#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ws9 n LEU 3 N 0.00 4.50 -0.27 0.99 4.77 -1.26 -4.90 117.00 120.83 1ws9 n LEU 3 Ca 0.00 1.20 -0.10 0.00 -0.03 0.00 0.00 56.01 57.08 1ws9 n LEU 3 Cb 0.00 -1.60 -0.06 0.00 -2.33 0.00 0.00 43.42 39.43 1ws9 n LEU 3 CO 0.00 0.08 0.53 -0.25 -1.33 0.00 0.00 177.39 176.41 1ws9 h TRP 4 N 3.45 -1.56 0.00 -1.77 7.01 -2.07 -0.27 115.95 120.74 1ws9 h TRP 4 Ca -0.49 0.10 0.00 0.00 2.11 0.00 0.00 58.89 60.61 1ws9 h TRP 4 Cb 1.24 0.78 0.00 0.00 -2.10 0.00 0.00 29.16 29.08 1ws9 h TRP 4 CO 0.54 -0.42 0.00 1.97 -2.79 0.00 0.00 178.44 177.74 1ws9 n PHE 5 N -5.36 0.00 -4.28 2.65 -1.74 -1.26 -4.72 117.46 102.75 1ws9 n PHE 5 Ca 0.01 0.00 -0.26 0.00 -0.56 0.00 0.00 57.45 56.64 1ws9 n PHE 5 Cb 0.33 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.24 1ws9 n PHE 5 CO 0.00 0.00 0.00 -2.00 -0.56 0.00 0.00 176.76 174.20 1ws9 s GLU 6 N -2.00 2.13 0.00 3.97 2.12 -0.11 -5.02 118.70 119.80 1ws9 s GLU 6 Ca 0.11 -1.25 -0.30 0.00 0.36 0.00 0.00 54.97 53.89 1ws9 s GLU 6 Cb 0.05 -2.19 -0.05 0.00 0.26 0.00 0.00 34.13 32.20 1ws9 s GLU 6 CO 0.09 0.43 1.34 -1.21 -0.54 0.00 0.00 175.26 175.37 1ws9 s GLU 7 N -2.91 4.32 0.91 4.30 2.02 -1.26 -4.76 118.70 121.31 1ws9 s GLU 7 Ca 0.26 1.89 -0.14 0.00 0.02 0.00 0.00 54.97 57.00 1ws9 s GLU 7 Cb -0.09 -3.52 0.17 0.00 0.10 0.00 0.00 34.13 30.79 1ws9 s GLU 7 CO 0.16 -0.50 1.27 0.20 0.02 0.00 0.00 175.26 176.41 1ws9 s GLY 8 N 1.64 1.74 0.13 -1.39 0.00 -1.26 -4.70 107.32 103.48 1ws9 s GLY 8 Ca 0.62 -1.09 -0.19 0.00 0.00 0.00 0.00 44.72 44.06 1ws9 s GLY 8 CO 0.26 -0.40 1.74 0.00 0.00 0.00 0.00 173.10 174.69 1ws9 h ALA 9 N -1.44 0.25 -0.36 3.20 0.00 -1.98 -1.04 119.26 117.90 1ws9 h ALA 9 Ca -0.44 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 1ws9 h ALA 9 Cb 1.26 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1ws9 h ALA 9 CO 0.45 -0.37 -0.03 0.93 0.00 0.00 0.00 179.25 180.23 1ws9 h GLU 10 N 0.15 0.57 -0.43 0.00 5.08 -2.00 -1.69 114.58 116.26 1ws9 h GLU 10 Ca 0.11 -0.14 -0.13 0.00 -1.00 0.00 0.00 59.36 58.20 1ws9 h GLU 10 Cb 0.11 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1ws9 h GLU 10 CO -0.14 0.62 -0.25 0.93 -1.00 0.00 0.00 179.01 179.16 1ws9 h GLU 11 N 0.54 0.94 -0.35 2.33 5.08 -1.82 -3.04 114.58 118.24 1ws9 h GLU 11 Ca 0.11 -0.43 -0.07 0.00 -1.00 0.00 0.00 59.36 57.97 1ws9 h GLU 11 Cb 0.39 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1ws9 h GLU 11 CO 0.02 1.09 -0.08 0.00 -1.00 0.00 0.00 179.01 179.03 1ws9 h ARG 12 N 0.77 0.60 0.00 2.33 2.47 -0.91 0.17 114.38 119.80 1ws9 h ARG 12 Ca 0.09 -0.17 -0.02 0.00 -1.26 0.00 0.00 59.98 58.62 1ws9 h ARG 12 Cb 0.83 -0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 29.08 1ws9 h ARG 12 CO 0.07 0.68 -0.11 1.96 0.56 0.00 0.00 179.97 183.13 1ws9 h GLN 13 N 0.55 0.00 0.00 0.04 4.20 -1.20 0.21 115.11 118.91 1ws9 h GLN 13 Ca 0.10 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.58 1ws9 h GLN 13 Cb 0.48 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.23 1ws9 h GLN 13 CO 0.03 0.11 -1.35 0.28 -0.67 0.00 0.00 178.83 177.22 1ws9 n VAL 14 N -4.20 1.52 -0.15 -0.54 0.31 -0.91 -4.40 118.33 109.95 1ws9 n VAL 14 Ca -0.03 -0.04 -0.10 0.00 -0.01 0.00 0.00 64.34 64.16 1ws9 n VAL 14 Cb 0.19 -2.07 -0.01 0.00 -0.91 0.00 0.00 33.84 31.04 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 -1.00 0.75 0.20 7.52 3.38 -0.67 -2.34 115.31 123.14 1ws9 h LEU 15 Ca -0.35 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.33 1ws9 h LEU 15 Cb 1.24 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.75 1ws9 h LEU 15 CO -0.21 0.87 -0.40 1.23 0.09 0.00 0.00 178.44 180.02 1ws9 h GLY 16 N 0.60 -0.85 1.61 0.83 0.00 -1.16 0.20 103.07 104.30 1ws9 h GLY 16 Ca 0.12 0.48 -0.05 0.00 0.00 0.00 0.00 47.33 47.88 1ws9 h GLY 16 CO 0.02 -0.28 -0.02 -2.55 0.00 0.00 0.00 176.54 173.71 1ws9 h PRO 17 N -0.69 0.49 -0.37 4.80 0.11 -1.75 -2.80 132.00 131.79 1ws9 h PRO 17 Ca 0.01 -0.11 -0.02 0.00 0.11 0.00 0.00 66.00 66.00 1ws9 h PRO 17 Cb 0.68 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.70 1ws9 h PRO 17 CO -0.19 0.53 0.17 0.35 -0.21 0.00 0.00 178.00 178.66 1ws9 h PHE 18 N 0.47 0.55 -0.94 0.65 -0.00 -0.83 -2.26 116.94 114.58 1ws9 h PHE 18 Ca 0.10 -0.03 0.02 0.00 -0.00 0.00 0.00 57.97 58.06 1ws9 h PHE 18 Cb 0.34 -0.17 -0.05 0.00 -0.00 0.00 0.00 35.95 36.07 1ws9 h PHE 18 CO 0.01 0.47 0.62 0.00 -0.00 0.00 0.00 178.31 179.41 1ws9 h ARG 19 N 0.47 1.19 -0.71 1.11 3.08 -0.37 -0.68 114.38 118.46 1ws9 h ARG 19 Ca 0.13 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.04 1ws9 h ARG 19 Cb 0.13 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 1ws9 h ARG 19 CO -0.01 0.79 0.18 0.93 -1.07 0.00 0.00 179.97 180.78 1ws9 h GLU 20 N 1.23 1.14 -0.18 0.04 4.39 -1.32 0.29 114.58 120.17 1ws9 h GLU 20 Ca 0.36 -0.27 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1ws9 h GLU 20 Cb -0.07 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.42 1ws9 h GLU 20 CO -0.10 1.00 0.12 0.35 -1.16 0.00 0.00 179.01 179.22 1ws9 h PHE 21 N 1.08 0.22 -0.24 4.33 3.57 -0.85 -0.92 116.94 124.13 1ws9 h PHE 21 Ca 0.22 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.75 1ws9 h PHE 21 Cb 0.37 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 1ws9 h PHE 21 CO 0.03 0.14 0.08 -0.07 -2.23 0.00 0.00 178.31 176.26 1ws9 h LEU 22 N 0.24 0.08 -1.23 0.59 3.38 -0.54 0.31 115.31 118.14 1ws9 h LEU 22 Ca 0.06 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.07 1ws9 h LEU 22 Cb -0.02 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1ws9 h LEU 22 CO -0.01 0.08 0.52 0.50 0.09 0.00 0.00 178.44 179.61 1ws9 h LYS 23 N 0.18 1.03 0.02 1.13 3.64 -0.20 0.77 116.57 123.14 1ws9 h LYS 23 Ca 0.10 -0.06 -0.28 0.00 -1.27 0.00 0.00 60.65 59.14 1ws9 h LYS 23 Cb 0.08 -0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 31.63 1ws9 h LYS 23 CO -0.11 0.68 -1.53 0.00 -2.27 0.00 0.00 179.45 176.22 1ws9 h ALA 24 N 1.51 0.60 0.00 5.00 0.00 -0.79 -3.36 119.26 122.22 1ws9 h ALA 24 Ca 0.29 -1.29 -0.12 0.00 0.00 0.00 0.00 54.91 53.79 1ws9 h ALA 24 Cb -0.12 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1ws9 h ALA 24 CO -0.06 1.45 -1.66 0.39 0.00 0.00 0.00 179.25 179.37 1ws9 n GLU 25 N -3.18 1.44 -0.13 0.00 -0.58 0.11 -4.70 120.64 113.59 1ws9 n GLU 25 Ca -0.13 -0.05 -0.23 0.00 -0.42 0.00 0.00 57.16 56.32 1ws9 n GLU 25 Cb 1.02 -1.28 -0.11 0.00 -0.57 0.00 0.00 31.44 30.50 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 -2.20 1.51 0.04 2.62 0.31 0.15 -4.67 118.33 116.10 1ws9 n VAL 26 Ca -0.11 -0.49 -0.10 0.00 -0.01 0.00 0.00 64.34 63.63 1ws9 n VAL 26 Cb 0.63 -1.64 -0.04 0.00 -0.91 0.00 0.00 33.84 31.88 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 -0.45 -0.15 -0.96 3.52 0.00 -1.41 -3.17 119.26 116.63 1ws9 h ALA 27 Ca -0.64 0.02 0.25 0.00 0.00 0.00 0.00 54.91 54.55 1ws9 h ALA 27 Cb 1.77 0.29 -0.18 0.00 0.00 0.00 0.00 17.79 19.67 1ws9 h ALA 27 CO -0.24 -0.64 0.01 -1.35 0.00 0.00 0.00 179.25 177.03 1ws9 h PRO 28 N -0.24 0.02 -0.62 0.00 0.11 -1.83 -1.68 132.00 127.77 1ws9 h PRO 28 Ca 0.07 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1ws9 h PRO 28 Cb 0.33 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.43 1ws9 h PRO 28 CO -0.18 0.02 0.00 0.41 -0.21 0.00 0.00 178.00 178.03 1ws9 n GLY 29 N -1.50 2.86 0.15 -0.55 0.00 -1.20 -4.56 105.19 100.38 1ws9 n GLY 29 Ca 0.22 -0.87 -0.11 0.00 0.00 0.00 0.00 46.02 45.26 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 3.95 0.33 -0.60 4.61 0.00 -1.27 -1.45 119.26 124.82 1ws9 h ALA 30 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1ws9 h ALA 30 Cb 1.53 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.19 1ws9 h ALA 30 CO 0.27 -0.01 0.38 0.00 0.00 0.00 0.00 179.25 179.90 1ws9 h ALA 31 N 0.87 0.76 -0.46 0.00 0.00 -1.80 -1.63 119.26 117.00 1ws9 h ALA 31 Ca 0.08 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1ws9 h ALA 31 Cb 0.29 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1ws9 h ALA 31 CO 0.00 0.20 0.05 1.49 0.00 0.00 0.00 179.25 180.99 1ws9 h GLU 32 N 0.81 0.78 -0.35 0.00 4.81 -1.83 -2.68 114.58 116.12 1ws9 h GLU 32 Ca 0.22 -0.23 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1ws9 h GLU 32 Cb -0.07 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 1ws9 h GLU 32 CO -0.05 0.82 0.05 0.00 -0.73 0.00 0.00 179.01 179.10 1ws9 h ARG 33 N 0.64 0.53 0.00 1.92 3.08 -1.06 0.85 114.38 120.33 1ws9 h ARG 33 Ca 0.14 -0.09 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 1ws9 h ARG 33 Cb 0.43 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1ws9 h ARG 33 CO 0.01 0.51 -0.22 0.22 -1.07 0.00 0.00 179.97 179.42 1ws9 h ASP 34 N 0.51 0.00 0.12 7.04 1.82 -1.02 0.42 116.42 125.32 1ws9 h ASP 34 Ca 0.12 0.00 -0.32 0.00 -0.39 0.00 0.00 57.03 56.44 1ws9 h ASP 34 Cb 0.25 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.25 1ws9 h ASP 34 CO 0.00 0.22 -1.65 0.03 -1.61 0.00 0.00 179.24 176.24 1ws9 h ARG 35 N 0.00 0.26 0.00 0.28 3.08 -0.94 -3.41 114.38 113.65 1ws9 h ARG 35 Ca -0.00 -0.44 -0.26 0.00 0.07 0.00 0.00 59.98 59.35 1ws9 h ARG 35 Cb 0.45 0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.62 1ws9 h ARG 35 CO 0.03 1.21 -1.52 1.79 -1.07 0.00 0.00 179.97 180.41 1ws9 h THR 36 N -0.17 0.93 -0.09 2.04 1.35 -0.83 -3.48 112.91 112.65 1ws9 h THR 36 Ca -0.35 -2.70 -0.04 0.00 -0.55 0.00 0.00 66.41 62.77 1ws9 h THR 36 Cb 1.87 2.43 -0.02 0.00 -1.73 0.00 0.00 68.15 70.70 1ws9 h THR 36 CO 0.06 0.53 -0.04 0.61 -0.25 0.00 0.00 175.52 176.44 1ws9 n GLY 37 N 1.49 0.52 3.64 5.82 0.00 0.15 -4.96 105.19 111.85 1ws9 n GLY 37 Ca -0.13 -0.27 -0.43 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.89 3.44 0.03 4.61 0.00 -1.26 -4.40 121.76 122.30 1ws9 s ALA 38 Ca 0.00 0.65 -0.32 0.00 0.00 0.00 0.00 51.96 52.29 1ws9 s ALA 38 Cb 0.00 -3.79 -0.11 0.00 0.00 0.00 0.00 23.12 19.22 1ws9 s ALA 38 CO 0.00 -1.67 1.87 0.34 0.00 0.00 0.00 175.76 176.30 1ws9 n PHE 39 N 7.80 2.47 -0.97 0.00 -0.00 -1.26 -4.85 117.46 120.65 1ws9 n PHE 39 Ca 0.18 -0.14 -0.34 0.00 -0.00 0.00 0.00 57.45 57.15 1ws9 n PHE 39 Cb 0.44 -2.72 -0.04 0.00 -0.00 0.00 0.00 39.48 37.17 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 6.34 1.77 -0.30 -7.13 -0.04 -1.26 -4.73 135.00 129.64 1ws9 n PRO 40 Ca 0.20 -1.68 -0.01 0.00 -0.04 0.00 0.00 63.50 61.98 1ws9 n PRO 40 Cb 0.35 -2.71 0.12 0.00 -0.04 0.00 0.00 33.50 31.22 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 7.16 0.98 -0.27 0.54 4.06 -1.99 -0.02 115.95 126.42 1ws9 h TRP 41 Ca 0.45 0.03 0.06 0.00 2.06 0.00 0.00 58.89 61.49 1ws9 h TRP 41 Cb 0.44 -0.32 -0.06 0.00 -1.00 0.00 0.00 29.16 28.22 1ws9 h TRP 41 CO 1.57 0.53 -0.10 0.38 -3.56 0.00 0.00 178.44 177.26 1ws9 h ASP 42 N 0.99 -0.35 0.11 -3.49 2.03 -2.00 -0.30 116.42 113.41 1ws9 h ASP 42 Ca 0.35 0.10 -0.14 0.00 -0.73 0.00 0.00 57.03 56.60 1ws9 h ASP 42 Cb 0.10 0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.80 1ws9 h ASP 42 CO -0.15 -0.13 -0.51 -0.07 -1.03 0.00 0.00 179.24 177.35 1ws9 h LEU 43 N -0.05 0.49 -0.08 0.15 3.38 -1.85 -1.99 115.31 115.36 1ws9 h LEU 43 Ca 0.14 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1ws9 h LEU 43 Cb 0.26 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1ws9 h LEU 43 CO -0.31 0.91 0.05 0.58 0.09 0.00 0.00 178.44 179.76 1ws9 h VAL 44 N 0.35 1.03 -0.51 1.22 2.07 -0.54 0.16 116.25 120.03 1ws9 h VAL 44 Ca 0.01 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.49 1ws9 h VAL 44 Cb 1.02 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.69 1ws9 h VAL 44 CO 0.09 0.03 0.28 -0.09 0.02 0.00 0.00 177.57 177.90 1ws9 h ARG 45 N 0.09 0.53 -0.40 1.57 2.43 -0.98 0.78 114.38 118.40 1ws9 h ARG 45 Ca 0.03 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 1ws9 h ARG 45 Cb 0.01 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 1ws9 h ARG 45 CO -0.01 0.35 -0.08 0.87 -1.51 0.00 0.00 179.97 179.59 1ws9 h LYS 46 N 0.54 0.70 -0.15 0.20 1.57 -0.99 -2.67 116.57 115.78 1ws9 h LYS 46 Ca 0.22 -0.21 -0.19 0.00 -1.87 0.00 0.00 60.65 58.59 1ws9 h LYS 46 Cb 0.09 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1ws9 h LYS 46 CO -0.13 0.77 -0.69 -0.07 -0.57 0.00 0.00 179.45 178.76 1ws9 h LEU 47 N 0.64 0.72 -1.33 2.94 3.38 -0.26 -3.09 115.31 118.30 1ws9 h LEU 47 Ca 0.12 -0.44 0.05 0.00 0.09 0.00 0.00 57.88 57.69 1ws9 h LEU 47 Cb 0.52 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1ws9 h LEU 47 CO 0.03 1.20 0.49 0.00 0.09 0.00 0.00 178.44 180.25 1ws9 h ALA 48 N 0.79 1.61 0.00 1.53 0.00 -0.65 0.51 119.26 123.05 1ws9 h ALA 48 Ca -0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ws9 h ALA 48 Cb 1.28 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1ws9 h ALA 48 CO 0.13 0.30 0.00 0.39 0.00 0.00 0.00 179.25 180.07 1ws9 n GLU 49 N -4.46 0.13 0.00 0.00 1.02 -1.03 -0.57 120.64 115.73 1ws9 n GLU 49 Ca 0.10 0.56 0.12 0.00 -0.02 0.00 0.00 57.16 57.92 1ws9 n GLU 49 Cb 0.16 -1.87 0.12 0.00 -0.02 0.00 0.00 31.44 29.83 1ws9 n GLU 49 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1ws9 n PHE 50 N -2.14 0.00 -1.48 -0.32 3.72 0.15 -4.96 117.46 112.43 1ws9 n PHE 50 Ca -0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.27 1ws9 n PHE 50 Cb 0.08 -0.02 -0.05 0.00 -0.94 