s GLU 144 CO -0.07 0.07 1.49 0.21 0.02 0.00 0.00 175.26 176.98 1ws9 s LYS 145 N 0.85 4.21 0.33 1.61 2.47 -1.26 -1.24 119.74 126.71 1ws9 s LYS 145 Ca 0.32 1.99 0.03 0.00 -1.56 0.00 0.00 55.97 56.75 1ws9 s LYS 145 Cb -0.16 -3.84 -0.05 0.00 -1.46 0.00 0.00 37.83 32.31 1ws9 s LYS 145 CO 0.14 -0.76 0.08 0.14 0.16 0.00 0.00 175.35 175.11 1ws9 s VAL 146 N 3.56 0.97 -0.07 4.02 -7.23 -0.72 -4.95 120.40 115.99 1ws9 s VAL 146 Ca 0.66 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 58.52 1ws9 s VAL 146 Cb -0.30 -2.69 -0.09 0.00 0.56 0.00 0.00 36.38 33.87 1ws9 s VAL 146 CO 0.24 0.00 2.02 1.21 -0.31 0.00 0.00 175.10 178.26 1ws9 n GLU 147 N -0.69 2.42 -0.00 4.82 4.07 -1.26 -1.61 120.64 128.38 1ws9 n GLU 147 Ca -0.03 0.84 0.00 0.00 -0.06 0.00 0.00 57.16 57.92 1ws9 n GLU 147 Cb 0.66 -2.94 0.00 0.00 -0.06 0.00 0.00 31.44 29.10 1ws9 n GLU 147 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ws9 n GLY 148 N 4.87 0.76 0.00 8.31 0.00 -1.26 -4.88 105.19 112.99 1ws9 n GLY 148 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1ws9 n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ws9 n GLY 149 N -2.00 -0.52 3.14 -0.02 0.00 -0.63 -2.77 105.19 102.38 1ws9 n GLY 149 Ca 0.00 0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 1ws9 n GLY 149 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ws9 s TRP 150 N 0.00 0.78 -0.17 1.61 0.52 0.64 -1.75 118.94 120.57 1ws9 s TRP 150 Ca 0.00 -0.89 0.00 0.00 0.02 0.00 0.00 56.10 55.23 1ws9 s TRP 150 Cb 0.00 -0.47 0.03 0.00 -1.15 0.00 0.00 33.47 31.88 1ws9 s TRP 150 CO 0.00 -0.19 -0.10 0.50 0.02 0.00 0.00 176.95 177.18 1ws9 s ARG 151 N -3.56 1.93 -0.08 4.98 3.52 -0.37 -1.03 118.95 124.35 1ws9 s ARG 151 Ca 0.08 -0.62 -0.03 0.00 -0.13 0.00 0.00 55.73 55.02 1ws9 s ARG 151 Cb 0.04 -2.15 -0.04 0.00 -1.56 0.00 0.00 34.95 31.24 1ws9 s ARG 151 CO -0.05 -0.35 0.06 -0.51 -0.81 0.00 0.00 175.30 173.64 1ws9 s LEU 152 N 1.51 3.90 -0.06 -0.88 1.02 0.13 -0.63 118.68 123.67 1ws9 s LEU 152 Ca 0.02 0.24 -0.02 0.00 0.02 0.00 0.00 54.13 54.39 1ws9 s LEU 152 Cb -0.15 -2.00 0.04 0.00 0.02 0.00 0.00 46.19 44.11 1ws9 s LEU 152 CO -0.09 0.36 0.11 0.20 0.02 0.00 0.00 176.35 176.95 1ws9 s ASN 153 N -1.12 0.56 0.00 2.29 0.01 -0.38 -1.68 114.94 114.63 1ws9 s ASN 153 Ca 0.16 0.20 0.00 0.00 -0.71 0.00 0.00 52.86 52.51 1ws9 s ASN 153 Cb -0.12 0.08 0.00 0.00 0.41 0.00 0.00 41.25 41.62 1ws9 s ASN 153 CO 0.05 -0.21 0.00 0.61 -1.51 0.00 0.00 177.10 176.05 1ws9 n GLY 154 N 4.89 -2.14 2.97 0.66 0.00 -1.04 -0.54 105.19 109.98 1ws9 n GLY 154 Ca -0.13 -1.20 -0.21 0.00 0.00 0.00 0.00 46.02 44.48 1ws9 n GLY 154 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ws9 s THR 155 N -2.21 0.79 -0.04 2.61 2.01 -1.26 -0.54 115.64 117.01 1ws9 s THR 155 Ca 0.00 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 61.70 1ws9 s THR 155 Cb 0.00 -0.74 -0.03 0.00 0.01 0.00 0.00 72.50 71.73 1ws9 s THR 155 CO 0.00 0.27 -0.00 -0.54 -0.69 0.00 0.00 174.62 173.66 1ws9 s LYS 156 N 0.60 2.85 -0.00 4.92 -0.14 0.15 -4.37 119.74 123.74 1ws9 s LYS 156 Ca -0.10 -0.53 0.08 0.00 -1.36 0.00 0.00 55.97 54.06 1ws9 s LYS 156 Cb -0.13 -2.71 -0.02 0.00 -1.68 0.00 0.00 37.83 33.29 1ws9 s LYS 156 CO 0.01 0.66 -0.26 -1.14 -0.76 0.00 0.00 175.35 173.86 1ws9 s GLN 157 N -1.27 2.04 -1.28 1.68 2.00 0.61 -0.43 119.66 123.00 1ws9 s GLN 157 Ca 0.17 -0.97 -0.04 0.00 -2.00 0.00 0.00 55.36 52.51 1ws9 s GLN 157 Cb -0.11 -2.03 0.01 0.00 0.80 0.00 0.00 33.01 31.67 1ws9 s GLN 157 CO 0.07 0.55 1.08 1.19 -0.50 0.00 0.00 175.29 177.68 1ws9 n PHE 158 N 2.26 -2.52 -3.08 1.67 0.99 -1.20 -4.56 117.46 111.02 1ws9 n PHE 158 Ca -0.16 0.97 -0.41 0.00 -0.00 0.00 0.00 57.45 57.85 1ws9 n PHE 158 Cb 0.51 -5.04 -0.06 0.00 -1.00 0.00 0.00 39.48 33.89 1ws9 n PHE 158 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 1ws9 s ILE 159 N -3.35 4.94 0.27 4.37 -1.09 -0.16 -4.74 121.20 121.44 1ws9 s ILE 159 Ca 0.28 1.06 -0.29 0.00 -2.23 0.00 0.00 60.65 59.47 1ws9 s ILE 159 Cb -0.13 -3.99 -0.09 0.00 -1.58 0.00 0.00 42.46 36.67 1ws9 s ILE 159 CO 0.73 -0.07 1.01 0.42 -1.23 0.00 0.00 174.94 175.80 1ws9 s THR 160 N 2.61 3.84 -0.84 2.92 -4.23 -1.26 -1.11 115.64 117.57 1ws9 s THR 160 Ca 0.27 1.80 0.00 0.00 -1.18 0.00 0.00 61.69 62.58 1ws9 s THR 160 Cb -0.15 -4.13 0.00 0.00 1.34 0.00 0.00 72.50 69.56 1ws9 s THR 160 CO 0.10 0.39 0.00 0.00 -0.54 0.00 0.00 174.62 174.57 1ws9 n GLN 161 N 1.22 -0.74 -0.31 3.99 3.00 0.21 -4.26 117.38 120.49 1ws9 n GLN 161 Ca -0.01 0.72 -0.02 0.00 -0.01 0.00 0.00 57.00 57.68 1ws9 n GLN 161 Cb 0.46 -4.60 0.10 0.00 0.00 0.00 0.00 30.24 26.20 1ws9 n GLN 161 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.06 177.84 1ws9 h GLY 162 N 0.00 1.21 0.30 1.08 0.00 -1.41 -0.96 103.07 103.28 1ws9 h GLY 162 Ca -0.16 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.75 1ws9 h GLY 162 CO 0.24 0.38 -1.30 -1.14 0.00 0.00 0.00 176.54 174.72 1ws9 n SER 163 N -4.54 0.54 -0.58 0.19 3.41 -1.26 -4.37 113.62 107.01 1ws9 n SER 163 Ca 0.10 -0.32 0.07 0.00 -0.26 0.00 0.00 58.87 58.46 1ws9 n SER 163 Cb 0.06 1.17 0.07 0.00 -0.26 0.00 0.00 64.21 65.26 1ws9 n SER 163 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1ws9 n VAL 164 N -1.96 0.12 -2.21 -3.33 0.24 -1.18 -5.04 118.33 104.97 1ws9 n VAL 164 Ca 0.01 -0.56 -0.36 0.00 -2.04 0.00 0.00 64.34 61.39 1ws9 n VAL 164 Cb 0.45 1.19 0.00 0.00 -1.47 0.00 0.00 33.84 34.02 1ws9 n VAL 164 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ws9 s ALA 165 N -1.13 2.77 -0.17 2.33 0.00 -0.37 -4.57 121.76 120.62 1ws9 s ALA 165 Ca 0.18 0.90 0.14 0.00 0.00 0.00 0.00 51.96 53.18 1ws9 s ALA 165 Cb 0.12 -3.39 -0.20 0.00 0.00 0.00 0.00 23.12 19.65 1ws9 s ALA 165 CO 0.17 -0.81 0.04 0.41 0.00 0.00 0.00 175.76 175.57 1ws9 n GLY 166 N 0.32 -0.79 3.25 0.00 0.00 0.24 -4.75 105.19 103.47 1ws9 n GLY 166 Ca 0.10 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 1ws9 n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ws9 s VAL 167 N -2.41 2.00 -0.05 1.61 1.01 -0.84 -0.73 120.40 120.99 1ws9 s VAL 167 Ca -0.10 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 60.91 1ws9 s VAL 167 Cb 0.05 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.73 1ws9 s VAL 167 CO 0.67 0.56 -0.23 -0.31 0.00 0.00 0.00 175.10 175.79 1ws9 s TYR 168 N -0.11 2.20 -0.21 5.22 1.51 0.41 -1.29 117.35 125.08 1ws9 s TYR 168 Ca -0.05 -0.62 0.02 0.00 -1.01 0.00 0.00 57.07 55.41 1ws9 s TYR 168 Cb -0.14 -1.45 0.04 0.00 -0.11 0.00 0.00 41.96 40.30 1ws9 s TYR 168 CO 0.04 -0.18 -0.16 0.08 -1.11 0.00 0.00 175.55 174.22 1ws9 s VAL 169 N -0.17 2.15 -0.02 0.71 1.01 -0.07 -1.32 120.40 122.69 1ws9 s VAL 169 Ca -0.02 -1.21 0.07 0.00 0.00 0.00 0.00 61.98 60.82 1ws9 s VAL 169 Cb -0.12 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 1ws9 s VAL 169 CO 0.03 0.30 -0.24 -0.69 0.00 0.00 0.00 175.10 174.50 1ws9 s VAL 170 N 1.22 1.89 -0.18 2.92 1.01 -0.29 0.52 120.40 127.49 1ws9 s VAL 170 Ca -0.01 -1.02 -0.10 0.00 0.00 0.00 0.00 61.98 60.85 1ws9 s VAL 170 Cb -0.16 -1.57 -0.05 0.00 0.00 0.00 0.00 36.38 34.61 1ws9 s VAL 170 CO -0.09 0.53 0.17 -0.04 0.00 0.00 0.00 175.10 175.67 1ws9 s MET 171 N -0.55 4.09 0.03 2.72 -1.94 -0.70 -0.63 119.30 122.32 1ws9 s MET 171 Ca 0.09 -0.14 -0.10 0.00 -1.71 0.00 0.00 55.69 53.83 1ws9 s MET 171 Cb -0.09 -3.38 0.01 0.00 2.01 0.00 0.00 34.83 33.37 1ws9 s MET 171 CO -0.01 0.37 0.22 0.00 -0.01 0.00 0.00 175.02 175.58 1ws9 s ALA 172 N 0.15 -0.44 -0.18 3.03 0.00 -0.07 -4.77 121.76 119.48 1ws9 s ALA 172 Ca 0.11 -0.18 -0.28 0.00 0.00 0.00 0.00 51.96 51.61 1ws9 s ALA 172 Cb -0.12 0.26 -0.00 0.00 0.00 0.00 0.00 23.12 23.26 1ws9 s ALA 172 CO 0.00 -0.35 0.98 0.50 0.00 0.00 0.00 175.76 176.89 1ws9 s ARG 173 N -2.37 4.32 -0.03 0.00 3.52 -0.08 -0.58 118.95 123.73 1ws9 s ARG 173 Ca -0.06 1.29 0.16 0.00 -0.13 0.00 0.00 55.73 56.98 1ws9 s ARG 173 Cb -0.02 -3.59 -0.24 0.00 -1.56 0.00 0.00 34.95 29.53 1ws9 s ARG 173 CO -0.03 -0.46 0.32 0.25 -0.81 0.00 0.00 175.30 174.57 1ws9 n THR 174 N 4.94 0.10 -3.95 4.11 -2.24 -0.13 -1.18 114.28 115.94 1ws9 n THR 174 Ca 0.09 -0.39 -0.10 0.00 -2.27 0.00 0.00 64.05 61.38 1ws9 n THR 174 Cb 0.48 0.06 -0.11 0.00 -2.10 0.00 0.00 70.33 68.66 1ws9 n THR 174 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ws9 s ASP 175 N -3.94 0.17 0.53 3.42 1.11 -0.85 -4.95 116.67 112.17 1ws9 s ASP 175 Ca -0.06 -0.41 -0.20 0.00 0.18 0.00 0.00 52.55 52.07 1ws9 s ASP 175 Cb 0.10 0.13 -0.06 0.00 1.07 0.00 0.00 42.92 44.15 1ws9 s ASP 175 CO 0.66 -0.31 1.13 -2.16 1.18 0.00 0.00 