#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wuq s ASP 34 N 0.00 6.48 0.38 4.52 -1.08 -1.26 -4.86 116.67 120.84 1wuq s ASP 34 Ca 0.00 -1.57 0.09 0.00 -0.52 0.00 0.00 52.55 50.55 1wuq s ASP 34 Cb 0.00 -2.46 0.85 0.00 -1.46 0.00 0.00 42.92 39.85 1wuq s ASP 34 CO 0.00 -1.31 1.94 -0.07 0.52 0.00 0.00 175.17 176.25 1wuq h LEU 35 N 11.45 0.57 -0.56 -1.34 3.38 -1.99 -1.96 115.31 124.86 1wuq h LEU 35 Ca 0.06 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1wuq h LEU 35 Cb 1.03 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 1wuq h LEU 35 CO 1.23 0.34 0.13 -0.33 0.09 0.00 0.00 178.44 179.90 1wuq h GLU 36 N 0.64 0.89 -0.27 1.13 4.39 -1.99 -1.04 114.58 118.33 1wuq h GLU 36 Ca 0.34 -0.22 -0.07 0.00 0.34 0.00 0.00 59.36 59.75 1wuq h GLU 36 Cb 0.46 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1wuq h GLU 36 CO -0.12 0.84 -0.11 0.00 -1.16 0.00 0.00 179.01 178.45 1wuq h ARG 37 N 0.79 0.56 -0.90 2.33 3.08 -1.80 -2.02 114.38 116.42 1wuq h ARG 37 Ca 0.17 -0.24 0.02 0.00 0.07 0.00 0.00 59.98 60.01 1wuq h ARG 37 Cb 0.34 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.33 1wuq h ARG 37 CO 0.00 0.79 0.59 -0.07 -1.07 0.00 0.00 179.97 180.22 1wuq h LEU 38 N 0.30 1.00 -0.62 3.04 3.38 -1.31 -0.52 115.31 120.57 1wuq h LEU 38 Ca 0.06 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1wuq h LEU 38 Cb 0.62 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1wuq h LEU 38 CO 0.04 0.71 0.34 -0.61 0.09 0.00 0.00 178.44 179.00 1wuq h GLN 39 N 1.18 0.87 -0.40 1.13 4.15 -1.00 0.66 115.11 121.70 1wuq h GLN 39 Ca 0.34 -0.11 -0.14 0.00 0.77 0.00 0.00 58.65 59.52 1wuq h GLN 39 Cb -0.06 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.45 1wuq h GLN 39 CO -0.09 0.67 -0.30 0.00 -1.93 0.00 0.00 178.83 177.18 1wuq h ALA 40 N 1.16 0.71 -0.49 3.38 0.00 -0.67 -1.61 119.26 121.74 1wuq h ALA 40 Ca 0.22 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1wuq h ALA 40 Cb 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1wuq h ALA 40 CO -0.03 0.66 0.09 -0.07 0.00 0.00 0.00 179.25 179.90 1wuq h LEU 41 N 0.74 0.77 -0.99 0.00 3.38 -0.76 -2.46 115.31 115.99 1wuq h LEU 41 Ca 0.08 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 1wuq h LEU 41 Cb 0.86 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1wuq h LEU 41 CO 0.08 0.83 0.06 0.00 0.09 0.00 0.00 178.44 179.50 1wuq h ALA 42 N 0.97 1.17 -0.48 1.53 0.00 -0.74 0.13 119.26 121.85 1wuq h ALA 42 Ca 0.15 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1wuq h ALA 42 Cb 0.37 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1wuq h ALA 42 CO 0.01 0.55 0.17 0.00 0.00 0.00 0.00 179.25 179.97 1wuq h ALA 43 N 1.31 0.62 -0.05 0.00 0.00 -1.11 -1.72 119.26 118.31 1wuq h ALA 43 Ca 0.16 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1wuq h ALA 43 Cb 0.37 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1wuq h ALA 43 CO 0.01 0.25 -0.55 1.49 0.00 0.00 0.00 179.25 180.45 1wuq h GLU 44 N 0.63 0.14 -0.52 0.00 4.81 -1.10 -2.80 114.58 115.75 1wuq h GLU 44 Ca 0.16 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1wuq h GLU 44 Cb 0.24 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 1wuq h GLU 44 CO -0.01 0.66 0.31 2.35 -0.73 0.00 0.00 179.01 181.59 1wuq h TRP 45 N 0.11 0.68 -0.66 0.92 2.91 -0.61 -1.74 115.95 117.55 1wuq h TRP 45 Ca -0.00 -0.00 0.06 0.00 1.13 0.00 0.00 58.89 60.07 1wuq h TRP 45 Cb 1.01 -0.22 -0.05 0.00 -0.51 0.00 0.00 29.16 29.38 1wuq h TRP 45 CO 0.01 0.47 0.37 -0.07 -1.03 0.00 0.00 178.44 178.19 1wuq h LEU 46 N 0.69 0.55 -0.14 0.65 3.38 -1.07 -2.80 115.31 116.58 1wuq h LEU 46 Ca 0.19 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1wuq h LEU 46 Cb -0.01 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1wuq h LEU 46 CO -0.03 0.36 0.04 1.56 0.09 0.00 0.00 178.44 180.45 1wuq h GLN 47 N 0.68 0.21 -0.23 1.13 4.20 -1.22 -0.74 115.11 119.14 1wuq h GLN 47 Ca 0.30 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.92 1wuq h GLN 47 Cb 0.18 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1wuq h GLN 47 CO -0.18 0.35 -0.01 -0.24 -0.67 0.00 0.00 178.83 178.08 1wuq h VAL 48 N 0.03 1.15 -0.01 -0.54 3.04 -1.19 -2.06 116.25 116.68 1wuq h VAL 48 Ca 0.04 -0.59 0.00 0.00 -1.01 0.00 0.00 66.70 65.14 1wuq h VAL 48 Cb 0.23 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 30.50 1wuq h VAL 48 CO -0.00 0.20 0.00 2.30 -1.01 0.00 0.00 177.57 179.06 1wuq n ILE 49 N -4.34 0.01 -0.13 3.17 -5.35 -1.07 -4.88 119.36 106.77 1wuq n ILE 49 Ca 0.00 -0.04 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 1wuq n ILE 49 Cb 0.20 -0.32 0.00 0.00 -1.74 0.00 0.00 39.64 37.78 1wuq n ILE 49 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1wuq n GLY 50 N 0.97 0.93 4.04 3.28 0.00 -0.77 -5.10 105.19 108.53 1wuq n GLY 50 Ca 0.21 -0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 1wuq n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wuq s GLU 51 N -0.57 2.22 -0.31 1.61 0.41 -0.29 -5.02 118.70 116.75 1wuq s GLU 51 Ca 0.00 -1.68 0.01 0.00 -0.41 0.00 0.00 54.97 52.90 1wuq s GLU 51 Cb 0.00 -2.63 0.09 0.00 -1.78 0.00 0.00 34.13 29.82 1wuq s GLU 51 CO 0.00 -0.95 0.06 0.34 -0.49 0.00 0.00 175.26 174.22 1wuq s ASP 52 N -4.71 4.28 0.67 -0.19 2.15 -1.26 -4.20 116.67 113.40 1wuq s ASP 52 Ca 0.63 -1.76 0.36 0.00 0.43 0.00 0.00 52.55 52.21 1wuq s ASP 52 Cb -0.05 -1.20 1.96 0.00 -0.30 0.00 0.00 42.92 43.33 1wuq s ASP 52 CO 0.40 -0.38 2.11 -0.65 -0.17 0.00 0.00 175.17 176.48 1wuq h PRO 53 N 7.89 0.00 0.00 4.34 0.11 -1.89 -1.24 132.00 141.21 1wuq h PRO 53 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1wuq h PRO 53 