0.00 0.00 39.48 38.56 1ws9 n PHE 50 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ws9 n GLY 51 N 1.37 1.13 0.21 1.37 0.00 0.27 -4.89 105.19 104.65 1ws9 n GLY 51 Ca 0.12 -0.44 0.01 0.00 0.00 0.00 0.00 46.02 45.71 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 1.24 -0.22 1.61 2.07 -1.70 -2.33 116.25 116.93 1ws9 h VAL 52 Ca -0.26 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.11 1ws9 h VAL 52 Cb 0.86 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1ws9 h VAL 52 CO 0.37 0.35 0.00 0.49 0.02 0.00 0.00 177.57 178.79 1ws9 n PHE 53 N -4.15 0.29 -2.20 1.57 3.01 -1.26 -3.31 117.46 111.40 1ws9 n PHE 53 Ca -0.01 -0.14 0.03 0.00 1.01 0.00 0.00 57.45 58.33 1ws9 n PHE 53 Cb 0.37 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.86 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 0.99 1.06 0.25 1.37 0.00 -0.98 -3.80 105.19 104.08 1ws9 n GLY 54 Ca 0.12 -0.50 0.02 0.00 0.00 0.00 0.00 46.02 45.66 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 0.53 0.65 0.00 4.61 0.00 -1.42 -0.08 119.26 123.54 1ws9 h ALA 55 Ca -0.11 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ws9 h ALA 55 Cb 1.62 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.80 1ws9 h ALA 55 CO 0.05 -0.41 -0.64 1.28 0.00 0.00 0.00 179.25 179.53 1ws9 n LEU 56 N -5.33 0.59 -4.70 0.00 4.77 -1.26 -0.32 117.00 110.74 1ws9 n LEU 56 Ca 0.11 -0.01 -0.42 0.00 -0.03 0.00 0.00 56.01 55.66 1ws9 n LEU 56 Cb 0.40 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 1ws9 n LEU 56 CO 0.07 0.09 0.97 -0.69 -1.33 0.00 0.00 177.39 176.51 1ws9 s VAL 57 N -3.06 4.04 0.58 4.08 1.01 -0.68 -4.71 120.40 121.66 1ws9 s VAL 57 Ca 0.09 1.41 -0.18 0.00 0.00 0.00 0.00 61.98 63.30 1ws9 s VAL 57 Cb 0.16 -3.91 -0.07 0.00 0.00 0.00 0.00 36.38 32.57 1ws9 s VAL 57 CO 0.73 0.03 0.74 -2.65 0.00 0.00 0.00 175.10 173.95 1ws9 n PRO 58 N 4.83 0.70 0.19 2.72 -0.02 -1.26 -1.29 135.00 140.87 1ws9 n PRO 58 Ca 0.11 0.27 0.08 0.00 -2.02 0.00 0.00 63.50 61.94 1ws9 n PRO 58 Cb 0.46 -1.92 0.59 0.00 -0.02 0.00 0.00 33.50 32.61 1ws9 n PRO 58 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1ws9 h GLU 59 N 0.38 0.12 0.00 -0.52 5.08 -1.87 -0.73 114.58 117.04 1ws9 h GLU 59 Ca -0.47 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1ws9 h GLU 59 Cb 1.38 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.61 1ws9 h GLU 59 CO 0.49 0.08 -0.00 0.00 -1.00 0.00 0.00 179.01 178.58 1ws9 h ALA 60 N 1.93 1.16 -0.47 3.43 0.00 -1.89 0.30 119.26 123.73 1ws9 h ALA 60 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ws9 h ALA 60 Cb 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ws9 h ALA 60 CO -0.01 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.90 1ws9 n TYR 61 N -3.32 0.64 -0.23 0.00 4.01 -0.60 -4.94 117.16 112.72 1ws9 n TYR 61 Ca -0.03 -0.51 0.00 0.00 -0.16 0.00 0.00 57.90 57.21 1ws9 n TYR 61 Cb 0.08 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.08 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 0.85 0.88 1.75 2.72 0.00 0.10 -2.97 105.19 108.51 1ws9 n GLY 62 Ca 0.16 -0.06 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.23 1.32 0.06 -0.02 0.00 -0.38 -4.63 105.19 99.30 1ws9 n GLY 63 Ca 0.00 -2.08 0.12 0.00 0.00 0.00 0.00 46.02 44.06 1ws9 n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ws9 n ALA 64 N -2.83 2.97 -3.41 4.61 0.00 -0.13 -3.92 120.51 117.80 1ws9 n ALA 64 Ca -0.07 -0.26 -0.24 0.00 0.00 0.00 0.00 53.44 52.88 1ws9 n ALA 64 Cb 0.27 -1.17 0.05 0.00 0.00 0.00 0.00 19.45 18.60 1ws9 n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ws9 n GLY 65 N 1.35 -0.53 3.88 0.00 0.00 -0.41 -4.80 105.19 104.67 1ws9 n GLY 65 Ca 0.04 0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 -7.05 3.71 0.70 0.99 1.43 0.56 -4.94 118.68 114.08 1ws9 s LEU 66 Ca 0.48 1.18 -0.11 0.00 -1.03 0.00 0.00 54.13 54.65 1ws9 s LEU 66 Cb -0.22 -4.09 0.01 0.00 0.03 0.00 0.00 46.19 41.92 1ws9 s LEU 66 CO 0.60 -0.50 1.06 -0.94 0.23 0.00 0.00 176.35 176.80 1ws9 s SER 67 N -3.41 5.37 0.30 2.29 1.04 -1.26 -4.61 113.70 113.42 1ws9 s SER 67 Ca 0.52 1.47 0.01 0.00 0.48 0.00 0.00 55.95 58.43 1ws9 s SER 67 Cb -0.10 -2.35 0.48 0.00 0.10 0.00 0.00 66.02 64.15 1ws9 s SER 67 CO 0.36 -1.43 1.85 0.74 0.98 0.00 0.00 173.24 175.74 1ws9 h THR 68 N -0.71 1.21 0.03 2.02 2.02 -1.96 -1.99 112.91 113.52 1ws9 h THR 68 Ca -0.45 -0.76 0.01 0.00 0.77 0.00 0.00 66.41 65.98 1ws9 h THR 68 Cb 1.22 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.33 1ws9 h THR 68 CO 0.59 0.28 -0.08 -0.09 0.37 0.00 0.00 175.52 176.59 1ws9 h ARG 69 N 0.72 -0.15 -0.72 6.66 2.43 -1.93 -0.10 114.38 121.29 1ws9 h ARG 69 Ca 0.16 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.28 1ws9 h ARG 69 Cb 0.27 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1ws9 h ARG 69 CO -0.00 -0.10 0.20 1.25 -1.51 0.00 0.00 179.97 179.81 1ws9 h LEU 70 N -0.16 1.07 -0.58 3.80 5.85 -1.90 -2.26 115.31 121.14 1ws9 h LEU 70 Ca 0.02 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1ws9 h LEU 70 Cb 0.18 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1ws9 h LEU 70 CO -0.06 1.01 0.27 0.15 -0.34 0.00 0.00 178.44 179.47 1ws9 h PHE 71 N 1.08 0.85 -0.30 1.25 3.57 -1.17 -1.49 116.94 120.72 1ws9 h PHE 71 Ca 0.23 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.73 1ws9 h PHE 71 Cb 0.34 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.78 1ws9 h PHE 71 CO 0.03 0.66 0.06 0.00 -2.23 0.00 0.00 178.31 176.82 1ws9 h ALA 72 N 1.11 0.31 -0.55 2.41 0.00 -0.79 -0.42 119.26 121.33 1ws9 h ALA 72 Ca 0.20 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.21 1ws9 h ALA 72 Cb 0.13 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1ws9 h ALA 72 CO -0.02 -0.35 0.36 0.00 0.00 0.00 0.00 179.25 179.24 1ws9 h ARG 73 N 0.16 0.58 -0.24 0.00 3.08 -1.14 -0.49 114.38 116.33 1ws9 h ARG 73 Ca 0.14 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 60.03 1ws9 h ARG 73 Cb 0.15 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1ws9 h ARG 73 CO -0.19 0.38 -0.38 0.52 -1.07 0.00 0.00 179.97 179.23 1ws9 h MET 74 N 0.59 0.54 -0.48 0.04 2.86 -0.25 -1.28 114.93 116.95 1ws9 h MET 74 Ca 0.23 -0.26 -0.11 0.00 -2.06 0.00 0.00 59.70 57.50 1ws9 h MET 74 Cb 0.15 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 1ws9 h MET 74 CO -0.06 0.84 -0.12 0.28 1.06 0.00 0.00 176.91 178.90 1ws9 h VAL 75 N 0.45 1.26 -0.58 -2.22 2.07 -0.04 -0.16 116.25 117.03 1ws9 h VAL 75 Ca 0.04 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 1ws9 h VAL 75 Cb 0.87 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 1ws9 h VAL 75 CO 0.07 0.43 0.28 -0.08 0.02 0.00 0.00 177.57 178.29 1ws9 h GLU 76 N 0.79 0.84 -0.64 1.57 4.81 -0.89 0.10 114.58 121.16 1ws9 h GLU 76 Ca 0.13 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1ws9 h GLU 76 Cb 0.65 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.85 1ws9 h GLU 76 CO 0.05 0.68 0.34 0.00 -0.73 0.00 0.00 179.01 179.35 1ws9 h ALA 77 N 1.12 0.82 0.05 2.92 0.00 -1.00 -1.20 119.26 121.97 1ws9 h ALA 77 Ca 0.20 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ws9 h ALA 77 Cb 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1ws9 h ALA 77 CO -0.03 0.34 -0.02 0.82 0.00 0.00 0.00 179.25 180.36 1ws9 h ILE 78 N 0.87 1.07 -0.69 0.00 2.04 -0.77 -2.94 117.51 117.09 1ws9 h ILE 78 Ca 0.22 -0.40 0.16 0.00 1.00 0.00 0.00 64.86 65.84 1ws9 h ILE 78 Cb 0.06 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 1ws9 h ILE 78 CO -0.03 0.10 0.47 0.00 0.00 0.00 0.00 178.15 178.69 1ws9 h ALA 79 N 0.70 2.28 -0.75 1.87 0.00 -0.81 0.14 119.26 122.69 1ws9 h ALA 79 Ca -0.01 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.02 1ws9 h ALA 79 Cb 0.22 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1ws9 h ALA 79 CO 0.01 -0.47 0.49 -0.92 0.00 0.00 0.00 179.25 178.37 1ws9 h TYR 80 N 0.26 0.59 0.00 0.00 3.20 -1.03 -3.21 116.97 116.78 1ws9 h TYR 80 Ca 0.34 0.02 -0.28 0.00 3.14 0.00 0.00 58.73 61.95 1ws9 h TYR 80 Cb 0.95 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.98 1ws9 h TYR 80 CO -0.00 0.25 -2.04 0.66 -1.64 0.00 0.00 178.16 175.39 1ws9 n TYR 81 N -4.49 0.00 -3.36 -3.82 4.02 -0.09 -4.78 117.16 104.64 1ws9 n TYR 81 Ca 0.13 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.91 1ws9 n TYR 81 Cb 0.44 -0.73 -0.08 0.00 -0.02 0.00 0.00 39.34 38.94 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 -5.12 0.65 0.18 7.72 2.15 0.29 -4.68 116.67 117.87 1ws9 s ASP 82 Ca -0.13 -0.17 -0.13 0.00 0.43 0.00 0.00 52.55 52.55 1ws9 s ASP 82 Cb 0.05 0.94 0.14 0.00 -0.30 0.00 0.00 42.92 43.75 1ws9 s ASP 82 CO 0.56 -0.33 1.77 1.23 -0.17 0.00 0.00 175.17 178.23 1ws9 h GLY 83 N 8.20 0.68 0.97 2.66 0.00 -1.80 -1.58 103.07 112.20 1ws9 h GLY 83 Ca -0.15 -0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.05 1ws9 h GLY 83 CO 0.28 0.08 0.56 0.00 0.00 0.00 0.00 176.54 177.46 1ws9 h ALA 84 N 1.28 1.09 -0.61 3.60 0.00 -1.94 -0.76 119.26 121.93 1ws9 h ALA 84 Ca 0.22 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1ws9 h ALA 84 Cb 0.16 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1ws9 h ALA 84 CO -0.18 0.45 0.05 1.25 0.00 0.00 0.00 179.25 180.82 1ws9 h LEU 85 N 1.13 0.99 -0.31 0.00 6.46 -1.85 -0.83 115.31 120.90 1ws9 h LEU 85 Ca 0.32 -0.25 0.01 0.00 -0.12 0.00 0.00 57.88 57.84 1ws9 h LEU 85 Cb -0.09 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 39.56 1ws9 h LEU 85 CO -0.08 1.02 0.19 0.00 -0.62 0.00 0.00 178.44 178.94 1ws9 h ALA 86 N 1.09 0.39 -0.60 1.25 0.00 -0.63 0.91 119.26 121.66 1ws9 h ALA 86 Ca 0.18 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1ws9 h ALA 86 Cb 0.49 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1ws9 h ALA 86 CO 0.02 -0.17 0.25 1.25 0.00 0.00 0.00 179.25 180.60 1ws9 h LEU 87 N 0.38 0.82 -0.17 0.00 5.85 -0.99 0.21 115.31 121.42 1ws9 h LEU 87 Ca 0.12 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.72 1ws9 h LEU 87 Cb -0.01 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.76 1ws9 h LEU 87 CO -0.05 0.76 -0.12 0.74 -0.34 0.00 0.00 178.44 179.43 1ws9 h THR 88 N 0.83 0.66 -0.14 1.05 2.02 -0.75 -0.48 112.91 116.10 1ws9 h THR 88 Ca 0.20 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.37 1ws9 h THR 88 Cb 0.18 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1ws9 h THR 88 CO -0.02 0.00 0.02 0.58 0.37 0.00 0.00 175.52 176.48 1ws9 h VAL 89 N -0.12 1.21 0.03 3.16 2.07 -0.59 -2.58 116.25 119.43 1ws9 h VAL 89 Ca 0.10 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 1ws9 h VAL 89 Cb 0.27 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1ws9 h VAL 89 CO -0.24 0.20 -0.01 0.00 0.02 0.00 0.00 177.57 177.54 1ws9 h ALA 90 N 0.81 -0.04 -0.48 1.67 0.00 -0.45 -2.34 119.26 118.42 1ws9 h ALA 90 Ca 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ws9 h ALA 90 Cb 0.29 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ws9 h ALA 90 CO 0.00 -0.47 0.28 0.66 0.00 0.00 0.00 179.25 179.73 1ws9 h SER 91 N -0.15 0.59 -0.09 0.00 4.64 -1.17 0.95 113.55 118.33 1ws9 h SER 91 Ca -0.00 -0.07 0.04 0.00 -0.47 0.00 0.00 61.79 61.29 1ws9 h SER 91 Cb 0.14 -0.15 -0.06 0.00 -0.31 0.00 0.00 62.40 62.02 1ws9 h SER 91 CO 0.01 0.49 -0.30 -0.74 -0.87 0.00 0.00 176.83 175.41 1ws9 h HIS 92 N 0.64 -0.82 -0.07 4.77 2.76 -1.41 0.17 115.15 121.20 1ws9 h HIS 92 Ca 0.17 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.36 1ws9 h HIS 92 Cb 0.01 0.37 -0.00 0.00 1.55 0.00 0.00 27.41 29.34 1ws9 h HIS 92 CO -0.03 -0.38 -0.00 -0.91 -1.30 0.00 0.00 177.93 175.31 1ws9 h ASN 93 N -0.40 0.12 -0.11 3.26 2.35 -1.27 -2.69 115.58 116.83 1ws9 h ASN 93 Ca 0.09 -0.32 -0.09 0.00 -0.55 0.00 0.00 56.30 55.43 1ws9 h ASN 93 Cb 0.53 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.87 1ws9 h ASN 93 CO -0.31 0.40 -0.30 0.28 -1.65 0.00 0.00 177.43 175.86 1ws9 h SER 94 N -0.17 0.45 0.00 5.81 0.02 -0.70 -0.24 113.55 118.72 1ws9 h SER 94 Ca 0.02 -0.59 0.00 0.00 -0.84 0.00 0.00 61.79 60.38 1ws9 h SER 94 Cb 0.34 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1ws9 h SER 94 CO 0.00 0.96 0.00 0.18 -1.14 0.00 0.00 176.83 176.84 1ws9 n LEU 95 N -4.42 1.08 0.11 5.07 4.77 0.59 -3.30 117.00 120.90 1ws9 n LEU 95 Ca -0.07 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.78 1ws9 n LEU 95 Cb 0.48 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 1ws9 n LEU 95 CO 0.42 0.00 0.70 0.00 -1.33 0.00 0.00 177.39 177.18 1ws9 h ALA 96 N -2.00 -0.41 0.22 -1.18 0.00 -1.70 0.19 119.26 114.38 1ws9 h ALA 96 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1ws9 h ALA 96 Cb 0.00 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1ws9 h ALA 96 CO 0.00 -0.77 -0.10 1.15 0.00 0.00 0.00 179.25 179.52 1ws9 h THR 97 N -0.44 0.81 -0.76 0.00 2.02 -1.64 -2.50 112.91 110.40 1ws9 h THR 97 Ca 0.03 -0.14 0.13 0.00 0.77 0.00 0.00 66.41 67.20 1ws9 h THR 97 Cb 0.46 0.90 -0.05 0.00 -1.74 0.00 0.00 68.15 67.72 1ws9 h THR 97 CO -0.14 0.03 0.50 1.23 0.37 0.00 0.00 175.52 177.52 1ws9 h GLY 98 N -0.36 0.84 0.83 2.16 0.00 -0.91 -0.52 103.07 105.12 1ws9 h GLY 98 Ca -0.03 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.00 1ws9 h GLY 98 CO 0.05 0.10 -0.18 0.84 0.00 0.00 0.00 176.54 177.34 1ws9 h HIS 99 N 0.53 0.57 -0.74 5.60 6.17 -0.43 -1.13 