175.17 175.67 1ws9 s PRO 176 N -1.40 3.42 0.38 8.23 0.04 -1.26 -4.44 135.00 139.96 1ws9 s PRO 176 Ca -0.15 1.63 -0.24 0.00 0.04 0.00 0.00 61.00 62.27 1ws9 s PRO 176 Cb -0.09 -2.06 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 1ws9 s PRO 176 CO -0.00 -0.80 1.01 -1.25 0.04 0.00 0.00 177.00 175.99 1ws9 s PRO 177 N -3.21 4.29 0.26 0.56 0.04 -1.26 -4.74 135.00 130.94 1ws9 s PRO 177 Ca 0.72 1.40 -0.03 0.00 0.04 0.00 0.00 61.00 63.13 1ws9 s PRO 177 Cb -0.24 -2.56 0.34 0.00 0.04 0.00 0.00 34.50 32.07 1ws9 s PRO 177 CO 0.28 -0.01 1.84 -1.00 0.04 0.00 0.00 177.00 178.15 1ws9 h PRO 178 N 2.60 0.99 -3.97 0.56 0.13 -1.86 -3.46 132.00 127.00 1ws9 h PRO 178 Ca -0.48 -0.17 -0.12 0.00 -0.87 0.00 0.00 66.00 64.37 1ws9 h PRO 178 Cb 1.20 -0.17 -0.11 0.00 0.13 0.00 0.00 31.00 32.05 1ws9 h PRO 178 CO 0.63 0.81 -0.30 -1.54 -0.23 0.00 0.00 178.00 177.37 1ws9 s SER 179 N -6.46 -0.00 0.26 1.44 1.04 -1.26 -5.05 113.70 103.67 1ws9 s SER 179 Ca -0.11 -1.06 0.01 0.00 0.48 0.00 0.00 55.95 55.27 1ws9 s SER 179 Cb 0.16 0.50 0.35 0.00 0.10 0.00 0.00 66.02 67.13 1ws9 s SER 179 CO 0.81 -1.02 1.68 1.55 0.98 0.00 0.00 173.24 177.25 1ws9 h PRO 180 N 2.40 0.51 0.00 4.02 0.13 -2.01 -2.49 132.00 134.56 1ws9 h PRO 180 Ca -0.30 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1ws9 h PRO 180 Cb 1.25 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1ws9 h PRO 180 CO 0.42 0.75 0.00 0.39 -0.23 0.00 0.00 178.00 179.34 1ws9 n GLU 181 N -4.09 0.85 -0.69 0.86 4.71 -1.26 -2.83 120.64 118.19 1ws9 n GLU 181 Ca -0.01 0.00 0.06 0.00 -0.01 0.00 0.00 57.16 57.20 1ws9 n GLU 181 Cb 0.44 -1.50 0.16 0.00 -1.01 0.00 0.00 31.44 29.53 1ws9 n GLU 181 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1ws9 n ARG 182 N -1.02 1.24 0.12 3.49 1.74 -0.94 -4.79 116.66 116.49 1ws9 n ARG 182 Ca 0.21 -2.94 0.09 0.00 -0.77 0.00 0.00 57.85 54.43 1ws9 n ARG 182 Cb 0.10 -1.30 0.44 0.00 -1.02 0.00 0.00 32.46 30.68 1ws9 n ARG 182 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1ws9 n LYS 183 N -0.85 0.11 0.01 5.56 2.85 -1.13 -0.88 118.16 123.83 1ws9 n LYS 183 Ca 0.16 0.56 0.10 0.00 -1.05 0.00 0.00 58.31 58.07 1ws9 n LYS 183 Cb 0.76 -1.83 0.42 0.00 -0.65 0.00 0.00 35.03 33.74 1ws9 n LYS 183 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 177.40 174.96 1ws9 n HIS 184 N -2.06 0.10 -3.47 5.58 1.44 -1.26 -4.66 115.22 110.90 1ws9 n HIS 184 Ca -0.00 0.04 -0.38 0.00 -2.01 0.00 0.00 57.72 55.36 1ws9 n HIS 184 Cb 0.06 -0.56 -0.06 0.00 0.12 0.00 0.00 29.99 29.55 1ws9 n HIS 184 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1ws9 s GLN 185 N -3.03 3.96 0.00 -1.40 -0.21 -0.06 -4.14 119.66 114.78 1ws9 s GLN 185 Ca 0.09 0.46 0.00 0.00 0.02 0.00 0.00 55.36 55.94 1ws9 s GLN 185 Cb 0.13 -3.22 0.00 0.00 1.00 0.00 0.00 33.01 30.91 1ws9 s GLN 185 CO 0.37 0.68 0.00 0.41 -2.12 0.00 0.00 175.29 174.64 1ws9 n GLY 186 N 1.80 0.86 3.74 3.09 0.00 -0.57 -4.20 105.19 109.92 1ws9 n GLY 186 Ca -0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 1ws9 n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ws9 s ILE 187 N -2.03 4.86 0.22 -0.61 1.01 -1.21 -0.95 121.20 122.48 1ws9 s ILE 187 Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 60.65 60.67 1ws9 s ILE 187 Cb 0.00 -3.11 -0.05 0.00 0.01 0.00 0.00 42.46 39.31 1ws9 s ILE 187 CO 0.00 0.57 -0.05 -0.44 0.00 0.00 0.00 174.94 175.02 1ws9 s SER 188 N -0.60 2.05 0.07 3.58 0.01 0.26 0.89 113.70 119.96 1ws9 s SER 188 Ca 0.11 -1.14 0.07 0.00 1.31 0.00 0.00 55.95 56.29 1ws9 s SER 188 Cb -0.12 -0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.04 1ws9 s SER 188 CO 0.02 -0.41 -0.13 0.00 0.41 0.00 0.00 173.24 173.14 1ws9 s ALA 189 N -3.28 2.83 -0.06 1.44 0.00 -1.25 -0.89 121.76 120.54 1ws9 s ALA 189 Ca 0.25 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 51.02 1ws9 s ALA 189 Cb 0.04 -0.86 0.02 0.00 0.00 0.00 0.00 23.12 22.32 1ws9 s ALA 189 CO 0.07 0.61 -0.08 -0.06 0.00 0.00 0.00 175.76 176.30 1ws9 s PHE 190 N -1.09 1.12 -0.17 0.00 0.40 0.19 -0.30 117.98 118.14 1ws9 s PHE 190 Ca 0.18 -0.40 -0.03 0.00 -0.60 0.00 0.00 56.93 56.08 1ws9 s PHE 190 Cb -0.11 -0.90 -0.02 0.00 0.51 0.00 0.00 43.02 42.50 1ws9 s PHE 190 CO 0.10 -0.27 -0.05 0.00 0.70 0.00 0.00 175.22 175.70 1ws9 s ALA 191 N 0.95 2.91 0.16 5.36 0.00 0.91 -1.13 121.76 130.92 1ws9 s ALA 191 Ca -0.10 -0.90 -0.18 0.00 0.00 0.00 0.00 51.96 50.78 1ws9 s ALA 191 Cb -0.15 -1.54 0.04 0.00 0.00 0.00 0.00 23.12 21.47 1ws9 s ALA 191 CO 0.00 0.09 0.49 -0.59 0.00 0.00 0.00 175.76 175.75 1ws9 s PHE 192 N 0.59 -0.21 0.47 0.00 -0.71 -0.44 -4.34 117.98 113.35 1ws9 s PHE 192 Ca -0.03 -0.11 -0.11 0.00 -1.04 0.00 0.00 56.93 55.64 1ws9 s PHE 192 Cb -0.15 0.37 -0.06 0.00 -1.21 0.00 0.00 43.02 41.97 1ws9 s PHE 192 CO 0.03 -0.83 0.86 -0.06 -1.34 0.00 0.00 175.22 173.87 1ws9 s PHE 193 N -3.83 3.50 -0.46 3.49 0.08 -1.26 -0.44 117.98 119.05 1ws9 s PHE 193 Ca 0.06 1.14 -0.43 0.00 0.12 0.00 0.00 56.93 57.82 1ws9 s PHE 193 Cb 0.00 -2.54 -0.18 0.00 -0.57 0.00 0.00 43.02 39.73 1ws9 s PHE 193 CO -0.08 -0.27 2.01 -2.13 -0.10 0.00 0.00 175.22 174.65 1ws9 n ARG 194 N -1.70 0.25 -2.06 0.44 0.63 0.09 -4.83 116.66 109.49 1ws9 n ARG 194 Ca 0.04 0.08 -0.36 0.00 -0.92 0.00 0.00 57.85 56.68 1ws9 n ARG 194 Cb 0.54 -1.69 0.02 0.00 0.45 0.00 0.00 32.46 31.79 1ws9 n ARG 194 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 1ws9 s PRO 195 N 5.23 3.18 0.37 -0.14 0.02 -1.26 -4.93 135.00 137.48 1ws9 s PRO 195 Ca 1.14 1.84 0.24 0.00 0.02 0.00 0.00 61.00 64.24 1ws9 s PRO 195 Cb -1.37 -2.06 0.50 0.00 0.02 0.00 0.00 34.50 31.58 1ws9 s PRO 195 CO 0.67 -1.05 1.66 0.93 -0.33 0.00 0.00 177.00 178.89 1ws9 h GLU 196 N 1.20 0.00 -2.63 5.54 5.08 -1.96 -3.46 114.58 118.35 1ws9 h GLU 196 Ca -0.50 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 57.92 1ws9 h GLU 196 Cb 1.29 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.41 1ws9 h GLU 196 CO 0.56 0.00 0.36 -0.98 -1.00 0.00 0.00 179.01 177.95 1ws9 s ARG 197 N -3.19 1.13 0.00 2.33 1.70 -1.26 -4.94 118.95 114.71 1ws9 s ARG 197 Ca 0.08 -0.47 0.00 0.00 -0.47 0.00 0.00 55.73 54.87 1ws9 s ARG 197 Cb 0.07 0.49 0.00 0.00 -0.57 0.00 0.00 34.95 34.94 1ws9 s ARG 197 CO 0.65 -0.50 0.00 0.41 -1.08 0.00 0.00 175.30 174.78 1ws9 n GLY 198 N -0.34 1.70 2.76 3.88 0.00 -1.26 -4.73 105.19 107.19 1ws9 n GLY 198 Ca -0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 1ws9 n GLY 198 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ws9 s LEU 199 N 0.00 1.89 0.07 0.99 2.96 -1.26 -0.56 118.68 122.76 1ws9 s LEU 199 Ca 0.00 -1.27 0.05 0.00 -0.22 0.00 0.00 54.13 52.69 1ws9 s LEU 199 Cb 0.00 -0.81 -0.04 0.00 0.50 0.00 0.00 46.19 45.85 1ws9 s LEU 199 CO 0.00 -0.35 -0.06 -1.59 -1.32 0.00 0.00 176.35 173.03 1ws9 s LYS 200 N 1.68 2.37 0.16 1.98 -2.85 -1.10 -4.97 119.74 117.01 1ws9 s LYS 200 Ca 0.04 -0.88 -0.14 0.00 -1.00 0.00 0.00 55.97 53.98 1ws9 s LYS 200 Cb -0.17 -2.42 -0.07 0.00 -2.06 0.00 0.00 37.83 33.10 1ws9 s LYS 200 CO -0.16 0.54 0.56 0.08 0.10 0.00 0.00 175.35 176.47 1ws9 s VAL 201 N -1.17 4.85 0.67 1.79 1.01 -1.26 -1.98 120.40 124.30 1ws9 s VAL 201 Ca 0.21 0.82 -0.05 0.00 0.00 0.00 0.00 61.98 62.96 1ws9 s VAL 201 Cb -0.11 -3.73 0.14 0.00 0.00 0.00 0.00 36.38 32.68 1ws9 s VAL 201 CO 0.13 0.20 0.92 0.61 0.00 0.00 0.00 175.10 176.96 1ws9 n GLY 202 N 0.68 -0.01 3.56 4.51 0.00 0.20 -4.97 105.19 109.16 1ws9 n GLY 202 Ca -0.04 -1.92 -0.50 0.00 0.00 0.00 0.00 46.02 43.56 1ws9 n GLY 202 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ws9 n ARG 203 N -2.79 0.98 -1.54 1.61 0.63 -1.26 -4.63 116.66 109.65 1ws9 n ARG 203 Ca 0.14 0.35 -0.37 0.00 -0.92 0.00 0.00 57.85 57.04 1ws9 n ARG 203 Cb 0.49 -1.83 0.06 0.00 0.45 0.00 0.00 32.46 31.63 1ws9 n ARG 203 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1ws9 n LYS 204 N 1.74 0.72 -3.63 -0.14 4.81 -1.26 -4.63 118.16 115.77 1ws9 n LYS 204 Ca 0.16 0.29 -0.38 0.00 -0.87 0.00 0.00 58.31 57.51 1ws9 n LYS 204 Cb 0.23 -2.08 -0.11 0.00 0.02 0.00 0.00 35.03 33.08 1ws9 n LYS 204 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1ws9 s GLU 205 N -2.76 3.91 -0.34 1.64 0.41 -1.25 -5.06 118.70 115.25 1ws9 s GLU 205 Ca 0.74 -0.34 -0.25 0.00 -0.41 0.00 0.00 54.97 54.71 1ws9 s GLU 205 Cb -0.40 -3.58 0.01 0.00 -1.78 0.00 0.00 34.13 28.38 1ws9 s GLU 205 CO 0.49 -0.15 0.88 -1.21 -0.49 0.00 0.00 175.26 174.77 1ws9 s GLU 206 N 1.64 3.89 0.18 1.61 0.41 -1.26 -4.93 118.70 120.24 1ws9 s GLU 206 Ca 0.07 0.60 0.06 0.00 -0.41 0.00 0.00 54.97 55.29 1ws9 s GLU 206 Cb -0.16 -3.77 -0.04 0.00 -1.78 0.00 0.00 34.13 28.38 1ws9 s GLU 206 CO 0.09 -0.84 0.08 0.15 -0.49 0.00 0.00 175.26 174.24 1ws9 s LYS 207 N 3.27 2.66 0.37 1.61 1.02 -1.26 -5.01 119.74 122.39 1ws9 s LYS 207 Ca 0.36 -1.03 0.05 0.00 0.02 0.00 0.00 55.97 55.37 1ws9 s LYS 207 Cb -0.13 -2.48 0.73 0.00 -0.52 0.00 0.00 37.83 35.42 1ws9 s LYS 207 CO 0.16 0.45 1.99 1.25 -0.92 0.00 0.00 175.35 178.28 1ws9 h LEU 208 N 2.40 0.66 0.00 3.17 5.85 -1.96 -3.46 115.31 121.97 1ws9 h LEU 208 Ca -0.47 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 1ws9 h LEU 208 Cb 1.21 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 1ws9 h LEU 208 CO 0.61 0.45 -0.00 0.61 -0.34 0.00 0.00 178.44 179.76 1ws9 n GLY 209 N -1.45 2.72 3.99 3.75 0.00 -1.26 -4.83 105.19 108.11 1ws9 n GLY 209 Ca 0.08 -1.28 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 1ws9 n GLY 209 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ws9 n LEU 210 N 0.00 -2.32 -0.24 0.99 4.77 -1.26 -4.85 117.00 114.08 1ws9 n LEU 210 Ca -0.00 -0.88 0.05 0.00 -0.03 0.00 0.00 56.01 55.15 1ws9 n LEU 210 Cb 0.04 -2.39 0.17 0.00 -2.33 0.00 0.00 43.42 38.90 1ws9 n LEU 210 CO 0.02 0.41 0.90 0.74 -1.33 0.00 0.00 177.39 178.13 1ws9 h THR 211 N -1.87 0.48 0.00 -5.08 2.02 -1.86 -1.23 112.91 105.38 1ws9 h THR 211 Ca -0.59 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 66.51 1ws9 h THR 211 Cb 1.38 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1ws9 h THR 211 CO 0.69 0.04 0.00 0.00 0.37 0.00 0.00 175.52 176.62 1ws9 n ALA 212 N -2.72 2.54 -2.69 6.16 0.00 -1.25 -4.58 120.51 117.97 1ws9 n ALA 212 Ca 0.13 -0.12 -0.40 0.00 0.00 0.00 0.00 53.44 53.05 1ws9 n ALA 212 Cb 0.45 -1.31 -0.05 0.00 0.00 0.00 0.00 19.45 18.55 1ws9 n ALA 212 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ws9 s SER 213 N -1.67 6.92 -0.33 0.00 0.15 -0.47 -4.40 113.70 113.90 1ws9 s SER 213 Ca 0.29 1.11 -0.29 0.00 0.70 0.00 0.00 55.95 57.76 1ws9 s SER 213 Cb 0.13 -2.41 0.01 0.00 -1.71 0.00 0.00 66.02 62.04 1ws9 s SER 213 CO 0.22 -0.23 1.29 -0.62 1.20 0.00 0.00 173.24 175.10 1ws9 s ASP 214 N 0.99 6.65 -0.09 5.45 2.15 -1.26 -4.98 116.67 125.57 1ws9 s ASP 214 Ca 0.36 1.09 0.01 0.00 0.43 0.00 0.00 52.55 54.44 1ws9 s ASP 214 Cb -0.17 -2.54 0.02 0.00 -0.30 0.00 0.00 42.92 39.93 1ws9 s ASP 214 CO 0.15 -1.12 -0.09 -0.89 -0.17 0.00 0.00 175.17 173.04 1ws9 s THR 215 N 4.46 1.04 0.12 1.71 2.01 -1.26 0.63 115.64 124.35 1ws9 s THR 215 Ca 0.55 -0.35 -0.08 0.00 0.31 0.00 0.00 61.69 62.13 1ws9 s THR 215 Cb -0.15 -1.01 -0.01 0.00 0.01 0.00 0.00 72.50 71.34 1ws9 s THR 215 CO 0.24 0.35 0.20 0.00 -0.69 0.00 0.00 174.62 174.73 1ws9 s ALA 216 N 1.25 0.00 -0.04 7.40 0.00 -0.27 -3.97 121.76 126.14 1ws9 s ALA 216 Ca -0.04 -0.83 -0.17 0.00 0.00 0.00 0.00 51.96 50.92 1ws9 s ALA 216 Cb -0.14 0.65 -0.05 0.00 0.00 0.00 0.00 23.12 23.58 1ws9 s ALA 216 CO -0.03 -0.55 0.47 -1.14 0.00 0.00 0.00 175.76 174.50 1ws9 s GLN 217 N -3.92 4.16 -0.13 0.00 0.74 -1.26 -0.99 119.66 118.26 1ws9 s GLN 217 Ca 0.11 0.49 0.00 0.00 0.05 0.00 0.00 55.36 56.01 1ws9 s GLN 217 Cb 0.05 -3.32 -0.01 0.00 1.10 0.00 0.00 33.01 30.83 1ws9 s GLN 217 CO -0.06 0.45 -0.14 -0.51 -0.55 0.00 0.00 175.29 174.48 1ws9 s LEU 218 N -0.33 2.65 -0.24 3.68 1.43 0.43 -0.63 118.68 125.66 1ws9 s LEU 218 Ca 0.26 -0.36 -0.00 0.00 -1.03 0.00 0.00 54.13 52.99 1ws9 s LEU 218 Cb -0.16 -1.59 0.03 0.00 0.03 0.00 0.00 46.19 44.49 1ws9 s LEU 218 CO 0.13 0.15 -0.09 -0.63 0.23 0.00 0.00 176.35 176.14 1ws9 s ILE 219 N 0.43 2.61 -0.26 -0.59 1.01 -0.84 0.30 121.20 123.87 1ws9 s ILE 219 Ca -0.10 -1.15 -0.17 0.00 0.00 0.00 0.00 60.65 59.23 1ws9 s ILE 219 Cb -0.16 -2.34 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 1ws9 s ILE 219 CO 0.05 0.19 0.45 -0.76 0.00 0.00 0.00 174.94 174.88 1ws9 s LEU 220 N 1.27 4.06 -0.34 2.97 1.43 0.30 -2.70 118.68 125.67 1ws9 s LEU 220 Ca -0.01 0.44 0.02 0.00 -1.03 0.00 0.00 54.13 53.55 1ws9 s LEU 220 Cb -0.17 -2.56 0.10 0.00 0.03 0.00 0.00 46.19 43.58 1ws9 s LEU 220 CO -0.06 -0.23 0.06 -1.61 0.23 0.00 0.00 176.35 174.75 1ws9 s GLU 221 N 2.10 1.72 -1.71 1.70 2.02 0.27 -2.51 118.70 122.30 1ws9 s GLU 221 Ca 0.19 -1.78 -0.16 0.00 0.02 0.00 0.00 54.97 53.24 1ws9 s GLU 221 Cb -0.16 -3.25 0.15 0.00 0.10 0.00 0.00 34.13 30.97 1ws9 s GLU 221 CO 0.09 -0.91 0.61 -0.25 0.02 0.00 0.00 175.26 174.82 1ws9 n ASP 222 N 4.36 -2.10 -4.67 -0.19 10.43 -0.98 -4.43 116.55 118.98 1ws9 n ASP 222 Ca -0.00 -1.11 -0.43 0.00 2.57 0.00 0.00 54.79 55.83 1ws9 n ASP 222 Cb 0.42 -2.34 -0.02 0.00 1.84 0.00 0.00 41.12 41.01 1ws9 n ASP 222 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 1ws9 s LEU 223 N -7.24 4.24 -0.10 0.64 2.96 -0.68 -4.72 118.68 113.79 1ws9 s LEU 223 Ca 0.61 1.89 -0.15 0.00 -0.22 0.00 0.00 54.13 56.25 1ws9 s LEU 223 Cb -0.34 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.76 1ws9 s LEU 223 CO 0.96 -0.77 0.38 0.12 -1.32 0.00 0.00 176.35 175.72 1ws9 s PHE 224 N 3.34 3.57 0.01 5.38 2.19 -1.26 0.19 117.98 131.40 1ws9 s PHE 224 Ca 0.60 0.81 0.03 0.00 0.33 0.00 0.00 56.93 58.70 1ws9 s PHE 224 Cb -0.26 -2.38 -0.01 0.00 -1.31 0.00 0.00 43.02 39.06 1ws9 s PHE 224 CO 0.20 0.36 -0.09 0.14 1.83 0.00 0.00 175.22 177.66 1ws9 s VAL 225 N -0.02 0.70 0.94 3.12 -7.23 -0.20 -4.98 120.40 112.73 1ws9 s VAL 225 Ca 0.22 -0.57 -0.11 0.00 -1.81 0.00 0.00 61.98 59.70 1ws9 s VAL 225 Cb -0.15 -0.62 0.16 0.00 0.56 0.00 0.00 36.38 36.33 1ws9 s VAL 225 CO 0.09 0.06 1.09 -2.16 -0.31 0.00 0.00 175.10 173.87 1ws9 s PRO 226 N -0.58 0.88 0.56 4.82 0.04 -1.26 -0.26 135.00 139.21 1ws9 s PRO 226 Ca 0.01 0.97 0.27 0.00 0.04 0.00 0.00 61.00 62.28 1ws9 s PRO 226 Cb -0.05 -1.75 1.50 0.00 0.04 0.00 0.00 34.50 34.23 1ws9 s PRO 226 CO 0.00 -2.54 2.02 0.93 0.04 0.00 0.00 177.00 177.45 1ws9 h GLU 227 N -1.77 0.00 0.00 4.56 4.39 -1.84 0.33 114.58 120.24 1ws9 h GLU 227 Ca -0.50 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.20 1ws9 h GLU 227 Cb 1.29 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1ws9 h GLU 227 CO 0.51 0.00 0.00 0.39 -1.16 0.00 0.00 179.01 178.75 1ws9 n GLU 228 N -4.05 0.15 0.11 2.33 4.71 -1.26 -3.04 120.64 119.59 1ws9 n GLU 228 Ca 0.06 0.11 -0.03 0.00 -0.01 0.00 0.00 57.16 57.29 1ws9 n GLU 228 Cb 0.50 -1.50 0.15 0.00 -1.01 0.00 0.00 31.44 29.58 1ws9 n GLU 228 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1ws9 h ALA 229 N 2.87 0.91 -2.02 0.62 0.00 -0.52 -3.45 119.26 117.68 1ws9 h ALA 229 Ca 0.00 -0.54 -0.62 0.00 0.00 0.00 0.00 54.91 53.75 1ws9 h ALA 229 Cb 0.28 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.00 1ws9 h ALA 229 CO 0.00 0.74 1.08 -0.11 0.00 0.00 0.00 179.25 180.96 1ws9 n LEU 230 N -3.86 3.40 -4.32 0.00 7.94 -1.17 -0.06 117.00 118.93 1ws9 n LEU 230 Ca -0.02 0.98 -0.36 0.00 -1.11 0.00 0.00 56.01 55.50 1ws9 n LEU 230 Cb 0.61 -1.36 -0.13 0.00 0.53 0.00 0.00 43.42 43.06 1ws9 n LEU 230 CO 0.43 -0.08 -0.32 -0.22 -1.11 0.00 0.00 177.39 176.09 1ws9 s LEU 231 N 3.94 3.47 0.00 -1.96 2.96 0.59 -4.86 118.68 122.82 1ws9 s LEU 231 Ca 0.92 -0.62 0.00 0.00 -0.22 0.00 0.00 54.13 54.22 1ws9 s LEU 231 Cb -0.71 -1.81 0.00 0.00 0.50 0.00 0.00 46.19 44.17 1ws9 s LEU 231 CO 0.52 -0.13 0.00 0.61 -1.32 0.00 0.00 176.35 176.03 1ws9 n GLY 232 N 4.82 -2.47 3.77 7.98 0.00 -1.24 -3.95 105.19 114.09 1ws9 n GLY 232 Ca -0.16 -1.61 -0.39 0.00 0.00 0.00 0.00 46.02 43.86 1ws9 n GLY 232 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ws9 s GLU 233 N -0.73 4.43 0.26 1.61 2.02 -1.26 -4.95 118.70 120.09 1ws9 s GLU 233 Ca 0.00 1.80 -0.31 0.00 0.02 0.00 0.00 54.97 56.48 1ws9 s GLU 233 Cb 0.00 -2.98 -0.12 0.00 0.10 0.00 0.00 34.13 31.13 1ws9 s GLU 233 CO 0.00 0.02 1.66 0.50 0.02 0.00 0.00 175.26 177.46 1ws9 s ARG 234 N -1.80 4.11 0.00 1.61 3.52 -1.26 -2.10 118.95 123.02 1ws9 s ARG 234 Ca 0.49 2.61 0.00 0.00 -0.13 0.00 0.00 55.73 58.70 1ws9 s ARG 234 Cb -0.31 -3.04 0.00 0.00 -1.56 0.00 0.00 34.95 30.04 1ws9 s ARG 234 CO 0.39 -0.69 0.00 0.41 -0.81 0.00 0.00 175.30 174.60 1ws9 n GLY 235 N 2.89 1.44 0.46 8.12 0.00 -1.21 -4.85 105.19 112.04 1ws9 n GLY 235 Ca 0.11 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.20 1ws9 n GLY 235 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ws9 n LYS 236 N -2.00 1.33 0.13 1.61 5.02 -0.88 -1.51 118.16 121.86 1ws9 n LYS 236 Ca 0.00 -2.89 0.01 0.00 -2.02 0.00 0.00 58.31 53.40 1ws9 n LYS 236 Cb 0.00 -1.45 0.31 0.00 -0.02 0.00 0.00 35.03 33.88 1ws9 n LYS 236 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1ws9 h GLY 237 N 0.60 0.19 1.56 0.72 0.00 0.39 -2.98 103.07 