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1wuq h PRO 53 CO 0.48 0.00 -0.43 0.78 -0.21 0.00 0.00 178.00 178.62 1wuq h GLY 54 N 0.00 0.00 -2.57 -0.55 0.00 -1.93 -3.30 103.07 94.71 1wuq h GLY 54 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 1wuq h GLY 54 CO -0.00 0.00 0.46 1.09 0.00 0.00 0.00 176.54 178.09 1wuq s ARG 55 N -3.18 3.71 0.26 4.80 1.70 -0.47 -4.79 118.95 120.98 1wuq s ARG 55 Ca 0.07 1.71 -0.12 0.00 -0.47 0.00 0.00 55.73 56.92 1wuq s ARG 55 Cb 0.12 -2.32 0.38 0.00 -0.57 0.00 0.00 34.95 32.55 1wuq s ARG 55 CO 0.69 -0.58 1.56 1.49 -1.08 0.00 0.00 175.30 177.38 1wuq h GLU 56 N 1.89 -0.00 0.00 3.89 4.81 -1.90 -0.17 114.58 123.09 1wuq h GLU 56 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1wuq h GLU 56 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1wuq h GLU 56 CO 0.60 -0.00 0.00 0.41 -0.73 0.00 0.00 179.01 179.29 1wuq n GLY 57 N -1.57 -1.21 0.34 1.92 0.00 -1.26 -3.03 105.19 100.38 1wuq n GLY 57 Ca 0.14 0.11 0.06 0.00 0.00 0.00 0.00 46.02 46.33 1wuq n GLY 57 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wuq n LEU 58 N -2.25 1.54 -0.18 0.99 4.77 -0.11 -4.70 117.00 117.07 1wuq n LEU 58 Ca 0.01 -0.81 -0.05 0.00 -0.03 0.00 0.00 56.01 55.14 1wuq n LEU 58 Cb 0.20 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.30 1wuq n LEU 58 CO 0.18 0.30 0.66 -0.07 -1.33 0.00 0.00 177.39 177.12 1wuq h LEU 59 N 1.67 -1.01 -1.65 2.23 3.38 -1.38 -1.85 115.31 116.71 1wuq h LEU 59 Ca 0.00 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1wuq h LEU 59 Cb 0.46 0.51 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1wuq h LEU 59 CO 0.00 -0.29 0.00 0.29 0.09 0.00 0.00 178.44 178.53 1wuq n LYS 60 N -5.43 2.07 -0.09 1.13 5.02 -1.26 -4.50 118.16 115.10 1wuq n LYS 60 Ca 0.04 -1.62 -0.10 0.00 -2.02 0.00 0.00 58.31 54.61 1wuq n LYS 60 Cb 0.34 -1.43 -0.02 0.00 -0.02 0.00 0.00 35.03 33.90 1wuq n LYS 60 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1wuq h THR 61 N 3.08 1.14 -0.77 -0.18 2.02 -1.61 -0.79 112.91 115.80 1wuq h THR 61 Ca 0.00 -0.39 0.07 0.00 0.77 0.00 0.00 66.41 66.87 1wuq h THR 61 Cb 0.68 0.85 -0.05 0.00 -1.74 0.00 0.00 68.15 67.90 1wuq h THR 61 CO 0.00 0.14 0.50 -0.65 0.37 0.00 0.00 175.52 175.89 1wuq h PRO 62 N 0.35 0.76 -0.15 6.66 0.11 -1.79 0.16 132.00 138.10 1wuq h PRO 62 Ca 0.10 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.08 1wuq h PRO 62 Cb 0.09 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.03 1wuq h PRO 62 CO -0.01 0.50 -0.23 1.49 -0.21 0.00 0.00 178.00 179.54 1wuq h GLU 63 N 0.79 0.43 -0.47 1.05 4.81 -1.81 -1.74 114.58 117.63 1wuq h GLU 63 Ca 0.34 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1wuq h GLU 63 Cb 0.31 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 1wuq h GLU 63 CO -0.12 0.84 0.28 0.00 -0.73 0.00 0.00 179.01 179.28 1wuq h ARG 64 N 0.05 0.65 -0.63 1.92 3.08 -0.55 -1.90 114.38 117.00 1wuq h ARG 64 Ca 0.01 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1wuq h ARG 64 Cb 0.80 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.69 1wuq h ARG 64 CO 0.05 0.49 0.31 0.28 -1.07 0.00 0.00 179.97 180.03 1wuq h VAL 65 N 0.63 1.22 -0.03 2.04 2.07 -0.72 -0.48 116.25 120.97 1wuq h VAL 65 Ca 0.17 -0.60 0.01 0.00 0.82 0.00 0.00 66.70 67.10 1wuq h VAL 65 Cb 0.01 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 1wuq h VAL 65 CO -0.03 0.25 -0.05 0.00 0.02 0.00 0.00 177.57 177.76 1wuq h ALA 66 N 1.13 -0.02 -0.64 1.67 0.00 -1.08 -1.30 119.26 119.03 1wuq h ALA 66 Ca 0.22 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1wuq h ALA 66 Cb 0.11 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1wuq h ALA 66 CO -0.03 -0.53 0.15 0.87 0.00 0.00 0.00 179.25 179.71 1wuq h LYS 67 N -0.07 1.00 -0.15 0.00 1.57 -1.19 -2.35 116.57 115.38 1wuq h LYS 67 Ca 0.03 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.59 1wuq h LYS 67 Cb 0.12 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1wuq h LYS 67 CO -0.08 0.89 0.09 0.00 -0.57 0.00 0.00 179.45 179.79 1wuq h ALA 68 N 1.20 0.19 0.00 3.86 0.00 -0.73 -2.09 119.26 121.69 1wuq h ALA 68 Ca 0.20 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 1wuq h ALA 68 Cb 0.34 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1wuq h ALA 68 CO 0.00 -0.31 -0.22 -1.49 0.00 0.00 0.00 179.25 177.23 1wuq h TRP 69 N 0.17 0.00 -0.37 0.00 4.06 -1.11 0.15 115.95 118.85 1wuq h TRP 69 Ca 0.05 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.92 1wuq h TRP 69 Cb 0.01 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.16 1wuq h TRP 69 CO -0.06 0.22 -0.09 0.00 -3.56 0.00 0.00 178.44 174.96 1wuq h ALA 70 N 1.78 0.51 -0.25 1.49 0.00 -0.99 -1.81 119.26 119.99 1wuq h ALA 70 Ca -0.00 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 1wuq h ALA 70 Cb 0.54 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1wuq h ALA 70 CO 0.03 0.37 -0.16 0.35 0.00 0.00 0.00 179.25 179.83 1wuq h PHE 71 N 0.52 0.64 0.00 0.00 3.57 -0.76 -2.49 116.94 118.42 1wuq h PHE 71 Ca 0.09 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.42 1wuq h PHE 71 Cb 0.60 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.20 1wuq h PHE 71 CO 0.05 0.83 0.00 -0.07 -2.23 0.00 0.00 178.31 176.89 1wuq h LEU 72 N 0.26 0.00 -2.99 0.59 3.38 -0.61 -2.49 115.31 113.45 1wuq h LEU 72 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1wuq h LEU 72 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1wuq h LEU 72 CO 0.04 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.92 1wuq n THR 73 N -2.93 1.29 0.30 0.22 -2.24 -0.69 -2.84 114.28 107.39 1wuq n THR 73 Ca -0.01 -1.25 0.17 0.00 -2.27 0.00 0.00 64.05 60.70 1wuq n THR 73 Cb 0.19 0.31 0.96 0.00 -2.10 