#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wm9 s VAL 33 N 0.00 5.44 -1.08 3.84 1.01 -1.26 -5.01 120.40 123.34 1wm9 s VAL 33 Ca 0.00 0.26 -0.23 0.00 0.00 0.00 0.00 61.98 62.01 1wm9 s VAL 33 Cb 0.00 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1wm9 s VAL 33 CO 0.00 0.58 1.84 -0.62 0.00 0.00 0.00 175.10 176.91 1wm9 s ASP 34 N -1.12 5.54 0.35 3.32 -1.08 -1.26 -4.79 116.67 117.62 1wm9 s ASP 34 Ca 0.17 -1.41 0.03 0.00 -0.52 0.00 0.00 52.55 50.82 1wm9 s ASP 34 Cb -0.13 -2.58 0.64 0.00 -1.46 0.00 0.00 42.92 39.40 1wm9 s ASP 34 CO 0.07 -2.47 1.99 -0.07 0.52 0.00 0.00 175.17 175.21 1wm9 h LEU 35 N 16.34 0.74 -1.06 -1.34 3.38 -1.95 -2.17 115.31 129.25 1wm9 h LEU 35 Ca 0.21 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 1wm9 h LEU 35 Cb 0.96 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 1wm9 h LEU 35 CO 1.28 0.52 0.06 -0.08 0.09 0.00 0.00 178.44 180.31 1wm9 h GLU 36 N 0.86 0.74 -0.06 1.13 4.81 -2.00 -0.80 114.58 119.26 1wm9 h GLU 36 Ca 0.27 -0.16 -0.21 0.00 -0.13 0.00 0.00 59.36 59.12 1wm9 h GLU 36 Cb 0.01 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.29 1wm9 h GLU 36 CO -0.07 0.71 -0.84 -0.09 -0.73 0.00 0.00 179.01 177.98 1wm9 h ARG 37 N 0.70 0.52 -0.69 1.92 9.65 -1.83 -2.76 114.38 121.89 1wm9 h ARG 37 Ca 0.15 -0.48 -0.07 0.00 -1.10 0.00 0.00 59.98 58.48 1wm9 h ARG 37 Cb 0.34 0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 29.01 1wm9 h ARG 37 CO 0.01 1.11 0.16 -0.07 2.80 0.00 0.00 179.97 183.97 1wm9 h LEU 38 N 0.33 1.04 -0.24 3.80 3.38 -1.05 -1.49 115.31 121.08 1wm9 h LEU 38 Ca -0.06 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.71 1wm9 h LEU 38 Cb 1.46 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 1wm9 h LEU 38 CO 0.15 1.00 0.09 1.56 0.09 0.00 0.00 178.44 181.34 1wm9 h GLN 39 N 1.04 0.21 -0.31 1.13 4.20 -1.10 0.07 115.11 120.35 1wm9 h GLN 39 Ca 0.22 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.91 1wm9 h GLN 39 Cb 0.38 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1wm9 h GLN 39 CO 0.00 0.14 0.18 0.00 -0.67 0.00 0.00 178.83 178.48 1wm9 h ALA 40 N 1.14 0.39 -0.55 3.87 0.00 -1.29 0.67 119.26 123.50 1wm9 h ALA 40 Ca 0.10 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1wm9 h ALA 40 Cb 0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1wm9 h ALA 40 CO -0.10 -0.10 0.33 -0.07 0.00 0.00 0.00 179.25 179.32 1wm9 h LEU 41 N 0.38 0.53 -0.82 0.00 3.38 -0.97 -0.87 115.31 116.96 1wm9 h LEU 41 Ca 0.11 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1wm9 h LEU 41 Cb 0.03 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1wm9 h LEU 41 CO -0.02 0.38 0.09 0.00 0.09 0.00 0.00 178.44 178.98 1wm9 h ALA 42 N 1.24 1.02 -0.54 1.53 0.00 -0.70 0.97 119.26 122.78 1wm9 h ALA 42 Ca 0.22 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1wm9 h ALA 42 Cb 0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1wm9 h ALA 42 CO -0.10 0.62 0.22 0.00 0.00 0.00 0.00 179.25 180.00 1wm9 h ALA 43 N 1.17 0.70 -0.30 0.00 0.00 -0.35 -0.81 119.26 119.67 1wm9 h ALA 43 Ca 0.19 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1wm9 h ALA 43 Cb 0.41 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1wm9 h ALA 43 CO 0.01 0.30 -0.29 1.49 0.00 0.00 0.00 179.25 180.76 1wm9 h GLU 44 N 0.73 0.62 -0.05 0.00 4.81 -0.92 -2.75 114.58 117.03 1wm9 h GLU 44 Ca 0.18 -0.27 0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1wm9 h GLU 44 Cb 0.18 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1wm9 h GLU 44 CO -0.02 0.84 -0.04 2.35 -0.73 0.00 0.00 179.01 181.41 1wm9 h TRP 45 N 0.54 -0.11 -0.74 0.92 2.91 -0.18 -0.96 115.95 118.32 1wm9 h TRP 45 Ca 0.07 0.01 0.09 0.00 1.13 0.00 0.00 58.89 60.18 1wm9 h TRP 45 Cb 0.77 0.06 -0.07 0.00 -0.51 0.00 0.00 29.16 29.41 1wm9 h TRP 45 CO 0.03 -0.07 0.40 -0.07 -1.03 0.00 0.00 178.44 177.70 1wm9 h LEU 46 N -0.06 0.55 -0.60 0.65 3.38 -1.02 -2.10 115.31 116.12 1wm9 h LEU 46 Ca 0.04 0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1wm9 h LEU 46 Cb 0.11 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1wm9 h LEU 46 CO -0.09 0.32 0.04 -0.61 0.09 0.00 0.00 178.44 178.19 1wm9 h GLN 47 N 0.68 1.03 -0.18 1.13 4.15 -1.16 -2.02 115.11 118.74 1wm9 h GLN 47 Ca 0.36 -0.31 -0.11 0.00 0.77 0.00 0.00 58.65 59.35 1wm9 h GLN 47 Cb 0.33 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.91 1wm9 h GLN 47 CO -0.25 1.00 -0.38 0.28 -1.93 0.00 0.00 178.83 177.55 1wm9 h VAL 48 N 0.93 1.30 0.00 2.39 2.07 -0.66 -2.89 116.25 119.38 1wm9 h VAL 48 Ca 0.17 -1.49 0.00 0.00 0.82 0.00 0.00 66.70 66.20 1wm9 h VAL 48 Cb 0.51 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1wm9 h VAL 48 CO 0.02 0.46 0.00 2.30 0.02 0.00 0.00 177.57 180.37 1wm9 n ILE 49 N -4.04 0.55 0.00 4.57 -5.35 -0.84 -4.88 119.36 109.37 1wm9 n ILE 49 Ca -0.01 0.09 0.00 0.00 -0.27 0.00 0.00 62.75 62.55 1wm9 n ILE 49 Cb 0.48 -0.78 0.00 0.00 -1.74 0.00 0.00 39.64 37.60 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 0.73 0.96 3.95 3.28 0.00 -1.09 -5.12 105.19 107.90 1wm9 n GLY 50 Ca 0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.46 2.91 -0.41 1.61 0.41 -0.76 -5.03 118.70 116.96 1wm9 s GLU 51 Ca 0.00 -0.40 -0.14 0.00 -0.41 0.00 0.00 54.97 54.02 1wm9 s GLU 51 Cb 0.00 -2.45 0.03 0.00 -1.78 0.00 0.00 34.13 29.93 1wm9 s GLU 51 CO 0.00 -0.50 0.29 0.34 -0.49 0.00 0.00 175.26 174.91 1wm9 s ASP 52 N -4.29 6.02 0.28 -0.19 2.15 -1.26 -4.16 116.67 115.22 1wm9 s ASP 52 Ca 0.52 -1.02 0.20 0.00 0.43 0.00 0.00 52.55 52.68 1wm9 s ASP 52 Cb -0.10 -2.13 1.03 0.00 -0.30 0.00 0.00 42.92 41.42 1wm9 s ASP 52 CO 0.40 -0.47 1.60 -2.65 -0.17 0.00 0.00 175.17 173.88 1wm9 n PRO 53 N 5.12 0.13 0.05 4.34 -0.02 -1.26 -1.88 135.00 141.49 1wm9 n PRO 53 Ca -0.11 0.59 0.12 0.00 -2.02 0.00 0.00 63.50 62.08 1wm9 n PRO 53 Cb 0.46 -1.90 0.24 0.00 -0.02 0.00 0.00 33.50 32.28 1wm9 n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wm9 n GLY 54 N -1.13 -1.43 3.51 -1.23 0.00 -1.26 -4.02 105.19 99.63 1wm9 n GLY 54 Ca -0.01 -0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 1wm9 n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wm9 n ARG 55 N -1.99 0.58 0.23 1.61 1.74 -0.79 -4.73 116.66 113.31 1wm9 n ARG 55 Ca 0.04 0.23 0.07 0.00 -0.77 0.00 0.00 57.85 57.43 1wm9 n ARG 55 Cb 