#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wm9 h ASP 34 N 0.00 0.77 -0.96 4.52 3.04 -2.04 -2.94 116.42 118.82 1wm9 h ASP 34 Ca 0.00 -0.35 0.06 0.00 -3.24 0.00 0.00 57.03 53.50 1wm9 h ASP 34 Cb 0.00 -0.21 -0.06 0.00 -1.04 0.00 0.00 39.33 38.01 1wm9 h ASP 34 CO 0.00 0.94 0.61 -0.07 -2.04 0.00 0.00 179.24 178.68 1wm9 h LEU 35 N 0.59 0.98 -0.52 0.15 3.38 -1.99 0.69 115.31 118.60 1wm9 h LEU 35 Ca 0.11 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 1wm9 h LEU 35 Cb 0.58 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1wm9 h LEU 35 CO 0.03 0.63 -0.20 -0.33 0.09 0.00 0.00 178.44 178.66 1wm9 h GLU 36 N 1.12 0.99 -0.44 1.13 4.39 -1.99 -0.52 114.58 119.27 1wm9 h GLU 36 Ca 0.41 -0.42 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1wm9 h GLU 36 Cb 0.16 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 1wm9 h GLU 36 CO -0.17 1.09 0.12 -0.09 -1.16 0.00 0.00 179.01 178.80 1wm9 h ARG 37 N 0.86 0.70 -0.73 2.33 2.43 -1.17 -1.96 114.38 116.84 1wm9 h ARG 37 Ca 0.11 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1wm9 h ARG 37 Cb 0.78 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.20 1wm9 h ARG 37 CO 0.06 0.69 0.39 -0.07 -1.51 0.00 0.00 179.97 179.54 1wm9 h LEU 38 N 0.58 0.93 -0.40 3.80 3.38 -0.72 -1.80 115.31 121.08 1wm9 h LEU 38 Ca 0.14 -0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.06 1wm9 h LEU 38 Cb 0.30 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1wm9 h LEU 38 CO -0.00 0.77 0.10 1.56 0.09 0.00 0.00 178.44 180.96 1wm9 h GLN 39 N 1.02 0.22 -0.40 1.13 4.20 -0.72 0.96 115.11 121.53 1wm9 h GLN 39 Ca 0.26 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.93 1wm9 h GLN 39 Cb 0.06 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 1wm9 h GLN 39 CO -0.04 0.15 0.16 0.00 -0.67 0.00 0.00 178.83 178.43 1wm9 h ALA 40 N 1.30 0.53 -0.49 3.87 0.00 -1.03 -0.84 119.26 122.59 1wm9 h ALA 40 Ca 0.19 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1wm9 h ALA 40 Cb 0.22 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1wm9 h ALA 40 CO -0.24 0.13 0.30 -0.07 0.00 0.00 0.00 179.25 179.37 1wm9 h LEU 41 N 0.51 0.58 -0.95 0.00 3.38 -0.85 -1.94 115.31 116.05 1wm9 h LEU 41 Ca 0.13 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1wm9 h LEU 41 Cb 0.19 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1wm9 h LEU 41 CO -0.01 0.46 0.50 0.00 0.09 0.00 0.00 178.44 179.48 1wm9 h ALA 42 N 1.15 1.20 -0.79 1.53 0.00 -0.59 -0.17 119.26 121.58 1wm9 h ALA 42 Ca 0.18 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1wm9 h ALA 42 Cb -0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.37 1wm9 h ALA 42 CO -0.03 0.66 0.37 0.00 0.00 0.00 0.00 179.25 180.24 1wm9 h ALA 43 N 1.30 1.02 -0.03 0.00 0.00 -0.72 -2.07 119.26 118.75 1wm9 h ALA 43 Ca 0.32 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 1wm9 h ALA 43 Cb 0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1wm9 h ALA 43 CO -0.05 0.60 -0.75 1.49 0.00 0.00 0.00 179.25 180.53 1wm9 h GLU 44 N 1.12 0.21 -0.52 0.00 4.81 -0.86 -3.07 114.58 116.28 1wm9 h GLU 44 Ca 0.27 -0.18 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1wm9 h GLU 44 Cb 0.14 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 1wm9 h GLU 44 CO -0.03 0.86 0.32 2.35 -0.73 0.00 0.00 179.01 181.78 1wm9 h TRP 45 N 0.13 0.60 -0.83 0.92 2.91 -0.66 -1.26 115.95 117.76 1wm9 h TRP 45 Ca -0.03 0.02 0.08 0.00 1.13 0.00 0.00 58.89 60.09 1wm9 h TRP 45 Cb 1.32 -0.20 -0.07 0.00 -0.51 0.00 0.00 29.16 29.71 1wm9 h TRP 45 CO 0.02 0.35 0.49 -0.07 -1.03 0.00 0.00 178.44 178.21 1wm9 h LEU 46 N 0.64 0.74 -0.18 0.65 3.38 -1.29 -2.40 115.31 116.85 1wm9 h LEU 46 Ca 0.21 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 1wm9 h LEU 46 Cb -0.00 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1wm9 h LEU 46 CO -0.08 0.44 -0.18 1.56 0.09 0.00 0.00 178.44 180.28 1wm9 h GLN 47 N 0.86 0.44 -0.22 1.13 4.20 -1.37 0.18 115.11 120.32 1wm9 h GLN 47 Ca 0.39 -0.23 0.02 0.00 0.06 0.00 0.00 58.65 58.89 1wm9 h GLN 47 Cb 0.29 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1wm9 h GLN 47 CO -0.22 0.80 0.15 0.28 -0.67 0.00 0.00 178.83 179.17 1wm9 h VAL 48 N 0.09 1.00 -0.01 -0.54 2.07 -0.94 -1.07 116.25 116.85 1wm9 h VAL 48 Ca 0.03 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1wm9 h VAL 48 Cb 0.71 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1wm9 h VAL 48 CO 0.04 0.04 -0.09 2.30 0.02 0.00 0.00 177.57 179.88 1wm9 n ILE 49 N -4.50 0.00 0.00 4.57 -5.35 -0.93 -4.92 119.36 108.23 1wm9 n ILE 49 Ca 0.01 -0.10 0.00 0.00 -0.27 0.00 0.00 62.75 62.39 1wm9 n ILE 49 Cb 0.15 0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.10 1wm9 n ILE 49 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1wm9 n GLY 50 N 1.23 0.79 3.97 3.28 0.00 -0.40 -5.11 105.19 108.96 1wm9 n GLY 50 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 1wm9 n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wm9 s GLU 51 N -0.83 1.82 -0.31 1.61 0.41 0.05 -5.00 118.70 116.45 1wm9 s GLU 51 Ca 0.00 -0.83 0.03 0.00 -0.41 0.00 0.00 54.97 53.76 1wm9 s GLU 51 Cb 0.00 -2.28 0.09 0.00 -1.78 0.00 0.00 34.13 30.16 1wm9 s GLU 51 CO 0.00 -1.37 0.02 0.34 -0.49 0.00 0.00 175.26 173.75 1wm9 s ASP 52 N -4.66 4.50 0.25 -0.19 2.15 -1.26 -4.14 116.67 113.33 1wm9 s ASP 52 Ca 0.64 -1.83 0.15 0.00 0.43 0.00 0.00 52.55 51.94 1wm9 s ASP 52 Cb -0.07 -1.46 0.83 0.00 -0.30 0.00 0.00 42.92 41.93 1wm9 s ASP 52 CO 0.44 -0.33 1.44 -2.65 -0.17 0.00 0.00 175.17 173.90 1wm9 n PRO 53 N 4.42 0.10 0.13 4.34 -0.02 -1.26 -1.76 135.00 140.94 1wm9 n PRO 53 Ca -0.02 0.59 0.12 0.00 -2.02 0.00 0.00 63.50 62.16 1wm9 n PRO 53 Cb 0.42 -1.89 0.09 0.00 -0.02 0.00 0.00 33.50 32.10 1wm9 n PRO 53 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1wm9 h GLY 54 N 0.00 0.00 -2.21 -1.23 0.00 -1.93 -3.33 103.07 94.37 1wm9 h GLY 54 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 1wm9 h GLY 54 CO 0.00 0.00 0.44 1.09 0.00 0.00 0.00 176.54 178.07 1wm9 s ARG 55 N -3.28 3.48 0.26 4.80 1.70 -0.72 -4.79 118.95 120.39 1wm9 s ARG 55 Ca 0.03 1.62 -0.06 0.00 -0.47 0.00 0.00 55.73 56.85 1wm9 s ARG 55 Cb 0.09 -2.09 0.49 0.00 -0.57 0.00 0.00 34.95 32.86 1wm9 s ARG 55 CO 0.74 -0.75 1.62 1.49 -1.08 0.00 0.00 175.30 177.32 1wm9 h GLU 56 N 1.40 0.07 0.00 3.89 4.81 -1.90 -0.96 114.58 121.88 1wm9 h