115.15 125.73 1ws9 h HIS 99 Ca 0.37 -0.17 -0.06 0.00 0.71 0.00 0.00 60.37 61.22 1ws9 h HIS 99 Cb 0.69 -0.12 -0.03 0.00 2.52 0.00 0.00 27.41 30.47 1ws9 h HIS 99 CO -0.00 0.83 0.22 0.82 0.71 0.00 0.00 177.93 180.50 1ws9 h ILE 100 N 0.16 1.26 -0.34 6.26 2.04 -0.96 -0.31 117.51 125.62 1ws9 h ILE 100 Ca 0.03 -0.93 -0.05 0.00 1.00 0.00 0.00 64.86 64.92 1ws9 h ILE 100 Cb 0.72 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 1ws9 h ILE 100 CO 0.05 0.36 -0.02 0.25 0.00 0.00 0.00 178.15 178.79 1ws9 h LEU 101 N 1.10 0.50 0.09 1.44 5.85 -1.08 0.17 115.31 123.38 1ws9 h LEU 101 Ca 0.24 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1ws9 h LEU 101 Cb 0.32 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1ws9 h LEU 101 CO -0.01 0.58 -0.04 0.25 -0.34 0.00 0.00 178.44 178.88 1ws9 h LEU 102 N 0.51 -0.10 0.00 2.25 5.85 -0.78 -3.40 115.31 119.64 1ws9 h LEU 102 Ca 0.11 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1ws9 h LEU 102 Cb 0.35 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.41 1ws9 h LEU 102 CO 0.01 0.55 -0.95 0.00 -0.34 0.00 0.00 178.44 177.71 1ws9 n ALA 103 N -2.62 3.83 -1.77 1.25 0.00 -0.16 -5.03 120.51 116.02 1ws9 n ALA 103 Ca -0.07 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.54 1ws9 n ALA 103 Cb 0.26 -0.58 -0.00 0.00 0.00 0.00 0.00 19.45 19.13 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 -2.79 2.85 1.04 0.00 0.00 0.58 -3.78 107.32 105.22 1ws9 s GLY 104 Ca 0.04 1.10 -0.15 0.00 0.00 0.00 0.00 44.72 45.71 1ws9 s GLY 104 CO 0.67 1.61 1.12 -1.35 0.00 0.00 0.00 173.10 175.15 1ws9 s SER 105 N -1.07 2.30 0.26 1.64 1.04 -1.26 -4.75 113.70 111.86 1ws9 s SER 105 Ca 0.62 0.90 -0.03 0.00 0.48 0.00 0.00 55.95 57.92 1ws9 s SER 105 Cb -0.34 -1.39 0.39 0.00 0.10 0.00 0.00 66.02 64.78 1ws9 s SER 105 CO 0.42 -3.30 1.88 -0.08 0.98 0.00 0.00 173.24 173.14 1ws9 h GLU 106 N -2.01 1.14 -0.11 4.02 4.57 -1.98 -1.16 114.58 119.05 1ws9 h GLU 106 Ca -0.50 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 57.59 1ws9 h GLU 106 Cb 1.32 -0.26 -0.00 0.00 -0.16 0.00 0.00 28.75 29.64 1ws9 h GLU 106 CO 0.51 0.76 0.02 0.00 -1.18 0.00 0.00 179.01 179.11 1ws9 h ALA 107 N 1.44 0.15 -0.79 2.92 0.00 -1.99 -1.90 119.26 119.09 1ws9 h ALA 107 Ca 0.42 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1ws9 h ALA 107 Cb 0.14 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1ws9 h ALA 107 CO -0.17 -0.19 0.52 1.96 0.00 0.00 0.00 179.25 181.37 1ws9 h GLN 108 N -0.04 1.03 -0.76 0.00 4.20 -1.86 -0.73 115.11 116.97 1ws9 h GLN 108 Ca 0.03 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1ws9 h GLN 108 Cb 0.29 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 1ws9 h GLN 108 CO 0.00 0.68 0.32 0.87 -0.67 0.00 0.00 178.83 180.04 1ws9 h LYS 109 N 1.07 1.11 0.00 1.46 1.57 -1.15 0.31 116.57 120.94 1ws9 h LYS 109 Ca 0.29 -0.18 -0.09 0.00 -1.87 0.00 0.00 60.65 58.80 1ws9 h LYS 109 Cb -0.11 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.00 1ws9 h LYS 109 CO -0.07 0.89 -0.43 0.93 -0.57 0.00 0.00 179.45 180.20 1ws9 h GLU 110 N 1.09 0.00 0.17 3.15 5.08 -0.93 -1.95 114.58 121.20 1ws9 h GLU 110 Ca 0.26 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.36 1ws9 h GLU 110 Cb 0.18 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.45 1ws9 h GLU 110 CO -0.02 0.43 -1.17 0.00 -1.00 0.00 0.00 179.01 177.24 1ws9 h ALA 111 N 1.57 -0.05 0.00 3.43 0.00 -0.40 -3.40 119.26 120.41 1ws9 h ALA 111 Ca -0.00 -0.84 -0.16 0.00 0.00 0.00 0.00 54.91 53.91 1ws9 h ALA 111 Cb 0.82 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1ws9 h ALA 111 CO 0.06 0.59 -1.18 1.19 0.00 0.00 0.00 179.25 179.90 1ws9 n PHE 112 N -3.94 0.68 -0.29 0.00 3.01 0.10 -4.57 117.46 112.45 1ws9 n PHE 112 Ca -0.17 0.29 0.11 0.00 1.01 0.00 0.00 57.45 58.69 1ws9 n PHE 112 Cb 0.93 -0.89 0.26 0.00 -0.01 0.00 0.00 39.48 39.77 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 -0.16 -0.58 4.37 3.38 -1.52 -1.50 115.31 118.31 1ws9 h LEU 113 Ca -0.24 0.21 0.10 0.00 0.09 0.00 0.00 57.88 58.04 1ws9 h LEU 113 Cb 1.04 0.32 -0.07 0.00 0.09 0.00 0.00 40.66 42.04 1ws9 h LEU 113 CO -0.15 -0.19 0.17 -0.65 0.09 0.00 0.00 178.44 177.71 1ws9 h PRO 114 N 0.15 0.31 0.00 1.13 0.11 -1.68 0.56 132.00 132.58 1ws9 h PRO 114 Ca 0.52 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 66.44 1ws9 h PRO 114 Cb 1.03 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 1ws9 h PRO 114 CO -0.70 0.21 -0.83 0.87 -0.21 0.00 0.00 178.00 177.34 1ws9 h LYS 115 N 0.32 0.01 -0.09 1.05 1.57 -1.55 -2.83 116.57 115.06 1ws9 h LYS 115 Ca 0.29 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.92 1ws9 h LYS 115 Cb 0.39 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.71 1ws9 h LYS 115 CO -0.33 0.83 -0.52 -0.07 -0.57 0.00 0.00 179.45 178.79 1ws9 h LEU 116 N 0.00 0.61 -1.52 2.94 3.38 -1.15 0.19 115.31 119.77 1ws9 h LEU 116 Ca -0.01 -0.66 -0.05 0.00 0.09 0.00 0.00 57.88 57.25 1ws9 h LEU 116 Cb 1.47 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1ws9 h LEU 116 CO 0.11 1.17 -0.24 0.00 0.09 0.00 0.00 178.44 179.57 1ws9 h ALA 117 N 0.45 1.59 0.00 1.53 0.00 -0.94 -2.23 119.26 119.67 1ws9 h ALA 117 Ca -0.04 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1ws9 h ALA 117 Cb 1.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1ws9 h ALA 117 CO 0.11 0.30 -0.38 -1.13 0.00 0.00 0.00 179.25 178.15 1ws9 n SER 118 N -4.24 0.45 0.00 0.00 3.41 -1.07 -2.91 113.62 109.26 1ws9 n SER 118 Ca -0.02 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1ws9 n SER 118 Cb 0.30 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 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 1.45 1.47 0.36 5.00 0.00 -0.84 -4.72 105.19 107.92 1ws9 n GLY 119 Ca 0.05 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.26 1ws9 n GLY 119 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ws9 h GLU 120 N 3.08 0.00 -3.23 1.61 4.81 -1.59 -3.36 114.58 115.91 1ws9 h GLU 120 Ca 0.00 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.86 1ws9 h GLU 120 Cb 0.00 0.00 -0.39 0.00 0.63 0.00 0.00 28.75 28.99 1ws9 h GLU 120 CO 0.00 0.00 -0.72 0.00 -0.73 0.00 0.00 179.01 177.56 1ws9 s ALA 121 N -4.60 0.19 0.26 2.92 0.00 -0.03 -4.89 121.76 115.61 1ws9 s ALA 121 Ca -0.04 0.18 -0.24 0.00 0.00 0.00 0.00 51.96 51.86 1ws9 s ALA 121 Cb 0.15 -0.72 -0.09 0.00 0.00 0.00 0.00 23.12 22.46 1ws9 s ALA 121 CO 0.53 -0.61 0.84 -0.51 0.00 0.00 0.00 175.76 176.02 1ws9 s LEU 122 N 2.19 4.39 -0.09 0.00 1.43 -1.26 -4.03 118.68 121.31 1ws9 s LEU 122 Ca 0.04 1.67 -0.10 0.00 -1.03 0.00 0.00 54.13 54.71 1ws9 s LEU 122 Cb -0.13 -3.74 -0.05 0.00 0.03 0.00 0.00 46.19 42.30 1ws9 s LEU 122 CO -0.04 0.02 0.23 -0.83 0.23 0.00 0.00 176.35 175.95 1ws9 s GLY 123 N -1.54 2.25 -0.09 -3.19 0.00 -1.26 -0.30 107.32 103.18 1ws9 s GLY 123 Ca 0.45 -0.50 0.04 0.00 0.00 0.00 0.00 44.72 44.71 1ws9 s GLY 123 CO 0.24 -0.14 -0.24 0.00 0.00 0.00 0.00 173.10 172.96 1ws9 s ALA 124 N -0.88 2.12 -0.30 3.20 0.00 -0.41 -4.56 121.76 120.93 1ws9 s ALA 124 Ca 0.17 -0.95 -0.00 0.00 0.00 0.00 0.00 51.96 51.18 1ws9 s ALA 124 Cb -0.13 -0.77 0.06 0.00 0.00 0.00 0.00 23.12 22.27 1ws9 s ALA 124 CO 0.07 0.30 -0.02 -0.46 0.00 0.00 0.00 175.76 175.65 1ws9 s TRP 125 N 0.28 3.30 -0.48 0.00 -0.00 -1.26 -1.37 118.94 119.40 1ws9 s TRP 125 Ca -0.16 -2.05 -0.09 0.00 -0.00 0.00 0.00 56.10 53.80 1ws9 s TRP 125 Cb -0.17 -2.14 0.12 0.00 -0.00 0.00 0.00 33.47 31.28 1ws9 s TRP 125 CO 0.08 -0.84 0.35 0.20 -0.00 0.00 0.00 176.95 176.75 1ws9 s GLY 126 N 1.23 2.07 -0.14 5.86 0.00 0.04 -4.71 107.32 111.67 1ws9 s GLY 126 Ca -0.05 -2.59 -0.07 0.00 0.00 0.00 0.00 44.72 42.01 1ws9 s GLY 126 CO -0.02 1.11 -0.18 -0.10 0.00 0.00 0.00 173.10 173.91 1ws9 n LEU 127 N 4.80 1.03 -4.77 0.66 7.94 -1.26 -2.40 117.00 123.00 1ws9 n LEU 127 Ca -0.06 0.16 -0.40 0.00 -1.11 0.00 0.00 56.01 54.60 1ws9 n LEU 127 Cb 0.41 -0.41 -0.01 0.00 0.53 0.00 0.00 43.42 43.94 1ws9 n LEU 127 CO 0.42 0.30 0.98 -0.89 -1.11 0.00 0.00 177.39 177.09 1ws9 s THR 128 N -2.25 2.56 0.23 1.96 2.01 -1.26 -4.91 115.64 113.97 1ws9 s THR 128 Ca -0.19 0.52 0.05 0.00 0.31 0.00 0.00 61.69 62.38 1ws9 s THR 128 Cb 0.07 -3.31 -0.05 0.00 0.01 0.00 0.00 72.50 69.22 1ws9 s THR 128 CO 0.24 0.09 -0.04 -1.61 -0.69 0.00 0.00 174.62 172.61 1ws9 s GLU 129 N -2.15 1.35 0.42 4.92 2.02 -0.69 -0.07 118.70 124.51 1ws9 s GLU 129 Ca 0.55 -1.67 0.20 0.00 0.02 0.00 0.00 54.97 54.07 1ws9 s GLU 129 Cb -0.39 -0.81 1.14 0.00 0.10 0.00 0.00 34.13 34.17 1ws9 s GLU 129 CO 0.51 -0.01 1.81 -1.35 0.02 0.00 0.00 175.26 176.25 1ws9 h PRO 130 N 2.47 0.35 -0.65 0.39 0.11 -1.89 -1.83 132.00 130.94 1ws9 h PRO 130 Ca -0.38 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1ws9 h PRO 130 Cb 1.22 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1ws9 h PRO 130 CO 0.65 0.23 0.00 0.41 -0.21 0.00 0.00 178.00 179.08 1ws9 n GLY 131 N -1.52 2.45 3.58 -0.55 0.00 -1.26 -4.92 105.19 102.96 1ws9 n GLY 131 Ca 0.22 -0.74 -0.02 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.04 -0.78 0.00 1.61 1.04 -0.69 -4.98 113.70 108.85 1ws9 s SER 132 Ca 0.45 1.15 0.00 0.00 0.48 0.00 0.00 55.95 58.03 1ws9 s SER 132 Cb 0.24 1.64 0.00 0.00 0.10 0.00 0.00 66.02 67.99 1ws9 s SER 132 CO 0.31 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.97 1ws9 n GLY 133 N 4.61 0.14 0.31 7.32 0.00 -1.26 -1.70 105.19 114.60 1ws9 n GLY 133 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 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 0.82 -1.29 1.61 0.02 -1.98 -2.57 113.55 110.17 1ws9 h SER 134 Ca 0.00 0.00 -0.75 0.00 -0.84 0.00 0.00 61.79 60.21 1ws9 h SER 134 Cb 0.00 -0.17 -0.14 0.00 0.14 0.00 0.00 62.40 62.23 1ws9 h SER 134 CO 0.00 0.55 2.22 -0.67 -1.14 0.00 0.00 176.83 177.80 1ws9 n ASP 135 N -4.61 7.95 0.07 3.07 2.03 -1.26 -4.78 116.55 119.02 1ws9 n ASP 135 Ca 0.10 -3.21 0.18 0.00 0.52 0.00 0.00 54.79 52.38 1ws9 n ASP 135 Cb 0.12 -1.33 0.71 0.00 -0.72 0.00 0.00 41.12 39.89 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 4.52 2.32 0.00 -1.67 0.00 -1.74 -0.42 119.26 122.27 1ws9 h ALA 136 Ca 0.68 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.58 1ws9 h ALA 136 Cb 0.31 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1ws9 h ALA 136 CO 1.43 -0.52 0.00 0.00 0.00 0.00 0.00 179.25 180.16 1ws9 n ALA 137 N -2.57 1.95 0.88 0.00 0.00 -1.26 -2.06 120.51 117.45 1ws9 n ALA 137 Ca 0.07 -0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.49 1ws9 n ALA 137 Cb 0.50 -1.27 0.19 0.00 0.00 0.00 0.00 19.45 18.87 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 -1.24 2.45 -1.53 0.00 0.00 -0.17 -4.43 120.51 115.60 1ws9 n ALA 138 Ca 0.09 -0.63 -0.37 0.00 0.00 0.00 0.00 53.44 52.52 1ws9 n ALA 138 Cb 0.12 -0.99 0.05 0.00 0.00 0.00 0.00 19.45 18.64 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 0.55 2.55 -0.00 0.00 -0.00 -0.87 -4.88 117.00 114.34 1ws9 n LEU 139 Ca 0.13 0.75 0.05 0.00 -0.00 0.00 0.00 56.01 56.94 1ws9 n LEU 139 Cb 0.32 -1.31 -0.06 0.00 -0.00 0.00 0.00 43.42 42.37 1ws9 n LEU 139 CO 0.09 -2.37 -0.21 0.29 -0.00 0.00 0.00 177.39 175.19 1ws9 n LYS 140 N -0.76 2.76 -1.72 1.47 4.01 -1.26 -4.86 118.16 117.80 1ws9 n LYS 140 Ca 0.13 -0.03 -0.43 0.00 -0.51 0.00 0.00 58.31 57.47 1ws9 n LYS 140 Cb 0.48 -1.03 -0.02 0.00 -0.51 0.00 0.00 35.03 33.95 1ws9 n LYS 140 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 1ws9 n THR 141 N -1.42 1.22 -4.37 -0.18 -1.04 -1.26 -4.81 114.28 102.42 1ws9 n THR 141 Ca 0.01 -0.31 -0.28 0.00 -2.04 0.00 0.00 64.05 61.43 1ws9 n THR 141 Cb 0.18 -1.76 -0.12 0.00 -1.82 0.00 0.00 70.33 66.81 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 -0.81 1.59 -0.09 -2.82 -2.85 -0.15 0.30 119.74 114.90 1ws9 s LYS 142 Ca 0.63 -1.36 -0.01 0.00 -1.00 0.00 0.00 55.97 54.22 1ws9 s LYS 142 Cb -0.55 -1.95 0.03 0.00 -2.06 0.00 0.00 37.83 33.30 1ws9 s LYS 142 CO 0.52 0.44 -0.01 0.00 0.10 0.00 0.00 175.35 176.39 1ws9 s ALA 143 N -1.35 0.90 -0.13 0.59 0.00 -0.22 -1.06 121.76 120.48 1ws9 s ALA 143 Ca 0.18 -0.29 -0.08 0.00 0.00 0.00 0.00 51.96 51.77 1ws9 s ALA 143 Cb -0.09 -0.83 -0.04 0.00 0.00 0.00 0.00 23.12 22.15 1ws9 s ALA 143 CO 0.09 -0.52 0.15 -1.21 0.00 0.00 0.00 175.76 174.27 1ws9 s GLU 144 N 1.89 3.60 0.19 0.00 2.02 -0.78 -4.42 118.70 121.20 1ws9 s GLU 144 Ca 0.04 -0.13 -0.30 0.00 0.02 0.00 0.00 54.97 54.61 1ws9 s GLU 144 Cb -0.13 -3.24 -0.08 0.00 0.10 0.00 0.00 34.13 30.78 1ws9 s GLU 144 CO -0.06 0.68 1.29 0.21 0.02 0.00 0.00 175.26 177.40 1ws9 s LYS 145 N -0.76 4.41 0.24 1.61 2.47 -1.26 -1.41 119.74 125.04 1ws9 s LYS 145 Ca 0.14 2.02 0.00 0.00 -1.56 0.00 0.00 55.97 56.57 1ws9 s LYS 145 Cb -0.12 -3.21 -0.03 0.00 -1.46 0.00 0.00 37.83 33.01 1ws9 s LYS 145 CO 0.03 -0.23 0.20 0.14 0.16 0.00 0.00 175.35 175.66 1ws9 s VAL 146 N 0.13 0.00 0.03 4.02 -7.23 -0.12 -4.92 120.40 112.32 1ws9 s VAL 146 Ca 0.56 -1.95 -0.30 0.00 -1.81 0.00 0.00 61.98 58.48 1ws9 s VAL 146 Cb -0.36 -2.49 -0.09 0.00 0.56 0.00 0.00 36.38 34.01 1ws9 s VAL 146 CO 0.37 0.00 1.91 -0.70 -0.31 0.00 0.00 175.10 176.37 1ws9 s GLU 147 N -3.92 4.15 0.00 4.82 2.12 -1.26 -1.64 118.70 122.97 1ws9 s GLU 147 Ca 0.38 2.55 0.00 0.00 0.36 0.00 0.00 54.97 58.26 1ws9 s GLU 147 Cb 0.05 -4.08 0.00 0.00 0.26 0.00 