0.42 -1.86 0.53 0.00 -1.02 0.00 0.00 32.46 30.52 1wm9 n ARG 55 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 1wm9 h GLU 56 N 0.19 0.00 -0.00 5.56 4.81 -1.92 -1.50 114.58 121.71 1wm9 h GLU 56 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1wm9 h GLU 56 Cb 1.38 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.76 1wm9 h GLU 56 CO 0.47 0.23 -0.08 0.41 -0.73 0.00 0.00 179.01 179.31 1wm9 n GLY 57 N -0.61 -0.80 0.00 1.92 0.00 -1.26 -3.94 105.19 100.49 1wm9 n GLY 57 Ca -0.02 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.79 0.24 -0.15 0.99 4.77 -0.84 -4.73 117.00 116.49 1wm9 n LEU 58 Ca 0.16 -0.53 -0.05 0.00 -0.03 0.00 0.00 56.01 55.56 1wm9 n LEU 58 Cb 0.27 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.37 1wm9 n LEU 58 CO 0.22 0.06 0.68 -0.07 -1.33 0.00 0.00 177.39 176.95 1wm9 h LEU 59 N 0.00 -0.88 -2.21 2.23 3.38 -1.42 -1.51 115.31 114.90 1wm9 h LEU 59 Ca 0.00 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1wm9 h LEU 59 Cb 0.02 0.46 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1wm9 h LEU 59 CO 0.00 -0.27 0.00 0.29 0.09 0.00 0.00 178.44 178.55 1wm9 n LYS 60 N -5.42 2.61 -0.05 1.13 5.02 -1.26 -4.53 118.16 115.65 1wm9 n LYS 60 Ca 0.03 -2.07 -0.12 0.00 -2.02 0.00 0.00 58.31 54.14 1wm9 n LYS 60 Cb 0.33 -1.56 -0.06 0.00 -0.02 0.00 0.00 35.03 33.72 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 3.20 1.24 -0.62 -0.18 2.02 -1.56 -1.82 112.91 115.19 1wm9 h THR 61 Ca 0.00 -0.79 0.04 0.00 0.77 0.00 0.00 66.41 66.43 1wm9 h THR 61 Cb 0.91 1.44 -0.04 0.00 -1.74 0.00 0.00 68.15 68.73 1wm9 h THR 61 CO 0.07 0.24 0.41 -0.65 0.37 0.00 0.00 175.52 175.96 1wm9 h PRO 62 N 0.05 0.66 -0.13 6.66 0.11 -1.80 0.21 132.00 137.76 1wm9 h PRO 62 Ca 0.05 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.08 1wm9 h PRO 62 Cb 0.35 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.30 1wm9 h PRO 62 CO 0.01 0.44 -0.06 1.49 -0.21 0.00 0.00 178.00 179.66 1wm9 h GLU 63 N 0.68 0.27 -0.73 1.05 4.81 -1.85 -1.73 114.58 117.09 1wm9 h GLU 63 Ca 0.25 -0.12 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1wm9 h GLU 63 Cb 0.15 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 1wm9 h GLU 63 CO -0.07 0.61 0.30 0.00 -0.73 0.00 0.00 179.01 179.12 1wm9 h ARG 64 N -0.07 1.08 -0.58 1.92 3.08 -0.67 -2.21 114.38 116.93 1wm9 h ARG 64 Ca 0.03 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 1wm9 h ARG 64 Cb 0.52 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 1wm9 h ARG 64 CO 0.02 0.88 0.28 0.28 -1.07 0.00 0.00 179.97 180.36 1wm9 h VAL 65 N 1.04 1.21 0.09 2.04 2.07 -0.57 -0.20 116.25 121.92 1wm9 h VAL 65 Ca 0.24 -0.59 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 1wm9 h VAL 65 Cb 0.19 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1wm9 h VAL 65 CO -0.02 0.24 -0.04 0.00 0.02 0.00 0.00 177.57 177.76 1wm9 h ALA 66 N 1.11 -0.12 -0.28 1.67 0.00 -1.06 -0.49 119.26 120.09 1wm9 h ALA 66 Ca 0.20 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1wm9 h ALA 66 Cb 0.12 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1wm9 h ALA 66 CO -0.03 -0.56 0.12 0.87 0.00 0.00 0.00 179.25 179.66 1wm9 h LYS 67 N -0.13 0.25 -0.29 0.00 1.57 -1.25 -1.86 116.57 114.87 1wm9 h LYS 67 Ca -0.01 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.82 1wm9 h LYS 67 Cb 0.10 -0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.29 1wm9 h LYS 67 CO 0.02 0.17 -0.14 0.00 -0.57 0.00 0.00 179.45 178.93 1wm9 h ALA 68 N 1.16 0.10 0.00 3.86 0.00 -0.73 -1.77 119.26 121.87 1wm9 h ALA 68 Ca 0.12 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1wm9 h ALA 68 Cb 0.06 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1wm9 h ALA 68 CO -0.10 -0.53 -0.24 -1.49 0.00 0.00 0.00 179.25 176.89 1wm9 h TRP 69 N -0.10 0.00 -0.33 0.00 4.06 -0.84 0.07 115.95 118.81 1wm9 h TRP 69 Ca 0.15 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.99 1wm9 h TRP 69 Cb 0.33 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.48 1wm9 h TRP 69 CO -0.34 0.24 -0.25 0.00 -3.56 0.00 0.00 178.44 174.53 1wm9 h ALA 70 N 1.76 0.47 -0.26 1.49 0.00 -0.61 -2.59 119.26 119.53 1wm9 h ALA 70 Ca -0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 1wm9 h ALA 70 Cb 0.58 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1wm9 h ALA 70 CO 0.03 0.46 0.05 0.35 0.00 0.00 0.00 179.25 180.15 1wm9 h PHE 71 N 0.52 0.45 0.00 0.00 3.57 -0.65 -1.96 116.94 118.87 1wm9 h PHE 71 Ca 0.06 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1wm9 h PHE 71 Cb 0.81 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.43 1wm9 h PHE 71 CO 0.07 0.52 0.00 1.28 -2.23 0.00 0.00 178.31 177.95 1wm9 n LEU 72 N -4.69 0.24 -0.01 0.59 4.77 -0.05 -2.12 117.00 115.73 1wm9 n LEU 72 Ca -0.03 0.58 0.01 0.00 -0.03 0.00 0.00 56.01 56.54 1wm9 n LEU 72 Cb 0.19 -0.57 0.01 0.00 -2.33 0.00 0.00 43.42 40.72 1wm9 n LEU 72 CO 0.37 -0.49 0.49 0.35 -1.33 0.00 0.00 177.39 176.78 1wm9 n THR 73 N -1.79 1.02 0.23 -5.08 -2.24 -0.98 -2.70 114.28 102.73 1wm9 n THR 73 Ca 0.02 -1.04 0.13 0.00 -2.27 0.00 0.00 64.05 60.88 1wm9 n THR 73 Cb 0.12 0.47 0.65 0.00 -2.10 0.00 0.00 70.33 69.47 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 0.00 0.00 0.00 -0.78 0.11 -0.81 -2.71 114.38 110.19 1wm9 h ARG 74 Ca 0.00 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.06 1wm9 h ARG 74 Cb 0.56 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.63 1wm9 h ARG 74 CO 0.00 0.00 -0.09 0.78 0.10 0.00 0.00 179.97 180.76 1wm9 h GLY 75 N 0.49 0.00 1.85 0.08 0.00 -1.48 -2.35 103.07 101.65 1wm9 h GLY 75 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 1wm9 h GLY 75 CO 0.00 0.00 -0.55 -0.97 0.00 0.00 0.00 176.54 175.02 1wm9 h TYR 76 N 0.00 0.20 -0.01 5.60 0.05 -1.65 -3.18 116.97 117.98 1wm9 h TYR 76 Ca -0.00 -0.07 0.00 0.00 0.05 0.00 0.00 58.73 58.71 1wm9 h TYR 76 Cb 0.18 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.88 1wm9 h TYR 76 CO 0.00 0.67 -0.15 0.54 -1.05 0.00 0.00 178.16 178.17 1wm9 n ARG 77 N -3.91 0.75 -2.88 4.88 3.00 -0.89 -4.91 116.66 112.71 1wm9 n ARG 77 Ca -0.02 -0.33 -0.31 0.00 -0.01 0.00 0.00 57.85 57.19 1wm9 n ARG 77 Cb 0.57 -1.49 -0.04 0.00 0.00 0.00 0.00 32.46 31.50 1wm9 n ARG 77 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 1wm9 s GLN 78 N -2.47 3.83 -0.11 5.56 -0.21 -1.17 -5.08 119.66 120.00 1wm9 s GLN 78 Ca 0.28 0.54 0.01 0.00 0.02 0.00 0.00 55.36 56.21 1wm9 s GLN 78 Cb 0.20 -2.38 -0.01 0.00 1.00 0.00 0.00 33.01 31.82 1wm9 s GLN 78 CO 0.49 -0.02 -0.16 1.03 -2.12 0.00 0.00 175.29 174.50 1wm9 s ARG 79 N -3.70 3.19 0.23 2.91 0.52 -1.26 -5.04 118.95 115.80 1wm9 s ARG 79 Ca 0.52 -0.75 -0.06 0.00 -0.52 0.00 0.00 55.73 54.92 1wm9 s ARG 79 Cb -0.10 -2.51 0.39 0.00 0.52 0.00 0.00 34.95 33.25 1wm9 s ARG 79 CO 0.29 0.25 1.73 1.25 0.02 0.00 0.00 175.30 178.84 1wm9 h LEU 80 N 6.57 0.24 -1.34 2.53 5.85 -1.98 -0.30 115.31 126.87 1wm9 h LEU 80 Ca -0.26 0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.50 1wm9 h LEU 80 Cb 1.21 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 1wm9 h LEU 80 CO 0.53 0.11 -0.31 1.05 -0.34 0.00 0.00 178.44 179.48 1wm9 h GLU 81 N 0.42 0.00 0.06 1.25 4.11 -1.99 -1.16 114.58 117.28 1wm9 h GLU 81 Ca 0.37 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.56 1wm9 h GLU 81 Cb 0.53 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1wm9 h GLU 81 CO -0.37 0.31 -1.10 0.93 0.07 0.00 0.00 179.01 178.85 1wm9 h GLU 82 N 0.00 0.17 -0.56 1.06 5.08 -1.70 -2.16 114.58 116.47 1wm9 h GLU 82 Ca -0.00 -0.27 -0.11 0.00 -1.00 0.00 0.00 59.36 57.98 1wm9 h GLU 82 Cb 0.64 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 1wm9 h GLU 82 CO 0.04 1.10 -0.09 0.28 -1.00 0.00 0.00 179.01 179.34 1wm9 h VAL 83 N 0.06 1.27 -0.09 3.13 2.07 -0.67 -3.00 116.25 119.02 1wm9 h VAL 83 Ca -0.08 -1.25 -0.20 0.00 0.82 0.00 0.00 66.70 65.99 1wm9 h VAL 83 Cb 1.82 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 32.51 1wm9 h VAL 83 CO 0.17 0.45 -0.76 0.58 0.02 0.00 0.00 177.57 178.03 1wm9 h VAL 84 N 0.94 1.36 -6.17 2.57 2.07 -1.27 -3.48 116.25 112.27 1wm9 h VAL 84 Ca 0.15 -2.13 -0.47 0.00 0.82 0.00 0.00 66.70 65.06 1wm9 h VAL 84 Cb 0.66 2.11 -0.10 0.00 -1.52 0.00 0.00 31.29 32.44 1wm9 h VAL 84 CO 0.05 0.65 -0.72 0.61 0.02 0.00 0.00 177.57 178.17 1wm9 n GLY 85 N 0.62 -0.48 2.70 2.17 0.00 -0.81 -2.03 105.19 107.35 1wm9 n GLY 85 Ca -0.05 0.15 -0.01 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.45 0.26 2.23 -0.02 0.00 -1.26 -4.86 105.19 100.09 1wm9 n GLY 86 Ca 0.04 -0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 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 1.03 6.63 -3.39 4.61 0.00 -0.86 -4.81 120.51 123.72 1wm9 n ALA 87 Ca -0.01 -2.65 -0.34 0.00 0.00 0.00 0.00 53.44 50.44 1wm9 n ALA 87 Cb 0.38 -2.48 -0.14 0.00 0.00 0.00 0.00 19.45 17.20 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 0.08 3.20 0.33 0.00 1.01 -1.26 -1.36 120.40 122.39 1wm9 s VAL 88 Ca 0.64 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 62.13 1wm9 s VAL 88 Cb 0.30 -2.41 -0.06 0.00 0.00 0.00 0.00 36.38 34.21 1wm9 s VAL 88 CO -0.08 0.47 -0.06 -0.36 0.00 0.00 0.00 175.10 175.06 1wm9 s PHE 89 N 1.04 2.23 0.32 5.22 0.08 0.22 -4.97 117.98 122.12 1wm9 s PHE 89 Ca -0.00 -0.61 -0.29 0.00 0.12 0.00 0.00 56.93 56.15 1wm9 s PHE 89 Cb -0.15 -1.32 -0.10 0.00 -0.57 0.00 0.00 43.02 40.89 1wm9 s PHE 89 CO -0.01 0.43 1.22 -2.14 -0.10 0.00 0.00 175.22 174.62 1wm9 s PRO 90 N -3.68 4.43 0.43 0.24 0.02 -1.26 -0.12 135.00 135.06 1wm9 s PRO 90 Ca 0.32 2.04 -0.26 0.00 0.02 0.00 0.00 61.00 63.12 1wm9 s PRO 90 Cb 0.04 -3.08 -0.08 0.00 0.02 0.00 0.00 34.50 31.40 1wm9 s PRO 90 CO 0.15 -0.06 1.36 0.00 -0.33 0.00 0.00 177.00 178.13 1wm9 s ALA 91 N -1.17 3.24 -0.14 -1.55 0.00 0.69 -4.57 121.76 118.25 1wm9 s ALA 91 Ca 0.48 1.34 0.17 0.00 0.00 0.00 0.00 51.96 53.95 1wm9 s ALA 91 Cb -0.36 -3.54 -0.24 0.00 0.00 0.00 0.00 23.12 18.98 1wm9 s ALA 91 CO 0.48 -1.01 0.32 0.39 0.00 0.00 0.00 175.76 175.93 1wm9 n GLU 92 N -0.05 0.67 -2.86 0.00 -0.58 -1.26 -4.96 120.64 111.59 1wm9 n GLU 92 Ca 0.04 0.05 -0.08 0.00 -0.42 0.00 0.00 57.16 56.76 1wm9 n GLU 92 Cb 0.43 -1.61 -0.02 0.00 -0.57 0.00 0.00 31.44 29.67 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 1.62 2.89 0.00 0.62 0.00 -1.26 -5.06 105.19 104.01 1wm9 n GLY 93 Ca -0.24 -1.58 0.08 0.00 0.00 0.00 0.00 46.02 44.28 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 -2.03 0.87 -4.76 1.61 3.41 -1.26 -4.82 113.62 106.64 1wm9 n SER 94 Ca 0.01 -0.56 -0.32 0.00 -0.26 0.00 0.00 58.87 57.74 1wm9 n SER 94 Cb 0.29 1.31 0.08 0.00 -0.26 0.00 0.00 64.21 65.63 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 -2.85 2.39 0.40 4.33 0.41 -1.26 -4.54 118.70 117.58 1wm9 s GLU 95 Ca 0.02 1.35 -0.27 0.00 -0.41 0.00 0.00 54.97 55.65 1wm9 s GLU 95 Cb 0.12 -1.90 -0.09 0.00 -1.78 0.00 0.00 34.13 30.48 1wm9 s GLU 95 CO 0.71 -1.56 1.38 1.41 -0.49 0.00 0.00 175.26 176.71 1wm9 s MET 96 N -4.44 4.00 -0.15 1.61 0.00 -1.26 -4.53 119.30 114.53 1wm9 s MET 96 Ca 0.65 2.33 -0.01 0.00 0.00 0.00 0.00 55.69 58.67 1wm9 s MET 96 Cb -0.20 -2.84 -0.01 0.00 0.00 0.00 0.00 34.83 31.78 1wm9 s MET 96 CO 0.49 -0.53 -0.12 0.08 0.00 0.00 0.00 175.02 174.94 1wm9 s VAL 97 N -1.19 3.06 -0.23 10.11 1.01 0.25 -4.95 120.40 128.45 1wm9 s VAL 97 Ca 0.55 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.91 1wm9 s VAL 97 Cb -0.42 -2.30 0.05 0.00 0.00 0.00 0.00 36.38 33.71 1wm9 s VAL 97 CO 0.55 0.51 -0.10 -0.69 0.00 0.00 0.00 175.10 175.36 1wm9 s VAL 98 N 0.58 1.91 -0.47 2.92 1.01 -1.26 -1.35 120.40 123.75 1wm9 s VAL 98 Ca -0.07 -1.35 -0.14 0.00 0.00 0.00 0.00 61.98 60.41 1wm9 s VAL 98 Cb -0.15 -2.02 0.08 0.00 0.00 0.00 0.00 36.38 34.29 1wm9 s VAL 98 CO 0.03 0.04 0.37 -0.69 0.00 0.00 0.00 175.10 174.86 1wm9 s VAL 99 N 1.24 4.96 0.33 2.92 1.01 0.18 -4.96 120.40 126.07 1wm9 s VAL 99 Ca -0.05 -1.21 0.08 0.00 0.00 0.00 0.00 61.98 60.80 1wm9 s VAL 99 Cb -0.18 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1wm9 s VAL 99 CO -0.07 -0.59 0.20 -1.59 0.00 0.00 0.00 175.10 173.05 1wm9 s LYS 100 N 1.58 2.55 -1.03 2.72 -2.85 -1.26 -0.22 119.74 121.23 1wm9 s LYS 100 Ca 0.04 -1.40 0.00 0.00 -1.00 0.00 0.00 55.97 53.61 1wm9 s LYS 100 Cb -0.25 -2.32 0.00 0.00 -2.06 0.00 0.00 37.83 33.20 1wm9 s LYS 100 CO 0.05 0.14 0.00 0.41 0.10 0.00 0.00 175.35 176.05 1wm9 n GLY 101 N -1.23 0.48 3.58 0.59 0.00 -1.22 -4.96 105.19 102.43 1wm9 n GLY 101 Ca -0.03 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.48 3.82 0.62 1.61 1.01 -0.77 -4.82 120.40 119.40 1wm9 s VAL 102 Ca 