GLU 56 Ca -0.50 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1wm9 h GLU 56 Cb 1.26 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1wm9 h GLU 56 CO 0.58 0.05 0.00 0.41 -0.73 0.00 0.00 179.01 179.31 1wm9 n GLY 57 N -1.46 -1.07 0.11 1.92 0.00 -1.26 -2.91 105.19 100.52 1wm9 n GLY 57 Ca 0.15 0.13 0.04 0.00 0.00 0.00 0.00 46.02 46.34 1wm9 n GLY 57 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wm9 n LEU 58 N -2.20 0.81 -0.22 0.99 4.77 -0.41 -4.75 117.00 115.98 1wm9 n LEU 58 Ca 0.01 -0.66 -0.07 0.00 -0.03 0.00 0.00 56.01 55.26 1wm9 n LEU 58 Cb 0.14 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.17 1wm9 n LEU 58 CO 0.15 0.17 0.49 -0.07 -1.33 0.00 0.00 177.39 176.80 1wm9 h LEU 59 N 0.55 -1.23 -1.29 2.23 3.38 -1.31 -1.11 115.31 116.53 1wm9 h LEU 59 Ca 0.00 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1wm9 h LEU 59 Cb 0.25 0.54 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1wm9 h LEU 59 CO 0.00 -0.15 0.00 0.29 0.09 0.00 0.00 178.44 178.67 1wm9 n LYS 60 N -4.29 1.82 -0.05 1.13 5.02 -1.26 -4.46 118.16 116.06 1wm9 n LYS 60 Ca 0.01 -1.26 -0.09 0.00 -2.02 0.00 0.00 58.31 54.94 1wm9 n LYS 60 Cb 0.16 -1.32 -0.03 0.00 -0.02 0.00 0.00 35.03 33.82 1wm9 n LYS 60 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1wm9 h THR 61 N 2.18 1.01 -0.90 -0.18 2.02 -1.49 -0.80 112.91 114.76 1wm9 h THR 61 Ca 0.00 -0.08 0.11 0.00 0.77 0.00 0.00 66.41 67.21 1wm9 h THR 61 Cb 0.49 0.76 -0.07 0.00 -1.74 0.00 0.00 68.15 67.59 1wm9 h THR 61 CO 0.00 0.04 0.58 -0.65 0.37 0.00 0.00 175.52 175.86 1wm9 h PRO 62 N 0.23 0.82 -0.17 6.66 0.11 -1.78 0.15 132.00 138.03 1wm9 h PRO 62 Ca 0.08 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.07 1wm9 h PRO 62 Cb 0.01 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 30.93 1wm9 h PRO 62 CO -0.05 0.54 -0.19 1.49 -0.21 0.00 0.00 178.00 179.59 1wm9 h GLU 63 N 0.85 0.42 -0.81 1.05 4.81 -1.80 -2.17 114.58 116.93 1wm9 h GLU 63 Ca 0.43 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1wm9 h GLU 63 Cb 0.48 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 1wm9 h GLU 63 CO -0.19 0.80 0.47 0.00 -0.73 0.00 0.00 179.01 179.37 1wm9 h ARG 64 N 0.06 1.11 -0.55 1.92 3.08 -0.39 -2.38 114.38 117.23 1wm9 h ARG 64 Ca 0.02 -0.11 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 1wm9 h ARG 64 Cb 0.74 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 1wm9 h ARG 64 CO 0.05 0.79 0.17 0.28 -1.07 0.00 0.00 179.97 180.19 1wm9 h VAL 65 N 1.12 1.24 -0.19 2.04 2.07 -0.69 -1.07 116.25 120.76 1wm9 h VAL 65 Ca 0.29 -0.79 0.03 0.00 0.82 0.00 0.00 66.70 67.04 1wm9 h VAL 65 Cb -0.02 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1wm9 h VAL 65 CO -0.05 0.30 0.02 0.00 0.02 0.00 0.00 177.57 177.86 1wm9 h ALA 66 N 1.04 0.18 -0.63 1.67 0.00 -1.12 -0.11 119.26 120.29 1wm9 h ALA 66 Ca 0.18 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1wm9 h ALA 66 Cb 0.28 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1wm9 h ALA 66 CO -0.01 -0.41 0.05 0.87 0.00 0.00 0.00 179.25 179.75 1wm9 h LYS 67 N 0.10 1.08 -0.21 0.00 1.57 -1.31 -2.06 116.57 115.74 1wm9 h LYS 67 Ca 0.09 -0.32 0.02 0.00 -1.87 0.00 0.00 60.65 58.57 1wm9 h LYS 67 Cb 0.09 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1wm9 h LYS 67 CO -0.12 1.03 0.07 0.00 -0.57 0.00 0.00 179.45 179.85 1wm9 h ALA 68 N 1.01 0.23 0.00 3.86 0.00 -0.77 -1.83 119.26 121.77 1wm9 h ALA 68 Ca 0.18 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 1wm9 h ALA 68 Cb 0.51 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1wm9 h ALA 68 CO 0.02 -0.35 -0.27 -1.49 0.00 0.00 0.00 179.25 177.16 1wm9 h TRP 69 N 0.17 0.00 -0.11 0.00 4.06 -0.85 0.15 115.95 119.37 1wm9 h TRP 69 Ca 0.09 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 60.90 1wm9 h TRP 69 Cb 0.06 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.21 1wm9 h TRP 69 CO -0.12 0.27 -0.54 0.00 -3.56 0.00 0.00 178.44 174.49 1wm9 h ALA 70 N 1.73 0.88 -0.02 1.49 0.00 -0.87 -2.32 119.26 120.16 1wm9 h ALA 70 Ca -0.00 -0.50 -0.23 0.00 0.00 0.00 0.00 54.91 54.18 1wm9 h ALA 70 Cb 0.53 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.25 1wm9 h ALA 70 CO 0.04 0.68 -0.87 0.35 0.00 0.00 0.00 179.25 179.45 1wm9 h PHE 71 N 0.24 0.92 0.00 0.00 3.57 -0.52 -2.44 116.94 118.71 1wm9 h PHE 71 Ca 0.00 -0.48 0.00 0.00 3.53 0.00 0.00 57.97 61.02 1wm9 h PHE 71 Cb 1.02 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.65 1wm9 h PHE 71 CO 0.02 1.31 0.00 1.28 -2.23 0.00 0.00 178.31 178.70 1wm9 n LEU 72 N -3.98 0.49 -0.11 0.59 4.77 0.45 -2.65 117.00 116.55 1wm9 n LEU 72 Ca -0.10 0.62 0.01 0.00 -0.03 0.00 0.00 56.01 56.51 1wm9 n LEU 72 Cb 0.80 -0.56 0.02 0.00 -2.33 0.00 0.00 43.42 41.35 1wm9 n LEU 72 CO 0.53 -0.49 0.42 0.35 -1.33 0.00 0.00 177.39 176.86 1wm9 n THR 73 N -2.05 0.56 0.26 -5.08 -2.24 -0.88 -2.84 114.28 102.01 1wm9 n THR 73 Ca 0.02 -0.78 0.18 0.00 -2.27 0.00 0.00 64.05 61.20 1wm9 n THR 73 Cb 0.21 0.74 0.87 0.00 -2.10 0.00 0.00 70.33 70.05 1wm9 n THR 73 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1wm9 h ARG 74 N 0.43 0.00 0.00 -0.78 0.11 -1.20 -1.93 114.38 111.00 1wm9 h ARG 74 Ca 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.05 1wm9 h ARG 74 Cb 0.35 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.42 1wm9 h ARG 74 CO 0.00 0.00 -0.12 0.78 0.10 0.00 0.00 179.97 180.73 1wm9 h GLY 75 N 0.00 0.00 1.71 0.08 0.00 -1.48 -2.44 103.07 100.95 1wm9 h GLY 75 Ca 0.05 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.34 1wm9 h GLY 75 CO -0.00 0.00 -0.03 -0.97 0.00 0.00 0.00 176.54 175.54 1wm9 h TYR 76 N 0.00 0.37 -0.66 5.60 0.05 -1.49 -2.88 116.97 117.95 1wm9 h TYR 76 Ca -0.00 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1wm9 h TYR 76 Cb 0.22 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 37.85 1wm9 h TYR 76 CO 0.00 0.40 0.00 2.89 -1.05 0.00 0.00 178.16 180.40 1wm9 n ARG 77 N -4.32 2.59 -3.33 4.88 1.85 -0.92 -4.95 116.66 112.45 1wm9 n ARG 77 Ca 0.00 -2.41 -0.29 0.00 -1.00 0.00 0.00 57.85 54.16 1wm9 n ARG 77 Cb 0.22 -1.53 -0.04 0.00 -1.05 0.00 0.00 32.46 30.07 1wm9 n ARG 77 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1wm9 s GLN 78 N -1.14 3.66 -0.16 2.89 -0.21 -1.09 -5.09 119.66 118.53 1wm9 s GLN 78 Ca 0.45 0.07 0.01 0.00 0.02 0.00 0.00 55.36 55.90 1wm9 s GLN 78 Cb 0.23 -2.64 0.01 