0.00 0.00 70.33 69.70 1wuq n THR 73 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1wuq h ARG 74 N 1.36 0.00 -0.57 -0.78 0.11 -0.97 -2.85 114.38 110.67 1wuq h ARG 74 Ca 0.00 0.00 0.09 0.00 0.10 0.00 0.00 59.98 60.17 1wuq h ARG 74 Cb 0.82 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.87 1wuq h ARG 74 CO 0.04 0.03 0.39 0.78 0.10 0.00 0.00 179.97 181.30 1wuq h GLY 75 N 0.31 0.56 1.89 0.08 0.00 -1.31 -1.34 103.07 103.25 1wuq h GLY 75 Ca -0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.12 1wuq h GLY 75 CO 0.00 0.11 -0.15 -0.97 0.00 0.00 0.00 176.54 175.53 1wuq h TYR 76 N 0.41 0.15 -0.17 5.60 0.05 -1.64 -2.90 116.97 118.47 1wuq h TYR 76 Ca 0.26 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.03 1wuq h TYR 76 Cb 0.49 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.19 1wuq h TYR 76 CO -0.00 0.29 0.00 0.54 -1.05 0.00 0.00 178.16 177.94 1wuq n ARG 77 N -4.30 1.91 -3.41 4.88 1.74 -0.52 -4.93 116.66 112.03 1wuq n ARG 77 Ca -0.01 -1.35 -0.25 0.00 -0.77 0.00 0.00 57.85 55.47 1wuq n ARG 77 Cb 0.26 -1.44 -0.02 0.00 -1.02 0.00 0.00 32.46 30.24 1wuq n ARG 77 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1wuq s GLN 78 N -1.80 3.51 -0.10 5.56 -0.21 -1.10 -5.10 119.66 120.43 1wuq s GLN 78 Ca 0.34 -0.28 0.04 0.00 0.02 0.00 0.00 55.36 55.48 1wuq s GLN 78 Cb 0.19 -2.68 -0.00 0.00 1.00 0.00 0.00 33.01 31.52 1wuq s GLN 78 CO 0.29 0.19 -0.23 1.03 -2.12 0.00 0.00 175.29 174.44 1wuq s ARG 79 N -4.08 3.06 0.24 2.91 0.52 -1.26 -5.03 118.95 115.31 1wuq s ARG 79 Ca 0.40 -0.87 -0.05 0.00 -0.52 0.00 0.00 55.73 54.69 1wuq s ARG 79 Cb -0.10 -2.32 0.45 0.00 0.52 0.00 0.00 34.95 33.50 1wuq s ARG 79 CO 0.34 0.19 1.70 1.25 0.02 0.00 0.00 175.30 178.80 1wuq h LEU 80 N 6.69 0.07 -0.69 2.53 5.85 -1.98 -0.04 115.31 127.75 1wuq h LEU 80 Ca -0.20 0.13 0.09 0.00 0.84 0.00 0.00 57.88 58.74 1wuq h LEU 80 Cb 1.24 0.17 -0.07 0.00 0.37 0.00 0.00 40.66 42.37 1wuq h LEU 80 CO 0.48 -0.00 0.35 -0.08 -0.34 0.00 0.00 178.44 178.84 1wuq h GLU 81 N 0.31 0.58 -0.01 1.25 4.81 -1.99 -0.72 114.58 118.82 1wuq h GLU 81 Ca 0.41 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 59.41 1wuq h GLU 81 Cb 0.67 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 1wuq h GLU 81 CO -0.48 0.39 -0.86 0.93 -0.73 0.00 0.00 179.01 178.27 1wuq h GLU 82 N 0.60 0.23 -0.56 1.92 5.08 -1.67 -2.01 114.58 118.17 1wuq h GLU 82 Ca 0.34 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 1wuq h GLU 82 Cb 0.33 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1wuq h GLU 82 CO -0.25 0.95 0.17 0.28 -1.00 0.00 0.00 179.01 179.16 1wuq h VAL 83 N 0.13 1.24 -0.01 3.13 2.07 -0.35 -2.68 116.25 119.79 1wuq h VAL 83 Ca -0.04 -0.82 -0.15 0.00 0.82 0.00 0.00 66.70 66.50 1wuq h VAL 83 Cb 1.47 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 1wuq h VAL 83 CO 0.13 0.30 -0.72 0.58 0.02 0.00 0.00 177.57 177.89 1wuq h VAL 84 N 0.78 1.49 -7.05 2.57 2.07 -1.18 -3.47 116.25 111.45 1wuq h VAL 84 Ca 0.18 -2.40 -0.61 0.00 0.82 0.00 0.00 66.70 64.69 1wuq h VAL 84 Cb 0.29 2.29 -0.20 0.00 -1.52 0.00 0.00 31.29 32.16 1wuq h VAL 84 CO -0.00 0.69 -0.97 0.61 0.02 0.00 0.00 177.57 177.92 1wuq n GLY 85 N 0.52 -0.15 7.00 2.17 0.00 -0.76 -3.79 105.19 110.19 1wuq n GLY 85 Ca -0.01 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1wuq n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wuq n GLY 86 N -2.54 2.36 3.39 -0.02 0.00 -1.26 -4.89 105.19 102.22 1wuq n GLY 86 Ca -0.32 -0.38 -0.23 0.00 0.00 0.00 0.00 46.02 45.09 1wuq n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wuq n ALA 87 N 9.17 -1.07 -3.88 4.61 0.00 -1.25 -4.89 120.51 123.20 1wuq n ALA 87 Ca 0.00 0.05 -0.34 0.00 0.00 0.00 0.00 53.44 53.15 1wuq n ALA 87 Cb 0.00 -2.53 -0.15 0.00 0.00 0.00 0.00 19.45 16.77 1wuq n ALA 87 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1wuq s VAL 88 N -2.88 2.55 0.26 0.00 1.01 -1.26 -1.01 120.40 119.08 1wuq s VAL 88 Ca 0.40 -1.02 0.10 0.00 0.00 0.00 0.00 61.98 61.46 1wuq s VAL 88 Cb -0.22 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 1wuq s VAL 88 CO 0.49 0.31 -0.07 -0.36 0.00 0.00 0.00 175.10 175.47 1wuq s PHE 89 N 1.30 2.58 0.42 5.22 0.08 -0.03 -4.94 117.98 122.61 1wuq s PHE 89 Ca 0.01 -0.25 -0.25 0.00 0.12 0.00 0.00 56.93 56.56 1wuq s PHE 89 Cb -0.16 -1.15 -0.08 0.00 -0.57 0.00 0.00 43.02 41.06 1wuq s PHE 89 CO -0.07 0.63 1.28 -1.25 -0.10 0.00 0.00 175.22 175.71 1wuq s PRO 90 N -3.53 3.90 0.42 0.24 0.04 -1.26 0.05 135.00 134.87 1wuq s PRO 90 Ca 0.30 2.09 -0.26 0.00 0.04 0.00 0.00 61.00 63.17 1wuq s PRO 90 Cb -0.06 -2.68 -0.08 0.00 0.04 0.00 0.00 34.50 31.71 1wuq s PRO 90 CO 0.18 -0.52 1.35 0.00 0.04 0.00 0.00 177.00 178.04 1wuq s ALA 91 N -1.31 3.24 -0.43 8.56 0.00 -0.80 -4.59 121.76 126.43 1wuq s ALA 91 Ca 0.58 1.31 0.23 0.00 0.00 0.00 0.00 51.96 54.08 1wuq s ALA 91 Cb -0.36 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.20 1wuq s ALA 91 CO 0.46 -0.96 0.94 0.39 0.00 0.00 0.00 175.76 176.59 1wuq n GLU 92 N -0.01 0.42 -2.84 0.00 -0.58 -1.26 -4.97 120.64 111.40 1wuq n GLU 92 Ca 0.04 -0.01 -0.02 0.00 -0.42 0.00 0.00 57.16 56.75 1wuq n GLU 92 Cb 0.43 -1.63 0.01 0.00 -0.57 0.00 0.00 31.44 29.68 1wuq n GLU 92 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1wuq n GLY 93 N 1.31 0.98 0.20 0.62 0.00 -1.26 -5.05 105.19 101.98 1wuq n GLY 93 Ca 0.01 -1.08 0.07 0.00 0.00 0.00 0.00 46.02 45.02 1wuq n GLY 93 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wuq n SER 94 N -1.06 1.19 -4.77 1.61 3.41 -1.26 -4.82 113.62 107.91 1wuq n SER 94 Ca -0.02 -1.09 -0.31 0.00 -0.26 0.00 0.00 58.87 57.18 1wuq n SER 94 Cb 0.35 0.71 0.09 0.00 -0.26 0.00 0.00 