0.00 0.73 -0.19 0.00 0.00 0.00 0.00 61.98 62.53 1wm9 s VAL 102 Cb 0.00 -4.41 -0.02 0.00 0.00 0.00 0.00 36.38 31.94 1wm9 s VAL 102 CO 0.00 -1.10 1.28 -1.61 0.00 0.00 0.00 175.10 173.67 1wm9 s GLU 103 N 5.37 2.72 0.05 2.72 8.01 -1.26 -0.36 118.70 135.95 1wm9 s GLU 103 Ca 0.53 2.02 -0.09 0.00 0.01 0.00 0.00 54.97 57.45 1wm9 s GLU 103 Cb -0.11 -1.91 0.00 0.00 -4.31 0.00 0.00 34.13 27.80 1wm9 s GLU 103 CO 0.26 -1.46 0.18 -0.59 0.01 0.00 0.00 175.26 173.67 1wm9 s PHE 104 N -1.43 0.10 -0.01 1.61 -0.71 -0.70 -4.85 117.98 111.99 1wm9 s PHE 104 Ca 0.80 -0.40 0.00 0.00 -1.04 0.00 0.00 56.93 56.30 1wm9 s PHE 104 Cb -0.36 -0.05 0.01 0.00 -1.21 0.00 0.00 43.02 41.41 1wm9 s PHE 104 CO 0.39 -0.46 -0.00 0.71 -1.34 0.00 0.00 175.22 174.52 1wm9 s TYR 105 N -2.99 0.14 0.33 3.49 2.02 -1.26 -2.55 117.35 116.54 1wm9 s TYR 105 Ca -0.02 0.01 -0.05 0.00 -0.37 0.00 0.00 57.07 56.64 1wm9 s TYR 105 Cb 0.01 -0.18 0.01 0.00 -0.40 0.00 0.00 41.96 41.40 1wm9 s TYR 105 CO -0.06 -0.04 0.50 0.45 -1.57 0.00 0.00 175.55 174.82 1wm9 s SER 106 N 0.39 0.70 -0.09 2.29 0.15 -0.50 -4.27 113.70 112.38 1wm9 s SER 106 Ca -0.03 -1.39 0.02 0.00 0.70 0.00 0.00 55.95 55.25 1wm9 s SER 106 Cb -0.06 0.67 0.01 0.00 -1.71 0.00 0.00 66.02 64.93 1wm9 s SER 106 CO -0.01 -1.31 -0.16 -0.04 1.20 0.00 0.00 173.24 172.92 1wm9 s MET 107 N -3.11 2.23 0.11 5.44 -1.94 -1.23 -1.14 119.30 119.67 1wm9 s MET 107 Ca 0.28 -0.58 -0.30 0.00 -1.71 0.00 0.00 55.69 53.38 1wm9 s MET 107 Cb -0.01 -1.82 -0.06 0.00 2.01 0.00 0.00 34.83 34.95 1wm9 s MET 107 CO 0.18 0.03 1.12 0.00 -0.01 0.00 0.00 175.02 176.33 1wm9 h GLU 109 N 5.98 0.00 0.01 0.00 4.11 -1.57 0.92 114.58 124.03 1wm9 h GLU 109 Ca -0.43 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 58.74 1wm9 h GLU 109 Cb 1.21 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.48 1wm9 h GLU 109 CO 0.76 0.00 -1.05 0.45 0.07 0.00 0.00 179.01 179.24 1wm9 h HIS 110 N 0.00 1.02 0.00 2.06 3.86 -1.91 -3.39 115.15 116.79 1wm9 h HIS 110 Ca 0.00 -0.56 0.00 0.00 -1.16 0.00 0.00 60.37 58.65 1wm9 h HIS 110 Cb 0.31 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.66 1wm9 h HIS 110 CO 0.00 1.40 0.00 0.72 0.86 0.00 0.00 177.93 180.91 1wm9 n HIS 111 N -3.84 0.00 -2.66 2.45 8.25 -1.20 -5.01 115.22 113.20 1wm9 n HIS 111 Ca -0.11 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.14 1wm9 n HIS 111 Cb 0.89 0.00 0.01 0.00 1.12 0.00 0.00 29.99 32.01 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 -0.13 -2.27 -4.55 2.41 4.77 0.31 -5.00 117.00 112.54 1wm9 n LEU 112 Ca 0.00 -0.13 -0.32 0.00 -0.03 0.00 0.00 56.01 55.53 1wm9 n LEU 112 Cb 0.09 -2.94 -0.11 0.00 -2.33 0.00 0.00 43.42 38.13 1wm9 n LEU 112 CO 0.00 -0.02 -0.42 -0.76 -1.33 0.00 0.00 177.39 174.86 1wm9 s LEU 113 N -6.23 3.00 0.49 2.23 1.43 -1.26 -4.85 118.68 113.49 1wm9 s LEU 113 Ca 0.13 -0.23 -0.23 0.00 -1.03 0.00 0.00 54.13 52.77 1wm9 s LEU 113 Cb -0.06 -1.73 -0.07 0.00 0.03 0.00 0.00 46.19 44.36 1wm9 s LEU 113 CO 0.16 0.27 1.33 -2.84 0.23 0.00 0.00 176.35 175.51 1wm9 s PRO 114 N -1.43 3.50 -0.01 1.29 0.02 -1.26 -1.84 135.00 135.27 1wm9 s PRO 114 Ca 0.16 2.18 0.02 0.00 0.02 0.00 0.00 61.00 63.39 1wm9 s PRO 114 Cb -0.11 -2.45 -0.00 0.00 0.02 0.00 0.00 34.50 31.96 1wm9 s PRO 114 CO 0.07 -0.88 -0.07 -0.59 -0.33 0.00 0.00 177.00 175.20 1wm9 s PHE 115 N -1.32 0.64 0.21 6.54 -0.12 -0.29 -2.23 117.98 121.42 1wm9 s PHE 115 Ca 0.65 -0.13 -0.13 0.00 -0.05 0.00 0.00 56.93 57.27 1wm9 s PHE 115 Cb -0.39 -0.43 0.00 0.00 -0.63 0.00 0.00 43.02 41.57 1wm9 s PHE 115 CO 0.47 -0.03 0.45 -0.59 -0.05 0.00 0.00 175.22 175.48 1wm9 s PHE 116 N -0.04 0.22 0.00 3.49 -0.71 -0.34 -1.40 117.98 119.20 1wm9 s PHE 116 Ca 0.01 -0.58 0.00 0.00 -1.04 0.00 0.00 56.93 55.32 1wm9 s PHE 116 Cb -0.04 0.20 0.00 0.00 -1.21 0.00 0.00 43.02 41.97 1wm9 s PHE 116 CO -0.00 -0.92 0.00 0.41 -1.34 0.00 0.00 175.22 173.37 1wm9 n GLY 117 N -0.33 -0.50 3.06 1.99 0.00 -1.06 0.32 105.19 108.67 1wm9 n GLY 117 Ca -0.05 0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 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 0.00 0.53 -0.09 1.61 1.02 0.15 -1.71 119.74 121.25 1wm9 s LYS 118 Ca 0.00 -0.95 0.04 0.00 0.02 0.00 0.00 55.97 55.08 1wm9 s LYS 118 Cb 0.00 0.02 0.00 0.00 -0.52 0.00 0.00 37.83 37.33 1wm9 s LYS 118 CO 0.00 -0.05 -0.22 0.08 -0.92 0.00 0.00 175.35 174.25 1wm9 s VAL 119 N -2.59 1.86 -0.15 3.17 1.01 0.51 -0.75 120.40 123.45 1wm9 s VAL 119 Ca -0.03 -0.91 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 1wm9 s VAL 119 Cb -0.02 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.74 1wm9 s VAL 119 CO -0.04 0.52 -0.14 -1.00 0.00 0.00 0.00 175.10 174.43 1wm9 s HIS 120 N 0.34 2.80 -0.07 5.22 0.09 0.69 -1.84 115.29 122.52 1wm9 s HIS 120 Ca -0.16 -0.94 0.04 0.00 -0.00 0.00 0.00 55.06 53.99 1wm9 s HIS 120 Cb -0.17 -1.89 -0.01 0.00 -0.00 0.00 0.00 32.58 30.50 1wm9 s HIS 120 CO 0.07 -0.42 -0.20 0.42 -0.00 0.00 0.00 174.74 174.61 1wm9 s ILE 121 N 0.75 2.47 -0.01 0.60 1.01 0.69 -1.02 121.20 125.69 1wm9 s ILE 121 Ca -0.06 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.70 1wm9 s ILE 121 Cb -0.15 -1.95 -0.00 0.00 0.01 0.00 0.00 42.46 40.37 1wm9 s ILE 121 CO 0.01 0.56 -0.05 -0.83 0.00 0.00 0.00 174.94 174.63 1wm9 s GLY 122 N -0.13 0.27 -0.01 6.18 0.00 -0.34 0.47 107.32 113.77 1wm9 s GLY 122 Ca -0.03 -0.21 -0.24 0.00 0.00 0.00 0.00 44.72 44.23 1wm9 s GLY 122 CO 0.04 -0.14 0.54 -2.52 0.00 0.00 0.00 173.10 171.02 1wm9 s TYR 123 N -0.04 -0.47 -0.27 1.90 -0.85 -0.46 0.18 117.35 117.34 1wm9 s TYR 123 Ca 0.01 0.71 -0.03 0.00 -0.52 0.00 0.00 57.07 57.24 1wm9 s TYR 123 Cb -0.03 0.32 0.02 0.00 0.38 0.00 0.00 41.96 42.65 1wm9 s TYR 123 CO -0.00 -0.57 -0.00 0.42 -1.52 0.00 0.00 175.55 173.87 1wm9 s ILE 124 N -1.64 3.27 0.89 -3.49 1.01 -1.06 -0.58 121.20 119.60 1wm9 s ILE 124 Ca -0.10 -0.95 -0.10 0.00 0.00 0.00 0.00 60.65 59.50 1wm9 s ILE 124 Cb -0.01 -2.69 0.13 0.00 0.01 0.00 0.00 42.46 39.89 1wm9 s ILE 124 CO 0.05 0.12 1.15 -2.84 0.00 0.00 0.00 174.94 173.41 1wm9 s PRO 125 N 1.38 1.21 -0.42 2.79 0.02 -1.26 -0.92 135.00 137.79 1wm9 s PRO 125 Ca 0.00 1.53 0.07 0.00 0.02 0.00 0.00 61.00 62.62 1wm9 s PRO 125 Cb -0.17 -1.75 0.23 0.00 0.02 0.00 0.00 34.50 32.83 1wm9 s PRO 125 CO -0.02 -2.49 0.57 -3.47 -0.33 