0.00 1.00 0.00 0.00 33.01 31.61 1wm9 s GLN 78 CO 0.30 0.22 -0.18 1.03 -2.12 0.00 0.00 175.29 174.55 1wm9 s ARG 79 N -3.43 3.13 0.25 2.91 0.52 -1.26 -5.03 118.95 116.04 1wm9 s ARG 79 Ca 0.45 -0.79 -0.04 0.00 -0.52 0.00 0.00 55.73 54.83 1wm9 s ARG 79 Cb -0.11 -2.58 0.50 0.00 0.52 0.00 0.00 34.95 33.28 1wm9 s ARG 79 CO 0.28 -0.04 1.68 1.25 0.02 0.00 0.00 175.30 178.50 1wm9 h LEU 80 N 7.47 0.05 -1.15 2.53 5.85 -1.98 0.17 115.31 128.25 1wm9 h LEU 80 Ca -0.35 0.15 0.09 0.00 0.84 0.00 0.00 57.88 58.60 1wm9 h LEU 80 Cb 1.18 0.19 -0.07 0.00 0.37 0.00 0.00 40.66 42.34 1wm9 h LEU 80 CO 0.58 -0.04 0.59 -0.33 -0.34 0.00 0.00 178.44 178.90 1wm9 h GLU 81 N 0.28 0.94 0.07 1.25 3.07 -1.98 -1.06 114.58 117.15 1wm9 h GLU 81 Ca 0.44 -0.06 -0.26 0.00 -0.50 0.00 0.00 59.36 58.98 1wm9 h GLU 81 Cb 0.76 -0.21 0.01 0.00 -0.84 0.00 0.00 28.75 28.47 1wm9 h GLU 81 CO -0.52 0.62 -1.11 0.93 -1.40 0.00 0.00 179.01 177.53 1wm9 h GLU 82 N 0.96 0.38 -0.75 2.33 5.08 -1.42 -2.69 114.58 118.48 1wm9 h GLU 82 Ca 0.42 -0.51 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 1wm9 h GLU 82 Cb 0.34 0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 1wm9 h GLU 82 CO -0.18 1.19 0.34 0.28 -1.00 0.00 0.00 179.01 179.64 1wm9 h VAL 83 N 0.17 1.25 0.08 3.13 2.07 -0.26 -3.06 116.25 119.63 1wm9 h VAL 83 Ca -0.12 -0.72 -0.26 0.00 0.82 0.00 0.00 66.70 66.42 1wm9 h VAL 83 Cb 1.79 0.33 0.01 0.00 -1.52 0.00 0.00 31.29 31.89 1wm9 h VAL 83 CO 0.19 0.30 -1.12 0.58 0.02 0.00 0.00 177.57 177.54 1wm9 h VAL 84 N 1.07 1.41 0.00 2.57 2.07 -1.31 -3.48 116.25 118.58 1wm9 h VAL 84 Ca 0.26 -2.67 0.00 0.00 0.82 0.00 0.00 66.70 65.10 1wm9 h VAL 84 Cb 0.15 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 1wm9 h VAL 84 CO -0.03 0.79 0.00 0.61 0.02 0.00 0.00 177.57 178.97 1wm9 n GLY 85 N 1.26 2.82 2.35 2.17 0.00 -1.01 -2.81 105.19 109.97 1wm9 n GLY 85 Ca -0.09 -0.40 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 1wm9 n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wm9 n GLY 86 N 0.00 5.99 2.15 -0.02 0.00 -1.26 -4.71 105.19 107.34 1wm9 n GLY 86 Ca 0.00 -2.50 -0.28 0.00 0.00 0.00 0.00 46.02 43.24 1wm9 n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wm9 n ALA 87 N -0.74 5.81 -3.35 4.61 0.00 -1.12 -4.91 120.51 120.81 1wm9 n ALA 87 Ca 0.53 -3.38 -0.34 0.00 0.00 0.00 0.00 53.44 50.24 1wm9 n ALA 87 Cb 0.68 -1.39 -0.14 0.00 0.00 0.00 0.00 19.45 18.60 1wm9 n ALA 87 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1wm9 s VAL 88 N -4.34 3.38 0.31 0.00 1.01 -1.26 -0.53 120.40 118.97 1wm9 s VAL 88 Ca 0.59 -0.51 0.08 0.00 0.00 0.00 0.00 61.98 62.15 1wm9 s VAL 88 Cb 0.48 -2.51 -0.06 0.00 0.00 0.00 0.00 36.38 34.29 1wm9 s VAL 88 CO 0.02 0.45 -0.08 -0.36 0.00 0.00 0.00 175.10 175.13 1wm9 s PHE 89 N 1.10 2.17 0.29 5.22 0.08 0.19 -4.94 117.98 122.08 1wm9 s PHE 89 Ca 0.01 -0.59 -0.29 0.00 0.12 0.00 0.00 56.93 56.18 1wm9 s PHE 89 Cb -0.15 -1.23 -0.10 0.00 -0.57 0.00 0.00 43.02 40.98 1wm9 s PHE 89 CO -0.01 0.44 1.36 -2.14 -0.10 0.00 0.00 175.22 174.77 1wm9 s PRO 90 N -3.66 4.32 0.41 0.24 0.02 -1.26 -0.12 135.00 134.95 1wm9 s PRO 90 Ca 0.31 2.24 -0.27 0.00 0.02 0.00 0.00 61.00 63.30 1wm9 s PRO 90 Cb 0.03 -3.10 -0.09 0.00 0.02 0.00 0.00 34.50 31.35 1wm9 s PRO 90 CO 0.14 -0.29 1.43 0.00 -0.33 0.00 0.00 177.00 177.96 1wm9 s ALA 91 N -0.57 3.39 -0.13 -1.55 0.00 -0.71 -4.66 121.76 117.54 1wm9 s ALA 91 Ca 0.54 1.48 0.20 0.00 0.00 0.00 0.00 51.96 54.18 1wm9 s ALA 91 Cb -0.40 -3.58 -0.19 0.00 0.00 0.00 0.00 23.12 18.94 1wm9 s ALA 91 CO 0.48 -1.08 0.64 0.39 0.00 0.00 0.00 175.76 176.19 1wm9 n GLU 92 N 0.14 0.64 -1.01 0.00 -0.58 -1.26 -4.97 120.64 113.60 1wm9 n GLU 92 Ca 0.03 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 1wm9 n GLU 92 Cb 0.41 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 1wm9 n GLU 92 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1wm9 n GLY 93 N 1.36 2.72 0.00 0.62 0.00 -1.26 -5.07 105.19 103.55 1wm9 n GLY 93 Ca -0.09 -1.13 0.04 0.00 0.00 0.00 0.00 46.02 44.84 1wm9 n GLY 93 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wm9 n SER 94 N -1.22 0.93 -4.79 1.61 3.41 -1.26 -4.85 113.62 107.45 1wm9 n SER 94 Ca 0.00 -0.57 -0.31 0.00 -0.26 0.00 0.00 58.87 57.73 1wm9 n SER 94 Cb 0.00 1.09 0.08 0.00 -0.26 0.00 0.00 64.21 65.12 1wm9 n SER 94 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1wm9 s GLU 95 N -2.02 2.44 0.32 4.33 0.41 -1.26 -4.63 118.70 118.28 1wm9 s GLU 95 Ca 0.02 1.05 -0.29 0.00 -0.41 0.00 0.00 54.97 55.34 1wm9 s GLU 95 Cb 0.07 -1.93 -0.11 0.00 -1.78 0.00 0.00 34.13 30.38 1wm9 s GLU 95 CO 0.38 -1.48 1.44 1.41 -0.49 0.00 0.00 175.26 176.52 1wm9 s MET 96 N -4.97 4.22 -0.16 1.61 0.00 -1.26 -4.59 119.30 114.15 1wm9 s MET 96 Ca 0.60 2.40 -0.05 0.00 0.00 0.00 0.00 55.69 58.64 1wm9 s MET 96 Cb -0.16 -3.04 -0.03 0.00 0.00 0.00 0.00 34.83 31.59 1wm9 s MET 96 CO 0.56 -0.42 -0.00 0.08 0.00 0.00 0.00 175.02 175.23 1wm9 s VAL 97 N -0.63 4.22 -0.18 10.11 1.01 0.45 -4.95 120.40 130.43 1wm9 s VAL 97 Ca 0.55 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.30 1wm9 s VAL 97 Cb -0.44 -2.87 0.03 0.00 0.00 0.00 0.00 36.38 33.10 1wm9 s VAL 97 CO 0.52 0.48 -0.15 -0.69 0.00 0.00 0.00 175.10 175.27 1wm9 s VAL 98 N 0.35 1.78 -0.43 2.92 1.01 -1.26 -1.40 120.40 123.37 1wm9 s VAL 98 Ca -0.02 -0.89 -0.07 0.00 0.00 0.00 0.00 61.98 61.00 1wm9 s VAL 98 Cb -0.13 -1.71 0.10 0.00 0.00 0.00 0.00 36.38 34.64 1wm9 s VAL 98 CO 0.02 0.38 0.27 -0.69 0.00 0.00 0.00 175.10 175.08 1wm9 s VAL 99 N 1.38 3.95 0.34 2.92 1.01 0.14 -4.99 120.40 125.15 1wm9 s VAL 99 Ca 0.02 -1.72 0.07 0.00 0.00 0.00 0.00 61.98 60.36 1wm9 s VAL 99 Cb -0.14 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1wm9 s VAL 99 CO -0.10 -0.65 0.31 -1.59 0.00 0.00 0.00 175.10 173.06 1wm9 s LYS 100 N 1.32 2.74 -1.17 2.72 -2.85 -1.26 -0.34 119.74 120.90 1wm9 s LYS 100 Ca 0.05 -1.29 0.00 0.00 -1.00 0.00 0.00 55.97 53.73 1wm9 s LYS 100 Cb -0.24 -2.49 0.00 0.00 -2.06 0.00 0.00 37.83 33.03 1wm9 s LYS 100 CO -0.01 0.08 0.00 0.41 0.10 0.00 0.00 175.35 175.93 1wm9 n GLY 101 N -1.40 0.47 3.56 0.59 0.00 -1.21 -4.95 105.19 102.24 1wm9 n GLY 101 Ca -0.01 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 1wm9 n GLY 101 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wm9 s VAL 102 N -2.55 3.63 0.51 1.61 1.01 -0.69 -4.79 120.40 