64.21 65.09 1wuq n SER 94 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1wuq s GLU 95 N -2.09 2.35 0.41 4.33 8.01 -1.26 -4.59 118.70 125.86 1wuq s GLU 95 Ca 0.10 1.17 -0.26 0.00 0.01 0.00 0.00 54.97 55.98 1wuq s GLU 95 Cb 0.12 -1.91 -0.09 0.00 -4.31 0.00 0.00 34.13 27.94 1wuq s GLU 95 CO 0.49 -1.58 1.40 1.41 0.01 0.00 0.00 175.26 176.99 1wuq s MET 96 N -4.86 3.91 -0.14 1.61 -2.45 -1.26 -4.58 119.30 111.53 1wuq s MET 96 Ca 0.61 2.37 0.00 0.00 -1.25 0.00 0.00 55.69 57.43 1wuq s MET 96 Cb -0.17 -2.79 -0.01 0.00 1.25 0.00 0.00 34.83 33.11 1wuq s MET 96 CO 0.55 -0.62 -0.15 0.08 1.05 0.00 0.00 175.02 175.93 1wuq s VAL 97 N -1.19 2.83 -0.18 10.11 1.01 0.01 -4.97 120.40 128.01 1wuq s VAL 97 Ca 0.57 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.83 1wuq s VAL 97 Cb -0.43 -2.18 0.03 0.00 0.00 0.00 0.00 36.38 33.80 1wuq s VAL 97 CO 0.56 0.52 -0.13 -0.69 0.00 0.00 0.00 175.10 175.36 1wuq s VAL 98 N 0.50 1.74 -0.44 2.92 1.01 -1.26 -1.42 120.40 123.45 1wuq s VAL 98 Ca -0.10 -0.93 -0.07 0.00 0.00 0.00 0.00 61.98 60.88 1wuq s VAL 98 Cb -0.16 -1.72 0.11 0.00 0.00 0.00 0.00 36.38 34.62 1wuq s VAL 98 CO 0.04 0.31 0.29 -0.69 0.00 0.00 0.00 175.10 175.05 1wuq s VAL 99 N 1.38 3.92 0.32 2.92 1.01 0.56 -4.99 120.40 125.52 1wuq s VAL 99 Ca 0.01 -1.82 0.07 0.00 0.00 0.00 0.00 61.98 60.24 1wuq s VAL 99 Cb -0.15 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 1wuq s VAL 99 CO -0.10 -0.71 0.29 -1.59 0.00 0.00 0.00 175.10 172.99 1wuq s LYS 100 N 1.30 2.79 -1.17 2.72 -2.85 -1.26 -0.68 119.74 120.58 1wuq s LYS 100 Ca 0.06 -1.23 -0.01 0.00 -1.00 0.00 0.00 55.97 53.80 1wuq s LYS 100 Cb -0.25 -2.52 0.00 0.00 -2.06 0.00 0.00 37.83 33.00 1wuq s LYS 100 CO -0.02 0.15 0.08 0.41 0.10 0.00 0.00 175.35 176.07 1wuq n GLY 101 N -1.36 -0.19 3.57 0.59 0.00 -1.20 -4.96 105.19 101.65 1wuq n GLY 101 Ca -0.03 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 1wuq n GLY 101 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wuq s VAL 102 N -2.75 3.93 0.50 1.61 1.01 -0.37 -4.82 120.40 119.52 1wuq s VAL 102 Ca 0.04 0.76 -0.23 0.00 0.00 0.00 0.00 61.98 62.55 1wuq s VAL 102 Cb -0.02 -4.79 -0.06 0.00 0.00 0.00 0.00 36.38 31.52 1wuq s VAL 102 CO 0.05 -1.50 1.30 -1.83 0.00 0.00 0.00 175.10 173.12 1wuq s GLU 103 N 5.19 3.43 0.05 2.72 1.03 -1.26 -0.45 118.70 129.41 1wuq s GLU 103 Ca 0.41 2.10 -0.06 0.00 0.03 0.00 0.00 54.97 57.45 1wuq s GLU 103 Cb -0.08 -2.37 -0.01 0.00 -0.80 0.00 0.00 34.13 30.87 1wuq s GLU 103 CO 0.22 -0.92 0.10 -0.59 -1.33 0.00 0.00 175.26 172.75 1wuq s PHE 104 N -1.36 0.23 -0.02 4.83 -0.71 -0.68 -4.86 117.98 115.40 1wuq s PHE 104 Ca 0.67 -0.58 0.01 0.00 -1.04 0.00 0.00 56.93 55.99 1wuq s PHE 104 Cb -0.37 -0.16 0.01 0.00 -1.21 0.00 0.00 43.02 41.29 1wuq s PHE 104 CO 0.45 -0.40 -0.03 0.71 -1.34 0.00 0.00 175.22 174.60 1wuq s TYR 105 N -2.98 0.44 0.22 3.49 2.02 -1.26 -2.04 117.35 117.23 1wuq s TYR 105 Ca -0.02 -0.08 0.02 0.00 -0.37 0.00 0.00 57.07 56.62 1wuq s TYR 105 Cb 0.01 -0.36 -0.01 0.00 -0.40 0.00 0.00 41.96 41.20 1wuq s TYR 105 CO -0.06 -0.07 0.25 0.45 -1.57 0.00 0.00 175.55 174.55 1wuq n SER 106 N 3.43 -0.67 -3.95 2.29 2.88 0.00 -4.31 113.62 113.30 1wuq n SER 106 Ca -0.18 -2.30 -0.23 0.00 -1.33 0.00 0.00 58.87 54.83 1wuq n SER 106 Cb 0.55 1.36 -0.17 0.00 -0.75 0.00 0.00 64.21 65.21 1wuq n SER 106 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1wuq s MET 107 N -2.68 1.26 0.25 -1.46 -1.94 -1.23 -1.57 119.30 111.93 1wuq s MET 107 Ca 0.22 -0.24 -0.30 0.00 -1.71 0.00 0.00 55.69 53.66 1wuq s MET 107 Cb 0.00 -1.15 -0.09 0.00 2.01 0.00 0.00 34.83 35.60 1wuq s MET 107 CO 0.16 -0.06 1.28 0.00 -0.01 0.00 0.00 175.02 176.39 1wuq h GLU 109 N 4.55 0.00 0.18 0.00 4.11 -1.34 -0.46 114.58 121.62 1wuq h GLU 109 Ca -0.46 0.00 -0.29 0.00 0.07 0.00 0.00 59.36 58.67 1wuq h GLU 109 Cb 1.22 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.50 1wuq h GLU 109 CO 0.72 0.00 -1.26 0.45 0.07 0.00 0.00 179.01 178.99 1wuq h HIS 110 N 0.00 0.93 0.00 2.06 3.86 -1.90 -3.40 115.15 116.70 1wuq h HIS 110 Ca 0.00 -0.63 0.00 0.00 -1.16 0.00 0.00 60.37 58.58 1wuq h HIS 110 Cb 0.43 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.85 1wuq h HIS 110 CO 0.00 1.48 0.00 0.72 0.86 0.00 0.00 177.93 180.99 1wuq n HIS 111 N -3.83 0.00 -3.19 2.45 8.25 -1.23 -5.01 115.22 112.66 1wuq n HIS 111 Ca -0.15 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.12 1wuq n HIS 111 Cb 1.00 0.00 0.05 0.00 1.12 0.00 0.00 29.99 32.16 1wuq n HIS 111 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1wuq n LEU 112 N -0.79 -2.89 -4.35 2.41 4.77 -0.18 -5.01 117.00 110.97 1wuq n LEU 112 Ca 0.00 -0.36 -0.30 0.00 -0.03 0.00 0.00 56.01 55.32 1wuq n LEU 112 Cb 0.00 -2.54 -0.15 0.00 -2.33 0.00 0.00 43.42 38.41 1wuq n LEU 112 CO 0.00 0.40 -0.56 -0.76 -1.33 0.00 0.00 177.39 175.14 1wuq s LEU 113 N -5.87 2.19 0.49 2.23 1.43 -1.26 -4.87 118.68 113.02 1wuq s LEU 113 Ca 0.39 -0.56 -0.24 0.00 -1.03 0.00 0.00 54.13 52.69 1wuq s LEU 113 Cb -0.17 -1.31 -0.07 0.00 0.03 0.00 0.00 46.19 44.67 1wuq s LEU 113 CO 0.48 0.27 1.40 -2.84 0.23 0.00 0.00 176.35 175.89 1wuq s PRO 114 N -1.17 3.47 -0.01 1.29 0.02 -1.26 -1.34 135.00 136.00 1wuq s PRO 114 Ca 0.12 2.34 0.01 0.00 0.02 0.00 0.00 61.00 63.49 1wuq s PRO 114 Cb -0.10 -2.50 0.01 0.00 0.02 0.00 0.00 34.50 31.93 1wuq s PRO 114 CO 0.02 -0.96 -0.02 -0.59 -0.33 0.00 0.00 177.00 175.12 1wuq s PHE 115 N -1.24 0.30 0.24 6.54 -0.71 -0.61 -2.09 117.98 120.41 1wuq s PHE 115 Ca 0.65 -0.04 -0.13 0.00 -1.04 0.00 0.00 56.93 56.38 1wuq s PHE 115 Cb -0.42 -0.28 -0.00 0.00 -1.21 0.00 0.00 43.02 41.11 1wuq s PHE 115 CO 0.53 -0.05 0.46 -0.59 -1.34 0.00 0.00 175.22 174.22 1wuq s PHE 116 N 0.35 0.35 0.00 3.49 -0.71 -0.60 -0.82 117.98 120.05 1wuq s PHE 116 Ca -0.03 -0.71 0.00 0.00 -1.04 0.00 0.00 56.93 55.15 1wuq s PHE 116 Cb -0.06 0.17 0.00 0.00 -1.21 0.00 0.00 43.02 41.92 1wuq s PHE 116 CO -0.01 -0.96 0.00 0.41 -1.34 0.00 0.00 175.22 173.32 1wuq n GLY 117 N -0.36 -0.52 3.05 1.99 0.00 -0.87 -0.23 105.19 108.26 1wuq n GLY 117 Ca -0.03 0.05 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 1wuq n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wuq s LYS 118 N 0.00 0.51 -0.09 1.61 1.02 -0.05 -1.69 119.74 121.06 1wuq s LYS 118 Ca 0.00 -0.85 0.04 0.00 0.02 0.00 0.00 55.97 55.18 1wuq s LYS 118 Cb 0.00 -0.08 -0.00 0.00 -0.52 0.00 0.00 37.83 37.23 1wuq s LYS 118 CO 0.00 -0.01 -0.24 0.08 -0.92 0.00 0.00 175.35 174.26 1wuq s VAL 119 N -2.06 2.03 -0.10 3.17 1.01 0.41 -1.14 120.40 123.70 1wuq s VAL 119 Ca -0.07 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 60.93 1wuq s VAL 119 Cb -0.05 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.58 1wuq s VAL 119 CO -0.02 0.56 -0.20 -1.00 0.00 0.00 0.00 175.10 174.44 1wuq s HIS 120 N 0.22 2.64 -0.02 5.22 0.09 0.19 -1.23 115.29 122.40 1wuq s HIS 120 Ca -0.15 -0.83 0.06 0.00 -0.00 0.00 0.00 55.06 54.15 1wuq s HIS 120 Cb -0.17 -1.74 -0.01 0.00 -0.00 0.00 0.00 32.58 30.66 1wuq s HIS 120 CO 0.07 -0.29 -0.21 0.42 -0.00 0.00 0.00 174.74 174.73 1wuq s ILE 121 N 0.23 1.66 0.01 0.60 1.01 0.14 -0.99 121.20 123.86 1wuq s ILE 121 Ca -0.13 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.64 1wuq s ILE 121 Cb -0.16 -1.38 -0.01 0.00 0.01 0.00 0.00 42.46 40.91 1wuq s ILE 121 CO 0.07 0.47 -0.03 -0.83 0.00 0.00 0.00 174.94 174.62 1wuq s GLY 122 N -0.43 0.18 0.04 6.18 0.00 0.15 -0.32 107.32 113.11 1wuq s GLY 122 Ca 0.06 -0.24 -0.26 0.00 0.00 0.00 0.00 44.72 44.29 1wuq s GLY 122 CO -0.00 -0.24 0.60 -2.52 0.00 0.00 0.00 173.10 170.94 1wuq s TYR 123 N -0.39 -0.54 -0.26 1.90 -0.85 -0.51 -0.40 117.35 116.31 1wuq s TYR 123 Ca -0.02 0.69 -0.04 0.00 -0.52 0.00 0.00 57.07 57.17 1wuq s TYR 123 Cb -0.03 0.42 0.01 0.00 0.38 0.00 0.00 41.96 42.74 1wuq s TYR 123 CO -0.00 -0.68 -0.00 0.42 -1.52 0.00 0.00 175.55 173.77 1wuq s ILE 124 N -2.27 3.43 0.79 -3.49 -1.09 -0.99 -0.81 121.20 116.76 1wuq s ILE 124 Ca -0.06 -0.74 -0.11 0.00 -2.23 0.00 0.00 60.65 57.51 1wuq s ILE 124 Cb -0.01 -2.70 0.07 0.00 -1.58 0.00 0.00 42.46 38.24 1wuq s ILE 124 CO 0.00 0.22 1.09 -2.16 -1.23 0.00 0.00 174.94 172.86 1wuq s PRO 125 N 1.44 2.14 -0.50 2.79 0.04 -1.26 -0.64 135.00 139.00 1wuq s PRO 125 Ca 0.03 0.98 0.07 0.00 0.04 0.00 0.00 61.00 62.12 1wuq s PRO 125 Cb -0.16 -1.90 0.26 0.00 0.04 0.00 0.00 34.50 32.74 1wuq s PRO 125 CO -0.02 -1.67 0.64 -3.47 0.04 0.00 0.00 177.00 172.52 1wuq n ASP 126 N -3.52 1.83 0.00 6.66 2.03 -1.26 -4.22 116.55 118.07 1wuq n ASP 126 Ca 0.08 -3.05 0.00 0.00 0.52 0.00 0.00 54.79 52.34 1wuq n ASP 126 Cb 0.54 -0.65 0.00 0.00 -0.72 0.00 0.00 41.12 40.29 1wuq n ASP 126 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wuq n GLY 127 N 1.05 2.25 2.83 0.27 0.00 -1.26 -4.89 105.19 105.44 1wuq n GLY 127 Ca 0.25 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.12 1wuq n GLY 127 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wuq s LYS 128 N -0.22 0.19 0.22 1.61 1.02 -1.26 -1.90 119.74 119.40 1wuq s LYS 128 Ca 0.00 0.06 0.10 0.00 0.02 0.00 0.00 55.97 56.15 1wuq s LYS 128 Cb 0.00 -0.35 -0.04 0.00 -0.52 0.00 0.00 37.83 36.91 1wuq s LYS 128 CO 0.00 -0.10 -0.12 0.96 -0.92 0.00 0.00 175.35 175.17 1wuq s ILE 129 N 0.77 2.97 0.08 2.17 -4.36 0.11 -4.69 121.20 118.25 1wuq s ILE 129 Ca -0.07 -1.91 0.03 0.00 -0.26 0.00 0.00 60.65 58.43 1wuq s ILE 129 Cb -0.10 -2.51 -0.04 0.00 1.25 0.00 0.00 42.46 41.06 1wuq s ILE 129 CO -0.02 -0.22 0.09 -0.22 0.24 0.00 0.00 174.94 174.81 1wuq s LEU 130 N -3.10 3.83 0.10 0.37 2.96 -1.26 -0.86 118.68 120.73 1wuq s LEU 130 Ca 0.26 0.00 -0.31 0.00 -0.22 0.00 0.00 54.13 53.87 1wuq s LEU 130 Cb -0.07 -2.51 -0.09 0.00 0.50 0.00 0.00 46.19 44.02 1wuq s LEU 130 CO 0.15 0.17 1.66 -0.83 -1.32 0.00 0.00 176.35 176.18 1wuq s GLY 131 N -2.42 1.52 0.26 7.98 0.00 -0.18 -4.88 107.32 109.60 1wuq s GLY 131 Ca 0.30 1.29 -0.09 0.00 0.00 0.00 0.00 44.72 46.21 1wuq s GLY 131 CO 0.22 2.86 1.58 1.41 0.00 0.00 0.00 173.10 179.17 1wuq h LEU 132 N 8.10 -0.81 -2.30 0.66 3.38 -1.97 0.46 115.31 122.83 1wuq h LEU 132 Ca -0.43 0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1wuq h LEU 132 Cb 1.20 0.55 -0.00 0.00 0.09 0.00 0.00 40.66 42.50 1wuq h LEU 132 CO 0.93 -0.29 -0.04 0.77 0.09 0.00 0.00 178.44 179.89 1wuq h SER 133 N 0.00 0.00 0.43 -0.43 4.64 -2.00 -2.32 113.55 113.88 1wuq h SER 133 Ca 0.43 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.71 1wuq h SER 133 Cb 0.67 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.75 1wuq h SER 133 CO -0.92 0.04 -0.22 0.11 -0.87 0.00 0.00 176.83 174.97 1wuq h LYS 134 N 0.00 0.00 -0.71 4.77 1.79 -1.25 -1.63 116.57 119.54 1wuq h LYS 134 Ca -0.00 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.41 1wuq h LYS 134 Cb 0.19 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.81 1wuq h LYS 134 CO 0.01 0.22 0.20 0.74 -1.08 0.00 0.00 179.45 179.53 1wuq h PHE 135 N 0.00 1.17 -0.37 -1.35 0.04 -1.50 -0.40 116.94 114.53 1wuq h PHE 135 Ca -0.00 -0.13 -0.11 0.00 2.80 0.00 0.00 57.97 60.53 1wuq h PHE 135 Cb 0.50 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 38.31 1wuq h PHE 135 CO 0.00 0.94 -0.19 0.00 -0.60 0.00 0.00 178.31 178.45 1wuq h ALA 136 N 1.14 0.53 -0.40 2.45 0.00 -1.47 -1.37 119.26 120.13 1wuq h ALA 136 Ca 0.23 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1wuq