0.00 0.00 177.00 171.27 1wm9 n ASP 126 N -4.07 -0.79 0.00 2.53 2.03 -1.26 -4.28 116.55 110.71 1wm9 n ASP 126 Ca 0.12 -2.77 0.00 0.00 0.52 0.00 0.00 54.79 52.66 1wm9 n ASP 126 Cb 0.52 0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1wm9 n ASP 126 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wm9 n GLY 127 N 1.82 2.79 2.94 0.27 0.00 -1.26 -4.86 105.19 106.89 1wm9 n GLY 127 Ca 0.20 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 1wm9 n GLY 127 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wm9 s LYS 128 N 0.00 0.27 0.25 1.61 -2.85 -1.26 -0.23 119.74 117.53 1wm9 s LYS 128 Ca 0.00 -0.23 0.11 0.00 -1.00 0.00 0.00 55.97 54.84 1wm9 s LYS 128 Cb 0.00 -0.19 -0.05 0.00 -2.06 0.00 0.00 37.83 35.54 1wm9 s LYS 128 CO 0.00 0.05 -0.14 0.96 0.10 0.00 0.00 175.35 176.32 1wm9 s ILE 129 N -0.38 2.83 0.06 3.79 -4.36 0.82 -4.74 121.20 119.22 1wm9 s ILE 129 Ca -0.02 -2.09 0.03 0.00 -0.26 0.00 0.00 60.65 58.31 1wm9 s ILE 129 Cb -0.03 -2.46 -0.04 0.00 1.25 0.00 0.00 42.46 41.18 1wm9 s ILE 129 CO -0.00 -0.30 0.02 -0.22 0.24 0.00 0.00 174.94 174.68 1wm9 s LEU 130 N -3.30 3.57 0.16 0.37 2.96 -1.26 -0.61 118.68 120.57 1wm9 s LEU 130 Ca 0.28 -0.09 -0.31 0.00 -0.22 0.00 0.00 54.13 53.79 1wm9 s LEU 130 Cb -0.06 -2.23 -0.11 0.00 0.50 0.00 0.00 46.19 44.29 1wm9 s LEU 130 CO 0.15 0.20 1.72 -0.83 -1.32 0.00 0.00 176.35 176.27 1wm9 s GLY 131 N -2.15 1.36 0.26 7.98 0.00 -0.47 -4.87 107.32 109.43 1wm9 s GLY 131 Ca 0.25 1.46 -0.06 0.00 0.00 0.00 0.00 44.72 46.37 1wm9 s GLY 131 CO 0.17 2.92 1.61 1.41 0.00 0.00 0.00 173.10 179.21 1wm9 h LEU 132 N 7.57 -0.49 -2.66 0.66 3.38 -1.97 -0.76 115.31 121.04 1wm9 h LEU 132 Ca -0.44 0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 1wm9 h LEU 132 Cb 1.21 0.42 -0.00 0.00 0.09 0.00 0.00 40.66 42.38 1wm9 h LEU 132 CO 0.94 -0.24 -0.00 0.77 0.09 0.00 0.00 178.44 180.00 1wm9 h SER 133 N 0.06 0.00 0.54 -0.43 4.64 -2.00 -1.94 113.55 114.43 1wm9 h SER 133 Ca 0.45 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.68 1wm9 h SER 133 Cb 0.79 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.87 1wm9 h SER 133 CO -0.77 0.00 -0.40 0.11 -0.87 0.00 0.00 176.83 174.90 1wm9 h LYS 134 N 0.00 0.00 -0.69 4.77 1.79 -1.49 -2.06 116.57 118.89 1wm9 h LYS 134 Ca -0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 1wm9 h LYS 134 Cb 0.11 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.73 1wm9 h LYS 134 CO 0.00 0.40 0.31 0.74 -1.08 0.00 0.00 179.45 179.82 1wm9 h PHE 135 N 0.00 1.01 -0.71 -1.35 0.04 -1.46 0.25 116.94 114.73 1wm9 h PHE 135 Ca -0.00 -0.06 -0.06 0.00 2.80 0.00 0.00 57.97 60.65 1wm9 h PHE 135 Cb 0.78 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 38.59 1wm9 h PHE 135 CO 0.00 0.77 0.21 0.00 -0.60 0.00 0.00 178.31 178.69 1wm9 h ALA 136 N 1.14 0.93 -0.31 2.45 0.00 -1.56 0.10 119.26 122.01 1wm9 h ALA 136 Ca 0.23 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1wm9 h ALA 136 Cb 0.15 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1wm9 h ALA 136 CO -0.03 0.61 -0.29 0.00 0.00 0.00 0.00 179.25 179.54 1wm9 h ARG 137 N 1.04 0.65 -0.27 0.00 3.08 -0.83 -0.44 114.38 117.62 1wm9 h ARG 137 Ca 0.23 -0.28 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 1wm9 h ARG 137 Cb 0.32 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1wm9 h ARG 137 CO -0.01 0.87 -0.05 0.82 -1.07 0.00 0.00 179.97 180.53 1wm9 h ILE 138 N 0.56 1.28 -0.28 2.04 2.04 -0.11 -1.66 117.51 121.38 1wm9 h ILE 138 Ca 0.07 -1.06 0.05 0.00 1.00 0.00 0.00 64.86 64.93 1wm9 h ILE 138 Cb 0.79 1.41 -0.05 0.00 -0.74 0.00 0.00 36.82 38.23 1wm9 h ILE 138 CO 0.06 0.33 -0.04 0.58 0.00 0.00 0.00 178.15 179.08 1wm9 h VAL 139 N 0.28 0.75 -0.64 1.67 2.07 -0.50 -2.31 116.25 117.57 1wm9 h VAL 139 Ca 0.07 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 1wm9 h VAL 139 Cb 0.52 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 1wm9 h VAL 139 CO 0.02 0.01 0.30 0.44 0.02 0.00 0.00 177.57 178.36 1wm9 h ASP 140 N 0.03 0.82 -0.96 0.57 3.32 -1.01 -0.94 116.42 118.25 1wm9 h ASP 140 Ca 0.13 -0.09 0.10 0.00 0.02 0.00 0.00 57.03 57.19 1wm9 h ASP 140 Cb 0.19 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 39.46 1wm9 h ASP 140 CO -0.26 0.70 0.61 -0.03 -1.72 0.00 0.00 179.24 178.55 1wm9 h MET 141 N 0.90 0.97 0.00 3.56 4.05 -0.72 -1.31 114.93 122.38 1wm9 h MET 141 Ca 0.22 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.56 1wm9 h MET 141 Cb 0.11 -0.22 -0.00 0.00 -0.80 0.00 0.00 31.60 30.69 1wm9 h MET 141 CO -0.03 0.64 -1.60 1.19 0.23 0.00 0.00 176.91 177.34 1wm9 n PHE 142 N -4.55 0.43 0.08 1.39 3.72 -1.05 -4.27 117.46 113.21 1wm9 n PHE 142 Ca 0.16 0.13 -0.14 0.00 -0.05 0.00 0.00 57.45 57.55 1wm9 n PHE 142 Cb 0.29 -0.73 -0.07 0.00 -0.94 0.00 0.00 39.48 38.03 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 1.93 0.29 -0.49 4.37 0.00 -0.91 -3.36 119.26 121.09 1wm9 h ALA 143 Ca -0.03 -0.76 -0.73 0.00 0.00 0.00 0.00 54.91 53.39 1wm9 h ALA 143 Cb 1.08 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.77 1wm9 h ALA 143 CO 0.00 0.87 2.70 0.54 0.00 0.00 0.00 179.25 183.36 1wm9 n ARG 144 N -3.68 3.82 -3.89 0.00 1.74 -0.52 -4.19 116.66 109.95 1wm9 n ARG 144 Ca -0.07 -3.09 -0.09 0.00 -0.77 0.00 0.00 57.85 53.82 1wm9 n ARG 144 Cb 0.89 -2.87 -0.01 0.00 -1.02 0.00 0.00 32.46 29.46 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 0.70 1.98 -0.10 5.56 0.52 -1.10 -1.61 118.95 124.90 1wm9 s ARG 145 Ca 0.51 -1.34 -0.22 0.00 -0.52 0.00 0.00 55.73 54.15 1wm9 s ARG 145 Cb 0.15 0.57 -0.03 0.00 0.52 0.00 0.00 34.95 36.16 1wm9 s ARG 145 CO -0.06 -0.90 0.67 -0.51 0.02 0.00 0.00 175.30 174.53 1wm9 s LEU 146 N -3.05 4.27 0.29 2.53 1.43 -1.26 -3.48 118.68 119.41 1wm9 s LEU 146 Ca 0.17 1.08 -0.02 0.00 -1.03 0.00 0.00 54.13 54.34 1wm9 s LEU 146 Cb -0.04 -3.01 -0.02 0.00 0.03 0.00 0.00 46.19 43.15 1wm9 s LEU 146 CO 0.11 -0.15 0.35 -1.10 0.23 0.00 0.00 176.35 175.79 1wm9 s GLN 147 N 1.08 1.64 -0.03 1.70 -1.52 0.15 -4.70 119.66 117.98 1wm9 s GLN 147 Ca 0.35 -1.71 0.05 0.00 -1.95 0.00 0.00 55.36 52.10 1wm9 s GLN 147 Cb -0.17 0.38 -0.01 0.00 -0.22 0.00 0.00 33.01 32.99 1wm9 s GLN 147 CO 0.15 -0.64 -0.18 0.14 -0.25 0.00 0.00 175.29 174.51 1wm9 s VAL 148 N -3.57 1.47 0.54 1.09 -7.23 -1.26 -1.56 120.40 109.88 1wm9 s