103.55 1ws9 h GLY 237 Ca -0.01 -0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 1ws9 h GLY 237 CO 0.01 0.14 -0.00 -2.75 0.00 0.00 0.00 176.54 173.93 1ws9 h PHE 238 N 0.16 0.57 -0.93 5.60 3.04 -1.79 -1.34 116.94 122.25 1ws9 h PHE 238 Ca 0.02 -0.06 0.01 0.00 3.98 0.00 0.00 57.97 61.92 1ws9 h PHE 238 Cb 0.63 -0.16 -0.05 0.00 2.56 0.00 0.00 35.95 38.93 1ws9 h PHE 238 CO 0.01 0.56 0.60 1.88 -2.02 0.00 0.00 178.31 179.33 1ws9 h TYR 239 N 0.52 1.18 -0.38 0.41 0.05 -1.83 -1.00 116.97 115.93 1ws9 h TYR 239 Ca 0.11 0.02 -0.11 0.00 0.05 0.00 0.00 58.73 58.80 1ws9 h TYR 239 Cb 0.34 -0.40 -0.01 0.00 1.01 0.00 0.00 36.73 37.67 1ws9 h TYR 239 CO 0.01 0.76 -0.21 -0.44 -1.05 0.00 0.00 178.16 177.23 1ws9 h ASP 240 N 1.26 0.76 -0.34 3.88 3.45 -1.46 -2.66 116.42 121.32 1ws9 h ASP 240 Ca 0.34 -0.26 0.04 0.00 0.43 0.00 0.00 57.03 57.57 1ws9 h ASP 240 Cb -0.12 -0.21 -0.04 0.00 -0.56 0.00 0.00 39.33 38.40 1ws9 h ASP 240 CO -0.07 0.95 0.12 0.58 -1.57 0.00 0.00 179.24 179.25 1ws9 h VAL 241 N 0.66 0.90 -0.37 -1.35 2.07 -0.36 0.14 116.25 117.94 1ws9 h VAL 241 Ca 0.09 -0.09 0.05 0.00 0.82 0.00 0.00 66.70 67.57 1ws9 h VAL 241 Cb 0.71 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1ws9 h VAL 241 CO 0.05 0.05 0.12 -0.07 0.02 0.00 0.00 177.57 177.75 1ws9 h LEU 242 N 0.26 0.13 -0.98 2.57 3.38 -1.14 0.21 115.31 119.73 1ws9 h LEU 242 Ca 0.15 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.19 1ws9 h LEU 242 Cb 0.13 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 1ws9 h LEU 242 CO -0.16 0.11 0.65 0.03 0.09 0.00 0.00 178.44 179.16 1ws9 h ARG 243 N 0.27 1.26 -0.51 1.13 3.08 -1.07 -1.46 114.38 117.08 1ws9 h ARG 243 Ca 0.17 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 60.04 1ws9 h ARG 243 Cb 0.16 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 1ws9 h ARG 243 CO -0.18 0.84 -0.08 0.28 -1.07 0.00 0.00 179.97 179.75 1ws9 h VAL 244 N 1.30 1.27 -0.39 2.04 2.07 -0.11 -2.92 116.25 119.50 1ws9 h VAL 244 Ca 0.37 -1.21 -0.06 0.00 0.82 0.00 0.00 66.70 66.62 1ws9 h VAL 244 Cb -0.10 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1ws9 h VAL 244 CO -0.09 0.43 -0.00 -0.07 0.02 0.00 0.00 177.57 177.85 1ws9 h LEU 245 N 0.82 0.60 -0.58 2.57 3.38 -0.13 -1.64 115.31 120.33 1ws9 h LEU 245 Ca 0.14 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.02 1ws9 h LEU 245 Cb 0.63 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1ws9 h LEU 245 CO 0.04 0.67 0.33 0.44 0.09 0.00 0.00 178.44 180.01 1ws9 h ASP 246 N 0.60 0.52 -0.34 -0.43 3.32 -1.09 -1.28 116.42 117.72 1ws9 h ASP 246 Ca 0.12 0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.11 1ws9 h ASP 246 Cb 0.38 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1ws9 h ASP 246 CO 0.01 0.35 -0.11 1.23 -1.72 0.00 0.00 179.24 179.01 1ws9 h GLY 247 N 0.64 0.73 1.36 2.75 0.00 -1.34 -3.15 103.07 104.06 1ws9 h GLY 247 Ca 0.25 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 1ws9 h GLY 247 CO -0.13 0.56 0.31 -1.33 0.00 0.00 0.00 176.54 175.95 1ws9 h GLY 248 N 0.45 0.89 1.60 4.60 0.00 -0.98 -2.66 103.07 106.98 1ws9 h GLY 248 Ca 0.08 -0.40 0.06 0.00 0.00 0.00 0.00 47.33 47.07 1ws9 h GLY 248 CO 0.04 0.38 0.14 3.21 0.00 0.00 0.00 176.54 180.31 1ws9 h ARG 249 N 0.84 0.00 -0.44 4.80 3.08 -1.19 -0.42 114.38 121.05 1ws9 h ARG 249 Ca 0.21 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.15 1ws9 h ARG 249 Cb 0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1ws9 h ARG 249 CO -0.03 0.00 -0.15 0.82 -1.07 0.00 0.00 179.97 179.53 1ws9 h ILE 250 N 0.00 1.27 -0.46 2.04 2.04 -1.55 -1.18 117.51 119.67 1ws9 h ILE 250 Ca 0.09 -1.29 -0.11 0.00 1.00 0.00 0.00 64.86 64.56 1ws9 h ILE 250 Cb 0.38 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 1ws9 h ILE 250 CO -0.00 0.44 -0.14 1.23 0.00 0.00 0.00 178.15 179.68 1ws9 h GLY 251 N 0.71 0.98 1.85 5.37 0.00 -1.18 -1.64 103.07 109.16 1ws9 h GLY 251 Ca 0.11 -0.82 -0.07 0.00 0.00 0.00 0.00 47.33 46.54 1ws9 h GLY 251 CO 0.05 0.75 -0.25 -2.22 0.00 0.00 0.00 176.54 174.87 1ws9 h ILE 252 N 0.74 1.22 -0.38 2.60 1.08 -1.20 0.83 117.51 122.41 1ws9 h ILE 252 Ca 0.11 -1.05 -0.10 0.00 -0.39 0.00 0.00 64.86 63.43 1ws9 h ILE 252 Cb 0.69 1.43 -0.01 0.00 -3.07 0.00 0.00 36.82 35.86 1ws9 h ILE 252 CO 0.05 0.31 -0.17 0.00 -0.69 0.00 0.00 178.15 177.66 1ws9 h ALA 253 N 1.59 0.53 -0.63 1.87 0.00 -0.94 -0.83 119.26 120.85 1ws9 h ALA 253 Ca 0.03 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 1ws9 h ALA 253 Cb 0.54 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1ws9 h ALA 253 CO 0.04 0.46 0.17 0.00 0.00 0.00 0.00 179.25 179.92 1ws9 h ALA 254 N 0.81 1.12 -0.27 0.00 0.00 -0.72 -1.97 119.26 118.23 1ws9 h ALA 254 Ca 0.09 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1ws9 h ALA 254 Cb 0.71 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1ws9 h ALA 254 CO 0.05 0.60 0.16 1.98 0.00 0.00 0.00 179.25 182.03 1ws9 h MET 255 N 0.93 0.38 -0.18 0.00 -1.53 -0.53 -2.01 114.93 111.98 1ws9 h MET 255 Ca 0.20 -0.04 0.02 0.00 -3.44 0.00 0.00 59.70 56.44 1ws9 h MET 255 Cb 0.31 -0.08 -0.02 0.00 -0.55 0.00 0.00 31.60 31.26 1ws9 h MET 255 CO -0.00 0.32 0.06 0.00 0.14 0.00 0.00 176.91 177.43 1ws9 h ALA 256 N 1.04 0.20 -0.81 0.39 0.00 -0.84 -2.54 119.26 116.69 1ws9 h ALA 256 Ca 0.10 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.10 1ws9 h ALA 256 Cb 0.04 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 1ws9 h ALA 256 CO -0.02 -0.37 0.48 0.28 0.00 0.00 0.00 179.25 179.62 1ws9 h VAL 257 N 0.15 0.96 -0.45 0.00 2.07 -1.18 -0.80 116.25 117.00 1ws9 h VAL 257 Ca 0.08 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1ws9 h VAL 257 Cb 0.04 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 1ws9 h VAL 257 CO -0.08 0.15 0.29 1.23 0.02 0.00 0.00 177.57 179.18 1ws9 h GLY 258 N 0.83 0.65 1.07 2.17 0.00 -0.98 0.84 103.07 107.66 1ws9 h GLY 258 Ca 0.38 -0.25 -0.11 0.00 0.00 0.00 0.00 47.33 47.34 1ws9 h GLY 258 CO -0.21 0.25 -0.14 1.41 0.00 0.00 0.00 176.54 177.84 1ws9 h LEU 259 N 0.61 0.97 -0.60 3.11 3.38 -1.05 -1.74 115.31 119.99 1ws9 h LEU 259 Ca 0.16 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 1ws9 h LEU 259 Cb -0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1ws9 h LEU 259 CO -0.03 1.12 0.17 1.23 0.09 0.00 0.00 178.44 181.01 1ws9 h GLY 260 N 0.81 1.01 0.99 0.83 0.00 -0.94 -1.55 103.07 104.22 1ws9 h GLY 260 Ca 0.12 -0.62 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 1ws9 h GLY 260 CO 0.05 0.57 0.28 -1.61 0.00 0.00 0.00 176.54 175.83 1ws9 h GLN 261 N 0.85 0.88 -0.22 4.80 5.75 -0.70 0.18 115.11 126.65 1ws9 h GLN 261 Ca 0.19 -0.14 0.02 0.00 -0.15 0.00 0.00 58.65 58.57 1ws9 h GLN 261 Cb 0.32 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.70 1ws9 h GLN 261 CO -0.00 0.72 0.09 0.00 -2.65 0.00 0.00 178.83 176.99 1ws9 h ALA 262 N 1.11 0.25 -0.86 3.38 0.00 -1.06 0.31 119.26 122.39 1ws9 h ALA 262 Ca 0.21 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1ws9 h ALA 262 Cb 0.14 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1ws9 h ALA 262 CO -0.02 -0.32 0.53 0.00 0.00 0.00 0.00 179.25 179.43 1ws9 h ALA 263 N 1.12 1.10 -0.34 0.00 0.00 -0.89 -1.28 119.26 118.97 1ws9 h ALA 263 Ca 0.09 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1ws9 h ALA 263 Cb 0.04 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1ws9 h ALA 263 CO -0.08 0.56 -0.11 1.25 0.00 0.00 0.00 179.25 180.87 1ws9 h LEU 264 N 1.19 0.69 -0.79 0.00 5.85 -0.02 -1.59 115.31 120.63 1ws9 h LEU 264 Ca 0.31 -0.38 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 1ws9 h LEU 264 Cb -0.06 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 1ws9 h LEU 264 CO -0.06 0.91 0.39 0.44 -0.34 0.00 0.00 178.44 179.78 1ws9 h ASP 265 N 0.47 1.03 -0.26 1.25 3.45 -0.16 -0.59 116.42 121.61 1ws9 h ASP 265 Ca 0.08 -0.13 -0.05 0.00 0.43 0.00 0.00 57.03 57.36 1ws9 h ASP 265 Cb 0.62 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 39.12 1ws9 h ASP 265 CO 0.04 0.87 -0.04 0.22 -1.57 0.00 0.00 179.24 178.75 1ws9 h TYR 266 N 1.11 0.54 -0.40 4.55 5.03 -1.15 -1.82 116.97 124.82 1ws9 h TYR 266 Ca 0.27 -0.11 -0.05 0.00 2.58 0.00 0.00 58.73 61.42 1ws9 h TYR 266 Cb 0.11 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.23 1ws9 h TYR 266 CO 0.01 0.68 0.02 0.00 -1.32 0.00 0.00 178.16 177.55 1ws9 h ALA 267 N 0.78 1.29 0.37 1.82 0.00 -1.10 0.12 119.26 122.53 1ws9 h ALA 267 Ca 0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ws9 h ALA 267 Cb 0.49 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1ws9 