0.00 34.13 30.36 1ws9 s GLU 147 CO 0.16 -0.93 0.00 0.41 -0.54 0.00 0.00 175.26 174.37 1ws9 n GLY 148 N 4.45 2.93 0.00 -1.50 0.00 -1.26 -4.88 105.19 104.93 1ws9 n GLY 148 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.47 3.08 -0.02 0.00 -0.65 -1.70 105.19 103.43 1ws9 n GLY 149 Ca 0.00 0.16 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 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 0.47 -0.18 1.61 0.52 -0.17 -0.95 118.94 120.24 1ws9 s TRP 150 Ca 0.00 -0.99 0.01 0.00 0.02 0.00 0.00 56.10 55.14 1ws9 s TRP 150 Cb 0.00 -0.35 0.03 0.00 -1.15 0.00 0.00 33.47 32.00 1ws9 s TRP 150 CO 0.00 -0.37 -0.15 0.50 0.02 0.00 0.00 176.95 176.95 1ws9 s ARG 151 N -3.64 2.49 -0.13 4.98 3.52 -0.50 -1.27 118.95 124.40 1ws9 s ARG 151 Ca 0.04 -0.78 -0.07 0.00 -0.13 0.00 0.00 55.73 54.79 1ws9 s ARG 151 Cb 0.06 -2.40 -0.04 0.00 -1.56 0.00 0.00 34.95 31.00 1ws9 s ARG 151 CO -0.09 -0.30 0.13 -0.51 -0.81 0.00 0.00 175.30 173.73 1ws9 s LEU 152 N 1.36 4.33 -0.04 -0.88 1.02 0.28 -1.87 118.68 122.89 1ws9 s LEU 152 Ca 0.03 0.43 0.00 0.00 0.02 0.00 0.00 54.13 54.61 1ws9 s LEU 152 Cb -0.14 -2.06 0.03 0.00 0.02 0.00 0.00 46.19 44.03 1ws9 s LEU 152 CO -0.11 0.38 -0.01 0.20 0.02 0.00 0.00 176.35 176.84 1ws9 s ASN 153 N -0.86 0.63 0.00 2.29 0.01 -0.23 -1.21 114.94 115.57 1ws9 s ASN 153 Ca 0.14 -0.05 0.00 0.00 -0.71 0.00 0.00 52.86 52.24 1ws9 s ASN 153 Cb -0.12 -0.28 0.00 0.00 0.41 0.00 0.00 41.25 41.26 1ws9 s ASN 153 CO 0.03 -0.10 0.00 0.61 -1.51 0.00 0.00 177.10 176.13 1ws9 n GLY 154 N 4.23 -1.87 3.05 0.66 0.00 -0.33 -0.98 105.19 109.96 1ws9 n GLY 154 Ca -0.24 -1.38 -0.20 0.00 0.00 0.00 0.00 46.02 44.20 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 -2.25 0.86 0.04 2.61 2.01 -1.26 0.48 115.64 118.13 1ws9 s THR 155 Ca 0.00 -0.46 0.07 0.00 0.31 0.00 0.00 61.69 61.61 1ws9 s THR 155 Cb 0.00 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 71.76 1ws9 s THR 155 CO 0.00 0.24 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.46 1ws9 s LYS 156 N -0.25 2.09 0.07 4.92 -0.14 0.17 -4.47 119.74 122.14 1ws9 s LYS 156 Ca 0.04 -0.97 0.09 0.00 -1.36 0.00 0.00 55.97 53.77 1ws9 s LYS 156 Cb -0.04 -2.20 -0.03 0.00 -1.68 0.00 0.00 37.83 33.87 1ws9 s LYS 156 CO -0.00 0.54 -0.23 -1.14 -0.76 0.00 0.00 175.35 173.76 1ws9 s GLN 157 N -1.45 1.78 -1.34 1.68 2.00 0.90 -0.19 119.66 123.04 1ws9 s GLN 157 Ca 0.15 -1.14 -0.01 0.00 -2.00 0.00 0.00 55.36 52.36 1ws9 s GLN 157 Cb -0.11 -2.04 -0.00 0.00 0.80 0.00 0.00 33.01 31.67 1ws9 s GLN 157 CO 0.05 0.50 0.57 1.19 -0.50 0.00 0.00 175.29 177.11 1ws9 n PHE 158 N 1.36 -1.79 -3.17 1.67 3.72 -1.24 -4.52 117.46 113.49 1ws9 n PHE 158 Ca -0.17 0.78 -0.42 0.00 -0.05 0.00 0.00 57.45 57.59 1ws9 n PHE 158 Cb 0.52 -4.06 -0.07 0.00 -0.94 0.00 0.00 39.48 34.93 1ws9 n PHE 158 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1ws9 s ILE 159 N -3.80 4.92 0.21 4.37 -1.09 -0.40 -4.80 121.20 120.61 1ws9 s ILE 159 Ca 0.02 0.24 -0.30 0.00 -2.23 0.00 0.00 60.65 58.38 1ws9 s ILE 159 Cb -0.01 -4.09 -0.09 0.00 -1.58 0.00 0.00 42.46 36.69 1ws9 s ILE 159 CO 0.85 -0.40 1.41 0.42 -1.23 0.00 0.00 174.94 175.98 1ws9 s THR 160 N 2.60 2.92 -0.05 2.92 -4.23 -1.25 -1.30 115.64 117.25 1ws9 s THR 160 Ca 0.21 0.73 0.00 0.00 -1.18 0.00 0.00 61.69 61.45 1ws9 s THR 160 Cb -0.15 -3.47 0.00 0.00 1.34 0.00 0.00 72.50 70.22 1ws9 s THR 160 CO 0.16 0.10 0.00 0.00 -0.54 0.00 0.00 174.62 174.34 1ws9 n GLN 161 N 2.83 -0.84 -0.26 3.99 3.00 0.13 -4.26 117.38 121.95 1ws9 n GLN 161 Ca 0.08 0.24 0.08 0.00 -0.01 0.00 0.00 57.00 57.39 1ws9 n GLN 161 Cb 0.41 -3.89 0.21 0.00 0.00 0.00 0.00 30.24 26.96 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 1.08 0.31 1.08 0.00 -1.34 -1.20 103.07 103.00 1ws9 h GLY 162 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1ws9 h GLY 162 CO 0.01 -0.27 -1.17 -1.14 0.00 0.00 0.00 176.54 173.98 1ws9 n SER 163 N -5.22 0.62 -0.60 0.19 3.41 -1.26 -4.35 113.62 106.42 1ws9 n SER 163 Ca 0.16 -0.44 0.07 0.00 -0.26 0.00 0.00 58.87 58.41 1ws9 n SER 163 Cb 0.52 1.06 0.06 0.00 -0.26 0.00 0.00 64.21 65.59 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 -1.84 0.01 -2.25 -3.33 0.24 -1.07 -5.04 118.33 105.06 1ws9 n VAL 164 Ca 0.02 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.34 61.48 1ws9 n VAL 164 Cb 0.42 1.30 -0.01 0.00 -1.47 0.00 0.00 33.84 34.09 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 -1.25 2.82 -0.03 2.33 0.00 -0.48 -4.56 121.76 120.60 1ws9 s ALA 165 Ca 0.18 0.44 0.16 0.00 0.00 0.00 0.00 51.96 52.74 1ws9 s ALA 165 Cb 0.13 -3.22 -0.25 0.00 0.00 0.00 0.00 23.12 19.77 1ws9 s ALA 165 CO 0.19 -0.58 0.34 0.41 0.00 0.00 0.00 175.76 176.12 1ws9 n GLY 166 N -0.82 -0.76 3.06 0.00 0.00 0.59 -4.71 105.19 102.54 1ws9 n GLY 166 Ca 0.09 -0.38 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.10 1.00 0.07 1.61 1.01 -1.01 -0.22 120.40 119.77 1ws9 s VAL 167 Ca -0.06 -0.50 0.09 0.00 0.00 0.00 0.00 61.98 61.51 1ws9 s VAL 167 Cb 0.10 -0.86 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 1ws9 s VAL 167 CO 0.69 0.30 -0.24 -0.31 0.00 0.00 0.00 175.10 175.54 1ws9 s TYR 168 N 0.02 2.06 -0.21 5.22 2.02 0.51 -1.29 117.35 125.68 1ws9 s TYR 168 Ca -0.01 -0.39 -0.01 0.00 -0.37 0.00 0.00 57.07 56.29 1ws9 s TYR 168 Cb -0.08 -1.19 0.06 0.00 -0.40 0.00 0.00 41.96 40.34 1ws9 s TYR 168 CO 0.01 0.16 -0.01 0.08 -1.57 0.00 0.00 175.55 174.21 1ws9 s VAL 169 N -0.90 1.07 -0.01 0.71 1.01 -0.47 -0.85 120.40 120.97 1ws9 s VAL 169 Ca 0.10 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.23 1ws9 s VAL 169 Cb -0.10 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1ws9 s VAL 169 CO 0.03 -0.14 -0.18 -0.69 0.00 0.00 0.00 175.10 174.12 1ws9 s VAL 170 N 1.61 2.76 -0.17 2.92 1.01 0.07 -0.78 120.40 127.83 1ws9 s VAL 170 Ca -0.03 -0.98 -0.10 0.00 0.00 0.00 0.00 61.98 60.87 1ws9 s VAL 170 Cb -0.18 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.06 1ws9 s VAL 170 CO -0.07 0.49 0.17 -0.04 0.00 0.00 0.00 175.10 175.65 1ws9 s MET 171 N -0.99 4.04 0.03 2.72 -1.94 -1.01 -0.42 119.30 121.73 1ws9 s MET 171 Ca 0.12 -0.13 -0.13 0.00 -1.71 0.00 0.00 55.69 53.84 1ws9 s MET 171 Cb -0.10 -3.37 0.02 0.00 2.01 0.00 0.00 34.83 33.39 1ws9 s MET 171 CO 0.02 0.40 0.29 0.00 -0.01 0.00 0.00 175.02 175.72 1ws9 s ALA 172 N 0.05 -0.67 0.08 3.03 0.00 -0.29 -4.74 121.76 119.22 1ws9 s ALA 172 Ca 0.11 0.05 -0.30 0.00 0.00 0.00 0.00 51.96 51.82 1ws9 s ALA 172 Cb -0.12 0.25 -0.05 0.00 0.00 0.00 0.00 23.12 23.20 1ws9 s ALA 172 CO 0.01 -0.37 1.08 0.50 0.00 0.00 0.00 175.76 176.98 1ws9 s ARG 173 N -2.23 4.55 -0.00 0.00 3.52 0.15 -0.53 118.95 124.40 1ws9 s ARG 173 Ca -0.07 1.62 0.03 0.00 -0.13 0.00 0.00 55.73 57.18 1ws9 s ARG 173 Cb -0.02 -3.36 -0.05 0.00 -1.56 0.00 0.00 34.95 29.96 1ws9 s ARG 173 CO -0.01 -0.05 0.08 0.25 -0.81 0.00 0.00 175.30 174.76 1ws9 n THR 174 N 3.35 0.00 -3.86 4.11 -2.24 -0.13 -1.06 114.28 114.45 1ws9 n THR 174 Ca 0.06 -0.12 -0.12 0.00 -2.27 0.00 0.00 64.05 61.60 1ws9 n THR 174 Cb 0.48 0.49 -0.12 0.00 -2.10 0.00 0.00 70.33 69.08 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 -2.27 -0.05 0.45 3.42 1.01 -0.86 -4.98 116.67 113.40 1ws9 s ASP 175 Ca -0.01 0.04 -0.25 0.00 0.71 0.00 0.00 52.55 53.05 1ws9 s ASP 175 Cb 0.02 0.22 -0.08 0.00 1.01 0.00 0.00 42.92 44.10 1ws9 s ASP 175 CO 0.14 -0.16 1.35 -2.16 0.21 0.00 0.00 175.17 174.55 1ws9 s PRO 176 N -0.49 3.69 0.27 8.23 0.04 -1.26 -4.43 135.00 141.05 1ws9 s PRO 176 Ca -0.06 2.23 -0.29 0.00 0.04 0.00 0.00 61.00 62.92 1ws9 s PRO 176 Cb -0.04 -2.59 -0.09 0.00 0.04 0.00 0.00 34.50 31.81 1ws9 s PRO 176 CO 0.00 -0.75 1.10 -1.25 0.04 0.00 0.00 177.00 176.15 1ws9 s PRO 177 N -2.48 4.64 0.65 0.56 0.04 -1.26 -4.76 135.00 132.39 1ws9 s PRO 177 Ca 0.62 1.80 0.42 0.00 0.04 0.00 0.00 61.00 63.88 1ws9 s PRO 177 Cb -0.40 -3.19 2.31 0.00 0.04 0.00 0.00 34.50 33.26 1ws9 s PRO 177 CO 0.50 0.21 2.35 -1.00 0.04 0.00 0.00 177.00 179.09 1ws9 h PRO 178 N 3.89 0.00 -1.21 0.56 0.13 -1.82 -3.45 132.00 130.09 1ws9 h PRO 178 Ca -0.47 0.00 0.37 0.00 -0.87 0.00 0.00 66.00 65.03 1ws9 h PRO 178 Cb 1.21 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.21 1ws9 h PRO 178 CO 0.67 0.00 0.92 -1.54 -0.23 0.00 0.00 178.00 177.82 1ws9 s SER 179 N -5.32 -0.03 0.17 1.44 1.04 -1.26 -5.02 113.70 104.72 1ws9 s SER 179 Ca -0.05 -0.06 -0.10 0.00 0.48 0.00 0.00 55.95 56.22 1ws9 s SER 179 Cb 0.13 0.08 0.04 0.00 0.10 0.00 0.00 66.02 66.37 1ws9 s SER 179 CO 0.44 -0.14 1.60 1.55 0.98 0.00 0.00 173.24 177.67 1ws9 h PRO 180 N 2.00 1.04 0.00 4.02 0.13 -2.00 -2.47 132.00 134.72 1ws9 h PRO 180 Ca -0.32 -0.37 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 1ws9 h PRO 180 Cb 1.20 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1ws9 h PRO 180 CO 0.29 1.07 0.12 1.49 -0.23 0.00 0.00 178.00 180.74 1ws9 h GLU 181 N 0.92 0.00 -0.73 0.86 4.81 -2.00 -2.38 114.58 116.06 1ws9 h GLU 181 Ca 0.15 0.00 -0.39 0.00 -0.13 0.00 0.00 59.36 58.99 1ws9 h GLU 181 Cb 0.65 0.00 -0.41 0.00 0.63 0.00 0.00 28.75 29.62 1ws9 h GLU 181 CO 0.05 0.00 -1.00 0.54 -0.73 0.00 0.00 179.01 177.86 1ws9 n ARG 182 N -2.73 2.37 0.20 1.92 1.74 -0.96 -4.86 116.66 114.34 1ws9 n ARG 182 Ca -0.02 -3.77 0.14 0.00 -0.77 0.00 0.00 57.85 53.44 1ws9 n ARG 182 Cb 0.17 -1.81 0.66 0.00 -1.02 0.00 0.00 32.46 30.46 1ws9 n ARG 182 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1ws9 h LYS 183 N 2.54 0.00 0.00 5.56 2.10 -1.13 -2.32 116.57 123.32 1ws9 h LYS 183 Ca 0.06 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.69 1ws9 h LYS 183 Cb 1.30 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.62 1ws9 h LYS 183 CO 0.47 0.00 -0.09 1.12 -2.00 0.00 0.00 179.45 178.95 1ws9 h HIS 184 N 0.00 0.00 -3.38 0.07 2.07 -1.87 -3.42 115.15 108.62 1ws9 h HIS 184 Ca 0.00 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.99 1ws9 h HIS 184 Cb 0.26 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.23 1ws9 h HIS 184 CO 0.00 0.09 0.46 -1.14 -3.07 0.00 0.00 177.93 174.27 1ws9 s GLN 185 N -4.53 4.54 0.00 5.12 0.74 -0.87 -3.22 119.66 121.44 1ws9 s GLN 185 Ca -0.04 1.62 0.00 0.00 0.05 0.00 0.00 55.36 56.99 1ws9 s GLN 185 Cb 0.15 -3.37 0.00 0.00 1.10 0.00 0.00 33.01 30.89 1ws9 s GLN 185 CO 0.61 -0.07 0.00 0.41 -0.55 0.00 0.00 175.29 175.70 1ws9 n GLY 186 N 2.76 0.64 3.82 2.59 0.00 -0.35 -4.17 105.19 110.48 1ws9 n GLY 186 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.00 5.05 0.29 -0.61 1.01 -1.20 -0.96 121.20 122.79 1ws9 s ILE 187 Ca 0.00 0.85 0.07 0.00 0.00 0.00 0.00 60.65 61.57 1ws9 s ILE 187 Cb 0.00 -3.73 -0.06 0.00 0.01 0.00 0.00 42.46 38.69 1ws9 s ILE 187 CO 0.00 0.54 -0.06 -0.44 0.00 0.00 0.00 174.94 174.98 1ws9 s SER 188 N -0.81 2.95 0.07 3.58 0.01 0.31 -1.17 113.70 118.64 1ws9 s SER 188 Ca 0.24 -1.20 0.07 0.00 1.31 0.00 0.00 55.95 56.37 1ws9 s SER 188 Cb -0.16 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.83 1ws9 s SER 188 CO 0.13 -0.32 -0.14 0.00 0.41 0.00 0.00 173.24 173.32 1ws9 s ALA 189 N -2.93 2.77 -0.05 1.44 0.00 -1.26 -1.13 121.76 120.60 1ws9 s ALA 189 Ca 0.30 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1ws9 s ALA 189 Cb 0.04 -0.82 0.02 0.00 0.00 0.00 0.00 23.12 22.36 1ws9 s ALA 189 CO 0.13 0.60 -0.03 -0.06 0.00 0.00 0.00 175.76 176.40 1ws9 s PHE 190 N -1.06 0.65 -0.11 0.00 0.40 0.44 -0.20 117.98 118.11 1ws9 s PHE 190 Ca 0.17 -0.16 -0.02 0.00 -0.60 0.00 0.00 56.93 56.33 1ws9 s PHE 190 Cb -0.11 -0.63 -0.03 0.00 0.51 0.00 0.00 43.02 42.76 1ws9 s PHE 190 CO 0.09 -0.20 -0.05 0.00 0.70 0.00 0.00 175.22 175.76 1ws9 s ALA 191 N 1.09 3.01 -0.06 5.36 0.00 0.16 -0.75 121.76 130.56 1ws9 s ALA 191 Ca -0.09 -0.85 -0.31 0.00 0.00 0.00 0.00 51.96 50.72 1ws9 s ALA 191 Cb -0.14 -1.40 0.08 0.00 0.00 0.00 0.00 23.12 21.66 1ws9 s ALA 191 CO -0.01 0.40 0.74 -0.59 0.00 0.00 0.00 175.76 176.30 1ws9 s PHE 192 N -0.25 -0.60 0.71 0.00 -0.71 -0.03 -4.36 117.98 112.75 1ws9 s PHE 192 Ca 0.04 1.00 -0.12 0.00 -1.04 0.00 0.00 56.93 56.81 1ws9 s PHE 192 Cb -0.13 0.42 0.02 0.00 -1.21 0.00 0.00 43.02 42.13 1ws9 s PHE 192 CO 0.02 -0.57 1.08 -0.06 -1.34 0.00 0.00 175.22 174.36 1ws9 s PHE 193 N -1.28 2.76 -0.41 3.49 0.40 -1.26 -0.36 117.98 121.31 1ws9 s PHE 193 Ca -0.09 1.52 -0.44 0.00 -0.60 0.00 0.00 56.93 57.32 1ws9 s PHE 193 Cb -0.00 -3.03 -0.18 0.00 0.51 0.00 0.00 43.02 40.32 1ws9 s PHE 193 CO 0.07 -1.57 1.72 -2.13 0.70 0.00 0.00 175.22 174.01 1ws9 n ARG 194 N -3.04 0.49 -1.50 0.44 0.63 0.70 -4.78 116.66 109.60 1ws9 n ARG 194 Ca 0.09 0.18 -0.35 0.00 -0.92 0.00 0.00 57.85 56.85 1ws9 n ARG 194 Cb 0.53 -1.77 0.09 0.00 0.45 0.00 0.00 32.46 31.75 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 3.55 2.21 0.31 -0.14 0.02 -1.26 -4.92 135.00 134.77 1ws9 s PRO 195 Ca 1.04 1.88 0.20 0.00 0.02 0.00 0.00 61.00 64.14 1ws9 s PRO 195 Cb -1.31 -1.83 0.15 0.00 0.02 0.00 0.00 34.50 31.53 1ws9 s PRO 195 CO 0.73 -1.81 1.37 0.93 -0.33 0.00 0.00 177.00 177.89 1ws9 h GLU 196 N -0.07 0.00 -1.81 5.54 5.08 -1.97 -3.48 114.58 117.88 1ws9 h GLU 196 Ca -0.49 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 57.96 1ws9 h GLU 196 Cb 1.31 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.36 1ws9 h GLU 196 CO 0.50 0.16 0.52 -0.98 -1.00 0.00 0.00 179.01 178.21 1ws9 s ARG 