h ALA 136 Cb 0.34 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1wuq h ALA 136 CO -0.00 0.47 0.04 0.00 0.00 0.00 0.00 179.25 179.76 1wuq h ARG 137 N 0.58 0.62 -0.26 0.00 3.08 -1.04 -1.00 114.38 116.35 1wuq h ARG 137 Ca 0.08 -0.13 -0.12 0.00 0.07 0.00 0.00 59.98 59.88 1wuq h ARG 137 Cb 0.74 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.70 1wuq h ARG 137 CO 0.06 0.61 -0.32 0.82 -1.07 0.00 0.00 179.97 180.07 1wuq h ILE 138 N 0.59 1.31 -0.21 2.04 2.04 -0.91 -1.75 117.51 120.62 1wuq h ILE 138 Ca 0.13 -1.50 0.04 0.00 1.00 0.00 0.00 64.86 64.53 1wuq h ILE 138 Cb 0.31 1.65 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 1wuq h ILE 138 CO 0.01 0.48 -0.06 0.58 0.00 0.00 0.00 178.15 179.15 1wuq h VAL 139 N 0.41 0.77 -0.55 1.67 2.07 -0.76 -2.24 116.25 117.63 1wuq h VAL 139 Ca 0.04 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 1wuq h VAL 139 Cb 0.90 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1wuq h VAL 139 CO 0.08 0.00 0.22 0.44 0.02 0.00 0.00 177.57 178.33 1wuq h ASP 140 N -0.01 0.71 -0.83 0.57 3.32 -1.15 0.79 116.42 119.81 1wuq h ASP 140 Ca 0.10 -0.08 0.03 0.00 0.02 0.00 0.00 57.03 57.10 1wuq h ASP 140 Cb 0.17 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.49 1wuq h ASP 140 CO -0.23 0.64 0.53 -0.03 -1.72 0.00 0.00 179.24 178.44 1wuq h MET 141 N 0.78 1.01 0.00 3.56 4.05 -0.72 -0.66 114.93 122.94 1wuq h MET 141 Ca 0.19 -0.06 -0.25 0.00 -0.28 0.00 0.00 59.70 59.30 1wuq h MET 141 Cb 0.15 -0.23 -0.04 0.00 -0.80 0.00 0.00 31.60 30.68 1wuq h MET 141 CO -0.02 0.67 -1.54 0.74 0.23 0.00 0.00 176.91 176.99 1wuq h PHE 142 N 1.04 0.00 -0.23 1.39 0.04 -1.16 -3.37 116.94 114.65 1wuq h PHE 142 Ca 0.33 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.93 1wuq h PHE 142 Cb 0.01 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.16 1wuq h PHE 142 CO -0.02 0.88 -0.54 0.00 -0.60 0.00 0.00 178.31 178.02 1wuq h ALA 143 N 1.12 0.61 0.00 2.45 0.00 -0.72 -3.33 119.26 119.39 1wuq h ALA 143 Ca -0.22 -0.51 -0.67 0.00 0.00 0.00 0.00 54.91 53.51 1wuq h ALA 143 Cb 1.87 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 19.59 1wuq h ALA 143 CO 0.08 0.69 3.65 0.54 0.00 0.00 0.00 179.25 184.20 1wuq n ARG 144 N -3.98 3.45 -3.88 0.00 1.74 -0.27 -4.28 116.66 109.43 1wuq n ARG 144 Ca -0.04 -2.24 -0.11 0.00 -0.77 0.00 0.00 57.85 54.69 1wuq n ARG 144 Cb 0.61 -2.88 0.01 0.00 -1.02 0.00 0.00 32.46 29.18 1wuq n ARG 144 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1wuq s ARG 145 N 2.46 2.19 -0.11 5.56 0.52 -1.13 -1.17 118.95 127.28 1wuq s ARG 145 Ca 0.64 -1.57 -0.23 0.00 -0.52 0.00 0.00 55.73 54.05 1wuq s ARG 145 Cb 0.17 0.58 -0.03 0.00 0.52 0.00 0.00 34.95 36.19 1wuq s ARG 145 CO -0.06 -1.00 0.70 -0.51 0.02 0.00 0.00 175.30 174.44 1wuq s LEU 146 N -3.13 4.26 0.37 2.53 1.43 -1.26 -3.50 118.68 119.38 1wuq s LEU 146 Ca 0.20 1.10 0.05 0.00 -1.03 0.00 0.00 54.13 54.45 1wuq s LEU 146 Cb -0.04 -3.05 -0.03 0.00 0.03 0.00 0.00 46.19 43.10 1wuq s LEU 146 CO 0.15 -0.18 0.18 -1.10 0.23 0.00 0.00 176.35 175.62 1wuq s GLN 147 N 1.21 1.84 -0.05 1.70 -1.52 0.18 -4.73 119.66 118.29 1wuq s GLN 147 Ca 0.35 -2.10 0.01 0.00 -1.95 0.00 0.00 55.36 51.67 1wuq s GLN 147 Cb -0.17 -0.24 0.02 0.00 -0.22 0.00 0.00 33.01 32.40 1wuq s GLN 147 CO 0.15 -0.54 -0.04 0.08 -0.25 0.00 0.00 175.29 174.70 1wuq s VAL 148 N -3.33 0.51 0.36 1.09 1.01 -1.26 -0.97 120.40 117.80 1wuq s VAL 148 Ca 0.30 -0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.28 1wuq s VAL 148 Cb 0.03 -0.56 0.31 0.00 0.00 0.00 0.00 36.38 36.16 1wuq s VAL 148 CO 0.19 0.23 1.91 -0.61 0.00 0.00 0.00 175.10 176.83 1wuq h GLN 149 N 7.43 0.71 -0.92 2.72 4.15 -2.00 -1.53 115.11 125.67 1wuq h GLN 149 Ca -0.34 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.03 1wuq h GLN 149 Cb 1.15 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.63 1wuq h GLN 149 CO 0.43 0.47 0.56 0.93 -1.93 0.00 0.00 178.83 179.29 1wuq h GLU 150 N 0.73 1.24 -0.20 1.69 3.07 -1.97 -2.82 114.58 116.32 1wuq h GLU 150 Ca 0.38 -0.11 -0.09 0.00 -0.50 0.00 0.00 59.36 59.04 1wuq h GLU 150 Cb 0.48 -0.26 -0.00 0.00 -0.84 0.00 0.00 28.75 28.13 1wuq h GLU 150 CO -0.15 0.86 -0.24 -0.09 -1.40 0.00 0.00 179.01 177.99 1wuq h ARG 151 N 1.26 0.51 -0.76 2.33 2.43 -1.73 -3.23 114.38 115.19 1wuq h ARG 151 Ca 0.33 -0.28 0.14 0.00 -0.81 0.00 0.00 59.98 59.35 1wuq h ARG 151 Cb -0.07 0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 29.41 1wuq h ARG 151 CO -0.06 0.87 0.32 1.25 -1.51 0.00 0.00 179.97 180.84 1wuq h LEU 152 N 0.18 0.33 -0.39 3.80 5.85 -1.11 -0.47 115.31 123.50 1wuq h LEU 152 Ca 0.03 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1wuq h LEU 152 Cb 0.80 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 1wuq h LEU 152 CO 0.06 0.14 0.15 0.00 -0.34 0.00 0.00 178.44 178.45 1wuq h ALA 153 N 1.53 0.51 -0.25 1.25 0.00 -1.57 -2.26 119.26 118.49 1wuq h ALA 153 Ca 0.41 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1wuq h ALA 153 Cb 0.60 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1wuq h ALA 153 CO -0.38 0.12 0.08 0.28 0.00 0.00 0.00 179.25 179.35 1wuq h VAL 154 N 0.49 1.19 -0.79 0.00 2.07 -1.37 -1.86 116.25 115.98 1wuq h VAL 154 Ca 0.13 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 1wuq h VAL 154 Cb 0.20 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 1wuq h VAL 154 CO -0.01 0.20 0.39 1.56 0.02 0.00 0.00 177.57 179.72 1wuq h GLN 155 N 0.23 1.13 -0.29 1.57 4.20 -1.09 0.11 115.11 120.97 1wuq h GLN 155 Ca 0.08 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 1wuq h GLN 155 Cb 0.23 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1wuq