h ALA 267 CO 0.02 0.48 -0.18 -0.07 0.00 0.00 0.00 179.25 179.51 1ws9 h LEU 268 N 0.60 -0.42 -0.24 0.00 3.38 -0.97 0.69 115.31 118.36 1ws9 h LEU 268 Ca 0.13 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1ws9 h LEU 268 Cb 0.35 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1ws9 h LEU 268 CO 0.01 -0.15 0.08 0.00 0.09 0.00 0.00 178.44 178.47 1ws9 h ALA 269 N -0.12 0.26 -0.09 1.53 0.00 -1.19 -1.96 119.26 117.69 1ws9 h ALA 269 Ca -0.05 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ws9 h ALA 269 Cb 0.48 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ws9 h ALA 269 CO 0.08 -0.34 0.02 -0.92 0.00 0.00 0.00 179.25 178.10 1ws9 h TYR 270 N 0.19 0.03 0.00 0.00 3.20 -0.93 -2.28 116.97 117.18 1ws9 h TYR 270 Ca 0.10 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 1ws9 h TYR 270 Cb 0.07 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.34 1ws9 h TYR 270 CO -0.13 0.02 -0.05 0.00 -1.64 0.00 0.00 178.16 176.36 1ws9 h ALA 271 N 1.06 1.52 0.00 1.82 0.00 -0.70 0.19 119.26 123.15 1ws9 h ALA 271 Ca 0.04 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1ws9 h ALA 271 Cb 0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1ws9 h ALA 271 CO -0.05 0.06 -0.84 -0.22 0.00 0.00 0.00 179.25 178.20 1ws9 h LYS 272 N 0.00 0.00 0.00 0.00 3.64 -0.82 -2.39 116.57 117.00 1ws9 h LYS 272 Ca -0.00 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.10 1ws9 h LYS 272 Cb 0.11 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.89 1ws9 h LYS 272 CO 0.01 0.84 -1.63 0.41 -2.27 0.00 0.00 179.45 176.80 1ws9 n GLY 273 N 0.97 -0.70 3.73 5.01 0.00 -0.63 -4.86 105.19 108.71 1ws9 n GLY 273 Ca -0.00 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1ws9 n GLY 273 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ws9 n ARG 274 N -4.39 2.59 -4.34 1.61 3.00 0.58 -4.91 116.66 110.81 1ws9 n ARG 274 Ca -0.37 0.92 -0.25 0.00 -0.00 0.00 0.00 57.85 58.16 1ws9 n ARG 274 Cb 0.71 -2.69 -0.13 0.00 0.00 0.00 0.00 32.46 30.35 1ws9 n ARG 274 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1ws9 s GLU 275 N -0.41 1.18 -0.11 -0.14 2.02 -1.26 -1.91 118.70 118.07 1ws9 s GLU 275 Ca 0.65 -1.16 -0.12 0.00 0.02 0.00 0.00 54.97 54.36 1ws9 s GLU 275 Cb -0.52 -1.46 0.03 0.00 0.10 0.00 0.00 34.13 32.28 1ws9 s GLU 275 CO 0.48 0.34 0.34 0.00 0.02 0.00 0.00 175.26 176.44 1ws9 s ALA 276 N -1.11 -0.84 -1.46 5.21 0.00 0.90 -4.86 121.76 119.60 1ws9 s ALA 276 Ca 0.07 0.87 -0.11 0.00 0.00 0.00 0.00 51.96 52.80 1ws9 s ALA 276 Cb -0.10 -0.46 0.05 0.00 0.00 0.00 0.00 23.12 22.60 1ws9 s ALA 276 CO 0.04 -0.18 0.99 1.19 0.00 0.00 0.00 175.76 177.81 1ws9 n PHE 277 N 2.64 -2.47 -1.02 0.00 3.01 -1.26 -2.40 117.46 115.96 1ws9 n PHE 277 Ca -0.14 0.88 -0.01 0.00 1.01 0.00 0.00 57.45 59.19 1ws9 n PHE 277 Cb 0.57 -4.39 -0.00 0.00 -0.01 0.00 0.00 39.48 35.65 1ws9 n PHE 277 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ws9 n GLY 278 N -1.77 0.47 3.55 1.37 0.00 -1.26 -5.03 105.19 102.52 1ws9 n GLY 278 Ca 0.01 -0.54 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 1ws9 n GLY 278 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ws9 s ARG 279 N -1.12 1.20 0.30 1.61 1.70 -1.01 -5.14 118.95 116.49 1ws9 s ARG 279 Ca 0.00 -0.52 -0.30 0.00 -0.47 0.00 0.00 55.73 54.45 1ws9 s ARG 279 Cb 0.00 0.51 -0.11 0.00 -0.57 0.00 0.00 34.95 34.77 1ws9 s ARG 279 CO 0.00 -0.53 1.59 -2.14 -1.08 0.00 0.00 175.30 173.13 1ws9 s PRO 280 N -3.53 4.12 0.64 3.89 0.02 -1.26 -0.07 135.00 138.81 1ws9 s PRO 280 Ca 0.05 2.58 0.41 0.00 0.02 0.00 0.00 61.00 64.06 1ws9 s PRO 280 Cb -0.02 -3.02 2.18 0.00 0.02 0.00 0.00 34.50 33.66 1ws9 s PRO 280 CO -0.07 -0.63 2.29 -0.84 -0.33 0.00 0.00 177.00 177.42 1ws9 h ILE 281 N 3.35 0.08 0.00 2.83 3.07 -1.41 0.04 117.51 125.48 1ws9 h ILE 281 Ca -0.47 -0.11 -0.00 0.00 1.55 0.00 0.00 64.86 65.83 1ws9 h ILE 281 Cb 1.22 1.09 -0.00 0.00 -0.27 0.00 0.00 36.82 38.87 1ws9 h ILE 281 CO 0.78 0.01 -0.02 0.00 -1.05 0.00 0.00 178.15 177.87 1ws9 h ALA 282 N 1.99 1.12 0.00 0.16 0.00 -1.69 -0.81 119.26 120.04 1ws9 h ALA 282 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ws9 h ALA 282 Cb 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ws9 h ALA 282 CO 0.00 0.03 0.00 0.39 0.00 0.00 0.00 179.25 179.67 1ws9 n GLU 283 N -3.29 0.48 -3.61 0.00 1.02 0.00 -4.05 120.64 111.20 1ws9 n GLU 283 Ca -0.02 0.03 -0.36 0.00 -0.02 0.00 0.00 57.16 56.79 1ws9 n GLU 283 Cb 0.14 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 29.99 1ws9 n GLU 283 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1ws9 s PHE 284 N -2.43 3.43 0.52 -0.32 0.08 -0.31 -4.96 117.98 113.99 1ws9 s PHE 284 Ca 0.28 0.48 0.26 0.00 0.12 0.00 0.00 56.93 58.07 1ws9 s PHE 284 Cb 0.17 -2.27 1.59 0.00 -0.57 0.00 0.00 43.02 41.95 1ws9 s PHE 284 CO 0.37 0.24 2.17 0.93 -0.10 0.00 0.00 175.22 178.83 1ws9 h GLU 285 N 6.73 0.00 -0.03 0.44 5.08 -1.86 0.98 114.58 125.92 1ws9 h GLU 285 Ca -0.41 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 57.96 1ws9 h GLU 285 Cb 1.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 1ws9 h GLU 285 CO 0.75 0.05 0.03 0.78 -1.00 0.00 0.00 179.01 179.62 1ws9 h GLY 286 N 0.29 0.00 0.00 -3.84 0.00 -1.93 -0.86 103.07 96.74 1ws9 h GLY 286 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.01 1ws9 h GLY 286 CO 0.01 0.00 -1.86 -0.62 0.00 0.00 0.00 176.54 174.06 1ws9 n VAL 287 N -4.35 1.52 -0.33 4.60 0.31 0.12 -4.35 118.33 115.85 1ws9 n VAL 287 Ca -0.02 -0.18 0.02 0.00 -0.01 0.00 0.00 64.34 64.15 1ws9 n VAL 287 Cb 0.12 -2.02 0.19 0.00 -0.91 0.00 0.00 33.84 31.23 1ws9 n VAL 287 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1ws9 h SER 288 N -1.00 1.00 -0.93 4.52 4.64 -0.91 -2.14 113.55 118.74 1ws9 h SER 288 Ca -0.48 -0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.85 1ws9 h SER 288 Cb 1.38 -0.22 -0.05 0.00 -0.31 0.00 0.00 62.40 63.21 1ws9 h SER 288 CO -0.29 0.67 0.61 -0.26 -0.87 0.00 0.00 176.83 176.69 1ws9 h PHE 289 N 1.15 1.17 -0.17 4.77 -1.00 -1.39 -0.05 116.94 121.42 1ws9 h PHE 289 Ca 0.39 0.03 -0.00 0.00 2.81 0.00 0.00 57.97 61.19 1ws9 h PHE 289 Cb 0.09 -0.40 -0.01 0.00 3.61 0.00 0.00 35.95 39.25 1ws9 h PHE 289 CO -0.00 0.74 0.09 0.87 -1.61 0.00 0.00 178.31 178.40 1ws9 h LYS 290 N 1.26 0.24 -0.77 1.51 1.57 -1.59 -1.36 116.57 117.42 1ws9 h LYS 290 Ca 0.34 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 59.10 1ws9 h LYS 290 Cb -0.14 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.08 1ws9 h LYS 290 CO -0.07 0.26 0.50 -0.07 -0.57 0.00 0.00 179.45 179.50 1ws9 h LEU 291 N 0.16 0.86 -0.45 2.94 3.38 -1.05 -1.43 115.31 119.72 1ws9 h LEU 291 Ca 0.06 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1ws9 h LEU 291 Cb 0.09 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1ws9 h LEU 291 CO -0.01 0.61 0.07 0.00 0.09 0.00 0.00 178.44 179.20 1ws9 h ALA 292 N 1.30 0.60 -0.25 1.53 0.00 -0.78 -1.49 119.26 120.17 1ws9 h ALA 292 Ca 0.29 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1ws9 h ALA 292 Cb -0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1ws9 h ALA 292 CO -0.08 0.33 -0.04 0.93 0.00 0.00 0.00 179.25 180.39 1ws9 h GLU 293 N 0.62 0.48 -0.28 0.00 5.08 -1.09 -2.05 114.58 117.33 1ws9 h GLU 293 Ca 0.14 -0.17 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1ws9 h GLU 293 Cb 0.39 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1ws9 h GLU 293 CO 0.01 0.68 0.17 0.00 -1.00 0.00 0.00 179.01 178.87 1ws9 h ALA 294 N 0.78 0.35 -0.82 3.43 0.00 -1.21 -1.29 119.26 120.50 1ws9 h ALA 294 Ca 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1ws9 h ALA 294 Cb 0.49 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1ws9 h ALA 294 CO 0.02 -0.21 0.44 0.00 0.00 0.00 0.00 179.25 179.51 1ws9 h ALA 295 N 1.12 1.05 -0.48 0.00 0.00 -1.25 -0.14 119.26 119.56 1ws9 h ALA 295 Ca 0.11 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1ws9 h ALA 295 Cb -0.01 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 1ws9 h ALA 295 CO -0.05 0.57 0.14 1.15 0.00 0.00 0.00 179.25 181.06 1ws9 h THR 296 N 1.14 1.23 -0.17 0.00 2.02 -1.09 -2.00 112.91 114.05 1ws9 h THR 296 Ca 0.29 -0.79 -0.19 0.00 0.77 0.00 0.00 66.41 66.49 1ws9 h THR 296 Cb 0.05 0.83 -0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1ws9 h THR 296 CO -0.04 0.29 -0.65 -0.33 0.37 0.00 0.00 175.52 175.16 1ws9 h GLU 297 N 0.65 0.63 -0.68 6.66 5.08 -0.96 -2.30 114.58 123.66 1ws9 h GLU 297 Ca 0.15 -0.45 -0.07 0.00 -1.00 0.00 0.00 59.36 58.00 1ws9 h GLU 297 Cb 0.30 