119.13 1wm9 s VAL 102 Ca 0.00 0.41 -0.23 0.00 0.00 0.00 0.00 61.98 62.17 1wm9 s VAL 102 Cb 0.00 -4.53 -0.06 0.00 0.00 0.00 0.00 36.38 31.80 1wm9 s VAL 102 CO 0.00 -1.43 1.32 -1.83 0.00 0.00 0.00 175.10 173.17 1wm9 s GLU 103 N 6.06 3.36 0.07 2.72 1.03 -1.26 -0.49 118.70 130.19 1wm9 s GLU 103 Ca 0.48 2.15 -0.02 0.00 0.03 0.00 0.00 54.97 57.61 1wm9 s GLU 103 Cb -0.10 -2.35 -0.03 0.00 -0.80 0.00 0.00 34.13 30.85 1wm9 s GLU 103 CO 0.19 -0.99 0.02 -0.59 -1.33 0.00 0.00 175.26 172.57 1wm9 s PHE 104 N -1.34 0.49 -0.02 4.83 -0.71 -0.42 -4.87 117.98 115.94 1wm9 s PHE 104 Ca 0.68 -1.00 0.00 0.00 -1.04 0.00 0.00 56.93 55.57 1wm9 s PHE 104 Cb -0.38 -0.34 0.02 0.00 -1.21 0.00 0.00 43.02 41.11 1wm9 s PHE 104 CO 0.46 -0.43 0.01 0.71 -1.34 0.00 0.00 175.22 174.63 1wm9 s TYR 105 N -3.92 0.16 0.32 3.49 2.02 -1.26 -1.99 117.35 116.17 1wm9 s TYR 105 Ca 0.09 0.05 0.04 0.00 -0.37 0.00 0.00 57.07 56.87 1wm9 s TYR 105 Cb 0.07 -0.27 -0.02 0.00 -0.40 0.00 0.00 41.96 41.34 1wm9 s TYR 105 CO -0.09 -0.09 0.32 0.45 -1.57 0.00 0.00 175.55 174.57 1wm9 s SER 106 N 0.82 1.36 -0.10 2.29 0.15 -0.02 -4.26 113.70 113.95 1wm9 s SER 106 Ca -0.08 -1.66 0.02 0.00 0.70 0.00 0.00 55.95 54.94 1wm9 s SER 106 Cb -0.11 0.57 0.01 0.00 -1.71 0.00 0.00 66.02 64.78 1wm9 s SER 106 CO -0.02 -1.10 -0.17 -0.04 1.20 0.00 0.00 173.24 173.11 1wm9 s MET 107 N -3.41 2.31 0.15 5.44 -1.94 -1.23 -1.46 119.30 119.17 1wm9 s MET 107 Ca 0.38 -0.61 -0.30 0.00 -1.71 0.00 0.00 55.69 53.45 1wm9 s MET 107 Cb 0.02 -1.89 -0.07 0.00 2.01 0.00 0.00 34.83 34.89 1wm9 s MET 107 CO 0.25 0.01 1.17 0.00 -0.01 0.00 0.00 175.02 176.43 1wm9 h GLU 109 N 5.56 0.00 0.07 0.00 4.11 -1.29 0.13 114.58 123.15 1wm9 h GLU 109 Ca -0.44 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 58.73 1wm9 h GLU 109 Cb 1.21 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.48 1wm9 h GLU 109 CO 0.75 0.00 -1.12 0.45 0.07 0.00 0.00 179.01 179.16 1wm9 h HIS 110 N 0.00 0.76 0.00 2.06 3.86 -1.91 -3.39 115.15 116.52 1wm9 h HIS 110 Ca 0.00 -0.46 0.00 0.00 -1.16 0.00 0.00 60.37 58.75 1wm9 h HIS 110 Cb 0.47 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.88 1wm9 h HIS 110 CO 0.00 1.31 0.00 0.72 0.86 0.00 0.00 177.93 180.82 1wm9 n HIS 111 N -3.72 0.00 -3.16 2.45 8.25 -1.21 -5.02 115.22 112.80 1wm9 n HIS 111 Ca -0.10 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.15 1wm9 n HIS 111 Cb 0.93 0.00 0.05 0.00 1.12 0.00 0.00 29.99 32.09 1wm9 n HIS 111 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1wm9 n LEU 112 N -0.43 -2.86 -4.41 2.41 4.77 0.43 -5.01 117.00 111.90 1wm9 n LEU 112 Ca 0.00 -0.35 -0.30 0.00 -0.03 0.00 0.00 56.01 55.33 1wm9 n LEU 112 Cb 0.03 -2.83 -0.13 0.00 -2.33 0.00 0.00 43.42 38.16 1wm9 n LEU 112 CO 0.00 0.36 -0.54 -0.76 -1.33 0.00 0.00 177.39 175.12 1wm9 s LEU 113 N -6.46 2.40 0.56 2.23 1.43 -1.25 -4.87 118.68 112.71 1wm9 s LEU 113 Ca 0.38 -0.59 -0.20 0.00 -1.03 0.00 0.00 54.13 52.68 1wm9 s LEU 113 Cb -0.17 -1.36 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 1wm9 s LEU 113 CO 0.46 0.22 1.26 -2.84 0.23 0.00 0.00 176.35 175.69 1wm9 s PRO 114 N -1.66 3.10 -0.01 1.29 0.02 -1.26 -1.52 135.00 134.97 1wm9 s PRO 114 Ca 0.14 1.98 0.00 0.00 0.02 0.00 0.00 61.00 63.14 1wm9 s PRO 114 Cb -0.10 -2.10 0.01 0.00 0.02 0.00 0.00 34.50 32.33 1wm9 s PRO 114 CO 0.05 -1.14 0.01 -0.59 -0.33 0.00 0.00 177.00 174.99 1wm9 s PHE 115 N -1.47 0.03 0.22 6.54 -0.71 -0.54 -2.12 117.98 119.94 1wm9 s PHE 115 Ca 0.74 0.03 -0.11 0.00 -1.04 0.00 0.00 56.93 56.56 1wm9 s PHE 115 Cb -0.34 -0.08 -0.01 0.00 -1.21 0.00 0.00 43.02 41.38 1wm9 s PHE 115 CO 0.39 -0.03 0.39 -0.59 -1.34 0.00 0.00 175.22 174.03 1wm9 s PHE 116 N 0.31 0.44 0.00 3.49 -0.71 -0.77 -0.84 117.98 119.90 1wm9 s PHE 116 Ca -0.03 -0.78 0.00 0.00 -1.04 0.00 0.00 56.93 55.08 1wm9 s PHE 116 Cb -0.04 0.04 0.00 0.00 -1.21 0.00 0.00 43.02 41.82 1wm9 s PHE 116 CO -0.01 -0.87 0.00 0.41 -1.34 0.00 0.00 175.22 173.41 1wm9 n GLY 117 N -0.32 -0.57 3.12 1.99 0.00 -0.84 -0.42 105.19 108.14 1wm9 n GLY 117 Ca -0.03 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 1wm9 n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wm9 s LYS 118 N -0.25 0.68 -0.11 1.61 1.02 -0.67 -1.30 119.74 120.72 1wm9 s LYS 118 Ca 0.00 -0.97 0.03 0.00 0.02 0.00 0.00 55.97 55.05 1wm9 s LYS 118 Cb 0.00 -0.38 0.01 0.00 -0.52 0.00 0.00 37.83 36.94 1wm9 s LYS 118 CO 0.00 0.06 -0.22 0.08 -0.92 0.00 0.00 175.35 174.35 1wm9 s VAL 119 N -2.01 1.96 -0.21 3.17 1.01 0.36 -1.60 120.40 123.09 1wm9 s VAL 119 Ca -0.02 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 60.98 1wm9 s VAL 119 Cb -0.06 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.59 1wm9 s VAL 119 CO -0.00 0.54 -0.04 -1.00 0.00 0.00 0.00 175.10 174.59 1wm9 s HIS 120 N 0.60 2.96 -0.11 5.22 0.09 0.24 -1.71 115.29 122.58 1wm9 s HIS 120 Ca -0.13 -0.80 0.01 0.00 -0.00 0.00 0.00 55.06 54.14 1wm9 s HIS 120 Cb -0.17 -2.08 -0.02 0.00 -0.00 0.00 0.00 32.58 30.32 1wm9 s HIS 120 CO 0.03 -0.45 -0.14 0.42 -0.00 0.00 0.00 174.74 174.61 1wm9 s ILE 121 N 1.28 3.03 -0.01 0.60 1.01 0.53 -1.13 121.20 126.52 1wm9 s ILE 121 Ca 0.03 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 60.03 1wm9 s ILE 121 Cb -0.14 -2.25 -0.01 0.00 0.01 0.00 0.00 42.46 40.07 1wm9 s ILE 121 CO -0.01 0.54 -0.08 -0.83 0.00 0.00 0.00 174.94 174.55 1wm9 s GLY 122 N 0.13 0.40 0.03 6.18 0.00 0.34 0.29 107.32 114.69 1wm9 s GLY 122 Ca -0.07 -0.36 -0.26 0.00 0.00 0.00 0.00 44.72 44.03 1wm9 s GLY 122 CO 0.05 -0.30 0.61 -2.52 0.00 0.00 0.00 173.10 170.93 1wm9 s TYR 123 N -0.21 -0.56 -0.22 1.90 -0.85 -0.49 0.47 117.35 117.39 1wm9 s TYR 123 Ca 0.03 0.75 -0.03 0.00 -0.52 0.00 0.00 57.07 57.29 1wm9 s TYR 123 Cb -0.03 0.42 -0.00 0.00 0.38 0.00 0.00 41.96 42.72 1wm9 s TYR 123 CO -0.00 -0.67 -0.05 0.42 -1.52 0.00 0.00 175.55 173.72 1wm9 s ILE 124 N -2.13 3.25 0.76 -3.49 1.01 -0.94 -0.41 121.20 119.25 1wm9 s ILE 124 Ca -0.07 -0.56 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 1wm9 s ILE 124 Cb -0.01 -2.49 0.05 0.00 0.01 0.00 0.00 42.46 40.03 1wm9 s ILE 124 CO 0.01 0.41 1.10 -2.84 0.00 0.00 0.00 174.94 173.62 1wm9 s PRO 125 N 1.46 2.29 -0.41 2.79 0.02 -1.26 -0.82 135.00 139.07 1wm9 s PRO 125 Ca 0.05 1.21 0.07 0.00 0.02 0.00 0.00 61.00 62.35 1wm9 s PRO 125 Cb -0.14 -1.90 0.23 0.00 0.02 0.00 0.00 34.50 32.71 1wm9 