197 N -3.15 0.68 0.00 2.33 1.70 -1.26 -4.99 118.95 114.27 1ws9 s ARG 197 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 55.73 55.30 1ws9 s ARG 197 Cb 0.07 0.32 0.00 0.00 -0.57 0.00 0.00 34.95 34.77 1ws9 s ARG 197 CO 0.73 -0.25 0.00 0.41 -1.08 0.00 0.00 175.30 175.11 1ws9 n GLY 198 N 0.40 2.52 3.30 3.88 0.00 -1.26 -4.65 105.19 109.38 1ws9 n GLY 198 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 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 2.79 -0.11 0.99 0.20 -1.26 -1.48 118.68 119.81 1ws9 s LEU 199 Ca 0.00 -0.41 0.03 0.00 0.69 0.00 0.00 54.13 54.44 1ws9 s LEU 199 Cb 0.00 -1.69 -0.00 0.00 -0.43 0.00 0.00 46.19 44.06 1ws9 s LEU 199 CO 0.00 0.01 -0.21 -0.75 -0.29 0.00 0.00 176.35 175.11 1ws9 s LYS 200 N 1.30 3.13 0.07 1.98 2.20 0.17 -4.98 119.74 123.61 1ws9 s LYS 200 Ca 0.04 -0.83 -0.23 0.00 -0.36 0.00 0.00 55.97 54.59 1ws9 s LYS 200 Cb -0.14 -2.38 -0.06 0.00 -1.51 0.00 0.00 37.83 33.73 1ws9 s LYS 200 CO -0.03 0.19 0.70 0.08 -0.36 0.00 0.00 175.35 175.93 1ws9 s VAL 201 N 0.33 4.67 0.71 4.02 1.01 -1.26 -0.27 120.40 129.61 1ws9 s VAL 201 Ca -0.17 1.50 -0.04 0.00 0.00 0.00 0.00 61.98 63.28 1ws9 s VAL 201 Cb -0.17 -4.05 0.10 0.00 0.00 0.00 0.00 36.38 32.26 1ws9 s VAL 201 CO 0.08 0.45 1.00 -0.83 0.00 0.00 0.00 175.10 175.79 1ws9 s GLY 202 N -0.54 1.76 -0.08 4.51 0.00 -0.23 -4.95 107.32 107.78 1ws9 s GLY 202 Ca 0.35 -1.36 -0.30 0.00 0.00 0.00 0.00 44.72 43.41 1ws9 s GLY 202 CO 0.22 -0.87 2.06 -0.96 0.00 0.00 0.00 173.10 173.55 1ws9 n ARG 203 N -2.87 2.41 -1.72 2.90 -4.01 -1.26 -4.68 116.66 107.42 1ws9 n ARG 203 Ca 0.12 0.81 -0.42 0.00 -1.04 0.00 0.00 57.85 57.32 1ws9 n ARG 203 Cb 0.60 -3.03 -0.01 0.00 -3.04 0.00 0.00 32.46 26.99 1ws9 n ARG 203 CO 0.00 0.00 0.00 1.17 -3.04 0.00 0.00 177.63 175.76 1ws9 n LYS 204 N 7.89 2.31 -4.86 2.89 4.81 -1.26 -4.82 118.16 125.12 1ws9 n LYS 204 Ca 0.25 0.81 -0.31 0.00 -0.87 0.00 0.00 58.31 58.19 1ws9 n LYS 204 Cb 0.40 -2.45 -0.14 0.00 0.02 0.00 0.00 35.03 32.86 1ws9 n LYS 204 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1ws9 s GLU 205 N -1.77 2.11 0.23 1.64 -1.05 -1.26 -5.11 118.70 113.49 1ws9 s GLU 205 Ca 0.56 -0.94 -0.30 0.00 -0.15 0.00 0.00 54.97 54.14 1ws9 s GLU 205 Cb -0.54 -2.16 -0.09 0.00 -0.44 0.00 0.00 34.13 30.90 1ws9 s GLU 205 CO 0.61 0.55 1.07 -1.21 0.95 0.00 0.00 175.26 177.24 1ws9 s GLU 206 N -1.13 4.66 0.21 -4.83 8.01 -1.26 -5.01 118.70 119.35 1ws9 s GLU 206 Ca 0.13 1.72 0.07 0.00 0.01 0.00 0.00 54.97 56.89 1ws9 s GLU 206 Cb -0.10 -3.24 -0.04 0.00 -4.31 0.00 0.00 34.13 26.44 1ws9 s GLU 206 CO 0.03 0.21 0.13 0.15 0.01 0.00 0.00 175.26 175.79 1ws9 s LYS 207 N -0.98 2.79 0.35 1.61 1.02 -1.26 -5.00 119.74 118.26 1ws9 s LYS 207 Ca 0.46 -1.03 0.06 0.00 0.02 0.00 0.00 55.97 55.48 1ws9 s LYS 207 Cb -0.30 -2.53 0.74 0.00 -0.52 0.00 0.00 37.83 35.22 1ws9 s LYS 207 CO 0.37 0.43 1.92 1.25 -0.92 0.00 0.00 175.35 178.40 1ws9 h LEU 208 N 1.99 0.69 0.00 3.17 5.85 -1.96 -3.46 115.31 121.60 1ws9 h LEU 208 Ca -0.48 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1ws9 h LEU 208 Cb 1.22 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.12 1ws9 h LEU 208 CO 0.61 0.42 0.00 0.61 -0.34 0.00 0.00 178.44 179.74 1ws9 n GLY 209 N -1.44 3.32 3.87 3.75 0.00 -1.26 -4.86 105.19 108.58 1ws9 n GLY 209 Ca 0.13 -1.15 -0.31 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.49 -0.27 0.99 4.77 -1.26 -4.82 117.00 114.92 1ws9 n LEU 210 Ca 0.00 -0.74 0.07 0.00 -0.03 0.00 0.00 56.01 55.32 1ws9 n LEU 210 Cb 0.00 -2.00 0.19 0.00 -2.33 0.00 0.00 43.42 39.28 1ws9 n LEU 210 CO 0.00 0.21 0.85 0.74 -1.33 0.00 0.00 177.39 177.86 1ws9 h THR 211 N -1.19 0.32 0.00 -5.08 2.02 -1.86 -1.21 112.91 105.91 1ws9 h THR 211 Ca -0.50 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1ws9 h THR 211 Cb 1.33 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1ws9 h THR 211 CO 0.67 0.02 0.00 0.00 0.37 0.00 0.00 175.52 176.58 1ws9 n ALA 212 N -2.90 2.48 -2.56 6.16 0.00 -1.25 -4.59 120.51 117.84 1ws9 n ALA 212 Ca 0.16 -0.16 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1ws9 n ALA 212 Cb 0.53 -1.44 -0.05 0.00 0.00 0.00 0.00 19.45 18.49 1ws9 n ALA 212 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ws9 s SER 213 N -2.11 7.07 -0.31 0.00 1.04 -0.46 -4.34 113.70 114.59 1ws9 s SER 213 Ca 0.38 1.28 -0.29 0.00 0.48 0.00 0.00 55.95 57.80 1ws9 s SER 213 Cb 0.19 -2.42 -0.01 0.00 0.10 0.00 0.00 66.02 63.87 1ws9 s SER 213 CO 0.33 -0.03 1.65 -0.62 0.98 0.00 0.00 173.24 175.55 1ws9 s ASP 214 N 0.31 6.16 -0.25 7.02 3.68 -1.26 -4.95 116.67 127.38 1ws9 s ASP 214 Ca 0.37 1.31 0.00 0.00 2.13 0.00 0.00 52.55 56.36 1ws9 s ASP 214 Cb -0.19 -2.53 0.07 0.00 -1.45 0.00 0.00 42.92 38.82 1ws9 s ASP 214 CO 0.20 -1.49 -0.00 -0.89 0.13 0.00 0.00 175.17 173.11 1ws9 s THR 215 N 5.99 1.28 0.13 1.71 2.01 -1.26 0.18 115.64 125.68 1ws9 s THR 215 Ca 0.73 -1.21 0.04 0.00 0.31 0.00 0.00 61.69 61.57 1ws9 s THR 215 Cb -0.21 -1.69 -0.04 0.00 0.01 0.00 0.00 72.50 70.56 1ws9 s THR 215 CO 0.32 -0.25 -0.10 0.00 -0.69 0.00 0.00 174.62 173.89 1ws9 s ALA 216 N 1.48 1.36 0.11 7.40 0.00 -0.60 -4.63 121.76 126.89 1ws9 s ALA 216 Ca -0.01 -1.39 -0.20 0.00 0.00 0.00 0.00 51.96 50.35 1ws9 s ALA 216 Cb -0.18 0.03 -0.07 0.00 0.00 0.00 0.00 23.12 22.90 1ws9 s ALA 216 CO -0.10 -0.07 0.62 -1.14 0.00 0.00 0.00 175.76 175.07 1ws9 s GLN 217 N -3.41 4.26 -0.12 0.00 0.74 -1.26 -1.27 119.66 118.60 1ws9 s GLN 217 Ca 0.13 0.81 0.02 0.00 0.05 0.00 0.00 55.36 56.37 1ws9 s GLN 217 Cb 0.01 -3.19 -0.01 0.00 1.10 0.00 0.00 33.01 30.92 1ws9 s GLN 217 CO 0.00 0.60 -0.19 -0.51 -0.55 0.00 0.00 175.29 174.64 1ws9 s LEU 218 N -1.24 2.35 -0.26 3.68 1.43 0.74 -1.07 118.68 124.31 1ws9 s LEU 218 Ca 0.32 -0.47 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 1ws9 s LEU 218 Cb -0.20 -1.50 0.03 0.00 0.03 0.00 0.00 46.19 44.56 1ws9 s LEU 218 CO 0.20 0.15 -0.05 -0.63 0.23 0.00 0.00 176.35 176.25 1ws9 s ILE 219 N 0.39 2.85 -0.31 -0.59 1.01 0.63 0.42 121.20 125.59 1ws9 s ILE 219 Ca -0.15 -1.12 -0.12 0.00 0.00 0.00 0.00 60.65 59.27 1ws9 s ILE 219 Cb -0.17 -2.49 -0.03 0.00 0.01 0.00 0.00 42.46 39.78 1ws9 s ILE 219 CO 0.07 0.14 0.21 -0.76 0.00 0.00 0.00 174.94 174.60 1ws9 s LEU 220 N 1.30 4.28 -0.27 2.97 1.43 0.18 -0.66 118.68 127.91 1ws9 s LEU 220 Ca -0.01 -0.25 0.02 0.00 -1.03 0.00 0.00 54.13 52.86 1ws9 s LEU 220 Cb -0.17 -2.12 0.07 0.00 0.03 0.00 0.00 46.19 44.00 1ws9 s LEU 220 CO -0.04 -0.15 -0.04 -1.61 0.23 0.00 0.00 176.35 174.73 1ws9 s GLU 221 N 1.73 1.75 -1.62 1.70 2.02 -0.55 -1.19 118.70 122.55 1ws9 s GLU 221 Ca 0.06 -1.32 -0.10 0.00 0.02 0.00 0.00 54.97 53.63 1ws9 s GLU 221 Cb -0.17 -2.79 0.09 0.00 0.10 0.00 0.00 34.13 31.36 1ws9 s GLU 221 CO 0.10 -0.69 0.48 -0.25 0.02 0.00 0.00 175.26 174.93 1ws9 n ASP 222 N 4.50 -1.32 -4.71 -0.19 8.00 -1.09 -4.59 116.55 117.15 1ws9 n ASP 222 Ca -0.09 -1.11 -0.42 0.00 0.71 0.00 0.00 54.79 53.89 1ws9 n ASP 222 Cb 0.43 -2.39 -0.03 0.00 -0.02 0.00 0.00 41.12 39.11 1ws9 n ASP 222 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1ws9 s LEU 223 N -7.21 4.37 -0.15 0.64 2.96 -0.35 -4.75 118.68 114.18 1ws9 s LEU 223 Ca 0.40 2.04 -0.07 0.00 -0.22 0.00 0.00 54.13 56.28 1ws9 s LEU 223 Cb -0.22 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.85 1ws9 s LEU 223 CO 0.95 -0.49 0.07 0.12 -1.32 0.00 0.00 176.35 175.68 1ws9 s PHE 224 N 1.11 3.32 0.03 5.38 2.19 -1.26 0.10 117.98 128.86 1ws9 s PHE 224 Ca 0.59 0.22 0.03 0.00 0.33 0.00 0.00 56.93 58.10 1ws9 s PHE 224 Cb -0.30 -2.00 -0.02 0.00 -1.31 0.00 0.00 43.02 39.39 1ws9 s PHE 224 CO 0.29 0.35 -0.10 0.14 1.83 0.00 0.00 175.22 177.73 1ws9 s VAL 225 N -0.16 0.80 0.91 3.12 -7.23 -0.40 -5.01 120.40 112.44 1ws9 s VAL 225 Ca 0.08 -0.91 -0.12 0.00 -1.81 0.00 0.00 61.98 59.22 1ws9 s VAL 225 Cb -0.12 -0.76 0.14 0.00 0.56 0.00 0.00 36.38 36.20 1ws9 s VAL 225 CO 0.01 -0.12 1.10 -2.16 -0.31 0.00 0.00 175.10 173.63 1ws9 s PRO 226 N -1.14 1.13 0.26 4.82 0.04 -1.26 -1.00 135.00 137.85 1ws9 s PRO 226 Ca -0.02 0.57 -0.01 0.00 0.04 0.00 0.00 61.00 61.58 1ws9 s PRO 226 Cb -0.08 -1.81 0.57 0.00 0.04 0.00 0.00 34.50 33.22 1ws9 s PRO 226 CO 0.01 -2.26 1.72 1.49 0.04 0.00 0.00 177.00 177.99 1ws9 h GLU 227 N -1.56 0.44 0.00 4.56 4.57 -1.66 0.81 114.58 121.74 1ws9 h GLU 227 Ca -0.51 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 1ws9 h GLU 227 Cb 1.31 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 1ws9 h GLU 227 CO 0.58 0.29 0.00 0.39 -1.18 0.00 0.00 179.01 179.09 1ws9 n GLU 228 N -5.00 0.31 0.06 1.92 4.71 -1.26 -2.71 120.64 118.67 1ws9 n GLU 228 Ca 0.18 0.00 -0.07 0.00 -0.01 0.00 0.00 57.16 57.25 1ws9 n GLU 228 Cb 0.51 -1.47 -0.11 0.00 -1.01 0.00 0.00 31.44 29.35 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 2.56 0.36 -2.01 0.62 0.00 -1.03 -3.45 119.26 116.31 1ws9 h ALA 229 Ca 0.00 -0.90 -0.60 0.00 0.00 0.00 0.00 54.91 53.41 1ws9 h ALA 229 Cb 0.00 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.65 1ws9 h ALA 229 CO 0.00 1.23 1.19 -0.11 0.00 0.00 0.00 179.25 181.56 1ws9 n LEU 230 N -3.37 3.47 -4.42 0.00 7.94 -1.10 0.36 117.00 119.87 1ws9 n LEU 230 Ca -0.00 0.84 -0.40 0.00 -1.11 0.00 0.00 56.01 55.34 1ws9 n LEU 230 Cb 0.93 -1.41 -0.11 0.00 0.53 0.00 0.00 43.42 43.36 1ws9 n LEU 230 CO 0.47 -0.12 -0.17 -0.22 -1.11 0.00 0.00 177.39 176.25 1ws9 s LEU 231 N 4.82 4.48 0.00 -1.96 2.96 0.72 -4.86 118.68 124.84 1ws9 s LEU 231 Ca 0.94 -0.74 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 1ws9 s LEU 231 Cb -0.63 -2.04 0.00 0.00 0.50 0.00 0.00 46.19 44.03 1ws9 s LEU 231 CO 0.48 -0.30 0.00 0.61 -1.32 0.00 0.00 176.35 175.83 1ws9 n GLY 232 N 5.01 -2.35 3.79 7.98 0.00 -1.25 -4.01 105.19 114.37 1ws9 n GLY 232 Ca -0.13 -1.62 -0.36 0.00 0.00 0.00 0.00 46.02 43.92 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 -0.45 4.41 0.18 1.61 2.02 -1.26 -4.94 118.70 120.26 1ws9 s GLU 233 Ca 0.00 1.31 -0.33 0.00 0.02 0.00 0.00 54.97 55.97 1ws9 s GLU 233 Cb 0.00 -2.58 -0.13 0.00 0.10 0.00 0.00 34.13 31.52 1ws9 s GLU 233 CO 0.00 0.11 1.68 -2.13 0.02 0.00 0.00 175.26 174.94 1ws9 n ARG 234 N 0.11 2.52 -0.87 1.61 0.63 -1.26 -2.03 116.66 117.36 1ws9 n ARG 234 Ca 0.04 0.91 0.00 0.00 -0.92 0.00 0.00 57.85 57.88 1ws9 n ARG 234 Cb 0.51 -2.73 0.00 0.00 0.45 0.00 0.00 32.46 30.69 1ws9 n ARG 234 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ws9 n GLY 235 N 3.77 0.61 0.18 5.14 0.00 -1.20 -4.81 105.19 108.88 1ws9 n GLY 235 Ca 0.17 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.24 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 -1.94 2.30 0.25 1.61 5.02 -0.86 -1.21 118.16 123.32 1ws9 n LYS 236 Ca 0.00 -2.11 0.16 0.00 -2.02 0.00 0.00 58.31 54.34 1ws9 n LYS 236 Cb 0.03 -1.30 0.66 0.00 -0.02 0.00 0.00 35.03 34.40 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 0.37 0.00 1.26 0.72 0.00 -1.22 -3.26 103.07 100.95 1ws9 h GLY 237 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 1ws9 h GLY 237 CO 0.02 0.00 0.10 -2.75 0.00 0.00 0.00 176.54 173.91 1ws9 h PHE 238 N 0.00 0.95 -0.57 5.60 3.04 -1.80 -1.30 116.94 122.87 1ws9 h PHE 238 Ca 0.00 -0.11 -0.02 0.00 3.98 0.00 0.00 57.97 61.82 1ws9 h PHE 238 Cb 0.47 -0.27 -0.03 0.00 2.56 0.00 0.00 35.95 38.68 1ws9 h PHE 238 CO 0.00 0.82 0.28 -0.92 -2.02 0.00 0.00 178.31 176.47 1ws9 h TYR 239 N 0.86 0.79 -0.24 0.41 5.03 -1.91 -0.76 116.97 121.14 1ws9 h TYR 239 Ca 0.18 -0.02 -0.11 0.00 2.58 0.00 0.00 58.73 61.36 1ws9 h TYR 239 Cb 0.38 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.39 1ws9 h TYR 239 CO 0.02 0.57 -0.32 -0.44 -1.32 0.00 0.00 178.16 176.68 1ws9 h ASP 240 N 0.80 0.52 -0.40 -2.11 3.32 -1.55 -2.36 116.42 114.64 1ws9 h ASP 240 Ca 0.20 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ws9 h ASP 240 Cb 0.07 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1ws9 h ASP 240 CO -0.03 0.81 0.26 0.58 -1.72 0.00 0.00 179.24 179.15 1ws9 h VAL 241 N 0.43 1.11 -0.57 -1.35 2.07 -0.05 -0.21 116.25 117.68 1ws9 h VAL 241 Ca 0.05 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.32 1ws9 h VAL 241 Cb 0.77 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1ws9 h VAL 241 CO 0.06 0.11 0.18 -0.07 0.02 0.00 0.00 177.57 177.86 1ws9 h LEU 242 N 0.54 0.84 -1.08 2.57 3.38 -1.16 -0.28 115.31 120.12 1ws9 h LEU 242 Ca 0.15 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1ws9 h LEU 242 Cb -0.05 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 1ws9 h LEU 242 CO -0.03 0.82 0.58 0.03 0.09 0.00 0.00 178.44 179.93 1ws9 h ARG 243 N 0.80 1.20 -0.68 1.13 2.47 -1.13 0.07 114.38 118.25 1ws9 h ARG 243 Ca 0.18 -0.09 -0.07 0.00 -1.26 0.00 0.00 59.98 58.75 1ws9 h ARG 243 Cb 0.29 -0.26 -0.03 0.00 -1.65 0.00 0.00 29.97 28.32 1ws9 h ARG 243 CO -0.01 0.81 0.16 0.28 0.56 0.00 0.00 179.97 181.78 1ws9 h VAL 244 N 1.23 1.26 -0.31 2.04 2.07 -0.64 -2.72 116.25 119.18 1ws9 h VAL 244 Ca 0.33 -0.96 -0.10 0.00 0.82 0.00 0.00 66.70 66.79 1ws9 h VAL 244 Cb -0.11 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1ws9 h VAL 244 CO -0.07 0.37 -0.21 -0.07 0.02 0.00 0.00 177.57 177.61 1ws9 h LEU 245 N 1.02 0.58 -0.32 2.57 3.38 -0.48 -1.39 115.31 120.66 1ws9 h LEU 245 Ca 0.21 -0.19 0.05 0.00 0.09 0.00 0.00 57.88 58.04 1ws9 h LEU 245 Cb 0.37 