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1ws9 h GLU 297 CO -0.00 1.07 0.15 -0.07 -1.00 0.00 0.00 179.01 179.16 1ws9 h LEU 298 N 0.46 1.03 -0.42 1.33 3.38 -0.95 0.11 115.31 120.24 1ws9 h LEU 298 Ca -0.01 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 1ws9 h LEU 298 Cb 1.23 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1ws9 h LEU 298 CO 0.13 0.99 0.12 -0.08 0.09 0.00 0.00 178.44 179.69 1ws9 h GLU 299 N 1.03 0.67 -0.92 1.13 4.57 -1.32 0.78 114.58 120.52 1ws9 h GLU 299 Ca 0.21 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 58.23 1ws9 h GLU 299 Cb 0.38 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.83 1ws9 h GLU 299 CO 0.00 0.67 0.53 0.00 -1.18 0.00 0.00 179.01 179.03 1ws9 h ALA 300 N 0.97 1.17 -0.59 2.92 0.00 -1.10 -1.37 119.26 121.26 1ws9 h ALA 300 Ca 0.13 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1ws9 h ALA 300 Cb 0.29 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1ws9 h ALA 300 CO -0.00 0.66 0.09 0.00 0.00 0.00 0.00 179.25 179.99 1ws9 h ALA 301 N 1.29 1.05 -0.48 0.00 0.00 -0.22 -1.69 119.26 119.20 1ws9 h ALA 301 Ca 0.33 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1ws9 h ALA 301 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1ws9 h ALA 301 CO -0.06 0.61 -0.14 -0.09 0.00 0.00 0.00 179.25 179.58 1ws9 h ARG 302 N 0.90 0.93 -0.74 0.00 2.43 -0.24 -2.27 114.38 115.40 1ws9 h ARG 302 Ca 0.18 -0.37 -0.03 0.00 -0.81 0.00 0.00 59.98 58.95 1ws9 h ARG 302 Cb 0.40 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.87 1ws9 h ARG 302 CO 0.01 1.03 0.34 -0.07 -1.51 0.00 0.00 179.97 179.77 1ws9 h LEU 303 N 0.78 0.97 -0.54 3.80 3.38 -1.07 -1.71 115.31 120.92 1ws9 h LEU 303 Ca 0.12 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1ws9 h LEU 303 Cb 0.70 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1ws9 h LEU 303 CO 0.05 0.84 0.26 -0.07 0.09 0.00 0.00 178.44 179.61 1ws9 h LEU 304 N 1.04 0.71 -0.62 1.67 3.38 -1.12 -0.99 115.31 119.38 1ws9 h LEU 304 Ca 0.25 -0.13 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 1ws9 h LEU 304 Cb 0.14 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1ws9 h LEU 304 CO -0.03 0.65 -0.68 0.10 0.09 0.00 0.00 178.44 178.57 1ws9 h TYR 305 N 0.73 0.09 -0.62 1.13 -0.00 -1.24 -1.84 116.97 115.22 1ws9 h TYR 305 Ca 0.19 -0.04 -0.10 0.00 0.00 0.00 0.00 58.73 58.78 1ws9 h TYR 305 Cb 0.13 -0.01 -0.02 0.00 0.00 0.00 0.00 36.73 36.82 1ws9 h TYR 305 CO -0.00 0.72 0.01 -0.07 -0.00 0.00 0.00 178.16 178.82 1ws9 h LEU 306 N 0.05 1.06 -0.22 0.10 3.38 -1.11 -0.44 115.31 118.12 1ws9 h LEU 306 Ca -0.01 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.65 1ws9 h LEU 306 Cb 1.20 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1ws9 h LEU 306 CO 0.09 1.10 0.12 0.50 0.09 0.00 0.00 178.44 180.34 1ws9 h LYS 307 N 0.98 0.31 -0.75 1.13 3.64 -1.00 -0.50 116.57 120.38 1ws9 h LYS 307 Ca 0.18 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1ws9 h LYS 307 Cb 0.55 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.27 1ws9 h LYS 307 CO 0.03 0.28 0.37 0.00 -2.27 0.00 0.00 179.45 177.86 1ws9 h ALA 308 N 1.01 0.96 -0.59 5.00 0.00 -1.12 -1.65 119.26 122.87 1ws9 h ALA 308 Ca 0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ws9 h ALA 308 Cb 0.06 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1ws9 h ALA 308 CO -0.01 0.51 0.36 0.00 0.00 0.00 0.00 179.25 180.11 1ws9 h ALA 309 N 1.19 0.76 -0.20 0.00 0.00 -0.80 -2.48 119.26 117.73 1ws9 h ALA 309 Ca 0.26 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.11 1ws9 h ALA 309 Cb 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1ws9 h ALA 309 CO -0.04 0.23 0.11 0.93 0.00 0.00 0.00 179.25 180.49 1ws9 h GLU 310 N 0.80 0.23 -0.70 0.00 4.39 -0.61 -0.48 114.58 118.22 1ws9 h GLU 310 Ca 0.21 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.93 1ws9 h GLU 310 Cb -0.03 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.53 1ws9 h GLU 310 CO -0.04 0.15 0.47 -0.07 -1.16 0.00 0.00 179.01 178.36 1ws9 h LEU 311 N 0.24 0.75 -0.15 1.33 3.38 -1.14 0.14 115.31 119.85 1ws9 h LEU 311 Ca 0.08 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1ws9 h LEU 311 Cb 0.00 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 1ws9 h LEU 311 CO -0.04 0.52 -0.16 0.50 0.09 0.00 0.00 178.44 179.35 1ws9 h LYS 312 N 0.88 0.38 0.00 1.13 3.64 -1.00 0.10 116.57 121.69 1ws9 h LYS 312 Ca 0.28 -0.20 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1ws9 h LYS 312 Cb 0.02 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1ws9 h LYS 312 CO -0.07 0.76 -0.08 -0.44 -2.27 0.00 0.00 179.45 177.35 1ws9 h ASP 313 N 0.01 0.00 -0.19 4.20 3.32 -0.55 -0.57 116.42 122.64 1ws9 h ASP 313 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ws9 h ASP 313 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1ws9 h ASP 313 CO 0.04 0.08 0.00 0.00 -1.72 0.00 0.00 179.24 177.64 1ws9 n ALA 314 N -2.45 2.49 -1.61 3.45 0.00 0.43 -4.89 120.51 117.93 1ws9 n ALA 314 Ca -0.03 -0.37 -0.16 0.00 0.00 0.00 0.00 53.44 52.88 1ws9 n ALA 314 Cb 0.16 -1.03 -0.06 0.00 0.00 0.00 0.00 19.45 18.52 1ws9 n ALA 314 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ws9 n GLY 315 N 0.88 1.32 3.85 0.00 0.00 -0.22 -5.00 105.19 106.02 1ws9 n GLY 315 Ca 0.09 -0.24 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 1ws9 n GLY 315 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ws9 s ARG 316 N -3.62 3.06 0.35 1.61 0.52 0.34 -5.02 118.95 116.19 1ws9 s ARG 316 Ca 0.00 -0.83 -0.29 0.00 -0.52 0.00 0.00 55.73 54.10 1ws9 s ARG 316 Cb 0.00 -2.72 -0.11 0.00 0.52 0.00 0.00 34.95 32.64 1ws9 s ARG 316 CO 0.00 0.48 1.52 -1.25 0.02 0.00 0.00 175.30 176.06 1ws9 s PRO 317 N -3.31 4.11 0.00 3.54 0.04 -1.26 -4.15 135.00 133.97 1ws9 s PRO 317 Ca 0.32 2.58 0.06 0.00 0.04 0.00 0.00 61.00 64.00 1ws9 s PRO 317 Cb -0.10 -2.98 0.10 0.00 0.04 0.00 0.00 34.50 31.56 1ws9 s PRO 317 CO 0.25 -0.56 0.97 1.97 0.04 0.00 0.00 177.00 179.66 1ws9 n PHE 318 N 0.92 0.00 0.05 0.56 1.16 -1.26 -4.88 117.46 114.01 1ws9 n PHE 318 Ca 0.03 -0.15 -0.12 0.00 -1.87 0.00 0.00 57.45 55.33 1ws9 n PHE 318 Cb 0.39 0.01 -0.07 0.00 -1.61 0.00 0.00 39.48 38.19 1ws9 n PHE 318 CO 0.00 0.00 0.00 1.15 -1.87 0.00 0.00 176.76 176.04 1ws9 h THR 319 N 6.58 0.99 -0.18 1.97 2.02 -1.94 0.51 112.91 122.86 1ws9 h THR 319 Ca -0.09 -0.08 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 1ws9 h THR 319 Cb 1.46 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 1ws9 h THR 319 CO 0.01 0.02 0.05 0.25 0.37 0.00 0.00 175.52 176.21 1ws9 h LEU 320 N -0.08 0.27 -1.18 2.58 5.85 -1.92 -2.29 115.31 118.55 1ws9 h LEU 320 Ca -0.00 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.45 1ws9 h LEU 320 Cb 0.06 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1ws9 h LEU 320 CO 0.01 0.42 0.08 -0.33 -0.34 0.00 0.00 178.44 178.28 1ws9 h GLU 321 N 0.11 0.65 -0.06 1.25 3.07 -1.89 -0.55 114.58 117.16 1ws9 h GLU 321 Ca 0.06 -0.13 -0.17 0.00 -0.50 0.00 0.00 59.36 58.62 1ws9 h GLU 321 Cb 0.25 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.05 1ws9 h GLU 321 CO -0.00 0.61 -0.72 0.00 -1.40 0.00 0.00 179.01 177.51 1ws9 h ALA 322 N 1.46 0.67 -0.34 3.43 0.00 -0.85 -1.53 119.26 122.09 1ws9 h ALA 322 Ca 0.14 -0.61 -0.15 0.00 0.00 0.00 0.00 54.91 54.29 1ws9 h ALA 322 Cb 0.28 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ws9 h ALA 322 CO 0.00 0.78 -0.37 0.00 0.00 0.00 0.00 179.25 179.66 1ws9 h ALA 323 N 1.03 0.51 -0.52 0.00 0.00 -1.00 -2.21 119.26 117.07 1ws9 h ALA 323 Ca -0.02 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 1ws9 h ALA 323 Cb 1.28 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1ws9 h ALA 323 CO 0.12 0.60 -0.03 1.96 0.00 0.00 0.00 179.25 181.90 1ws9 h GLN 324 N 0.65 0.94 0.08 0.00 4.20 -1.02 -1.43 115.11 118.53 1ws9 h GLN 324 Ca 0.05 -0.32 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 1ws9 h GLN 324 Cb 0.96 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1ws9 h GLN 324 CO 0.09 0.98 -0.04 0.00 -0.67 0.00 0.00 178.83 179.19 1ws9 h ALA 325 N 0.94 -0.10 -0.56 3.87 0.00 -1.25 -1.02 119.26 121.13 1ws9 h ALA 325 Ca 0.14 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ws9 h ALA 325 Cb 0.57 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1ws9 h ALA 325 CO 0.03 -0.47 0.23 -0.22 0.00 0.00 0.00 179.25 178.83 1ws9 h LYS 326 N -0.28 0.83 0.10 0.00 3.11 -1.40 0.65 116.57 119.58 1ws9 h LYS 326 Ca -0.01 -0.15 -0.00 0.00 -2.81 0.00 0.00 60.65 57.68 1ws9 h LYS 326 Cb 0.24 -0.14 0.00 0.00 -1.00 0.00 0.00 32.23 