h GLN 155 CO -0.00 0.87 0.04 0.82 -0.67 0.00 0.00 178.83 179.88 1wuq h ILE 156 N 1.12 1.24 -0.56 2.54 2.04 -1.30 -1.02 117.51 121.57 1wuq h ILE 156 Ca 0.27 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 1wuq h ILE 156 Cb 0.10 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1wuq h ILE 156 CO -0.04 0.27 0.29 0.00 0.00 0.00 0.00 178.15 178.67 1wuq h ALA 157 N 0.87 0.72 -0.29 1.87 0.00 -0.97 -2.07 119.26 119.38 1wuq h ALA 157 Ca 0.09 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1wuq h ALA 157 Cb 0.36 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1wuq h ALA 157 CO 0.01 0.26 -0.18 0.93 0.00 0.00 0.00 179.25 180.26 1wuq h GLU 158 N 0.75 0.53 -0.58 0.00 5.08 -0.67 -1.02 114.58 118.67 1wuq h GLU 158 Ca 0.19 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.28 1wuq h GLU 158 Cb 0.09 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1wuq h GLU 158 CO -0.03 0.69 -0.02 0.00 -1.00 0.00 0.00 179.01 178.65 1wuq h ALA 159 N 1.33 0.79 -0.52 3.43 0.00 -0.97 -1.17 119.26 122.14 1wuq h ALA 159 Ca 0.08 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 1wuq h ALA 159 Cb 0.59 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1wuq h ALA 159 CO 0.04 0.64 0.05 0.82 0.00 0.00 0.00 179.25 180.81 1wuq h ILE 160 N 0.94 1.26 -0.42 0.00 1.08 -1.06 -2.20 117.51 117.10 1wuq h ILE 160 Ca 0.16 -1.00 0.01 0.00 -0.39 0.00 0.00 64.86 63.64 1wuq h ILE 160 Cb 0.58 0.89 -0.02 0.00 -3.07 0.00 0.00 36.82 35.20 1wuq h ILE 160 CO 0.03 0.36 0.27 -0.61 -0.69 0.00 0.00 178.15 177.51 1wuq h GLN 161 N 0.76 0.54 -0.54 2.37 5.75 -0.94 -0.75 115.11 122.29 1wuq h GLN 161 Ca 0.15 -0.03 -0.08 0.00 -0.15 0.00 0.00 58.65 58.54 1wuq h GLN 161 Cb 0.45 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.86 1wuq h GLN 161 CO 0.02 0.36 0.03 1.49 -2.65 0.00 0.00 178.83 178.07 1wuq h GLU 162 N 0.55 0.90 -0.03 1.69 4.81 -1.09 0.25 114.58 121.67 1wuq h GLU 162 Ca 0.16 -0.25 -0.24 0.00 -0.13 0.00 0.00 59.36 58.90 1wuq h GLU 162 Cb -0.05 -0.10 0.02 0.00 0.63 0.00 0.00 28.75 29.25 1wuq h GLU 162 CO -0.04 0.88 -0.93 0.28 -0.73 0.00 0.00 179.01 178.47 1wuq h VAL 163 N 0.84 1.30 0.00 0.32 2.07 -1.16 -3.39 116.25 116.23 1wuq h VAL 163 Ca 0.16 -2.17 -0.07 0.00 0.82 0.00 0.00 66.70 65.45 1wuq h VAL 163 Cb 0.46 2.35 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1wuq h VAL 163 CO 0.02 0.67 -1.75 0.18 0.02 0.00 0.00 177.57 176.71 1wuq n LEU 164 N -3.93 0.00 -3.96 2.57 4.77 -0.31 -5.01 117.00 111.14 1wuq n LEU 164 Ca -0.10 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.62 1wuq n LEU 164 Cb 0.83 0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.99 1wuq n LEU 164 CO 0.54 0.09 -0.21 -0.62 -1.33 0.00 0.00 177.39 175.86 1wuq n GLU 165 N -2.15 -3.41 -1.52 3.23 1.02 0.87 -4.73 120.64 113.95 1wuq n GLU 165 Ca -0.08 0.42 -0.29 0.00 -0.02 0.00 0.00 57.16 57.19 1wuq n GLU 165 Cb 0.54 -4.61 0.17 0.00 -0.02 0.00 0.00 31.44 27.51 1wuq n GLU 165 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1wuq s PRO 166 N -6.55 0.56 0.41 3.49 0.04 -1.26 -4.54 135.00 127.15 1wuq s PRO 166 Ca 0.06 0.08 0.11 0.00 0.04 0.00 0.00 61.00 61.28 1wuq s PRO 166 Cb -0.03 -1.79 0.87 0.00 0.04 0.00 0.00 34.50 33.59 1wuq s PRO 166 CO 0.89 -2.55 1.96 1.96 0.04 0.00 0.00 177.00 179.30 1wuq h GLN 167 N -1.75 0.19 -1.84 4.56 4.20 -1.05 -3.46 115.11 115.97 1wuq h GLN 167 Ca -0.48 -0.04 0.18 0.00 0.06 0.00 0.00 58.65 58.37 1wuq h GLN 167 Cb 1.30 -0.03 -0.18 0.00 0.30 0.00 0.00 27.48 28.88 1wuq h GLN 167 CO 0.52 0.30 0.66 0.20 -0.67 0.00 0.00 178.83 179.84 1wuq s GLY 168 N -4.06 -0.36 0.01 3.46 0.00 -1.21 -1.23 107.32 103.93 1wuq s GLY 168 Ca -0.05 1.39 -0.01 0.00 0.00 0.00 0.00 44.72 46.05 1wuq s GLY 168 CO 0.72 0.48 -0.01 0.14 0.00 0.00 0.00 173.10 174.44 1wuq s VAL 169 N -2.63 0.07 -0.02 1.40 1.01 -0.65 -2.35 120.40 117.23 1wuq s VAL 169 Ca 0.07 -0.59 -0.00 0.00 0.00 0.00 0.00 61.98 61.46 1wuq s VAL 169 Cb -0.01 -0.19 0.03 0.00 0.00 0.00 0.00 36.38 36.21 1wuq s VAL 169 CO -0.06 -0.32 0.03 -0.83 0.00 0.00 0.00 175.10 173.91 1wuq s GLY 170 N -0.95 0.14 -0.08 4.51 0.00 0.47 -0.25 107.32 111.16 1wuq s GLY 170 Ca -0.10 0.27 0.02 0.00 0.00 0.00 0.00 44.72 44.90 1wuq s GLY 170 CO -0.01 0.76 -0.11 0.14 0.00 0.00 0.00 173.10 173.88 1wuq s VAL 171 N 1.19 1.11 -0.11 1.40 1.01 -0.07 -0.67 120.40 124.26 1wuq s VAL 171 Ca -0.08 -0.43 0.04 0.00 0.00 0.00 0.00 61.98 61.51 1wuq s VAL 171 Cb -0.13 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.21 1wuq s VAL 171 CO -0.03 0.36 -0.23 -0.69 0.00 0.00 0.00 175.10 174.51 1wuq s VAL 172 N 0.92 2.02 -0.09 2.92 1.01 -0.16 -1.07 120.40 125.95 1wuq s VAL 172 Ca -0.10 -0.99 0.04 0.00 0.00 0.00 0.00 61.98 60.93 1wuq s VAL 172 Cb -0.15 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.46 1wuq s VAL 172 CO 0.01 0.55 -0.21 -0.69 0.00 0.00 0.00 175.10 174.76 1wuq s VAL 173 N 0.47 2.39 -0.09 2.92 1.01 0.54 -0.63 120.40 127.01 1wuq s VAL 173 Ca -0.16 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 60.90 1wuq s VAL 173 Cb -0.17 -1.92 0.02 0.00 0.00 0.00 0.00 36.38 34.30 1wuq s VAL 173 CO 0.06 0.56 -0.08 -0.70 0.00 0.00 0.00 175.10 174.94 1wuq s GLU 174 N 0.06 1.43 0.15 2.72 2.12 -0.30 -1.14 118.70 123.74 1wuq s GLU 174 Ca -0.09 -0.25 -0.12 0.00 0.36 0.00 0.00 54.97 54.87 1wuq s GLU 174 Cb -0.15 -1.41 0.01 0.00 0.26 0.00 0.00 34.13 32.83 1wuq s GLU 174 CO 0.06 -0.17 0.35 0.20 -0.54 0.00 0.00 175.26 175.15 1wuq s GLY 175 N 1.37 0.12 -0.01 -1.50 0.00 -0.31 -0.87 107.32 106.13 1wuq s GLY 175 Ca -0.02 -0.52 0.01 0.00 0.00 0.00 0.00 44.72 44.19 1wuq s GLY 175 CO -0.04 -0.59 0.01 -1.34 0.00 0.00 0.00 173.10 171.14 