s PRO 125 CO -0.04 -1.62 0.50 -3.47 -0.33 0.00 0.00 177.00 172.04 1wm9 n ASP 126 N -3.40 0.32 0.00 2.53 4.64 -1.26 -4.31 116.55 115.07 1wm9 n ASP 126 Ca 0.09 -2.69 0.00 0.00 -1.38 0.00 0.00 54.79 50.81 1wm9 n ASP 126 Cb 0.53 -0.63 0.00 0.00 -1.04 0.00 0.00 41.12 39.98 1wm9 n ASP 126 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1wm9 n GLY 127 N 1.65 2.80 2.95 0.27 0.00 -1.26 -4.89 105.19 106.71 1wm9 n GLY 127 Ca 0.23 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.08 1wm9 n GLY 127 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wm9 s LYS 128 N -0.29 0.58 0.14 1.61 1.02 -1.26 -1.73 119.74 119.81 1wm9 s LYS 128 Ca 0.00 -0.19 0.10 0.00 0.02 0.00 0.00 55.97 55.90 1wm9 s LYS 128 Cb 0.00 -0.58 -0.04 0.00 -0.52 0.00 0.00 37.83 36.69 1wm9 s LYS 128 CO 0.00 0.08 -0.23 0.96 -0.92 0.00 0.00 175.35 175.24 1wm9 s ILE 129 N 0.14 1.99 0.06 2.17 -4.36 0.83 -4.71 121.20 117.32 1wm9 s ILE 129 Ca -0.01 -1.76 0.01 0.00 -0.26 0.00 0.00 60.65 58.63 1wm9 s ILE 129 Cb -0.06 -1.83 -0.04 0.00 1.25 0.00 0.00 42.46 41.78 1wm9 s ILE 129 CO -0.00 -0.08 0.14 -0.22 0.24 0.00 0.00 174.94 175.01 1wm9 s LEU 130 N -2.23 4.05 0.11 0.37 2.96 -1.26 -0.64 118.68 122.04 1wm9 s LEU 130 Ca 0.13 0.13 -0.31 0.00 -0.22 0.00 0.00 54.13 53.85 1wm9 s LEU 130 Cb -0.09 -2.66 -0.09 0.00 0.50 0.00 0.00 46.19 43.85 1wm9 s LEU 130 CO 0.06 0.18 1.64 -0.83 -1.32 0.00 0.00 176.35 176.08 1wm9 s GLY 131 N -2.37 1.53 0.31 7.98 0.00 0.31 -4.88 107.32 110.21 1wm9 s GLY 131 Ca 0.31 1.29 0.08 0.00 0.00 0.00 0.00 44.72 46.41 1wm9 s GLY 131 CO 0.24 2.82 1.68 1.41 0.00 0.00 0.00 173.10 179.24 1wm9 h LEU 132 N 7.90 0.37 -2.17 0.66 3.38 -1.97 0.68 115.31 124.16 1wm9 h LEU 132 Ca -0.43 0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1wm9 h LEU 132 Cb 1.20 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 1wm9 h LEU 132 CO 0.93 -0.07 -0.07 0.77 0.09 0.00 0.00 178.44 180.09 1wm9 h SER 133 N 0.35 0.00 0.84 -0.43 4.64 -1.99 -2.30 113.55 114.66 1wm9 h SER 133 Ca 0.64 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.89 1wm9 h SER 133 Cb 1.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 1wm9 h SER 133 CO -0.58 0.07 -0.32 0.11 -0.87 0.00 0.00 176.83 175.23 1wm9 h LYS 134 N 0.00 0.00 -0.64 4.77 1.79 -1.21 -2.55 116.57 118.72 1wm9 h LYS 134 Ca -0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 1wm9 h LYS 134 Cb 0.21 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.84 1wm9 h LYS 134 CO 0.01 0.32 0.20 0.74 -1.08 0.00 0.00 179.45 179.64 1wm9 h PHE 135 N 0.00 1.03 -0.40 -1.35 0.04 -1.48 0.58 116.94 115.36 1wm9 h PHE 135 Ca -0.00 -0.10 -0.12 0.00 2.80 0.00 0.00 57.97 60.54 1wm9 h PHE 135 Cb 0.83 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.67 1wm9 h PHE 135 CO 0.00 0.84 -0.25 0.00 -0.60 0.00 0.00 178.31 178.30 1wm9 h ALA 136 N 1.07 0.82 -0.30 2.45 0.00 -1.61 -0.54 119.26 121.15 1wm9 h ALA 136 Ca 0.20 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 1wm9 h ALA 136 Cb 0.30 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1wm9 h ALA 136 CO -0.01 0.64 -0.19 0.00 0.00 0.00 0.00 179.25 179.70 1wm9 h ARG 137 N 0.70 0.54 -0.24 0.00 3.08 -1.08 0.05 114.38 117.42 1wm9 h ARG 137 Ca 0.09 -0.19 -0.13 0.00 0.07 0.00 0.00 59.98 59.82 1wm9 h ARG 137 Cb 0.77 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.78 1wm9 h ARG 137 CO 0.06 0.71 -0.37 0.82 -1.07 0.00 0.00 179.97 180.12 1wm9 h ILE 138 N 0.49 1.31 -0.41 2.04 2.04 -0.63 -2.07 117.51 120.29 1wm9 h ILE 138 Ca 0.08 -1.57 0.03 0.00 1.00 0.00 0.00 64.86 64.40 1wm9 h ILE 138 Cb 0.61 1.73 -0.03 0.00 -0.74 0.00 0.00 36.82 38.38 1wm9 h ILE 138 CO 0.04 0.50 0.20 0.58 0.00 0.00 0.00 178.15 179.47 1wm9 h VAL 139 N 0.40 0.97 -0.20 1.67 2.07 -0.76 -2.36 116.25 118.04 1wm9 h VAL 139 Ca 0.02 -0.14 -0.04 0.00 0.82 0.00 0.00 66.70 67.36 1wm9 h VAL 139 Cb 0.96 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1wm9 h VAL 139 CO 0.09 0.07 -0.06 0.44 0.02 0.00 0.00 177.57 178.13 1wm9 h ASP 140 N 0.40 0.28 -0.78 0.57 3.32 -0.91 -0.72 116.42 118.58 1wm9 h ASP 140 Ca 0.17 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 1wm9 h ASP 140 Cb 0.09 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 1wm9 h ASP 140 CO -0.13 0.38 0.48 -0.03 -1.72 0.00 0.00 179.24 178.23 1wm9 h MET 141 N 0.29 1.05 0.00 3.56 4.05 -0.83 -1.47 114.93 121.58 1wm9 h MET 141 Ca 0.06 -0.09 -0.06 0.00 -0.28 0.00 0.00 59.70 59.33 1wm9 h MET 141 Cb 0.30 -0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 1wm9 h MET 141 CO 0.01 0.73 -1.28 1.19 0.23 0.00 0.00 176.91 177.80 1wm9 n PHE 142 N -4.49 0.84 0.01 1.39 3.72 -1.08 -4.20 117.46 113.64 1wm9 n PHE 142 Ca 0.07 0.26 -0.18 0.00 -0.05 0.00 0.00 57.45 57.55 1wm9 n PHE 142 Cb 0.05 -0.95 -0.09 0.00 -0.94 0.00 0.00 39.48 37.55 1wm9 n PHE 142 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1wm9 h ALA 143 N 1.81 0.19 0.00 4.37 0.00 -1.02 -3.35 119.26 121.26 1wm9 h ALA 143 Ca -0.06 -0.62 -0.67 0.00 0.00 0.00 0.00 54.91 53.55 1wm9 h ALA 143 Cb 1.20 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1wm9 h ALA 143 CO 0.01 0.60 3.42 0.54 0.00 0.00 0.00 179.25 183.82 1wm9 n ARG 144 N -3.98 3.16 -3.89 0.00 1.74 -0.57 -4.28 116.66 108.84 1wm9 n ARG 144 Ca -0.09 -2.33 -0.10 0.00 -0.77 0.00 0.00 57.85 54.55 1wm9 n ARG 144 Cb 0.78 -3.01 0.01 0.00 -1.02 0.00 0.00 32.46 29.21 1wm9 n ARG 144 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1wm9 s ARG 145 N 2.81 2.14 -0.14 5.56 0.52 -1.13 -1.60 118.95 127.10 1wm9 s ARG 145 Ca 0.58 -1.53 -0.22 0.00 -0.52 0.00 0.00 55.73 54.04 1wm9 s ARG 145 Cb 0.16 0.58 -0.03 0.00 0.52 0.00 0.00 34.95 36.17 1wm9 s ARG 145 CO -0.06 -0.97 0.66 -0.51 0.02 0.00 0.00 175.30 174.43 1wm9 s LEU 146 N -3.12 4.22 0.33 2.53 1.43 -1.26 -3.49 118.68 119.32 1wm9 s LEU 146 Ca 0.20 0.99 0.05 0.00 -1.03 0.00 0.00 54.13 54.34 1wm9 s LEU 146 Cb -0.04 -2.97 -0.03 0.00 0.03 0.00 0.00 46.19 43.18 1wm9 s LEU 146 CO 0.14 -0.20 0.22 -1.10 0.23 0.00 0.00 176.35 175.64 1wm9 s GLN 147 N 1.42 1.72 -0.02 1.70 -1.52 0.80 -4.77 119.66 118.99 1wm9 s GLN 147 Ca 0.32 -2.00 0.01 0.00 -1.95 0.00 0.00 55.36 51.74 1wm9 s GLN 147 Cb -0.16 0.10 0.01 0.00 -0.22 0.00 0.00 33.01 32.73 1wm9 s GLN 147 CO 0.13 -0.57 -0.03 0.14 -0.25 0.00 0.00 175.29 174.70 1wm9 s VAL 148 N -3.49 0.35 0.47 1.09 -7.23 -1.26 -0.85 120.40 109.49 