31.34 1ws9 h LYS 326 CO 0.02 0.71 -0.05 1.25 -2.81 0.00 0.00 179.45 178.57 1ws9 h LEU 327 N 0.77 -0.11 -0.19 5.20 5.85 -1.22 -0.31 115.31 125.30 1ws9 h LEU 327 Ca 0.19 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1ws9 h LEU 327 Cb 0.19 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1ws9 h LEU 327 CO -0.02 -0.02 0.04 0.15 -0.34 0.00 0.00 178.44 178.25 1ws9 h PHE 328 N -0.20 0.33 0.08 1.25 3.57 -1.10 -2.17 116.94 118.71 1ws9 h PHE 328 Ca -0.01 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.44 1ws9 h PHE 328 Cb 0.16 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.81 1ws9 h PHE 328 CO -0.05 0.45 -0.04 0.00 -2.23 0.00 0.00 178.31 176.44 1ws9 h ALA 329 N 0.84 -0.11 -0.59 2.41 0.00 -0.85 0.22 119.26 121.18 1ws9 h ALA 329 Ca 0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ws9 h ALA 329 Cb 0.29 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1ws9 h ALA 329 CO 0.00 -0.50 0.36 0.66 0.00 0.00 0.00 179.25 179.78 1ws9 h SER 330 N -0.23 0.70 -0.25 0.00 4.64 -1.10 0.27 113.55 117.58 1ws9 h SER 330 Ca -0.01 -0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.21 1ws9 h SER 330 Cb 0.19 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1ws9 h SER 330 CO 0.02 0.54 -0.03 -0.33 -0.87 0.00 0.00 176.83 176.16 1ws9 h GLU 331 N 0.79 0.47 -0.61 4.77 4.39 -1.33 -2.32 114.58 120.76 1ws9 h GLU 331 Ca 0.21 -0.17 -0.08 0.00 0.34 0.00 0.00 59.36 59.67 1ws9 h GLU 331 Cb -0.03 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 1ws9 h GLU 331 CO -0.04 0.67 0.08 0.00 -1.16 0.00 0.00 179.01 178.56 1ws9 h ALA 332 N 0.79 0.81 -0.38 3.43 0.00 -0.76 -2.49 119.26 120.66 1ws9 h ALA 332 Ca 0.07 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1ws9 h ALA 332 Cb 0.48 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1ws9 h ALA 332 CO 0.02 0.58 0.13 0.00 0.00 0.00 0.00 179.25 179.97 1ws9 h ALA 333 N 1.01 0.49 -0.64 0.00 0.00 -0.42 -0.37 119.26 119.34 1ws9 h ALA 333 Ca 0.18 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1ws9 h ALA 333 Cb 0.45 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ws9 h ALA 333 CO 0.02 0.13 0.11 0.28 0.00 0.00 0.00 179.25 179.78 1ws9 h VAL 334 N 0.46 1.26 -0.09 0.00 2.07 -1.42 -0.69 116.25 117.84 1ws9 h VAL 334 Ca 0.12 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1ws9 h VAL 334 Cb 0.24 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1ws9 h VAL 334 CO -0.01 0.38 0.05 0.50 0.02 0.00 0.00 177.57 178.51 1ws9 h LYS 335 N 0.97 0.10 -0.79 1.57 1.63 -1.24 0.08 116.57 118.87 1ws9 h LYS 335 Ca 0.19 -0.01 0.01 0.00 -0.85 0.00 0.00 60.65 60.00 1ws9 h LYS 335 Cb 0.43 -0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.00 1ws9 h LYS 335 CO 0.01 0.06 0.52 0.00 -3.45 0.00 0.00 179.45 176.60 1ws9 h ALA 336 N 1.04 1.01 -0.68 5.00 0.00 -0.85 -1.29 119.26 123.49 1ws9 h ALA 336 Ca 0.04 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1ws9 h ALA 336 Cb 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1ws9 h ALA 336 CO -0.02 0.40 0.19 0.00 0.00 0.00 0.00 179.25 179.82 1ws9 h ASP 338 N 1.02 0.77 0.14 0.00 1.82 -0.48 -2.27 116.42 117.41 1ws9 h ASP 338 Ca 0.22 -0.27 -0.14 0.00 -0.39 0.00 0.00 57.03 56.45 1ws9 h ASP 338 Cb 0.32 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 40.11 1ws9 h ASP 338 CO -0.00 0.96 -0.50 -0.33 -1.61 0.00 0.00 179.24 177.76 1ws9 h GLU 339 N 0.67 0.41 -0.35 0.28 5.08 -0.91 -2.14 114.58 117.62 1ws9 h GLU 339 Ca 0.10 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 58.15 1ws9 h GLU 339 Cb 0.71 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 1ws9 h GLU 339 CO 0.05 0.82 -0.05 0.00 -1.00 0.00 0.00 179.01 178.83 1ws9 h ALA 340 N 1.14 1.25 -0.32 3.43 0.00 -0.78 0.47 119.26 124.46 1ws9 h ALA 340 Ca 0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1ws9 h ALA 340 Cb 0.99 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1ws9 h ALA 340 CO 0.09 0.50 0.08 0.82 0.00 0.00 0.00 179.25 180.73 1ws9 h ILE 341 N 0.54 1.22 -0.16 0.00 2.04 -1.15 -2.43 117.51 117.57 1ws9 h ILE 341 Ca 0.11 -0.72 0.01 0.00 1.00 0.00 0.00 64.86 65.25 1ws9 h ILE 341 Cb 0.43 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1ws9 h ILE 341 CO 0.02 0.24 0.09 -0.61 0.00 0.00 0.00 178.15 177.90 1ws9 h GLN 342 N 0.36 0.19 -0.45 2.37 5.75 -0.71 -2.76 115.11 119.86 1ws9 h GLN 342 Ca 0.10 -0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.62 1ws9 h GLN 342 Cb 0.29 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.77 1ws9 h GLN 342 CO 0.00 0.12 0.30 0.82 -2.65 0.00 0.00 178.83 177.43 1ws9 h ILE 343 N 0.19 1.06 -0.00 2.39 2.04 -0.85 -0.93 117.51 121.41 1ws9 h ILE 343 Ca 0.06 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1ws9 h ILE 343 Cb -0.01 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 1ws9 h ILE 343 CO -0.03 0.10 -0.02 0.18 0.00 0.00 0.00 178.15 178.38 1ws9 n LEU 344 N -4.48 0.20 0.00 1.44 4.32 -0.92 -4.94 117.00 112.62 1ws9 n LEU 344 Ca 0.05 0.02 0.00 0.00 -0.02 0.00 0.00 56.01 56.06 1ws9 n LEU 344 Cb 0.13 -0.09 0.00 0.00 -1.62 0.00 0.00 43.42 41.84 1ws9 n LEU 344 CO 0.35 0.03 0.00 0.61 -1.22 0.00 0.00 177.39 177.16 1ws9 n GLY 345 N 1.12 3.51 0.27 -0.72 0.00 -0.36 -2.00 105.19 107.01 1ws9 n GLY 345 Ca 0.20 -0.12 0.04 0.00 0.00 0.00 0.00 46.02 46.14 1ws9 n GLY 345 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ws9 h GLY 346 N 0.00 0.35 2.00 -0.02 0.00 -1.89 -1.68 103.07 101.83 1ws9 h GLY 346 Ca 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 1ws9 h GLY 346 CO 0.00 0.16 -0.14 -0.97 0.00 0.00 0.00 176.54 175.59 1ws9 h TYR 347 N 0.33 0.00 0.00 5.60 0.05 -1.76 -0.93 116.97 120.26 1ws9 h TYR 347 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.86 1ws9 h TYR 347 Cb 0.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.89 1ws9 h TYR 347 CO 0.00 0.14 0.00 0.41 -1.05 0.00 0.00 178.16 177.66 1ws9 n GLY 348 N -0.24 -1.39 0.17 3.88 0.00 -0.63 -2.50 105.19 104.48 1ws9 n GLY 348 Ca -0.01 0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.19 1ws9 n GLY 348 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1ws9 n TYR 349 N -2.26 0.00 -4.29 1.61 9.36 -0.36 -4.09 117.16 117.13 1ws9 n TYR 349 Ca 0.03 0.00 -0.34 0.00 3.32 0.00 0.00 57.90 60.91 1ws9 n TYR 349 Cb 0.28 -0.12 -0.09 0.00 -0.63 0.00 0.00 39.34 38.79 1ws9 n TYR 349 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1ws9 s VAL 350 N -2.73 4.31 -1.48 2.97 -7.23 -1.04 -5.00 120.40 110.19 1ws9 s VAL 350 Ca 0.16 -0.43 0.14 0.00 -1.81 0.00 0.00 61.98 60.04 1ws9 s VAL 350 Cb 0.18 -2.89 0.26 0.00 0.56 0.00 0.00 36.38 34.49 1ws9 s VAL 350 CO 0.64 0.46 1.36 0.29 -0.31 0.00 0.00 175.10 177.54 1ws9 n LYS 351 N 1.65 0.22 0.23 4.82 5.02 -1.26 -2.34 118.16 126.50 1ws9 n LYS 351 Ca -0.16 0.14 0.10 0.00 -2.02 0.00 0.00 58.31 56.37 1ws9 n LYS 351 Cb 0.53 -1.50 0.56 0.00 -0.02 0.00 0.00 35.03 34.60 1ws9 n LYS 351 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1ws9 h ASP 352 N 0.00 0.00 -3.32 4.39 3.32 -1.94 -3.42 116.42 115.44 1ws9 h ASP 352 Ca 0.00 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 56.40 1ws9 h ASP 352 Cb 0.12 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.55 1ws9 h ASP 352 CO 0.00 0.21 -0.66 -0.31 -1.72 0.00 0.00 179.24 176.76 1ws9 s TYR 353 N -3.99 3.01 -1.33 4.55 2.02 -0.99 -5.06 117.35 115.55 1ws9 s TYR 353 Ca -0.02 -0.02 0.29 0.00 -0.37 0.00 0.00 57.07 56.96 1ws9 s TYR 353 Cb 0.12 -1.54 1.31 0.00 -0.40 0.00 0.00 41.96 41.45 1ws9 s TYR 353 CO 0.63 0.48 1.93 -0.35 -1.57 0.00 0.00 175.55 176.68 1ws9 n PRO 354 N 0.54 0.34 0.03 -1.71 -0.04 -1.26 -4.31 135.00 128.59 1ws9 n PRO 354 Ca -0.10 -0.05 -0.03 0.00 -0.04 0.00 0.00 63.50 63.28 1ws9 n PRO 354 Cb 0.52 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.70 1ws9 n PRO 354 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 1ws9 h VAL 355 N 0.13 1.26 -0.24 0.52 -1.51 -1.90 -1.36 116.25 113.14 1ws9 h VAL 355 Ca 0.00 -1.22 -0.06 0.00 -1.23 0.00 0.00 66.70 64.19 1ws9 h VAL 355 Cb 0.37 1.34 -0.01 0.00 -2.13 0.00 0.00 31.29 30.86 1ws9 h VAL 355 CO 0.00 0.39 -0.13 1.05 -1.23 0.00 0.00 177.57 177.65 1ws9 h GLU 356 N 0.40 0.40 -0.29 5.19 -0.00 -1.75 -1.97 114.58 116.56 1ws9 h GLU 356 Ca 0.06 -0.11 -0.15 0.00 -0.00 0.00 0.00 59.36 59.16 1ws9 h GLU 356 Cb 0.64 -0.05 -0.00 0.00 -0.00 0.00 0.00 28.75 29.34 1ws9 h GLU 356 CO 0.05 0.54 -0.40 -0.09 -0.00 0.00 0.00 179.01 179.10 1ws9 h ARG 357 N 0.38 0.79 -0.61 1.06 2.43 -1.68 -1.95 114.38 114.78 1ws9 h ARG 357 Ca 0.07 -0.46 0.08 0.00 -0.81 0.00 0.00 59.98 58.87 1ws9 