VAL 148 Ca 0.34 -0.76 0.23 0.00 -1.81 0.00 0.00 61.98 59.97 1wm9 s VAL 148 Cb 0.02 -1.24 0.35 0.00 0.56 0.00 0.00 36.38 36.07 1wm9 s VAL 148 CO 0.18 0.42 2.06 -0.61 -0.31 0.00 0.00 175.10 176.84 1wm9 h GLN 149 N 5.98 0.00 -0.66 4.82 4.15 -2.00 -2.05 115.11 125.35 1wm9 h GLN 149 Ca -0.35 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.03 1wm9 h GLN 149 Cb 1.16 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.82 1wm9 h GLN 149 CO 0.48 0.00 0.23 0.93 -1.93 0.00 0.00 178.83 178.54 1wm9 h GLU 150 N 0.00 1.01 -0.11 1.69 3.07 -1.97 -2.81 114.58 115.46 1wm9 h GLU 150 Ca 0.14 -0.20 -0.17 0.00 -0.50 0.00 0.00 59.36 58.62 1wm9 h GLU 150 Cb 0.59 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.34 1wm9 h GLU 150 CO -0.00 0.87 -0.67 -0.09 -1.40 0.00 0.00 179.01 177.72 1wm9 h ARG 151 N 0.95 0.44 -0.65 2.33 2.43 -1.81 -3.12 114.38 114.94 1wm9 h ARG 151 Ca 0.22 -0.33 0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1wm9 h ARG 151 Cb 0.26 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1wm9 h ARG 151 CO -0.01 0.95 0.42 1.25 -1.51 0.00 0.00 179.97 181.07 1wm9 h LEU 152 N 0.31 0.73 -0.60 3.80 5.85 -1.28 -0.58 115.31 123.54 1wm9 h LEU 152 Ca -0.02 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.62 1wm9 h LEU 152 Cb 1.22 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.05 1wm9 h LEU 152 CO 0.12 0.53 0.13 0.00 -0.34 0.00 0.00 178.44 178.87 1wm9 h ALA 153 N 1.24 0.79 -0.06 1.25 0.00 -1.53 -2.29 119.26 118.66 1wm9 h ALA 153 Ca 0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1wm9 h ALA 153 Cb -0.09 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 1wm9 h ALA 153 CO -0.06 0.51 0.01 0.28 0.00 0.00 0.00 179.25 180.00 1wm9 h VAL 154 N 0.88 1.20 -0.58 0.00 2.07 -1.39 -2.56 116.25 115.87 1wm9 h VAL 154 Ca 0.19 -0.61 -0.05 0.00 0.82 0.00 0.00 66.70 67.05 1wm9 h VAL 154 Cb 0.38 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 1wm9 h VAL 154 CO 0.01 0.17 0.15 1.56 0.02 0.00 0.00 177.57 179.47 1wm9 h GLN 155 N -0.13 0.89 -0.18 1.57 4.20 -1.09 0.26 115.11 120.64 1wm9 h GLN 155 Ca 0.02 -0.18 -0.03 0.00 0.06 0.00 0.00 58.65 58.52 1wm9 h GLN 155 Cb 0.26 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1wm9 h GLN 155 CO 0.00 0.79 0.01 0.82 -0.67 0.00 0.00 178.83 179.79 1wm9 h ILE 156 N 0.86 1.24 -0.52 2.54 2.04 -1.42 -1.07 117.51 121.18 1wm9 h ILE 156 Ca 0.19 -0.80 0.01 0.00 1.00 0.00 0.00 64.86 65.25 1wm9 h ILE 156 Cb 0.30 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 1wm9 h ILE 156 CO -0.00 0.24 0.34 0.00 0.00 0.00 0.00 178.15 178.73 1wm9 h ALA 157 N 0.80 0.66 -0.52 1.87 0.00 -1.20 -1.77 119.26 119.09 1wm9 h ALA 157 Ca 0.05 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1wm9 h ALA 157 Cb 0.35 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1wm9 h ALA 157 CO 0.01 0.09 0.03 0.93 0.00 0.00 0.00 179.25 180.31 1wm9 h GLU 158 N 0.70 0.86 -0.39 0.00 5.08 -0.89 -0.75 114.58 119.20 1wm9 h GLU 158 Ca 0.19 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1wm9 h GLU 158 Cb -0.07 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 1wm9 h GLU 158 CO -0.05 0.85 0.18 0.00 -1.00 0.00 0.00 179.01 178.99 1wm9 h ALA 159 N 1.22 0.50 -0.46 3.43 0.00 -0.82 -0.10 119.26 123.02 1wm9 h ALA 159 Ca 0.16 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1wm9 h ALA 159 Cb 0.45 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1wm9 h ALA 159 CO 0.02 0.07 -0.04 0.82 0.00 0.00 0.00 179.25 180.11 1wm9 h ILE 160 N 0.48 1.25 -0.68 0.00 2.04 -1.13 -1.36 117.51 118.11 1wm9 h ILE 160 Ca 0.13 -1.07 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 1wm9 h ILE 160 Cb 0.14 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1wm9 h ILE 160 CO -0.02 0.37 0.34 -0.61 0.00 0.00 0.00 178.15 178.24 1wm9 h GLN 161 N 0.73 0.96 -0.31 2.37 5.75 -0.65 -1.58 115.11 122.39 1wm9 h GLN 161 Ca 0.13 -0.13 -0.10 0.00 -0.15 0.00 0.00 58.65 58.40 1wm9 h GLN 161 Cb 0.51 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.87 1wm9 h GLN 161 CO 0.03 0.75 -0.21 1.49 -2.65 0.00 0.00 178.83 178.23 1wm9 h GLU 162 N 0.93 0.68 -0.33 1.69 4.81 -0.71 0.11 114.58 121.76 1wm9 h GLU 162 Ca 0.23 -0.32 -0.12 0.00 -0.13 0.00 0.00 59.36 59.02 1wm9 h GLU 162 Cb 0.09 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1wm9 h GLU 162 CO -0.03 0.93 -0.29 0.28 -0.73 0.00 0.00 179.01 179.16 1wm9 h VAL 163 N 0.43 1.28 0.00 0.32 2.07 -1.11 -3.36 116.25 115.88 1wm9 h VAL 163 Ca 0.06 -1.41 0.00 0.00 0.82 0.00 0.00 66.70 66.17 1wm9 h VAL 163 Cb 0.75 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1wm9 h VAL 163 CO 0.06 0.46 -1.12 0.18 0.02 0.00 0.00 177.57 177.16 1wm9 n LEU 164 N -4.09 0.07 -3.94 2.57 4.77 -0.61 -5.03 117.00 110.75 1wm9 n LEU 164 Ca -0.01 -0.10 -0.30 0.00 -0.03 0.00 0.00 56.01 55.58 1wm9 n LEU 164 Cb 0.46 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.54 1wm9 n LEU 164 CO 0.45 0.02 -0.22 -0.62 -1.33 0.00 0.00 177.39 175.68 1wm9 n GLU 165 N -1.63 -2.26 -1.36 3.23 1.02 0.40 -4.69 120.64 115.35 1wm9 n GLU 165 Ca -0.01 0.35 -0.29 0.00 -0.02 0.00 0.00 57.16 57.19 1wm9 n GLU 165 Cb 0.17 -4.13 0.19 0.00 -0.02 0.00 0.00 31.44 27.65 1wm9 n GLU 165 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 1wm9 s PRO 166 N -6.60 0.04 0.53 3.49 0.02 -1.26 -4.61 135.00 126.60 1wm9 s PRO 166 Ca 0.16 0.09 0.33 0.00 0.02 0.00 0.00 61.00 61.60 1wm9 s PRO 166 Cb -0.07 -1.73 1.42 0.00 0.02 0.00 0.00 34.50 34.15 1wm9 s PRO 166 CO 0.90 -2.90 1.99 1.96 -0.33 0.00 0.00 177.00 178.62 1wm9 h GLN 167 N -2.00 0.00 0.00 5.54 4.20 -1.21 -3.47 115.11 118.17 1wm9 h GLN 167 Ca -0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.23 1wm9 h GLN 167 Cb 1.