1wm9 s VAL 148 Ca 0.37 -0.10 0.17 0.00 -1.81 0.00 0.00 61.98 60.60 1wm9 s VAL 148 Cb 0.03 -0.35 0.34 0.00 0.56 0.00 0.00 36.38 36.95 1wm9 s VAL 148 CO 0.23 0.14 2.01 -0.61 -0.31 0.00 0.00 175.10 176.56 1wm9 h GLN 149 N 6.61 0.23 -0.60 4.82 4.15 -2.00 -1.81 115.11 126.51 1wm9 h GLN 149 Ca -0.34 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.05 1wm9 h GLN 149 Cb 1.17 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.78 1wm9 h GLN 149 CO 0.49 0.15 0.31 0.93 -1.93 0.00 0.00 178.83 178.78 1wm9 h GLU 150 N 0.23 0.85 -0.34 1.69 3.07 -1.97 -3.02 114.58 115.09 1wm9 h GLU 150 Ca 0.22 -0.11 -0.09 0.00 -0.50 0.00 0.00 59.36 58.87 1wm9 h GLU 150 Cb 0.57 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 1wm9 h GLU 150 CO -0.04 0.67 -0.15 -0.09 -1.40 0.00 0.00 179.01 178.00 1wm9 h ARG 151 N 0.82 0.70 -0.81 2.33 2.43 -1.77 -3.22 114.38 114.86 1wm9 h ARG 151 Ca 0.21 -0.30 0.14 0.00 -0.81 0.00 0.00 59.98 59.22 1wm9 h ARG 151 Cb 0.09 -0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 29.52 1wm9 h ARG 151 CO -0.03 0.90 0.38 1.25 -1.51 0.00 0.00 179.97 180.96 1wm9 h LEU 152 N 0.47 0.43 -0.40 3.80 5.85 -1.33 -1.22 115.31 122.92 1wm9 h LEU 152 Ca 0.08 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 1wm9 h LEU 152 Cb 0.68 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1wm9 h LEU 152 CO 0.05 0.18 -0.07 0.00 -0.34 0.00 0.00 178.44 178.26 1wm9 h ALA 153 N 1.55 0.55 -0.45 1.25 0.00 -1.56 -2.19 119.26 118.41 1wm9 h ALA 153 Ca 0.44 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1wm9 h ALA 153 Cb 0.63 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1wm9 h ALA 153 CO -0.37 0.40 -0.10 -0.39 0.00 0.00 0.00 179.25 178.79 1wm9 h VAL 154 N 0.58 1.27 -0.55 0.00 -1.51 -1.41 -1.87 116.25 112.75 1wm9 h VAL 154 Ca 0.11 -1.21 -0.08 0.00 -1.23 0.00 0.00 66.70 64.29 1wm9 h VAL 154 Cb 0.58 1.12 -0.02 0.00 -2.13 0.00 0.00 31.29 30.84 1wm9 h VAL 154 CO 0.03 0.41 0.03 1.56 -1.23 0.00 0.00 177.57 178.38 1wm9 h GLN 155 N 0.70 0.92 -0.18 5.19 4.20 -1.23 0.16 115.11 124.88 1wm9 h GLN 155 Ca 0.12 -0.25 -0.03 0.00 0.06 0.00 0.00 58.65 58.54 1wm9 h GLN 155 Cb 0.64 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1wm9 h GLN 155 CO 0.04 0.89 -0.01 0.82 -0.67 0.00 0.00 178.83 179.91 1wm9 h ILE 156 N 0.86 1.26 -0.52 2.54 2.04 -1.32 -1.25 117.51 121.13 1wm9 h ILE 156 Ca 0.17 -0.88 0.01 0.00 1.00 0.00 0.00 64.86 65.16 1wm9 h ILE 156 Cb 0.46 1.49 -0.03 0.00 -0.74 0.00 0.00 36.82 38.00 1wm9 h ILE 156 CO 0.02 0.26 0.33 0.00 0.00 0.00 0.00 178.15 178.76 1wm9 h ALA 157 N 0.77 0.66 -0.43 1.87 0.00 -1.02 -2.08 119.26 119.02 1wm9 h ALA 157 Ca 0.05 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1wm9 h ALA 157 Cb 0.40 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1wm9 h ALA 157 CO 0.01 0.06 -0.02 0.93 0.00 0.00 0.00 179.25 180.23 1wm9 h GLU 158 N 0.66 0.70 -0.50 0.00 5.08 -0.61 -1.30 114.58 118.61 1wm9 h GLU 158 Ca 0.20 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 1wm9 h GLU 158 Cb -0.03 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 1wm9 h GLU 158 CO -0.07 0.73 0.06 0.00 -1.00 0.00 0.00 179.01 178.74 1wm9 h ALA 159 N 1.32 0.67 -0.39 3.43 0.00 -0.86 -1.01 119.26 122.43 1wm9 h ALA 159 Ca 0.13 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1wm9 h ALA 159 Cb 0.43 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1wm9 h ALA 159 CO 0.02 0.42 -0.11 0.82 0.00 0.00 0.00 179.25 180.40 1wm9 h ILE 160 N 0.71 1.25 -0.68 0.00 2.04 -1.10 -1.76 117.51 117.97 1wm9 h ILE 160 Ca 0.15 -1.11 -0.07 0.00 1.00 0.00 0.00 64.86 64.84 1wm9 h ILE 160 Cb 0.42 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 1wm9 h ILE 160 CO 0.01 0.37 0.17 -0.61 0.00 0.00 0.00 178.15 178.09 1wm9 h GLN 161 N 0.62 1.09 -0.29 2.37 5.75 -0.88 -1.56 115.11 122.21 1wm9 h GLN 161 Ca 0.11 -0.26 -0.08 0.00 -0.15 0.00 0.00 58.65 58.27 1wm9 h GLN 161 Cb 0.55 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.95 1wm9 h GLN 161 CO 0.03 0.97 -0.12 1.49 -2.65 0.00 0.00 178.83 178.55 1wm9 h GLU 162 N 1.01 0.60 -0.31 1.69 4.81 -0.83 0.32 114.58 121.87 1wm9 h GLU 162 Ca 0.21 -0.25 -0.09 0.00 -0.13 0.00 0.00 59.36 59.10 1wm9 h GLU 162 Cb 0.37 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1wm9 h GLU 162 CO 0.00 0.82 -0.15 0.28 -0.73 0.00 0.00 179.01 179.24 1wm9 h VAL 163 N 0.35 1.29 0.00 0.32 2.07 -1.28 -3.37 116.25 115.63 1wm9 h VAL 163 Ca 0.07 -1.25 -0.12 0.00 0.82 0.00 0.00 66.70 66.22 1wm9 h VAL 163 Cb 0.63 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 1wm9 h VAL 163 CO 0.04 0.40 -1.90 0.18 0.02 0.00 0.00 177.57 176.31 1wm9 n LEU 164 N -4.38 0.00 -3.74 2.57 4.77 -0.59 -5.02 117.00 110.60 1wm9 n LEU 164 Ca -0.03 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.67 1wm9 n LEU 164 Cb 0.38 0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.66 1wm9 n LEU 164 CO 0.42 0.17 -0.11 -0.62 -1.33 0.00 0.00 177.39 175.92 1wm9 n GLU 165 N -2.30 -2.29 -1.71 3.23 -0.58 0.11 -4.73 120.64 112.37 1wm9 n GLU 165 Ca -0.13 0.48 -0.29 0.00 -0.42 0.00 0.00 57.16 56.79 1wm9 n GLU 165 Cb 0.68 -4.41 0.16 0.00 -0.57 0.00 0.00 31.44 27.30 1wm9 n GLU 165 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 1wm9 s PRO 166 N -6.09 0.87 0.37 3.49 0.02 -1.26 -4.58 135.00 127.82 1wm9 s PRO 166 Ca 0.29 -0.05 0.14 0.00 0.02 0.00 0.00 61.00 61.39 1wm9 s PRO 166 Cb -0.10 -1.84 0.73 0.00 0.02 0.00 0.00 34.50 33.31 1wm9 s PRO 166 CO 0.86 -2.32 1.82 1.96 -0.33 0.00 0.00 177.00 178.99 1wm9 h GLN 167 N -1.58 0.00 -1.61 5.54 4.20 -1.17 -3.46 115.11 117.04 1wm9 h GLN 167 Ca -0.46 0.00 0.19 0.00 0.06 0.00 0.00 58.65 58.44 1wm9 h GLN 167 Cb 1.29 0.00 -0.20 0.00 0.30 0.00 0.00 27.48 28.87 1wm9 h GLN 167 CO 0.51 0.38 0.72 0.20 -0.67 0.00 0.00 178.83 179.96 1wm9 s GLY 168 N -4.32 -0.28 0.01 3.46 0.00 -1.22 -1.40 107.32 103.58 1wm9 s GLY 168 Ca -0.02 1.71 0.01 0.00 0.00 0.00 0.00 44.72 46.41 1wm9 s GLY 168 CO 0.72 0.65 -0.04 0.14 0.00 0.00 0.00 173.10 174.57 1wm9 s VAL 169 N -2.16 0.25 -0.04 1.40 1.01 -0.39 -2.21 120.40 118.26 1wm9 s VAL 169 Ca 0.06 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.62 1wm9 s VAL 169 Cb -0.01 -0.27 0.02 0.00 0.00 0.00 0.00 36.38 36.12 1wm9 s VAL 169 CO -0.05 -0.13 -0.06 -0.83 0.00 0.00 0.00 175.10 174.04 1wm9 s GLY 170 N -0.60 0.47 -0.06 4.51 0.00 0.18 -0.43 