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 1ws9 h LEU 245 CO 0.00 0.79 0.05 0.44 0.09 0.00 0.00 178.44 179.81 1ws9 h ASP 246 N 0.51 -0.01 -0.30 -0.43 3.32 -0.69 -0.89 116.42 117.92 1ws9 h ASP 246 Ca 0.08 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 1ws9 h ASP 246 Cb 0.65 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 1ws9 h ASP 246 CO 0.05 0.03 0.01 1.23 -1.72 0.00 0.00 179.24 178.84 1ws9 h GLY 247 N 0.16 0.56 0.91 2.75 0.00 -1.30 -3.11 103.07 103.04 1ws9 h GLY 247 Ca 0.15 -0.40 0.06 0.00 0.00 0.00 0.00 47.33 47.13 1ws9 h GLY 247 CO -0.21 0.37 0.58 -1.33 0.00 0.00 0.00 176.54 175.95 1ws9 h GLY 248 N 0.32 1.28 1.42 4.60 0.00 -0.94 -2.08 103.07 107.67 1ws9 h GLY 248 Ca 0.09 -0.41 0.07 0.00 0.00 0.00 0.00 47.33 47.08 1ws9 h GLY 248 CO 0.01 0.32 0.23 3.21 0.00 0.00 0.00 176.54 180.31 1ws9 h ARG 249 N 1.03 0.11 -0.52 4.80 3.08 -1.09 -0.09 114.38 121.70 1ws9 h ARG 249 Ca 0.37 -0.01 -0.12 0.00 0.07 0.00 0.00 59.98 60.30 1ws9 h ARG 249 Cb 0.16 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1ws9 h ARG 249 CO -0.13 0.07 -0.14 0.82 -1.07 0.00 0.00 179.97 179.52 1ws9 h ILE 250 N 0.11 1.27 -0.11 2.04 2.04 -1.42 -0.43 117.51 121.00 1ws9 h ILE 250 Ca 0.15 -1.29 -0.14 0.00 1.00 0.00 0.00 64.86 64.57 1ws9 h ILE 250 Cb 0.46 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1ws9 h ILE 250 CO -0.02 0.45 -0.55 1.23 0.00 0.00 0.00 178.15 179.26 1ws9 h GLY 251 N 0.92 0.36 1.67 5.37 0.00 -1.09 -1.64 103.07 108.66 1ws9 h GLY 251 Ca 0.13 -0.42 -0.13 0.00 0.00 0.00 0.00 47.33 46.91 1ws9 h GLY 251 CO 0.05 0.37 -0.50 -2.22 0.00 0.00 0.00 176.54 174.24 1ws9 h ILE 252 N 0.25 1.34 -0.23 2.60 1.08 -0.96 0.12 117.51 121.70 1ws9 h ILE 252 Ca 0.00 -1.74 -0.03 0.00 -0.39 0.00 0.00 64.86 62.70 1ws9 h ILE 252 Cb 1.05 1.79 -0.01 0.00 -3.07 0.00 0.00 36.82 36.59 1ws9 h ILE 252 CO 0.09 0.53 0.03 0.00 -0.69 0.00 0.00 178.15 178.10 1ws9 h ALA 253 N 1.19 0.31 -0.78 1.87 0.00 -0.83 -0.56 119.26 120.46 1ws9 h ALA 253 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1ws9 h ALA 253 Cb 0.98 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 1ws9 h ALA 253 CO 0.08 0.00 0.50 0.00 0.00 0.00 0.00 179.25 179.84 1ws9 h ALA 254 N 0.83 0.99 -0.54 0.00 0.00 -1.13 -1.05 119.26 118.36 1ws9 h ALA 254 Ca 0.07 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ws9 h ALA 254 Cb 0.35 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1ws9 h ALA 254 CO 0.01 0.42 0.31 1.98 0.00 0.00 0.00 179.25 181.97 1ws9 h MET 255 N 1.06 0.74 -0.41 0.00 -1.53 -0.70 -1.34 114.93 112.75 1ws9 h MET 255 Ca 0.28 -0.08 -0.01 0.00 -3.44 0.00 0.00 59.70 56.46 1ws9 h MET 255 Cb -0.09 -0.15 -0.02 0.00 -0.55 0.00 0.00 31.60 30.79 1ws9 h MET 255 CO -0.06 0.55 0.24 0.00 0.14 0.00 0.00 176.91 177.78 1ws9 h ALA 256 N 1.15 0.52 -0.97 0.39 0.00 -0.61 -2.55 119.26 117.19 1ws9 h ALA 256 Ca 0.19 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1ws9 h ALA 256 Cb 0.01 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 1ws9 h ALA 256 CO -0.03 0.03 0.64 0.28 0.00 0.00 0.00 179.25 180.17 1ws9 h VAL 257 N 0.53 1.22 -0.41 0.00 2.07 -0.90 -1.31 116.25 117.45 1ws9 h VAL 257 Ca 0.15 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1ws9 h VAL 257 Cb 0.03 -0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 29.61 1ws9 h VAL 257 CO -0.03 0.23 0.26 1.23 0.02 0.00 0.00 177.57 179.28 1ws9 h GLY 258 N 1.28 0.59 1.19 2.17 0.00 -0.91 0.62 103.07 108.01 1ws9 h GLY 258 Ca 0.37 -0.24 -0.12 0.00 0.00 0.00 0.00 47.33 47.34 1ws9 h GLY 258 CO -0.10 0.23 -0.19 1.41 0.00 0.00 0.00 176.54 177.90 1ws9 h LEU 259 N 0.55 0.94 -0.67 3.11 3.38 -1.13 -1.91 115.31 119.59 1ws9 h LEU 259 Ca 0.15 -0.34 -0.13 0.00 0.09 0.00 0.00 57.88 57.65 1ws9 h LEU 259 Cb -0.02 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1ws9 h LEU 259 CO -0.03 1.11 -0.36 1.23 0.09 0.00 0.00 178.44 180.48 1ws9 h GLY 260 N 0.92 0.69 1.00 0.83 0.00 -1.05 -2.03 103.07 103.43 1ws9 h GLY 260 Ca 0.11 -0.66 -0.07 0.00 0.00 0.00 0.00 47.33 46.71 1ws9 h GLY 260 CO 0.06 0.60 0.05 -1.61 0.00 0.00 0.00 176.54 175.64 1ws9 h GLN 261 N 0.53 0.86 -0.67 4.80 5.75 -0.71 0.70 115.11 126.37 1ws9 h GLN 261 Ca 0.05 -0.25 -0.01 0.00 -0.15 0.00 0.00 58.65 58.30 1ws9 h GLN 261 Cb 0.86 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.29 1ws9 h GLN 261 CO 0.07 0.87 0.39 0.00 -2.65 0.00 0.00 178.83 177.51 1ws9 h ALA 262 N 0.96 0.86 -0.50 3.38 0.00 -1.20 0.15 119.26 122.90 1ws9 h ALA 262 Ca 0.15 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1ws9 h ALA 262 Cb 0.45 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1ws9 h ALA 262 CO 0.02 0.35 0.06 0.00 0.00 0.00 0.00 179.25 179.68 1ws9 h ALA 263 N 1.20 0.66 0.08 0.00 0.00 -1.08 -1.72 119.26 118.39 1ws9 h ALA 263 Ca 0.24 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ws9 h ALA 263 Cb -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1ws9 h ALA 263 CO -0.04 0.41 -0.04 1.25 0.00 0.00 0.00 179.25 180.84 1ws9 h LEU 264 N 0.71 -0.09 -0.62 0.00 5.85 -0.39 -1.49 115.31 119.28 1ws9 h LEU 264 Ca 0.15 -0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.85 1ws9 h LEU 264 Cb 0.42 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.42 1ws9 h LEU 264 CO 0.01 0.03 0.30 0.44 -0.34 0.00 0.00 178.44 178.88 1ws9 h ASP 265 N -0.20 0.40 -0.57 1.25 3.45 -0.64 0.97 116.42 121.08 1ws9 h ASP 265 Ca -0.01 0.05 -0.03 0.00 0.43 0.00 0.00 57.03 57.47 1ws9 h ASP 265 Cb 0.17 -0.02 -0.03 0.00 -0.56 0.00 0.00 39.33 38.89 1ws9 h ASP 265 CO 0.02 0.25 0.23 0.22 -1.57 0.00 0.00 179.24 178.40 1ws9 h TYR 266 N 0.55 0.87 -0.65 4.55 3.20 -1.20 -1.46 116.97 122.83 1ws9 h TYR 266 Ca 0.29 -0.06 -0.04 0.00 3.14 0.00 0.00 58.73 62.05 1ws9 h TYR 266 Cb 0.25 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 1ws9 h TYR 266 CO -0.11 0.70 0.23 0.00 -1.64 0.00 0.00 178.16 177.34 1ws9 h ALA 267 N 1.08 0.84 0.69 1.82 0.00 -0.61 -0.08 119.26 123.00 1ws9 h ALA 267 Ca 0.19 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ws9 h ALA 267 Cb 0.19 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ws9 h ALA 267 CO -0.02 0.49 -0.39 -0.07 0.00 0.00 0.00 179.25 179.26 1ws9 h LEU 268 N 0.92 -0.96 -0.53 0.00 3.38 -0.50 0.31 115.31 117.93 1ws9 h LEU 268 Ca 0.21 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.30 1ws9 h LEU 268 Cb 0.25 0.27 -0.06 0.00 0.09 0.00 0.00 40.66 41.21 1ws9 h LEU 268 CO -0.01 -0.62 0.19 0.00 0.09 0.00 0.00 178.44 178.09 1ws9 h ALA 269 N -0.75 0.66 0.17 1.53 0.00 -1.23 -1.47 119.26 118.17 1ws9 h ALA 269 Ca -0.09 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1ws9 h ALA 269 Cb 0.80 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1ws9 h ALA 269 CO 0.11 -0.20 -0.08 -0.92 0.00 0.00 0.00 179.25 178.16 1ws9 h TYR 270 N 0.38 -0.22 -0.04 0.00 3.20 -0.80 -2.36 116.97 117.13 1ws9 h TYR 270 Ca 0.26 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.13 1ws9 h TYR 270 Cb 0.28 0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.62 1ws9 h TYR 270 CO -0.16 -0.08 0.08 0.00 -1.64 0.00 0.00 178.16 176.35 1ws9 h ALA 271 N 0.52 1.36 0.00 1.82 0.00 -0.05 0.13 119.26 123.05 1ws9 h ALA 271 Ca -0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1ws9 h ALA 271 Cb 0.23 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ws9 h ALA 271 CO 0.04 -0.10 -0.42 -0.22 0.00 0.00 0.00 179.25 178.55 1ws9 h LYS 272 N 0.00 0.00 0.00 0.00 3.64 -0.76 -2.27 116.57 117.18 1ws9 h LYS 272 Ca 0.02 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 1ws9 h LYS 272 Cb 0.17 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 1ws9 h LYS 272 CO -0.00 0.09 -1.61 0.41 -2.27 0.00 0.00 179.45 176.07 1ws9 n GLY 273 N 1.16 -0.49 3.72 5.01 0.00 -0.04 -4.87 105.19 109.67 1ws9 n GLY 273 Ca 0.02 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1ws9 n GLY 273 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ws9 s ARG 274 N -2.44 4.65 0.06 1.61 6.06 0.26 -4.99 118.95 124.16 1ws9 s ARG 274 Ca -0.05 1.42 0.09 0.00 -2.50 0.00 0.00 55.73 54.70 1ws9 s ARG 274 Cb 0.05 -3.40 -0.03 0.00 0.06 0.00 0.00 34.95 31.63 1ws9 s ARG 274 CO 0.43 0.16 -0.26 -1.21 -2.50 0.00 0.00 175.30 171.92 1ws9 s GLU 275 N 0.23 1.78 -0.11 5.12 2.02 -1.26 -1.31 118.70 125.17 1ws9 s GLU 275 Ca 0.48 -1.13 -0.09 0.00 0.02 0.00 0.00 54.97 54.24 1ws9 s GLU 275 Cb -0.23 -1.99 0.03 0.00 0.10 0.00 0.00 34.13 32.04 1ws9 s GLU 275 CO 0.29 0.51 0.28 0.00 0.02 0.00 0.00 175.26 176.36 1ws9 s ALA 276 N -0.85 -0.70 -1.60 5.21 0.00 -0.43 -4.86 121.76 118.53 1ws9 s ALA 276 Ca 0.12 0.83 -0.01 0.00 0.00 0.00 0.00 51.96 52.90 1ws9 s ALA 276 Cb -0.10 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.54 1ws9 s ALA 276 CO 0.03 -0.14 0.15 1.19 0.00 0.00 0.00 175.76 176.98 1ws9 n PHE 277 N 3.05 -1.31 -2.40 0.00 3.01 -1.26 -2.79 117.46 115.76 1ws9 n PHE 277 Ca -0.14 0.13 -0.04 0.00 1.01 0.00 0.00 57.45 58.41 1ws9 n PHE 277 Cb 0.58 -3.84 0.01 0.00 -0.01 0.00 0.00 39.48 36.21 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 -1.09 0.48 3.58 1.37 0.00 -1.26 -5.05 105.19 103.21 1ws9 n GLY 278 Ca -0.19 -0.62 -0.06 0.00 0.00 0.00 0.00 46.02 45.14 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 -4.74 0.42 0.35 1.61 1.70 -1.12 -5.13 118.95 112.05 1ws9 s ARG 279 Ca 0.05 -0.07 -0.29 0.00 -0.47 0.00 0.00 55.73 54.95 1ws9 s ARG 279 Cb -0.02 0.20 -0.11 0.00 -0.57 0.00 0.00 34.95 34.44 1ws9 s ARG 279 CO 0.07 -0.17 1.54 -2.14 -1.08 0.00 0.00 175.30 173.51 1ws9 s PRO 280 N -2.06 4.10 0.28 3.89 0.02 -1.26 -1.31 135.00 138.66 1ws9 s PRO 280 Ca 0.06 2.59 0.20 0.00 0.02 0.00 0.00 61.00 63.87 1ws9 s PRO 280 Cb -0.01 -2.98 1.03 0.00 0.02 0.00 0.00 34.50 32.56 1ws9 s PRO 280 CO -0.05 -0.59 1.61 0.44 -0.33 0.00 0.00 177.00 178.09 1ws9 n ILE 281 N 1.11 1.08 0.31 2.83 -5.35 -0.43 -1.35 119.36 117.56 1ws9 n ILE 281 Ca 0.04 0.61 0.17 0.00 -0.27 0.00 0.00 62.75 63.30 1ws9 n ILE 281 Cb 0.38 -1.59 0.75 0.00 -1.74 0.00 0.00 39.64 37.45 1ws9 n ILE 281 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ws9 h ALA 282 N 2.06 1.00 -0.12 -1.28 0.00 -1.68 -2.21 119.26 117.03 1ws9 h ALA 282 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ws9 h ALA 282 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ws9 h ALA 282 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.64 1ws9 n GLU 283 N -2.87 1.43 -3.98 0.00 1.02 -0.45 -4.14 120.64 111.64 1ws9 n GLU 283 Ca -0.00 -0.65 -0.35 0.00 -0.02 0.00 0.00 57.16 56.14 1ws9 n GLU 283 Cb 0.22 -1.29 -0.12 0.00 -0.02 0.00 0.00 31.44 30.23 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 -1.84 3.11 0.56 -0.32 0.08 -0.83 -4.99 117.98 113.76 1ws9 s PHE 284 Ca 0.25 -0.28 0.26 0.00 0.12 0.00 0.00 56.93 57.28 1ws9 s PHE 284 Cb 0.13 -2.13 1.52 0.00 -0.57 0.00 0.00 43.02 41.97 1ws9 s PHE 284 CO 0.20 -0.15 2.07 0.93 -0.10 0.00 0.00 175.22 178.17 1ws9 h GLU 285 N 7.46 0.00 0.00 0.44 5.08 -1.86 0.16 114.58 125.85 1ws9 h GLU 285 Ca -0.36 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.00 1ws9 h GLU 285 Cb 1.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1ws9 h GLU 285 CO 0.62 0.00 -0.00 0.78 -1.00 0.00 0.00 179.01 179.41 1ws9 h GLY 286 N 0.00 0.00 0.00 -3.84 0.00 -1.94 -0.74 103.07 96.55 1ws9 h GLY 286 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 47.33 47.04 1ws9 h GLY 286 CO -0.00 0.00 -2.38 -0.62 0.00 0.00 0.00 176.54 173.54 1ws9 n VAL 287 N -3.87 1.46 -0.15 4.60 0.31 0.41 -4.37 118.33 116.72 1ws9 n VAL 287 Ca -0.03 -0.33 0.01 0.00 -0.01 0.00 0.00 64.34 63.97 1ws9 n VAL 287 Cb 0.09 -1.90 0.28 0.00 -0.91 0.00 0.00 33.84 31.40 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 -0.95 0.76 -0.62 4.52 4.64 -1.08 -2.06 113.55 118.75 1ws9 h SER 288 Ca -0.63 -0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 60.59 1ws9 h SER 288 Cb 1.55 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 63.42 1ws9 h SER 288 CO -0.38 0.58 0.17 -0.26 -0.87 0.00 0.00 176.83 176.07 1ws9 h PHE 289 N 0.87 1.04 -0.29 4.77 -1.00 -1.37 0.43 116.94 121.39 1ws9 h PHE 289 Ca 0.23 -0.11 -0.01 0.00 2.81 0.00 0.00 57.97 60.89 1ws9 h PHE 289 Cb -0.03 -0.30 -0.01 0.00 3.61 0.00 0.00 35.95 39.21 1ws9 h PHE 289 CO 0.00 0.85 0.13 0.87 -1.61 0.00 0.00 178.31 178.55 1ws9 h LYS 290 N 0.96 0.43 -0.66 1.51 1.57 -1.59 -0.01 116.57 118.77 1ws9 h LYS 290 Ca 0.21 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 58.94 1ws9 h LYS 290 Cb 0.32 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 1ws9 h LYS 290 CO -0.00 0.43 0.42 -0.07 -0.57 0.00 0.00 179.45 179.66 1ws9 h LEU 291 N 0.33 0.70 -0.44 2.94 3.38 -0.93 -1.24 115.31 120.05 1ws9 h LEU 291 Ca 0.10 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 1ws9 h LEU 291 Cb 0.15 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1ws9 h LEU 291 CO -0.01 0.50 0.05 0.00 0.09 0.00 0.00 178.44 179.07 1ws9 h ALA 292 N 1.27 0.59 -0.32 1.53 0.00 -0.61 -1.87 119.26 119.86 1ws9 h ALA 292 Ca 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1ws9 h ALA 292 Cb -0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1ws9 h ALA 292 CO -0.09 0.33 0.11 0.93 0.00 0.00 0.00 179.25 180.53 1ws9 h GLU 293 N 0.60 0.49 -0.29 0.00 5.08 -0.74 -1.99 114.58 117.73 1ws9 h GLU 293 Ca 0.13 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1ws9 