h ARG 357 Cb 0.46 0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 29.98 1ws9 h ARG 357 CO 0.03 1.08 0.27 1.88 -1.51 0.00 0.00 179.97 181.73 1ws9 h TYR 358 N 0.54 0.49 -0.01 2.20 0.05 -0.76 0.13 116.97 119.61 1ws9 h TYR 358 Ca 0.03 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.84 1ws9 h TYR 358 Cb 0.99 -0.13 -0.00 0.00 1.01 0.00 0.00 36.73 38.60 1ws9 h TYR 358 CO 0.07 0.18 0.00 2.35 -1.05 0.00 0.00 178.16 179.71 1ws9 h TRP 359 N 0.49 0.01 -0.95 4.88 7.01 -1.28 0.08 115.95 126.20 1ws9 h TRP 359 Ca 0.30 -0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.35 1ws9 h TRP 359 Cb 0.31 -0.00 -0.06 0.00 -2.10 0.00 0.00 29.16 27.31 1ws9 h TRP 359 CO -0.13 0.20 0.62 0.00 -2.79 0.00 0.00 178.44 176.34 1ws9 h ARG 360 N -0.19 1.11 -0.03 2.65 3.08 -0.82 0.01 114.38 120.19 1ws9 h ARG 360 Ca 0.00 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 1ws9 h ARG 360 Cb 0.20 -0.25 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 1ws9 h ARG 360 CO -0.00 0.73 -0.04 -0.44 -1.07 0.00 0.00 179.97 179.15 1ws9 h ASP 361 N 1.14 0.10 -0.22 7.04 5.19 -0.63 -3.27 116.42 125.76 1ws9 h ASP 361 Ca 0.39 -0.52 -0.04 0.00 -0.62 0.00 0.00 57.03 56.25 1ws9 h ASP 361 Cb 0.10 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.57 1ws9 h ASP 361 CO -0.14 0.59 0.04 0.00 -3.12 0.00 0.00 179.24 176.62 1ws9 h ALA 362 N 0.50 1.50 -1.12 3.45 0.00 -0.76 -3.17 119.26 119.66 1ws9 h ALA 362 Ca 0.00 -0.15 0.31 0.00 0.00 0.00 0.00 54.91 55.07 1ws9 h ALA 362 Cb 0.57 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 18.14 1ws9 h ALA 362 CO 0.01 0.37 0.75 -0.09 0.00 0.00 0.00 179.25 180.29 1ws9 h ARG 363 N 0.45 0.24 0.00 0.00 9.65 -1.04 0.14 114.38 123.81 1ws9 h ARG 363 Ca 0.10 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 58.91 1ws9 h ARG 363 Cb 0.23 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.75 1ws9 h ARG 363 CO 0.00 0.16 -0.26 1.25 2.80 0.00 0.00 179.97 183.92 1ws9 h LEU 364 N 0.24 0.00 -2.33 3.80 5.85 -1.73 -3.02 115.31 118.12 1ws9 h LEU 364 Ca 0.62 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.34 1ws9 h LEU 364 Cb 1.86 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.89 1ws9 h LEU 364 CO -0.23 0.26 0.00 0.71 -0.34 0.00 0.00 178.44 178.84 1ws9 h THR 365 N 0.00 0.00 -0.01 1.05 1.35 -0.92 0.24 112.91 114.62 1ws9 h THR 365 Ca -0.00 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.79 1ws9 h THR 365 Cb 0.63 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 67.98 1ws9 h THR 365 CO 0.03 0.00 -0.14 0.54 -0.25 0.00 0.00 175.52 175.70 1ws9 n ARG 366 N -2.84 1.28 -0.02 4.72 1.74 -1.14 -4.43 116.66 115.97 1ws9 n ARG 366 Ca -0.02 -0.79 -0.05 0.00 -0.77 0.00 0.00 57.85 56.22 1ws9 n ARG 366 Cb 0.09 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.03 1ws9 n ARG 366 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1ws9 n ILE 367 N -0.17 0.34 -1.82 0.55 5.41 0.55 -2.30 119.36 121.92 1ws9 n ILE 367 Ca 0.15 -0.05 -0.36 0.00 1.00 0.00 0.00 62.75 63.49 1ws9 n ILE 367 Cb 0.37 -1.58 0.06 0.00 -0.71 0.00 0.00 39.64 37.77 1ws9 n ILE 367 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1ws9 s GLY 368 N -5.05 2.72 -1.55 7.39 0.00 0.49 -3.05 107.32 108.27 1ws9 s GLY 368 Ca -0.07 1.06 -0.12 0.00 0.00 0.00 0.00 44.72 45.59 1ws9 s GLY 368 CO 0.09 1.46 0.80 1.18 0.00 0.00 0.00 173.10 176.64 1ws9 n GLU 369 N -1.89 -4.34 0.00 2.90 1.02 -1.26 -4.57 120.64 112.50 1ws9 n GLU 369 Ca 0.14 0.50 0.00 0.00 -0.02 0.00 0.00 57.16 57.78 1ws9 n GLU 369 Cb 0.49 -5.17 0.00 0.00 -0.02 0.00 0.00 31.44 26.74 1ws9 n GLU 369 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ws9 n GLY 370 N -1.64 1.05 3.68 0.62 0.00 -1.23 -4.87 105.19 102.81 1ws9 n GLY 370 Ca -0.04 -0.94 -0.31 0.00 0.00 0.00 0.00 46.02 44.72 1ws9 n GLY 370 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ws9 s THR 371 N 0.00 2.22 0.32 2.61 -4.23 -1.17 -4.64 115.64 110.74 1ws9 s THR 371 Ca 0.00 0.07 0.04 0.00 -1.18 0.00 0.00 61.69 60.62 1ws9 s THR 371 Cb 0.00 -2.15 0.29 0.00 1.34 0.00 0.00 72.50 71.98 1ws9 s THR 371 CO 0.00 -0.09 1.88 0.28 -0.54 0.00 0.00 174.62 176.15 1ws9 h SER 372 N -1.79 0.82 -0.56 3.99 0.02 -1.78 -0.06 113.55 114.18 1ws9 h SER 372 Ca -0.43 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.53 1ws9 h SER 372 Cb 1.26 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.63 1ws9 h SER 372 CO 0.43 0.48 0.32 -0.33 -1.14 0.00 0.00 176.83 176.58 1ws9 h GLU 373 N 0.90 0.78 -0.36 3.45 3.07 -1.89 -1.13 114.58 119.40 1ws9 h GLU 373 Ca 0.43 -0.08 -0.05 0.00 -0.50 0.00 0.00 59.36 59.16 1ws9 h GLU 373 Cb 0.42 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.16 1ws9 h GLU 373 CO -0.19 0.59 0.05 0.82 -1.40 0.00 0.00 179.01 178.88 1ws9 h ILE 374 N 0.76 1.24 -0.63 3.13 1.08 -1.57 -2.85 117.51 118.68 1ws9 h ILE 374 Ca 0.20 -0.88 -0.01 0.00 -0.39 0.00 0.00 64.86 63.79 1ws9 h ILE 374 Cb 0.02 1.11 -0.03 0.00 -3.07 0.00 0.00 36.82 34.85 1ws9 h ILE 374 CO -0.03 0.29 0.36 -0.07 -0.69 0.00 0.00 178.15 178.01 1ws9 h LEU 375 N 0.45 0.76 -1.44 1.44 3.38 -0.79 -0.55 115.31 118.55 1ws9 h LEU 375 Ca 0.11 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1ws9 h LEU 375 Cb 0.38 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1ws9 h LEU 375 CO 0.01 0.60 -0.22 0.11 0.09 0.00 0.00 178.44 179.03 1ws9 h LYS 376 N 0.87 0.09 -0.15 1.13 1.57 -1.05 -0.10 116.57 118.92 1ws9 h LYS 376 Ca 0.22 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.89 1ws9 h LYS 376 Cb -0.00 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 1ws9 h LYS 376 CO -0.04 0.31 -0.25 -0.07 -0.57 0.00 0.00 179.45 178.83 1ws9 h LEU 377 N 0.08 0.48 -0.68 2.94 3.38 -0.92 -1.70 115.31 118.90 1ws9 h LEU 377 Ca 0.01 -0.53 -0.00 0.00 0.09 0.00 0.00 57.88 57.45 1ws9 h LEU 377 Cb 0.44 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1ws9 h LEU 377 CO 0.03 0.92 0.41 0.58 0.09 0.00 0.00 178.44 180.48 1ws9 h VAL 378 N 0.06 1.19 0.26 1.22 2.07 -0.81 -1.22 116.25 119.02 1ws9 h VAL 378 Ca 0.01 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 1ws9 h VAL 378 Cb 0.83 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1ws9 h VAL 378 CO 0.06 0.20 -0.12 0.40 0.02 0.00 0.00 177.57 178.12 1ws9 h ILE 379 N 0.92 0.79 -0.73 4.57 2.04 -1.03 -2.58 117.51 121.50 1ws9 h ILE 379 Ca 0.24 -0.38 0.07 0.00 1.00 0.00 0.00 64.86 65.79 1ws9 h ILE 379 Cb -0.04 1.01 -0.06 0.00 -0.74 0.00 0.00 36.82 36.99 1ws9 h ILE 379 CO -0.05 0.08 0.41 0.00 0.00 0.00 0.00 178.15 178.60 1ws9 h ALA 380 N 0.14 0.99 -0.32 1.87 0.00 -1.20 -0.39 119.26 120.35 1ws9 h ALA 380 Ca -0.04 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ws9 h ALA 380 Cb 0.40 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1ws9 h ALA 380 CO 0.06 0.08 0.20 -0.09 0.00 0.00 0.00 179.25 179.50 1ws9 h ARG 381 N 0.74 0.40 -0.81 0.00 2.43 -1.19 0.15 114.38 116.10 1ws9 h ARG 381 Ca 0.33 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.47 1ws9 h ARG 381 Cb 0.23 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.65 1ws9 h ARG 381 CO -0.20 0.27 0.47 0.00 -1.51 0.00 0.00 179.97 178.99 1ws9 h ARG 382 N 0.42 1.11 -0.61 0.20 2.47 -0.99 -1.81 114.38 115.17 1ws9 h ARG 382 Ca 0.12 -0.11 -0.07 0.00 -1.26 0.00 0.00 59.98 58.66 1ws9 h ARG 382 Cb -0.03 -0.23 -0.02 0.00 -1.65 0.00 0.00 29.97 28.04 1ws9 h ARG 382 CO -0.04 0.80 0.10 -0.07 0.56 0.00 0.00 179.97 181.32 1ws9 h LEU 383 N 1.11 0.96 -0.44 3.04 3.38 -0.59 -3.01 115.31 119.77 1ws9 h LEU 383 Ca 0.29 -0.26 -0.15 0.00 0.09 0.00 0.00 57.88 57.85 1ws9 h LEU 383 Cb -0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1ws9 h LEU 383 CO -0.05 0.98 -0.33 -0.07 0.09 0.00 0.00 178.44 179.06 1ws9 h LEU 384 N 0.91 1.00 -1.29 1.67 3.38 -0.35 -3.01 115.31 117.62 1ws9 h LEU 384 Ca 0.18 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1ws9 h LEU 384 Cb 0.42 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 1ws9 h LEU 384 CO 0.01 1.23 -0.06 1.05 0.09 0.00 0.00 178.44 180.77 1ws9 h GLU 385 N 0.79 0.00 0.00 1.13 4.11 -1.36 -1.94 114.58 117.32 1ws9 h GLU 385 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.51 1ws9 h GLU 385 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.17 1ws9 h GLU 385 CO 0.09 0.06 0.00 0.00 0.07 0.00 0.00 179.01 179.22 1ws9 n ALA 386 N -2.13 2.25 1.75 1.06 0.00 -1.14 -5.12 120.51 117.18 1ws9 n ALA 386 Ca 0.01 -0.02 0.15 0.00 0.00 0.00 0.00 53.44 53.57 1ws9 n ALA 386 Cb 0.35 -1.46 0.74 0.00 0.00 0.00 0.00 19.45 19.07 1ws9 n ALA 386 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78