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.08 1wm9 h GLN 167 CO 0.47 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 179.04 1wm9 n GLY 168 N -0.08 1.21 3.06 3.46 0.00 -1.23 -1.05 105.19 110.56 1wm9 n GLY 168 Ca 0.00 -0.75 -0.12 0.00 0.00 0.00 0.00 46.02 45.15 1wm9 n GLY 168 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wm9 s VAL 169 N -2.00 0.02 -0.02 1.61 1.01 -0.78 -2.55 120.40 117.69 1wm9 s VAL 169 Ca 0.00 -0.13 0.04 0.00 0.00 0.00 0.00 61.98 61.89 1wm9 s VAL 169 Cb 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 36.38 36.09 1wm9 s VAL 169 CO 0.00 -0.07 -0.13 -0.83 0.00 0.00 0.00 175.10 174.07 1wm9 s GLY 170 N -0.18 0.70 -0.04 4.51 0.00 0.13 -0.27 107.32 112.16 1wm9 s GLY 170 Ca -0.03 -0.56 0.01 0.00 0.00 0.00 0.00 44.72 44.15 1wm9 s GLY 170 CO 0.01 -0.37 -0.05 0.14 0.00 0.00 0.00 173.10 172.82 1wm9 s VAL 171 N -0.12 0.58 -0.12 1.40 1.01 -0.03 -1.19 120.40 121.93 1wm9 s VAL 171 Ca 0.01 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.84 1wm9 s VAL 171 Cb -0.07 -0.59 0.02 0.00 0.00 0.00 0.00 36.38 35.73 1wm9 s VAL 171 CO 0.00 0.23 -0.16 -0.69 0.00 0.00 0.00 175.10 174.48 1wm9 s VAL 172 N 0.80 1.64 -0.14 2.92 1.01 -0.19 -1.27 120.40 125.17 1wm9 s VAL 172 Ca -0.11 -0.71 -0.00 0.00 0.00 0.00 0.00 61.98 61.15 1wm9 s VAL 172 Cb -0.14 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.74 1wm9 s VAL 172 CO 0.01 0.47 -0.13 -0.69 0.00 0.00 0.00 175.10 174.76 1wm9 s VAL 173 N 1.05 3.06 -0.13 2.92 1.01 0.12 -0.22 120.40 128.21 1wm9 s VAL 173 Ca -0.04 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.29 1wm9 s VAL 173 Cb -0.15 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 33.96 1wm9 s VAL 173 CO -0.04 0.52 -0.15 -0.70 0.00 0.00 0.00 175.10 174.73 1wm9 s GLU 174 N 0.44 2.31 0.10 2.72 2.12 0.07 -1.20 118.70 125.26 1wm9 s GLU 174 Ca -0.10 -0.58 -0.09 0.00 0.36 0.00 0.00 54.97 54.57 1wm9 s GLU 174 Cb -0.16 -2.02 -0.00 0.00 0.26 0.00 0.00 34.13 32.21 1wm9 s GLU 174 CO 0.05 -0.13 0.21 0.20 -0.54 0.00 0.00 175.26 175.04 1wm9 s GLY 175 N 1.19 0.17 -0.08 -1.50 0.00 -0.45 -0.67 107.32 105.97 1wm9 s GLY 175 Ca -0.02 -0.67 -0.03 0.00 0.00 0.00 0.00 44.72 44.00 1wm9 s GLY 175 CO -0.05 -0.81 0.06 -1.34 0.00 0.00 0.00 173.10 170.96 1wm9 s VAL 176 N -3.88 4.79 -0.24 1.40 -7.23 0.15 -0.80 120.40 114.59 1wm9 s VAL 176 Ca 0.07 -0.12 -0.01 0.00 -1.81 0.00 0.00 61.98 60.11 1wm9 s VAL 176 Cb 0.05 -3.07 0.02 0.00 0.56 0.00 0.00 36.38 33.94 1wm9 s VAL 176 CO -0.09 0.57 -0.07 -1.00 -0.31 0.00 0.00 175.10 174.20 1wm9 s HIS 177 N -0.99 3.04 0.38 2.82 3.76 -1.26 -1.20 115.29 121.85 1wm9 s HIS 177 Ca 0.16 -1.54 0.10 0.00 -0.15 0.00 0.00 55.06 53.63 1wm9 s HIS 177 Cb -0.12 -2.05 0.77 0.00 1.11 0.00 0.00 32.58 32.30 1wm9 s HIS 177 CO 0.05 -0.73 1.90 -0.07 -0.85 0.00 0.00 174.74 175.04 1wm9 h LEU 178 N 8.01 0.18 -0.98 0.89 3.38 -1.77 -1.21 115.31 123.80 1wm9 h LEU 178 Ca -0.34 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1wm9 h LEU 178 Cb 1.11 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1wm9 h LEU 178 CO 0.58 0.38 0.00 0.00 0.09 0.00 0.00 178.44 179.49 1wm9 n MET 180 N -2.08 0.99 -0.03 0.00 0.00 -0.48 -4.36 117.12 111.16 1wm9 n MET 180 Ca -0.00 -0.09 -0.03 0.00 -0.00 0.00 0.00 57.70 57.58 1wm9 n MET 180 Cb 0.07 -1.34 -0.04 0.00 0.00 0.00 0.00 33.22 31.91 1wm9 n MET 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1wm9 n MET 181 N -1.79 2.74 -0.25 2.12 -0.00 -0.30 -1.57 117.12 118.07 1wm9 n MET 181 Ca -0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.70 57.81 1wm9 n MET 181 Cb 0.36 -1.15 0.25 0.00 -0.00 0.00 0.00 33.22 32.68 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 -2.27 2.56 -3.88 3.17 3.85 -0.11 -4.50 117.12 115.95 1wm9 n MET 182 Ca -0.10 -2.39 -0.08 0.00 -1.00 0.00 0.00 57.70 54.13 1wm9 n MET 182 Cb 0.68 -1.51 -0.03 0.00 -1.05 0.00 0.00 33.22 31.31 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 -1.26 1.67 6.19 3.17 3.52 -1.25 -5.02 118.95 125.97 1wm9 s ARG 183 Ca 0.41 -1.04 0.00 0.00 -0.13 0.00 0.00 55.73 54.97 1wm9 s ARG 183 Cb 0.23 0.56 0.00 0.00 -1.56 0.00 0.00 34.95 34.18 1wm9 s ARG 183 CO 0.31 -0.74 0.00 0.41 -0.81 0.00 0.00 175.30 174.47 1wm9 n GLY 184 N -0.42 3.79 0.26 8.12 0.00 -1.26 -1.82 105.19 113.86 1wm9 n GLY 184 Ca -0.04 0.15 0.09 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 0.88 -4.25 1.61 -1.51 -1.86 -3.47 116.25 107.66 1wm9 h VAL 185 Ca 0.00 -0.17 -0.40 0.00 -1.23 0.00 0.00 66.70 64.90 1wm9 h VAL 185 Cb 0.00 1.09 0.03 0.00 -2.13 0.00 0.00 31.29 30.28 1wm9 h VAL 185 CO 0.00 0.04 -0.58 -0.62 -1.23 0.00 0.00 177.57 175.18 1wm9 n GLU 186 N -4.26 -4.06 -2.28 5.19 1.02 -0.76 -4.98 120.64 110.51 1wm9 n GLU 186 Ca -0.03 0.89 -0.37 0.00 -0.02 0.00 0.00 57.16 57.63 1wm9 n GLU 186 Cb 0.13 -5.69 -0.01 0.00 -0.02 0.00 0.00 31.44 25.84 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 -5.58 3.82 -0.04 3.49 -0.14 -0.61 -4.83 119.74 115.86 1wm9 s LYS 187 Ca 0.24 1.77 0.09 0.00 -1.36 0.00 0.00 55.97 56.70 1wm9 s LYS 187 Cb -0.11 -2.45 -0.13 0.00 -1.68 0.00 0.00 37.83 33.46 1wm9 s LYS 187 CO 0.30 -0.50 0.13 1.04 -0.76 0.00 0.00 175.35 175.57 1wm9 n GLN 188 N -0.39 1.23 0.00 1.68 1.13 -1.26 -3.99 117.38 115.79 1wm9 n GLN 188 Ca 0.07 -0.05 0.12 0.00 -1.94 0.00 0.00 57.00 55.19 1wm9 n GLN 188 Cb 0.48 -1.22 0.16 0.00 0.11 0.00 0.00 30.24 29.76 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 -2.03 0.00 -2.62 1.08 8.25 -1.26 -5.00 115.22 113.64 1wm9 n HIS 189 Ca -0.07 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.03 1wm9 n HIS 189 Cb 0.47 -0.04 -0.05 0.00 1.12 0.00 0.00 29.99 31.49 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 -2.42 6.95 -0.03 0.41 0.15 -1.26 -5.08 113.70 112.42 1wm9 s SER 190 Ca 0.22 1.97 -0.04 0.00 0.70 0.00 0.00 55.95 58.80 1wm9 s SER 190 Cb 0.19 -2.58 0.01 0.00 -1.71 0.00 0.00 66.02 61.92 1wm9 s SER 190 CO 0.52 -0.36 0.10 -0.13 1.20 0.00 0.00 173.24 174.58 1wm9 s ARG 191 N -2.37 0.22 -0.10 5.44 0.52 -1.26 -4.69 118.95 116.70 1wm9 s ARG 191 Ca 0.55 -0.03 0.02 0.00 -0.52 0.00 0.00 55.73 55.76 1wm9 s ARG 191 Cb -0.21 0.10 -0.01 0.00 0.52 0.00 0.00 34.95 35.35 1wm9 s ARG 191 CO 0.26 -0.04 -0.18 0.99 0.02 0.00 0.00 175.30 176.35 1wm9 s THR 192 N -0.38 2.63 -0.17 0.02 2.01 0.02 -4.94 115.64 114.83 1wm9 s THR 192 Ca -0.05 -0.83 -0.02 0.00 0.31 0.00 0.00 61.69 61.10 1wm9 s THR 192 Cb -0.03 -2.05 -0.01 0.00 0.01 0.00 0.00 72.50 70.42 1wm9 s THR 192 CO 0.00 0.55 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.72 1wm9 s VAL 193 N 0.14 3.37 0.23 3.82 1.01 -1.26 -1.34 120.40 126.37 1wm9 s VAL 193 Ca -0.09 -0.52 0.08 0.00 0.00 0.00 0.00 61.98 61.44 1wm9 s VAL 193 Cb -0.16 -2.48 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 1wm9 s VAL 193 CO 0.06 0.48 -0.13 0.42 0.00 0.00 0.00 175.10 175.92 1wm9 s THR 194 N 0.83 1.80 0.18 3.92 -4.23 -0.34 -4.99 115.64 112.80 1wm9 s THR 194 Ca -0.02 -2.22 -0.20 0.00 -1.18 0.00 0.00 61.69 58.07 1wm9 s THR 194 Cb -0.15 -2.15 0.05 0.00 1.34 0.00 0.00 72.50 71.59 1wm9 s THR 194 CO 0.01 -0.52 0.57 -0.94 -0.54 0.00 0.00 174.62 173.20 1wm9 s SER 195 N -3.36 -0.40 -0.06 3.99 1.04 -1.26 -0.70 113.70 112.95 1wm9 s SER 195 Ca 0.25 -0.25 -0.02 0.00 0.48 0.00 0.00 55.95 56.41 1wm9 s SER 195 Cb -0.00 0.59 0.04 0.00 0.10 0.00 0.00 66.02 66.75 1wm9 s SER 195 CO 0.09 -1.03 0.12 0.00 0.98 0.00 0.00 173.24 173.40 1wm9 s ALA 196 N -3.81 -0.18 -0.13 5.32 0.00 -0.40 -4.77 121.76 117.79 1wm9 s ALA 196 Ca 0.05 0.59 0.01 0.00 0.00 0.00 0.00 51.96 52.61 1wm9 s ALA 196 Cb -0.01 -0.43 0.02 0.00 0.00 0.00 0.00 23.12 22.70 1wm9 s ALA 196 CO -0.08 -0.17 -0.16 -1.64 0.00 0.00 0.00 175.76 173.71 1wm9 s MET 197 N 1.21 2.43 0.18 0.00 -1.94 -1.26 -0.85 119.30 119.07 1wm9 s MET 197 Ca -0.09 -0.63 0.11 0.00 -1.71 0.00 0.00 55.69 53.38 1wm9 s MET 197 Cb -0.12 -2.10 -0.04 0.00 2.01 0.00 0.00 34.83 34.58 1wm9 s MET 197 CO -0.05 -0.12 -0.24 -0.51 -0.01 0.00 0.00 175.02 174.08 1wm9 s LEU 198 N 1.14 2.41 0.00 -0.03 1.43 0.63 -4.41 118.68 119.85 1wm9 s LEU 198 Ca -0.02 -0.84 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 1wm9 s LEU 198 Cb -0.14 -1.16 0.00 0.00 0.03 0.00 0.00 46.19 44.92 1wm9 s LEU 198 CO -0.05 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.26 1wm9 n GLY 199 N 0.42 3.38 0.31 -3.19 0.00 -1.26 -1.87 105.19 102.98 1wm9 n GLY 199 Ca -0.14 -0.10 0.18 0.00 0.00 0.00 0.00 46.02 45.96 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 0.26 0.00 1.61 -1.51 -1.43 0.12 116.25 115.30 1wm9 h VAL 200 Ca 0.00 -0.18 0.00 0.00 -1.23 0.00 0.00 66.70 65.29 1wm9 h VAL 200 Cb 0.00 1.13 0.00 0.00 -2.13 0.00 0.00 31.29 30.29 1wm9 h VAL 200 CO 0.00 0.03 0.00 -0.26 -1.23 0.00 0.00 177.57 176.11 1wm9 h PHE 201 N 0.00 0.00 0.00 5.19 0.04 -1.68 0.93 116.94 121.42 1wm9 h PHE 201 Ca -0.00 0.00 -0.40 0.00 2.80 0.00 0.00 57.97 60.37 1wm9 h PHE 201 Cb 0.13 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.22 1wm9 h PHE 201 CO 0.00 0.00 -2.43 -2.13 -0.60 0.00 0.00 178.31 173.15 1wm9 n ARG 202 N -2.67 0.59 0.09 1.51 0.63 -0.08 -4.45 116.66 112.27 1wm9 n ARG 202 Ca 0.03 0.18 -0.04 0.00 -0.92 0.00 0.00 57.85 57.10 1wm9 n ARG 202 Cb 0.34 -1.47 -0.07 0.00 0.45 0.00 0.00 32.46 31.71 1wm9 n ARG 202 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1wm9 h GLU 203 N -0.40 0.00 -4.60 -0.14 4.39 -0.87 -3.43 114.58 109.54 1wm9 h GLU 203 Ca -0.60 0.00 -0.70 0.00 0.34 0.00 0.00 59.36 58.40 1wm9 h GLU 203 Cb 1.74 0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 30.10 1wm9 h GLU 203 CO -0.22 0.81 -0.56 1.21 -1.16 0.00 0.00 179.01 179.09 1wm9 s ASN 204 N -6.60 5.41 0.26 1.42 3.84 0.32 -4.97 114.94 114.60 1wm9 s ASN 204 Ca 0.02 -1.29 -0.02 0.00 0.21 0.00 0.00 52.86 51.77 1wm9 s ASN 204 Cb 0.09 -1.90 0.45 0.00 -0.55 0.00 0.00 41.25 39.34 1wm9 s ASN 204 CO 0.79 -0.40 1.82 -0.61 -2.79 0.00 0.00 177.10 175.92 1wm9 h GLN 205 N 8.26 0.85 -0.43 0.43 5.75 -1.83 -2.33 115.11 125.81 1wm9 h GLN 205 Ca -0.22 -0.05 -0.12 0.00 -0.15 0.00 0.00 58.65 58.11 1wm9 h GLN 205 Cb 1.08 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 29.42 1wm9 h GLN 205 CO 0.65 0.56 -0.20 0.87 -2.65 0.00 0.00 178.83 178.06 1wm9 h LYS 206 N 0.87 0.85 -0.46 1.69 1.79 -1.93 -1.70 116.57 117.69 1wm9 h LYS 206 Ca 0.43 -0.34 -0.11 0.00 -2.18 0.00 0.00 60.65 58.45 1wm9 h LYS 206 Cb 0.39 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.99 1wm9 h LYS 206 CO -0.25 0.98 -0.14 1.79 -1.08 0.00 0.00 179.45 180.76 1wm9 h THR 207 N 0.75 1.27 -0.24 -0.16 1.35 -1.74 -1.80 112.91 112.34 1wm9 h THR 207 Ca 0.10 -1.27 -0.01 0.00 -0.55 0.00 0.00 66.41 64.69 1wm9 h THR 207 Cb 0.74 1.12 -0.01 0.00 -1.73 0.00 0.00 68.15 68.27 1wm9 h THR 207 CO 0.06 0.44 0.13 -0.09 -0.25 0.00 0.00 175.52 175.80 1wm9 h ARG 208 N 0.76 0.34 -0.68 4.72 2.43 -1.33 -1.55 114.38 119.06 1wm9 h ARG 208 Ca 0.11 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1wm9 h ARG 208 Cb 0.69 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.14 1wm9 h ARG 208 CO 0.05 0.32 0.37 0.93 -1.51 0.00 0.00 179.97 180.13 1wm9 h GLU 209 N 0.27 0.94 -0.55 0.20 5.08 -1.23 -0.93 114.58 118.35 1wm9 h GLU 209 Ca 0.08 -0.10 -0.09 0.00 -1.00 0.00 0.00 59.36 58.25 1wm9 h GLU 209 Cb 0.08 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 1wm9 h GLU 209 CO -0.01 0.69 -0.02 1.49 -1.00 0.00 0.00 179.01 180.16 1wm9 h GLU 210 N 0.94 0.96 0.01 2.33 4.81 -0.91 0.18 114.58 122.91 1wm9 h GLU 210 Ca 0.24 -0.30 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1wm9 h GLU 210 Cb 0.03 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.31 1wm9 h GLU 210 CO -0.04 0.96 -0.01 0.35 -0.73 0.00 0.00 179.01 179.54 1wm9 h PHE 211 N 0.88 -0.02 -0.94 0.92 -0.00 -0.79 -2.24 116.94 114.76 1wm9 h PHE 211 Ca 0.16 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 58.12 1wm9 h PHE 211 Cb 0.54 0.01 -0.05 0.00 -0.00 0.00 0.00 35.95 36.45 1wm9 h PHE 211 CO 0.03 0.25 0.56 -0.07 -0.00 0.00 0.00 178.31 179.09 1wm9 h LEU 212 N -0.29 1.13 -1.03 0.59 3.38 -1.05 -2.41 115.31 115.62 1wm9 h LEU 212 Ca -0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1wm9 h LEU 212 Cb 0.28 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1wm9 h LEU 212 CO 0.00 0.87 0.50 0.28 0.09 0.00 0.00 178.44 180.18 1wm9 h SER 213 N 1.29 1.04 0.01 -0.43 0.02 -0.54 -1.37 113.55 113.57 1wm9 h SER 213 Ca 0.34 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1wm9 h SER 213 Cb -0.05 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.22 1wm9 h SER 213 CO -0.06 0.81 -0.01 0.45 -1.14 0.00 0.00 176.83 176.88 1wm9 h HIS 214 N 1.19 0.00 0.00 3.45 3.86 -0.89 -1.86 115.15 120.90 1wm9 h HIS 214 Ca 0.31 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.52 1wm9 h HIS 214 Cb -0.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.44 1wm9 h HIS 214 CO 0.01 0.01 0.00 1.28 0.86 0.00 0.00 177.93 180.08 1wm9 n LEU 215 N -4.43 0.60 -0.57 2.43 4.77 -0.52 -5.12 117.00 114.16 1wm9 n LEU 215 Ca -0.03 0.58 0.14 0.00 -0.03 0.00 0.00 56.01 56.66 1wm9 n LEU 215 Cb 0.09 -0.41 0.45 0.00 -2.33 0.00 0.00 43.42 41.22 1wm9 n LEU 215 CO 0.33 -0.23 0.83 0.54 -1.33 0.00 0.00 177.39 177.53