107.32 111.38 1wm9 s GLY 170 Ca -0.04 -0.12 0.01 0.00 0.00 0.00 0.00 44.72 44.57 1wm9 s GLY 170 CO -0.00 0.29 -0.07 0.14 0.00 0.00 0.00 173.10 173.46 1wm9 s VAL 171 N 0.71 0.75 -0.12 1.40 1.01 0.04 -0.50 120.40 123.69 1wm9 s VAL 171 Ca -0.10 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.67 1wm9 s VAL 171 Cb -0.13 -0.75 0.01 0.00 0.00 0.00 0.00 36.38 35.52 1wm9 s VAL 171 CO 0.01 0.28 -0.18 -0.69 0.00 0.00 0.00 175.10 174.51 1wm9 s VAL 172 N 0.95 1.76 -0.10 2.92 1.01 -0.28 -0.83 120.40 125.82 1wm9 s VAL 172 Ca -0.10 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.09 1wm9 s VAL 172 Cb -0.15 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 1wm9 s VAL 172 CO 0.00 0.49 -0.15 -0.69 0.00 0.00 0.00 175.10 174.76 1wm9 s VAL 173 N 0.90 2.95 -0.16 2.92 1.01 0.13 -0.59 120.40 127.56 1wm9 s VAL 173 Ca -0.07 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 1wm9 s VAL 173 Cb -0.15 -2.20 0.05 0.00 0.00 0.00 0.00 36.38 34.07 1wm9 s VAL 173 CO -0.02 0.55 -0.01 -0.70 0.00 0.00 0.00 175.10 174.92 1wm9 s GLU 174 N 0.02 0.97 0.12 2.72 2.12 -0.62 -0.53 118.70 123.49 1wm9 s GLU 174 Ca -0.05 -0.35 -0.01 0.00 0.36 0.00 0.00 54.97 54.92 1wm9 s GLU 174 Cb -0.14 -1.82 -0.04 0.00 0.26 0.00 0.00 34.13 32.38 1wm9 s GLU 174 CO 0.04 -0.48 0.05 0.20 -0.54 0.00 0.00 175.26 174.53 1wm9 s GLY 175 N 1.79 0.87 -0.03 -1.50 0.00 -0.27 -1.66 107.32 106.51 1wm9 s GLY 175 Ca 0.01 -1.39 0.00 0.00 0.00 0.00 0.00 44.72 43.34 1wm9 s GLY 175 CO -0.07 -1.33 0.00 -1.34 0.00 0.00 0.00 173.10 170.36 1wm9 s VAL 176 N -4.02 4.21 -0.24 1.40 -7.23 0.44 -0.62 120.40 114.34 1wm9 s VAL 176 Ca 0.21 -0.48 -0.02 0.00 -1.81 0.00 0.00 61.98 59.88 1wm9 s VAL 176 Cb 0.07 -2.84 0.02 0.00 0.56 0.00 0.00 36.38 34.19 1wm9 s VAL 176 CO -0.00 0.45 -0.07 -1.00 -0.31 0.00 0.00 175.10 174.17 1wm9 s HIS 177 N -1.02 3.02 0.43 2.82 3.76 -1.26 -1.85 115.29 121.19 1wm9 s HIS 177 Ca 0.18 -1.41 0.19 0.00 -0.15 0.00 0.00 55.06 53.86 1wm9 s HIS 177 Cb -0.11 -2.06 1.15 0.00 1.11 0.00 0.00 32.58 32.67 1wm9 s HIS 177 CO 0.08 -0.69 2.01 -0.07 -0.85 0.00 0.00 174.74 175.21 1wm9 h LEU 178 N 8.03 0.00 0.00 0.89 3.38 -1.75 -1.24 115.31 124.62 1wm9 h LEU 178 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1wm9 h LEU 178 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1wm9 h LEU 178 CO 0.59 0.18 0.00 0.00 0.09 0.00 0.00 178.44 179.29 1wm9 n MET 180 N -1.45 0.60 -0.12 0.00 0.00 -0.53 -4.46 117.12 111.16 1wm9 n MET 180 Ca 0.03 -0.08 -0.21 0.00 -0.00 0.00 0.00 57.70 57.44 1wm9 n MET 180 Cb 0.12 -1.24 -0.12 0.00 0.00 0.00 0.00 33.22 31.98 1wm9 n MET 180 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 175.97 174.64 1wm9 n MET 181 N -1.91 0.65 -0.39 2.12 2.00 -0.46 -1.44 117.12 117.68 1wm9 n MET 181 Ca -0.04 0.19 0.11 0.00 0.00 0.00 0.00 57.70 57.96 1wm9 n MET 181 Cb 0.33 -1.54 0.31 0.00 0.00 0.00 0.00 33.22 32.32 1wm9 n MET 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1wm9 n MET 182 N -3.50 2.92 -3.83 0.03 3.85 0.85 -4.50 117.12 112.93 1wm9 n MET 182 Ca -0.46 -2.64 -0.06 0.00 -1.00 0.00 0.00 57.70 53.54 1wm9 n MET 182 Cb 0.97 -1.59 -0.02 0.00 -1.05 0.00 0.00 33.22 31.53 1wm9 n MET 182 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 1wm9 s ARG 183 N -1.16 1.67 6.30 3.17 3.52 -1.25 -5.02 118.95 126.18 1wm9 s ARG 183 Ca 0.46 -0.93 0.00 0.00 -0.13 0.00 0.00 55.73 55.13 1wm9 s ARG 183 Cb 0.25 0.56 0.00 0.00 -1.56 0.00 0.00 34.95 34.20 1wm9 s ARG 183 CO 0.30 -0.76 0.00 0.41 -0.81 0.00 0.00 175.30 174.43 1wm9 n GLY 184 N -0.47 3.84 0.30 8.12 0.00 -1.26 -1.98 105.19 113.75 1wm9 n GLY 184 Ca -0.05 0.21 0.04 0.00 0.00 0.00 0.00 46.02 46.22 1wm9 n GLY 184 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1wm9 h VAL 185 N 0.00 1.10 -4.19 1.61 -1.51 -1.85 -3.47 116.25 107.94 1wm9 h VAL 185 Ca 0.00 -0.20 -0.39 0.00 -1.23 0.00 0.00 66.70 64.89 1wm9 h VAL 185 Cb 0.00 0.57 0.06 0.00 -2.13 0.00 0.00 31.29 29.79 1wm9 h VAL 185 CO 0.00 0.10 -0.58 -0.62 -1.23 0.00 0.00 177.57 175.24 1wm9 n GLU 186 N -4.47 -4.53 -2.50 5.19 1.02 -0.63 -4.99 120.64 109.73 1wm9 n GLU 186 Ca 0.02 0.88 -0.34 0.00 -0.02 0.00 0.00 57.16 57.70 1wm9 n GLU 186 Cb 0.07 -5.64 -0.03 0.00 -0.02 0.00 0.00 31.44 25.82 1wm9 n GLU 186 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1wm9 s LYS 187 N -5.61 3.77 -0.04 3.49 -0.14 -0.52 -4.86 119.74 115.83 1wm9 s LYS 187 Ca 0.27 1.42 0.06 0.00 -1.36 0.00 0.00 55.97 56.36 1wm9 s LYS 187 Cb -0.12 -2.13 -0.08 0.00 -1.68 0.00 0.00 37.83 33.81 1wm9 s LYS 187 CO 0.34 -0.47 0.07 1.04 -0.76 0.00 0.00 175.35 175.57 1wm9 n GLN 188 N -0.91 1.92 0.00 1.68 1.13 -1.26 -3.98 117.38 115.95 1wm9 n GLN 188 Ca 0.09 -0.02 0.13 0.00 -1.94 0.00 0.00 57.00 55.25 1wm9 n GLN 188 Cb 0.52 -1.15 0.25 0.00 0.11 0.00 0.00 30.24 29.97 1wm9 n GLN 188 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1wm9 n HIS 189 N -2.02 0.00 -2.98 1.08 8.25 -1.26 -4.99 115.22 113.30 1wm9 n HIS 189 Ca -0.06 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.04 1wm9 n HIS 189 Cb 0.48 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.53 1wm9 n HIS 189 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1wm9 s SER 190 N -2.02 7.09 -0.07 0.41 0.15 -1.26 -5.08 113.70 112.92 1wm9 s SER 190 Ca 0.31 1.55 -0.13 0.00 0.70 0.00 0.00 55.95 58.39 1wm9 s SER 190 Cb 0.20 -2.47 0.03 0.00 -1.71 0.00 0.00 66.02 62.07 1wm9 s SER 190 CO 0.32 -0.07 0.31 0.00 1.20 0.00 0.00 173.24 175.01 1wm9 s ARG 191 N -2.25 0.52 -0.08 5.44 1.70 -1.26 -4.69 118.95 118.33 1wm9 s ARG 191 Ca 0.48 0.13 0.00 0.00 -0.47 0.00 0.00 55.73 55.88 1wm9 s ARG 191 Cb -0.16 0.24 -0.03 0.00 -0.57 0.00 0.00 34.95 34.43 1wm9 s ARG 191 CO 0.21 -0.11 -0.06 0.99 -1.08 0.00 0.00 175.30 175.25 1wm9 s THR 192 N -0.57 3.80 -0.16 4.99 2.01 0.20 -4.93 115.64 120.99 1wm9 s THR 192 Ca -0.07 -0.44 -0.01 0.00 0.31 0.00 0.00 61.69 61.49 1wm9 s THR 192 Cb -0.04 -2.57 -0.01 0.00 0.01 0.00 0.00 72.50 69.89 1wm9 s THR 192 CO 0.02 0.59 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.73 1wm9 s VAL 193 N -0.71 3.01 0.14 3.82 1.01 -1.26 -1.12 120.40 125.29 1wm9 s VAL 193 Ca 0.11 -0.66 0.05 0.00 0.00 0.00 0.00 61.98 61.48 1wm9 s VAL 193 Cb -0.11 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 1wm9 s VAL 193 CO 0.02 0.50 -0.11 0.42 0.00 0.00 0.00 175.10 175.93 1wm9 s THR 194 N 0.71 1.19 