h GLU 293 Cb 0.41 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1ws9 h GLU 293 CO 0.01 0.51 0.09 0.00 -1.00 0.00 0.00 179.01 178.62 1ws9 h ALA 294 N 0.95 0.38 -0.44 3.43 0.00 -1.21 -0.71 119.26 121.66 1ws9 h ALA 294 Ca 0.10 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1ws9 h ALA 294 Cb 0.22 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1ws9 h ALA 294 CO -0.01 0.02 0.26 0.00 0.00 0.00 0.00 179.25 179.52 1ws9 h ALA 295 N 0.92 0.56 -0.06 0.00 0.00 -1.31 0.11 119.26 119.48 1ws9 h ALA 295 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ws9 h ALA 295 Cb 0.25 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1ws9 h ALA 295 CO -0.00 -0.05 0.04 1.15 0.00 0.00 0.00 179.25 180.38 1ws9 h THR 296 N 0.53 1.02 -0.55 0.00 2.02 -1.21 -1.49 112.91 113.23 1ws9 h THR 296 Ca 0.18 -0.04 -0.10 0.00 0.77 0.00 0.00 66.41 67.22 1ws9 h THR 296 Cb 0.01 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1ws9 h THR 296 CO -0.08 0.02 -0.06 -0.33 0.37 0.00 0.00 175.52 175.44 1ws9 h GLU 297 N 0.08 1.00 -0.05 6.66 5.08 -0.85 -1.63 114.58 124.87 1ws9 h GLU 297 Ca 0.02 -0.35 -0.16 0.00 -1.00 0.00 0.00 59.36 57.88 1ws9 h GLU 297 Cb -0.01 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1ws9 h GLU 297 CO -0.00 1.03 -0.67 -0.07 -1.00 0.00 0.00 179.01 178.30 1ws9 h LEU 298 N 0.88 0.25 -0.09 1.33 3.38 -0.70 0.34 115.31 120.70 1ws9 h LEU 298 Ca 0.15 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1ws9 h LEU 298 Cb 0.61 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1ws9 h LEU 298 CO 0.04 0.85 0.03 -0.08 0.09 0.00 0.00 178.44 179.37 1ws9 h GLU 299 N 0.15 0.07 -0.77 1.13 4.57 -1.16 0.39 114.58 118.97 1ws9 h GLU 299 Ca -0.01 -0.00 0.08 0.00 -1.18 0.00 0.00 59.36 58.24 1ws9 h GLU 299 Cb 1.20 -0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 29.70 1ws9 h GLU 299 CO 0.10 0.05 0.43 0.00 -1.18 0.00 0.00 179.01 178.41 1ws9 h ALA 300 N 1.05 1.06 -0.63 2.92 0.00 -1.00 0.29 119.26 122.96 1ws9 h ALA 300 Ca 0.04 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ws9 h ALA 300 Cb 0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1ws9 h ALA 300 CO -0.04 0.08 0.26 0.00 0.00 0.00 0.00 179.25 179.54 1ws9 h ALA 301 N 1.42 1.27 -0.51 0.00 0.00 0.77 -1.99 119.26 120.22 1ws9 h ALA 301 Ca 0.36 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1ws9 h ALA 301 Cb 0.30 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1ws9 h ALA 301 CO -0.23 0.54 -0.15 -0.09 0.00 0.00 0.00 179.25 179.32 1ws9 h ARG 302 N 0.90 1.00 -0.46 0.00 2.43 0.16 -2.62 114.38 115.79 1ws9 h ARG 302 Ca 0.21 -0.40 -0.06 0.00 -0.81 0.00 0.00 59.98 58.93 1ws9 h ARG 302 Cb 0.17 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1ws9 h ARG 302 CO -0.02 1.07 0.02 -0.07 -1.51 0.00 0.00 179.97 179.47 1ws9 h LEU 303 N 0.86 0.70 -0.38 3.80 3.38 -0.68 -1.69 115.31 121.30 1ws9 h LEU 303 Ca 0.12 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1ws9 h LEU 303 Cb 0.72 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1ws9 h LEU 303 CO 0.06 0.75 0.03 -0.07 0.09 0.00 0.00 178.44 179.30 1ws9 h LEU 304 N 0.69 0.63 -0.74 1.67 3.38 -1.17 -1.12 115.31 118.66 1ws9 h LEU 304 Ca 0.14 -0.29 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 1ws9 h LEU 304 Cb 0.39 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1ws9 h LEU 304 CO 0.01 0.76 -0.48 0.10 0.09 0.00 0.00 178.44 178.93 1ws9 h TYR 305 N 0.48 0.00 -0.47 1.13 -0.00 -1.33 -1.50 116.97 115.29 1ws9 h TYR 305 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 58.73 58.73 1ws9 h TYR 305 Cb 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.14 1ws9 h TYR 305 CO 0.03 0.48 -0.16 -0.07 -0.00 0.00 0.00 178.16 178.44 1ws9 h LEU 306 N 0.00 0.94 0.04 0.10 3.38 -1.14 -0.77 115.31 117.87 1ws9 h LEU 306 Ca -0.00 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.58 1ws9 h LEU 306 Cb 1.05 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1ws9 h LEU 306 CO 0.06 1.11 -0.02 0.50 0.09 0.00 0.00 178.44 180.18 1ws9 h LYS 307 N 0.77 -0.05 -0.41 1.13 3.64 -0.96 -0.36 116.57 120.33 1ws9 h LYS 307 Ca 0.11 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.55 1ws9 h LYS 307 Cb 0.72 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.50 1ws9 h LYS 307 CO 0.05 0.05 0.14 0.00 -2.27 0.00 0.00 179.45 177.43 1ws9 h ALA 308 N 0.80 0.48 -0.96 5.00 0.00 -1.17 -0.82 119.26 122.59 1ws9 h ALA 308 Ca -0.01 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ws9 h ALA 308 Cb 0.13 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1ws9 h ALA 308 CO 0.01 -0.25 0.63 0.00 0.00 0.00 0.00 179.25 179.64 1ws9 h ALA 309 N 1.27 1.30 -0.21 0.00 0.00 -1.00 -1.99 119.26 118.63 1ws9 h ALA 309 Ca 0.19 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ws9 h ALA 309 Cb 0.18 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1ws9 h ALA 309 CO -0.20 0.64 0.13 1.49 0.00 0.00 0.00 179.25 181.31 1ws9 h GLU 310 N 1.31 0.28 -0.79 0.00 4.57 -0.03 -0.63 114.58 119.29 1ws9 h GLU 310 Ca 0.35 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.51 1ws9 h GLU 310 Cb -0.14 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.35 1ws9 h GLU 310 CO -0.07 0.23 0.49 -0.07 -1.18 0.00 0.00 179.01 178.40 1ws9 h LEU 311 N 0.26 0.93 -0.37 1.64 3.38 -0.87 -1.95 115.31 118.32 1ws9 h LEU 311 Ca 0.08 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1ws9 h LEU 311 Cb 0.01 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1ws9 h LEU 311 CO -0.01 0.71 0.09 0.50 0.09 0.00 0.00 178.44 179.81 1ws9 h LYS 312 N 1.08 0.60 0.00 1.13 3.64 -1.03 -0.50 116.57 121.48 1ws9 h LYS 312 Ca 0.28 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1ws9 h LYS 312 Cb -0.07 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1ws9 h LYS 312 CO -0.06 0.64 -0.08 -0.44 -2.27 0.00 0.00 179.45 177.25 1ws9 h ASP 313 N 0.45 0.00 -0.42 4.20 3.32 -0.85 -0.73 116.42 122.40 1ws9 h ASP 313 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1ws9 h ASP 313 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1ws9 h ASP 313 CO 0.00 0.08 0.00 0.00 -1.72 0.00 0.00 179.24 177.60 1ws9 n ALA 314 N -2.27 2.43 -2.39 3.45 0.00 -0.76 -4.92 120.51 116.05 1ws9 n ALA 314 Ca -0.02 -0.74 -0.19 0.00 0.00 0.00 0.00 53.44 52.49 1ws9 n ALA 314 Cb 0.19 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.67 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 1.17 -0.43 3.69 0.00 0.00 -0.28 -5.00 105.19 104.34 1ws9 n GLY 315 Ca 0.14 -0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 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 -4.99 2.46 0.27 1.61 0.52 -0.24 -5.03 118.95 113.54 1ws9 s ARG 316 Ca 0.01 -1.29 -0.30 0.00 -0.52 0.00 0.00 55.73 53.63 1ws9 s ARG 316 Cb -0.01 -2.28 -0.13 0.00 0.52 0.00 0.00 34.95 33.05 1ws9 s ARG 316 CO 0.02 0.39 1.42 -2.30 0.02 0.00 0.00 175.30 174.85 1ws9 n PRO 317 N -0.85 2.18 -0.24 3.54 -0.02 -1.26 -4.20 135.00 134.15 1ws9 n PRO 317 Ca -0.07 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1ws9 n PRO 317 Cb 0.58 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1ws9 n PRO 317 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1ws9 n PHE 318 N 1.65 0.00 0.03 6.00 1.16 -1.26 -4.86 117.46 120.18 1ws9 n PHE 318 Ca 0.10 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.57 1ws9 n PHE 318 Cb 0.33 0.03 -0.04 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 4.72 0.58 -0.22 1.97 2.02 -1.94 0.27 112.91 120.31 1ws9 h THR 319 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1ws9 h THR 319 Cb 1.15 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1ws9 h THR 319 CO 0.00 0.00 0.12 0.25 0.37 0.00 0.00 175.52 176.26 1ws9 h LEU 320 N -0.24 0.28 -1.11 2.58 5.85 -1.93 -2.26 115.31 118.48 1ws9 h LEU 320 Ca 0.07 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 1ws9 h LEU 320 Cb 0.34 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1ws9 h LEU 320 CO -0.20 0.29 -0.00 -0.33 -0.34 0.00 0.00 178.44 177.85 1ws9 h GLU 321 N 0.24 0.62 -0.11 1.25 3.07 -1.84 -1.08 114.58 116.73 1ws9 h GLU 321 Ca 0.08 -0.15 -0.15 0.00 -0.50 0.00 0.00 59.36 58.64 1ws9 h GLU 321 Cb 0.08 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 1ws9 h GLU 321 CO -0.01 0.65 -0.59 0.00 -1.40 0.00 0.00 179.01 177.66 1ws9 h ALA 322 N 1.41 0.79 -0.23 3.43 0.00 -0.38 -1.30 119.26 122.98 1ws9 h ALA 322 Ca 0.12 -0.53 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 1ws9 h ALA 322 Cb 0.38 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1ws9 h ALA 322 CO 0.01 0.71 -0.10 0.00 0.00 0.00 0.00 179.25 179.87 1ws9 h ALA 323 N 1.10 0.32 -0.57 0.00 0.00 -1.01 -1.66 119.26 117.44 1ws9 h ALA 323 Ca -0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1ws9 h ALA 323 Cb 1.11 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1ws9 h ALA 323 CO 0.10 0.16 0.20 1.96 0.00 0.00 0.00 179.25 181.68 1ws9 h GLN 324 N 0.20 0.86 -0.29 0.00 4.20 -1.12 0.69 115.11 119.65 1ws9 h GLN 324 Ca 0.05 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 1ws9 h GLN 324 Cb 0.59 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 1ws9 h GLN 324 CO 0.03 0.76 0.13 0.00 -0.67 0.00 0.00 178.83 179.08 1ws9 h ALA 325 N 1.06 0.37 -0.29 3.87 0.00 -1.19 -0.78 119.26 122.30 1ws9 h ALA 325 Ca 0.19 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1ws9 h ALA 325 Cb 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ws9 h ALA 325 CO -0.01 -0.05 0.03 -0.22 0.00 0.00 0.00 179.25 179.00 1ws9 h LYS 326 N 0.33 0.49 0.10 0.00 3.11 -1.17 -0.09 116.57 119.34 1ws9 h LYS 326 Ca 0.10 -0.14 0.00 0.00 -2.81 0.00 0.00 60.65 57.80 1ws9 h LYS 326 Cb 0.15 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.32 1ws9 h LYS 326 CO -0.01 0.61 -0.08 1.25 -2.81 0.00 0.00 179.45 178.41 1ws9 h LEU 327 N 0.30 -0.21 -0.19 5.20 5.85 -0.77 -1.32 115.31 124.17 1ws9 h LEU 327 Ca 0.09 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.76 1ws9 h LEU 327 Cb 0.37 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 1ws9 h LEU 327 CO 0.01 -0.13 -0.13 0.15 -0.34 0.00 0.00 178.44 178.00 1ws9 h PHE 328 N -0.19 0.50 -0.08 1.25 3.04 -1.11 -2.35 116.94 118.00 1ws9 h PHE 328 Ca -0.00 -0.14 0.01 0.00 3.98 0.00 0.00 57.97 61.82 1ws9 h PHE 328 Cb 0.18 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.57 1ws9 h PHE 328 CO -0.10 0.75 0.03 0.00 -2.02 0.00 0.00 178.31 176.97 1ws9 h ALA 329 N 0.67 0.08 -0.14 2.41 0.00 -1.00 0.67 119.26 121.95 1ws9 h ALA 329 Ca 0.04 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ws9 h ALA 329 Cb 0.64 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1ws9 h ALA 329 CO 0.04 -0.44 0.08 0.66 0.00 0.00 0.00 179.25 179.59 1ws9 h SER 330 N 0.07 0.18 -0.28 0.00 4.64 -1.29 0.17 113.55 117.04 1ws9 h SER 330 Ca 0.03 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1ws9 h SER 330 Cb 0.01 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 1ws9 h SER 330 CO -0.03 0.19 0.14 -0.33 -0.87 0.00 0.00 176.83 175.93 1ws9 h GLU 331 N 0.15 0.40 -0.51 4.77 4.39 -1.33 -1.72 114.58 120.73 1ws9 h GLU 331 Ca 0.05 -0.06 -0.08 0.00 0.34 0.00 0.00 59.36 59.61 1ws9 h GLU 331 Cb 0.05 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 1ws9 h GLU 331 CO -0.01 0.38 -0.01 0.00 -1.16 0.00 0.00 179.01 178.21 1ws9 h ALA 332 N 1.00 0.69 -0.23 3.43 0.00 -0.76 -2.56 119.26 120.82 1ws9 h ALA 332 Ca 0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1ws9 h ALA 332 Cb 0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1ws9 h ALA 332 CO -0.01 0.51 0.12 0.00 0.00 0.00 0.00 179.25 179.86 1ws9 h ALA 333 N 0.93 0.30 -0.60 0.00 0.00 -0.58 0.06 119.26 119.36 1ws9 h ALA 333 Ca 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ws9 h ALA 333 Cb 0.54 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1ws9 h ALA 333 CO 0.03 -0.15 0.36 0.28 0.00 0.00 0.00 179.25 179.76 1ws9 h VAL 334 N 0.25 1.18 -0.46 0.00 2.07 -1.30 0.66 116.25 118.65 1ws9 h VAL 334 Ca 0.08 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 1ws9 h VAL 334 Cb 0.10 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1ws9 h VAL 334 CO -0.01 0.19 0.23 0.50 0.02 0.00 0.00 177.57 178.50 1ws9 h LYS 335 N 0.82 0.65 -0.69 1.57 3.64 -1.26 0.42 116.57 121.73 1ws9 h LYS 335 Ca 0.22 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1ws9 h LYS 335 Cb -0.00 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.66 1ws9 h LYS 335 CO -0.04 0.55 0.40 0.00 -2.27 0.00 0.00 179.45 178.09 1ws9 h ALA 336 N 1.07 0.88 -0.37 5.00 0.00 -0.57 0.54 119.26 125.80 1ws9 h ALA 336 Ca 0.16 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1ws9 h ALA 336 Cb 0.10 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1ws9 h ALA 336 CO -0.02 0.36 -0.04 0.00 0.00 0.00 0.00 179.25 179.55 1ws9 h ASP 338 N 0.57 0.97 -0.55 0.00 -0.00 -0.01 -2.63 116.42 114.77 1ws9 h ASP 338 Ca 0.11 -0.43 -0.06 0.00 -0.00 0.00 0.00 57.03 56.65 1ws9 h ASP 338 Cb 0.42 -0.27 -0.03 0.00 -0.00 0.00 0.00 39.33 39.45 1ws9 h ASP 338 CO 0.02 1.20 0.12 -0.33 -0.00 0.00 0.00 179.24 180.25 1ws9 h GLU 339 N 0.75 0.94 -0.45 0.28 4.39 -0.60 -2.20 114.58 117.70 1ws9 h GLU 339 Ca 0.08 -0.22 -0.03 0.00 0.34 0.00 0.00 59.36 59.54 1ws9 h GLU 339 Cb 0.87 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.37 1ws9 h GLU 339 CO 0.08 0.85 0.15 0.00 -1.16 0.00 0.00 179.01 178.93 1ws9 h ALA 340 N 1.24 1.43 -0.27 3.43 0.00 -0.93 0.19 119.26 124.35 1ws9 h ALA 340 Ca 0.19 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1ws9 h ALA 340 Cb 0.35 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1ws9 h ALA 340 CO 0.00 0.43 0.01 0.82 0.00 0.00 0.00 179.25 180.51 1ws9 h ILE 341 N 0.64 1.25 -0.27 0.00 2.04 -1.10 -2.54 117.51 117.53 1ws9 h ILE 341 Ca 0.15 -0.88 0.01 0.00 1.00 0.00 0.00 64.86 65.15 1ws9 h ILE 341 Cb 0.17 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 1ws9 h ILE 341 CO -0.01 0.28 0.16 -0.61 0.00 0.00 0.00 178.15 177.97 1ws9 h GLN 342 N 0.25 0.32 0.00 2.37 5.75 -0.73 -2.51 115.11 120.56 1ws9 h GLN 342 Ca 0.08 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.55 1ws9 h GLN 342 Cb 0.39 -0.07 -0.00 0.00 1.07 0.00 0.00 27.48 28.87 1ws9 h GLN 342 CO 0.01 0.21 -0.03 0.82 -2.65 0.00 0.00 178.83 177.19 1ws9 h ILE 343 N 0.33 0.89 -0.00 2.39 2.04 -0.57 -1.09 117.51 121.49 1ws9 h ILE 343 Ca 0.11 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1ws9 h ILE 343 Cb -0.00 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1ws9 h ILE 343 CO -0.05 0.03 -0.23 0.18 0.00 0.00 0.00 178.15 178.08 1ws9 n LEU 344 N -4.30 0.57 0.00 1.44 4.32 -0.97 -4.93 117.00 113.14 1ws9 n LEU 344 Ca -0.03 -0.01 0.00 0.00 -0.02 0.00 0.00 56.01 55.95 1ws9 n LEU 344 Cb 0.12 -0.22 0.00 0.00 -1.62 0.00 0.00 43.42 41.70 1ws9 n LEU 344 CO 0.33 0.12 0.00 0.61 -1.22 0.00 0.00 177.39 177.22 1ws9 n GLY 345 N 1.38 2.96 0.34 -0.72 0.00 -0.42 -2.33 105.19 106.41 1ws9 n GLY 345 Ca 0.11 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 45.95 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 0.39 2.00 -0.02 0.00 -1.89 -0.85 103.07 102.70 1ws9 h GLY 346 Ca 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 1ws9 h GLY 346 CO 0.00 0.08 -0.03 -0.97 0.00 0.00 0.00 176.54 175.62 1ws9 h TYR 347 N 0.29 0.00 0.00 5.60 -1.99 -1.81 -1.70 116.97 117.35 1ws9 h TYR 347 Ca 0.23 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.96 1ws9 h TYR 347 Cb 0.52 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.25 1ws9 h TYR 347 CO -0.00 0.03 0.00 0.78 -0.00 0.00 0.00 178.16 178.97 1ws9 h GLY 348 N 1.78 0.00 0.59 3.88 0.00 -1.21 -2.95 103.07 105.15 1ws9 h GLY 348 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ws9 h GLY 348 CO 0.00 0.00 -0.28 2.98 0.00 0.00 0.00 176.54 179.25 1ws9 n TYR 349 N -3.07 0.00 -4.22 5.60 9.36 -0.64 -3.95 117.16 120.24 1ws9 n TYR 349 Ca 0.03 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 60.92 1ws9 n TYR 349 Cb 0.44 -0.17 -0.08 0.00 -0.63 0.00 0.00 39.34 38.89 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 -2.63 4.40 -1.79 2.97 -7.23 -1.11 -5.01 120.40 110.00 1ws9 s VAL 350 Ca 0.22 -0.48 0.21 0.00 -1.81 0.00 0.00 61.98 60.12 1ws9 s VAL 350 Cb 0.19 -2.97 0.52 0.00 0.56 0.00 0.00 36.38 34.68 1ws9 s VAL 350 CO 0.55 0.39 1.66 0.29 -0.31 0.00 0.00 175.10 177.69 1ws9 n LYS 351 N 1.40 0.53 0.17 4.82 5.02 -1.26 -2.81 118.16 126.04 1ws9 n LYS 351 Ca -0.15 0.03 0.13 0.00 -2.02 0.00 0.00 58.31 56.31 1ws9 n LYS 351 Cb 0.53 -1.50 0.46 0.00 -0.02 0.00 0.00 35.03 34.50 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 -3.60 4.39 3.32 -1.95 -3.42 116.42 115.16 1ws9 h ASP 352 Ca 0.00 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.38 1ws9 h ASP 352 Cb 0.07 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.46 1ws9 h ASP 352 CO 0.00 0.00 -0.72 -0.31 -1.72 0.00 0.00 179.24 176.49 1ws9 s TYR 353 N -3.32 2.80 -0.72 4.55 2.02 -1.12 -5.06 117.35 116.50 1ws9 s TYR 353 Ca 0.06 -0.11 0.25 0.00 -0.37 0.00 0.00 57.07 56.90 1ws9 s TYR 353 Cb 0.09 -1.51 0.90 0.00 -0.40 0.00 0.00 41.96 41.04 1ws9 s TYR 353 CO 0.53 0.39 1.77 -0.35 -1.57 0.00 0.00 175.55 176.32 1ws9 n PRO 354 N 1.09 0.20 -0.14 -1.71 -0.04 -1.26 -4.30 135.00 128.84 1ws9 n PRO 354 Ca -0.14 0.24 0.01 0.00 -0.04 0.00 0.00 63.50 63.57 1ws9 n PRO 354 Cb 0.52 -1.76 0.29 0.00 -0.04 0.00 0.00 33.50 32.51 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 0.00 1.17 0.00 0.52 -1.51 -1.90 -1.41 116.25 113.12 1ws9 h VAL 355 Ca 0.00 -0.37 -0.05 0.00 -1.23 0.00 0.00 66.70 65.04 1ws9 h VAL 355 Cb 0.59 0.30 -0.01 0.00 -2.13 0.00 0.00 31.29 30.04 1ws9 h VAL 355 CO 0.00 0.18 -0.26 1.05 -1.23 0.00 0.00 177.57 177.31 1ws9 h GLU 356 N 0.84 0.00 -0.05 5.19 -0.00 -1.75 -2.58 114.58 116.23 1ws9 h GLU 356 Ca 0.22 0.00 -0.21 0.00 -0.00 0.00 0.00 59.36 59.38 1ws9 h GLU 356 Cb -0.04 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 28.72 1ws9 h GLU 356 CO -0.04 0.26 -0.78 -0.09 -0.00 0.00 0.00 179.01 178.36 1ws9 h ARG 357 N 0.00 0.61 -0.58 1.06 2.43 -1.56 -2.50 114.38 113.85 1ws9 h ARG 357 Ca -0.00 -0.59 0.09 0.00 -0.81 0.00 0.00 59.98 58.66 1ws9 h ARG 357 Cb 0.60 0.15 -0.07 0.00 -0.42 0.00 0.00 29.97 30.23 1ws9 h ARG 357 CO 0.03 1.21 0.19 1.88 -1.51 0.00 0.00 179.97 181.77 1ws9 h TYR 358 N 0.24 0.33 0.19 2.20 0.05 -0.99 0.21 116.97 119.21 1ws9 h TYR 358 Ca -0.08 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.72 1ws9 h TYR 358 Cb 1.44 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 39.12 1ws9 h TYR 358 CO 0.11 0.07 -0.09 2.35 -1.05 0.00 0.00 178.16 179.55 1ws9 h TRP 359 N 0.36 -0.23 -0.88 4.88 7.01 -1.49 0.12 115.95 125.71 1ws9 h TRP 359 Ca 0.29 -0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.39 1ws9 h TRP 359 Cb 0.37 0.08 -0.06 0.00 -2.10 0.00 0.00 29.16 27.44 1ws9 h TRP 359 CO -0.18 -0.04 0.57 0.00 -2.79 0.00 0.00 178.44 175.99 1ws9 h ARG 360 N -0.38 0.84 -0.02 2.65 3.08 -0.91 0.24 114.38 119.87 1ws9 h ARG 360 Ca -0.03 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 1ws9 h ARG 360 Cb 0.29 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1ws9 h ARG 360 CO 0.04 0.55 -0.10 -0.44 -1.07 0.00 0.00 179.97 178.95 1ws9 h ASP 361 N 0.86 0.13 0.37 7.04 3.32 -0.42 -3.28 116.42 124.43 1ws9 h ASP 361 Ca 0.41 -0.65 -0.05 0.00 0.02 0.00 0.00 57.03 56.77 1ws9 h ASP 361 Cb 0.43 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1ws9 h ASP 361 CO -0.18 0.76 -0.23 0.00 -1.72 0.00 0.00 179.24 177.88 1ws9 h ALA 362 N 0.38 1.39 -0.66 3.45 0.00 -0.31 -3.13 119.26 120.39 1ws9 h ALA 362 Ca -0.01 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 54.89 1ws9 h ALA 362 Cb 0.76 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1ws9 h ALA 362 CO 0.02 0.28 0.47 -0.09 0.00 0.00 0.00 179.25 179.94 1ws9 h ARG 363 N 0.00 0.01 0.00 0.00 9.65 -0.59 -0.39 114.38 123.05 1ws9 h ARG 363 Ca -0.00 -0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.82 1ws9 h ARG 363 Cb 0.47 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.04 1ws9 h ARG 363 CO 0.03 0.00 -0.26 1.25 2.80 0.00 0.00 179.97 183.80 1ws9 h LEU 364 N 0.01 0.00 -2.37 3.80 5.85 -1.73 -3.13 115.31 117.73 1ws9 h LEU 364 Ca 0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.03 1ws9 h LEU 364 Cb 1.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1ws9 h LEU 364 CO -0.00 0.26 0.00 0.71 -0.34 0.00 0.00 178.44 179.06 1ws9 h THR 365 N 0.00 0.00 -0.01 1.05 1.35 -1.27 0.91 112.91 114.94 1ws9 h THR 365 Ca -0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1ws9 h THR 365 Cb 0.81 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 1ws9 h THR 365 CO 0.03 0.00 -0.28 0.54 -0.25 0.00 0.00 175.52 175.56 1ws9 n ARG 366 N -2.87 0.61 -0.03 4.72 1.74 -1.18 -4.45 116.66 115.20 1ws9 n ARG 366 Ca -0.02 -0.33 -0.06 0.00 -0.77 0.00 0.00 57.85 56.67 1ws9 n ARG 366 Cb 0.10 -1.49 -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 -0.90 0.33 -2.10 0.55 5.41 0.12 -2.00 119.36 120.76 1ws9 n ILE 367 Ca 0.11 -0.09 -0.37 0.00 1.00 0.00 0.00 62.75 63.40 1ws9 n ILE 367 Cb 0.33 -1.42 0.01 0.00 -0.71 0.00 0.00 39.64 37.85 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 -5.01 2.77 -1.38 7.39 0.00 -0.08 -2.98 107.32 108.03 1ws9 s GLY 368 Ca -0.08 1.02 -0.07 0.00 0.00 0.00 0.00 44.72 45.59 1ws9 s GLY 368 CO 0.11 1.46 0.97 1.18 0.00 0.00 0.00 173.10 176.83 1ws9 n GLU 369 N -0.97 -6.21 -0.06 2.90 1.02 -1.26 -4.62 120.64 111.43 1ws9 n GLU 369 Ca 0.10 0.70 0.00 0.00 -0.02 0.00 0.00 57.16 57.94 1ws9 n GLU 369 Cb 0.48 -5.58 0.00 0.00 -0.02 0.00 0.00 31.44 26.32 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 -1.67 0.51 3.62 0.62 0.00 -1.24 -4.89 105.19 102.15 1ws9 n GLY 370 Ca -0.10 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.65 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 2.15 0.34 2.61 -4.23 -1.16 -4.65 115.64 110.70 1ws9 s THR 371 Ca 0.00 0.05 0.05 0.00 -1.18 0.00 0.00 61.69 60.60 1ws9 s THR 371 Cb 0.00 -2.12 0.29 0.00 1.34 0.00 0.00 72.50 72.01 1ws9 s THR 371 CO 0.00 -0.06 1.93 0.28 -0.54 0.00 0.00 174.62 176.23 1ws9 h SER 372 N -2.06 0.74 -0.20 3.99 0.02 -1.72 -0.32 113.55 114.00 1ws9 h SER 372 Ca -0.49 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.46 1ws9 h SER 372 Cb 1.29 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.67 1ws9 h SER 372 CO 0.45 0.46 0.08 -0.33 -1.14 0.00 0.00 176.83 176.35 1ws9 h GLU 373 N 0.83 0.31 -0.61 3.45 3.07 -1.90 -1.78 114.58 117.96 1ws9 h GLU 373 Ca 0.36 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 59.16 1ws9 h GLU 373 Cb 0.31 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.14 1ws9 h GLU 373 CO -0.13 0.38 0.37 0.82 -1.40 0.00 0.00 179.01 179.05 1ws9 h ILE 374 N 0.17 1.18 -0.56 3.13 1.08 -1.67 -2.47 117.51 118.37 1ws9 h ILE 374 Ca 0.07 -0.39 -0.02 0.00 -0.39 0.00 0.00 64.86 64.13 1ws9 h ILE 374 Cb 0.19 0.34 -0.03 0.00 -3.07 0.00 0.00 36.82 34.25 1ws9 h ILE 374 CO -0.00 0.18 0.26 -0.07 -0.69 0.00 0.00 178.15 177.83 1ws9 h LEU 375 N 0.82 0.71 -1.00 1.44 3.38 -0.90 -1.49 115.31 118.28 1ws9 h LEU 375 Ca 0.22 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 1ws9 h LEU 375 Cb -0.03 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1ws9 h LEU 375 CO -0.04 0.62 -0.11 0.11 0.09 0.00 0.00 178.44 179.11 1ws9 h LYS 376 N 0.79 0.60 -0.10 1.13 1.57 -0.88 0.14 116.57 119.82 1ws9 h LYS 376 Ca 0.20 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1ws9 h LYS 376 Cb 0.10 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 1ws9 h LYS 376 CO -0.02 0.70 0.01 -0.07 -0.57 0.00 0.00 179.45 179.50 1ws9 h LEU 377 N 0.55 0.17 -0.50 2.94 3.38 -1.02 0.41 115.31 121.24 1ws9 h LEU 377 Ca 0.10 -0.29 0.04 0.00 0.09 0.00 0.00 57.88 57.83 1ws9 h LEU 377 Cb 0.52 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1ws9 h LEU 377 CO 0.03 0.42 0.25 0.58 0.09 0.00 0.00 178.44 179.81 1ws9 h VAL 378 N -0.08 0.96 -0.07 1.22 2.07 -0.96 -0.21 116.25 119.18 1ws9 h VAL 378 Ca 0.03 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1ws9 h VAL 378 Cb 0.32 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1ws9 h VAL 378 CO 0.00 0.09 0.02 0.40 0.02 0.00 0.00 177.57 178.10 1ws9 h ILE 379 N 0.49 1.19 -0.32 4.57 2.04 -0.63 -2.69 117.51 122.16 1ws9 h ILE 379 Ca 0.22 -0.56 0.01 0.00 1.00 0.00 0.00 64.86 65.53 1ws9 h ILE 379 Cb 0.13 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 1ws9 h ILE 379 CO -0.15 0.16 0.19 0.00 0.00 0.00 0.00 178.15 178.35 1ws9 h ALA 380 N 0.81 0.40 -0.39 1.87 0.00 -0.69 -1.46 119.26 119.81 1ws9 h ALA 380 Ca 0.02 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1ws9 h ALA 380 Cb 0.23 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 1ws9 h ALA 380 CO -0.00 -0.16 0.12 -0.09 0.00 0.00 0.00 179.25 179.12 1ws9 h ARG 381 N 0.40 0.26 -0.67 0.00 2.43 -1.03 0.19 114.38 115.95 1ws9 h ARG 381 Ca 0.13 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.24 1ws9 h ARG 381 Cb -0.01 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 1ws9 h ARG 381 CO -0.05 0.17 0.26 -0.09 -1.51 0.00 0.00 179.97 178.75 1ws9 h ARG 382 N 0.27 0.99 -0.49 0.20 9.65 -1.21 -0.23 114.38 123.56 1ws9 h ARG 382 Ca 0.18 -0.17 -0.11 0.00 -1.10 0.00 0.00 59.98 58.78 1ws9 h ARG 382 Cb 0.18 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.57 1ws9 h ARG 382 CO -0.20 0.81 -0.14 -0.07 2.80 0.00 0.00 179.97 183.18 1ws9 h LEU 383 N 0.97 0.97 -0.87 3.80 3.38 -0.53 -2.68 115.31 120.35 1ws9 h LEU 383 Ca 0.23 -0.37 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 1ws9 h LEU 383 Cb 0.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1ws9 h LEU 383 CO -0.02 1.11 -0.23 -0.07 0.09 0.00 0.00 178.44 179.32 1ws9 h LEU 384 N 0.81 0.58 -1.03 1.67 3.38 -0.18 -2.84 115.31 117.71 1ws9 h LEU 384 Ca 0.12 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 1ws9 h LEU 384 Cb 0.70 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1ws9 h LEU 384 CO 0.05 0.81 -0.29 -0.33 0.09 0.00 0.00 178.44 178.77 1ws9 h GLU 385 N 0.51 0.34 -0.08 1.13 5.08 -0.95 -2.28 114.58 118.34 1ws9 h GLU 385 Ca 0.08 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1ws9 h GLU 385 Cb 0.67 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1ws9 h GLU 385 CO 0.05 0.60 0.00 0.00 -1.00 0.00 0.00 179.01 178.66 1ws9 n ALA 386 N -2.48 2.57 1.57 3.43 0.00 -1.02 -5.11 120.51 119.47 1ws9 n ALA 386 Ca -0.01 -0.36 0.14 0.00 0.00 0.00 0.00 53.44 53.21 1ws9 n ALA 386 Cb 0.41 -1.20 0.58 0.00 0.00 0.00 0.00 19.45 19.24 1ws9 n ALA 386 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78