0.27 3.92 -4.23 0.31 -4.99 115.64 112.83 1wm9 s THR 194 Ca -0.06 -1.93 -0.17 0.00 -1.18 0.00 0.00 61.69 58.35 1wm9 s THR 194 Cb -0.15 -1.71 0.01 0.00 1.34 0.00 0.00 72.50 71.99 1wm9 s THR 194 CO 0.02 -0.64 0.62 -0.94 -0.54 0.00 0.00 174.62 173.13 1wm9 s SER 195 N -2.91 -0.15 -0.12 3.99 1.04 -1.26 0.20 113.70 114.50 1wm9 s SER 195 Ca 0.14 -0.79 -0.06 0.00 0.48 0.00 0.00 55.95 55.71 1wm9 s SER 195 Cb -0.00 0.68 0.05 0.00 0.10 0.00 0.00 66.02 66.84 1wm9 s SER 195 CO 0.01 -1.28 0.28 0.00 0.98 0.00 0.00 173.24 173.23 1wm9 s ALA 196 N -3.85 -0.66 -0.11 5.32 0.00 -0.01 -4.71 121.76 117.73 1wm9 s ALA 196 Ca 0.16 1.06 0.01 0.00 0.00 0.00 0.00 51.96 53.19 1wm9 s ALA 196 Cb -0.04 -0.66 0.02 0.00 0.00 0.00 0.00 23.12 22.44 1wm9 s ALA 196 CO 0.08 -0.20 -0.11 -1.64 0.00 0.00 0.00 175.76 173.89 1wm9 s MET 197 N 1.13 1.86 0.17 0.00 -1.94 -1.26 -0.78 119.30 118.49 1wm9 s MET 197 Ca -0.08 -0.41 0.10 0.00 -1.71 0.00 0.00 55.69 53.59 1wm9 s MET 197 Cb -0.09 -1.74 -0.04 0.00 2.01 0.00 0.00 34.83 34.97 1wm9 s MET 197 CO -0.08 -0.18 -0.21 -0.51 -0.01 0.00 0.00 175.02 174.03 1wm9 s LEU 198 N 1.37 2.42 0.00 -0.03 1.02 0.42 -4.40 118.68 119.48 1wm9 s LEU 198 Ca 0.00 -0.85 0.00 0.00 0.02 0.00 0.00 54.13 53.30 1wm9 s LEU 198 Cb -0.13 -1.00 0.00 0.00 0.02 0.00 0.00 46.19 45.08 1wm9 s LEU 198 CO -0.06 0.05 0.00 0.61 0.02 0.00 0.00 176.35 176.97 1wm9 n GLY 199 N 0.36 3.01 0.30 -3.19 0.00 -1.26 -1.26 105.19 103.15 1wm9 n GLY 199 Ca -0.13 -0.26 0.19 0.00 0.00 0.00 0.00 46.02 45.82 1wm9 n GLY 199 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1wm9 h VAL 200 N 0.00 0.00 0.00 1.61 -1.51 -1.57 -2.09 116.25 112.69 1wm9 h VAL 200 Ca 0.00 -0.33 -0.06 0.00 -1.23 0.00 0.00 66.70 65.08 1wm9 h VAL 200 Cb 0.00 1.33 -0.01 0.00 -2.13 0.00 0.00 31.29 30.48 1wm9 h VAL 200 CO 0.00 0.00 -0.31 -0.26 -1.23 0.00 0.00 177.57 175.77 1wm9 h PHE 201 N 0.00 0.00 0.12 5.19 0.04 -1.78 0.89 116.94 121.40 1wm9 h PHE 201 Ca -0.00 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.43 1wm9 h PHE 201 Cb 0.33 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.46 1wm9 h PHE 201 CO 0.00 0.31 -1.80 -0.09 -0.60 0.00 0.00 178.31 176.13 1wm9 h ARG 202 N 0.00 0.26 0.00 1.51 2.43 -1.51 -3.40 114.38 113.67 1wm9 h ARG 202 Ca -0.00 -0.44 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 1wm9 h ARG 202 Cb 0.80 0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1wm9 h ARG 202 CO 0.04 1.21 -0.89 0.93 -1.51 0.00 0.00 179.97 179.75 1wm9 h GLU 203 N -0.09 0.00 -4.60 0.20 4.39 -1.43 -3.44 114.58 109.61 1wm9 h GLU 203 Ca -0.39 0.00 -0.70 0.00 0.34 0.00 0.00 59.36 58.61 1wm9 h GLU 203 Cb 1.93 0.00 -0.30 0.00 -0.10 0.00 0.00 28.75 30.28 1wm9 h GLU 203 CO 0.07 0.00 -0.57 1.21 -1.16 0.00 0.00 179.01 178.56 1wm9 s ASN 204 N -4.95 5.36 0.15 1.42 3.04 0.30 -4.99 114.94 115.27 1wm9 s ASN 204 Ca 0.02 -1.37 -0.17 0.00 0.04 0.00 0.00 52.86 51.37 1wm9 s ASN 204 Cb 0.11 -1.88 0.05 0.00 -1.54 0.00 0.00 41.25 37.99 1wm9 s ASN 204 CO 0.77 -0.41 1.71 -0.61 -3.04 0.00 0.00 177.10 175.52 1wm9 h GLN 205 N 8.23 0.10 -0.86 0.43 5.75 -1.85 -2.02 115.11 124.89 1wm9 h GLN 205 Ca -0.22 -0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.25 1wm9 h GLN 205 Cb 1.08 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.56 1wm9 h GLN 205 CO 0.65 0.07 0.44 0.87 -2.65 0.00 0.00 178.83 178.20 1wm9 h LYS 206 N 0.10 1.22 -0.64 1.69 6.56 -1.95 -1.47 116.57 122.08 1wm9 h LYS 206 Ca 0.15 -0.16 -0.03 0.00 -1.06 0.00 0.00 60.65 59.55 1wm9 h LYS 206 Cb 0.20 -0.23 -0.03 0.00 -0.57 0.00 0.00 32.23 31.61 1wm9 h LYS 206 CO -0.25 0.92 0.27 1.15 -2.06 0.00 0.00 179.45 179.48 1wm9 h THR 207 N 1.21 1.23 0.09 -0.16 2.02 -1.77 -0.41 112.91 115.12 1wm9 h THR 207 Ca 0.30 -0.70 -0.00 0.00 0.77 0.00 0.00 66.41 66.77 1wm9 h THR 207 Cb 0.08 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1wm9 h THR 207 CO -0.04 0.28 -0.04 -0.09 0.37 0.00 0.00 175.52 176.00 1wm9 h ARG 208 N 0.90 -0.11 -0.83 6.66 2.43 -1.05 -2.24 114.38 120.13 1wm9 h ARG 208 Ca 0.22 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.46 1wm9 h ARG 208 Cb 0.18 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.69 1wm9 h ARG 208 CO -0.02 0.10 0.51 0.93 -1.51 0.00 0.00 179.97 179.98 1wm9 h GLU 209 N -0.32 0.89 -0.88 0.20 5.08 -1.14 -0.05 114.58 118.37 1wm9 h GLU 209 Ca -0.01 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1wm9 h GLU 209 Cb 0.27 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 1wm9 h GLU 209 CO 0.02 0.59 0.47 1.49 -1.00 0.00 0.00 179.01 180.58 1wm9 h GLU 210 N 0.92 1.22 0.06 2.33 4.81 -0.93 0.17 114.58 123.17 1wm9 h GLU 210 Ca 0.37 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 1wm9 h GLU 210 Cb 0.19 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.33 1wm9 h GLU 210 CO -0.18 0.90 -0.03 0.35 -0.73 0.00 0.00 179.01 179.32 1wm9 h PHE 211 N 1.23 -0.08 -0.23 0.92 3.57 -0.68 -2.46 116.94 119.21 1wm9 h PHE 211 Ca 0.31 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.78 1wm9 h PHE 211 Cb 0.04 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1wm9 h PHE 211 CO 0.01 0.23 0.01 -0.07 -2.23 0.00 0.00 178.31 176.26 1wm9 h LEU 212 N -0.39 0.30 -0.82 0.59 3.38 -0.79 -2.32 115.31 115.26 1wm9 h LEU 212 Ca -0.01 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 1wm9 h LEU 212 Cb 0.34 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1wm9 h LEU 212 CO 0.01 0.35 -0.18 0.28 0.09 0.00 0.00 178.44 178.99 1wm9 h SER 213 N 0.32 0.69 0.25 -0.43 0.02 -0.58 -2.40 113.55 111.42 1wm9 h SER 213 Ca 0.08 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.79 1wm9 h SER 213 Cb 0.20 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.55 1wm9 h SER 213 CO 0.00 0.87 -0.07 0.45 -1.14 0.00 0.00 176.83 176.94 1wm9 h HIS 214 N 0.61 0.00 0.00 3.45 3.86 -0.93 -2.26 115.15 119.89 1wm9 h HIS 214 Ca 0.10 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 1wm9 h HIS 214 Cb 0.65 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.12 1wm9 h HIS 214 CO 0.03 0.07 -0.16 1.28 0.86 0.00 0.00 177.93 180.00 1wm9 n LEU 215 N -3.64 0.42 -0.38 2.43 4.77 -0.90 -5.12 117.00 114.57 1wm9 n LEU 215 Ca -0.02 0.41 0.14 0.00 -0.03 0.00 0.00 56.01 56.51 1wm9 n LEU 215 Cb 0.18 -0.36 0.61 0.00 -2.33 0.00 0.00 43.42 41.52 1wm9 n LEU 215 CO 0.28 -0.04 0.92 0.54 -1.33 0.00 0.00 177.39 177.76