1wuq s VAL 176 N -3.89 4.27 -0.22 1.40 -7.23 0.68 -0.64 120.40 114.77 1wuq s VAL 176 Ca 0.10 -0.53 -0.01 0.00 -1.81 0.00 0.00 61.98 59.73 1wuq s VAL 176 Cb 0.02 -2.90 0.02 0.00 0.56 0.00 0.00 36.38 34.08 1wuq s VAL 176 CO -0.05 0.40 -0.11 -1.00 -0.31 0.00 0.00 175.10 174.03 1wuq s HIS 177 N -1.08 2.95 0.47 2.82 3.76 -1.26 -1.55 115.29 121.40 1wuq s HIS 177 Ca 0.19 -1.47 0.24 0.00 -0.15 0.00 0.00 55.06 53.88 1wuq s HIS 177 Cb -0.12 -2.02 1.41 0.00 1.11 0.00 0.00 32.58 32.97 1wuq s HIS 177 CO 0.10 -0.72 2.10 -0.07 -0.85 0.00 0.00 174.74 175.30 1wuq h LEU 178 N 8.00 0.00 -0.83 0.89 3.38 -1.74 -1.18 115.31 123.83 1wuq h LEU 178 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1wuq h LEU 178 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1wuq h LEU 178 CO 0.60 0.10 0.00 0.00 0.09 0.00 0.00 178.44 179.23 1wuq n MET 180 N -2.31 0.66 -0.11 0.00 2.81 -0.50 -4.42 117.12 113.26 1wuq n MET 180 Ca 0.02 -0.17 -0.23 0.00 -1.81 0.00 0.00 57.70 55.51 1wuq n MET 180 Cb 0.22 -1.51 -0.12 0.00 -0.71 0.00 0.00 33.22 31.10 1wuq n MET 180 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 1wuq n MET 181 N -2.31 0.64 -0.08 0.03 2.00 -0.60 -1.13 117.12 115.67 1wuq n MET 181 Ca -0.08 0.24 0.12 0.00 0.00 0.00 0.00 57.70 57.98 1wuq n MET 181 Cb 0.64 -1.56 0.26 0.00 0.00 0.00 0.00 33.22 32.57 1wuq n MET 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1wuq n MET 182 N -3.71 2.16 -3.36 0.03 3.85 0.30 -4.52 117.12 111.87 1wuq n MET 182 Ca -0.46 -1.72 -0.06 0.00 -1.00 0.00 0.00 57.70 54.47 1wuq n MET 182 Cb 0.94 -1.47 0.02 0.00 -1.05 0.00 0.00 33.22 31.66 1wuq n MET 182 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 175.97 178.86 1wuq n ARG 183 N 0.99 0.81 0.00 3.17 1.85 -1.26 -5.01 116.66 117.23 1wuq n ARG 183 Ca 0.17 -1.65 0.00 0.00 -1.00 0.00 0.00 57.85 55.37 1wuq n ARG 183 Cb 0.51 2.11 0.00 0.00 -1.05 0.00 0.00 32.46 34.02 1wuq n ARG 183 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1wuq n GLY 184 N -0.50 4.08 0.26 2.89 0.00 -1.26 -1.62 105.19 109.04 1wuq n GLY 184 Ca -0.06 0.16 0.13 0.00 0.00 0.00 0.00 46.02 46.26 1wuq n GLY 184 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1wuq h VAL 185 N 0.00 0.44 -6.42 1.61 -1.51 -1.83 -3.47 116.25 105.07 1wuq h VAL 185 Ca 0.00 -0.64 -0.50 0.00 -1.23 0.00 0.00 66.70 64.33 1wuq h VAL 185 Cb 0.00 1.45 -0.08 0.00 -2.13 0.00 0.00 31.29 30.53 1wuq h VAL 185 CO 0.00 0.12 -0.78 -0.62 -1.23 0.00 0.00 177.57 175.06 1wuq n GLU 186 N -3.45 -4.93 -2.77 5.19 1.02 -0.56 -4.95 120.64 110.18 1wuq n GLU 186 Ca -0.01 0.54 -0.38 0.00 -0.02 0.00 0.00 57.16 57.29 1wuq n GLU 186 Cb 0.28 -5.39 -0.06 0.00 -0.02 0.00 0.00 31.44 26.25 1wuq n GLU 186 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1wuq s LYS 187 N -6.70 4.72 -0.11 3.49 -0.14 -0.28 -4.89 119.74 115.82 1wuq s LYS 187 Ca 0.68 1.41 0.12 0.00 -1.36 0.00 0.00 55.97 56.82 1wuq s LYS 187 Cb -0.35 -3.03 -0.17 0.00 -1.68 0.00 0.00 37.83 32.60 1wuq s LYS 187 CO 0.86 0.39 0.09 1.04 -0.76 0.00 0.00 175.35 176.97 1wuq n GLN 188 N 1.00 1.66 -0.01 1.68 1.13 -1.26 -3.99 117.38 117.59 1wuq n GLN 188 Ca 0.00 -0.03 0.13 0.00 -1.94 0.00 0.00 57.00 55.16 1wuq n GLN 188 Cb 0.49 -1.33 0.33 0.00 0.11 0.00 0.00 30.24 29.83 1wuq n GLN 188 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1wuq n HIS 189 N -2.39 0.03 -3.00 1.08 8.25 -1.26 -4.98 115.22 112.95 1wuq n HIS 189 Ca -0.18 -0.02 -0.35 0.00 -0.26 0.00 0.00 57.72 56.92 1wuq n HIS 189 Cb 0.83 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.87 1wuq n HIS 189 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1wuq s SER 190 N -1.95 7.03 -0.05 0.41 0.15 -1.26 -5.08 113.70 112.94 1wuq s SER 190 Ca 0.34 1.51 -0.11 0.00 0.70 0.00 0.00 55.95 58.38 1wuq s SER 190 Cb 0.20 -2.46 0.02 0.00 -1.71 0.00 0.00 66.02 62.08 1wuq s SER 190 CO 0.32 -0.11 0.27 0.00 1.20 0.00 0.00 173.24 174.92 1wuq s ARG 191 N -2.42 0.49 -0.04 5.44 1.70 -1.26 -4.71 118.95 118.15 1wuq s ARG 191 Ca 0.50 0.03 0.02 0.00 -0.47 0.00 0.00 55.73 55.82 1wuq s ARG 191 Cb -0.14 0.22 -0.03 0.00 -0.57 0.00 0.00 34.95 34.43 1wuq s ARG 191 CO 0.19 -0.11 -0.09 0.99 -1.08 0.00 0.00 175.30 175.20 1wuq s THR 192 N -0.68 3.49 -0.10 4.99 2.01 0.19 -4.93 115.64 120.61 1wuq s THR 192 Ca -0.08 -0.64 0.03 0.00 0.31 0.00 0.00 61.69 61.31 1wuq s THR 192 Cb -0.04 -2.44 -0.01 0.00 0.01 0.00 0.00 72.50 70.03 1wuq s THR 192 CO 0.02 0.54 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.60 1wuq s VAL 193 N -0.84 2.40 0.10 3.82 1.01 -1.26 -1.16 120.40 124.47 1wuq s VAL 193 Ca 0.13 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.23 1wuq s VAL 193 Cb -0.11 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1wuq s VAL 193 CO 0.03 0.55 -0.08 0.42 0.00 0.00 0.00 175.10 176.02 1wuq s THR 194 N 0.25 0.80 0.28 3.92 -4.23 -0.29 -4.99 115.64 111.38 1wuq s THR 194 Ca -0.14 -1.74 -0.16 0.00 -1.18 0.00 0.00 61.69 58.48 1wuq s THR 194 Cb -0.17 -1.45 0.01 0.00 1.34 0.00 0.00 72.50 72.24 1wuq s THR 194 CO 0.07 -0.69 0.61 -0.94 -0.54 0.00 0.00 174.62 173.13 1wuq s SER 195 N -2.66 -0.10 -0.11 3.99 1.04 -1.26 -0.34 113.70 114.26 1wuq s SER 195 Ca 0.07 -0.85 -0.06 0.00 0.48 0.00 0.00 55.95 55.59 1wuq s SER 195 Cb 0.00 0.67 0.05 0.00 0.10 0.00 0.00 66.02 66.84 1wuq s SER 195 CO -0.02 -1.29 0.27 0.00 0.98 0.00 0.00 173.24 173.19 1wuq s ALA 196 N -3.77 -0.64 -0.12 5.32 0.00 -0.23 -4.67 121.76 117.65 1wuq s ALA 196 Ca 0.18 1.08 0.02 0.00 0.00 0.00 0.00 51.96 53.24 1wuq s ALA 196 Cb -0.03 -0.68 0.01 0.00 0.00 0.00 0.00 23.12 22.42 1wuq s ALA 196 CO 0.09 -0.21 -0.17 -1.64 0.00 0.00 0.00 175.76 173.84 1wuq s MET 197 N 1.28 2.39 0.15 0.00 -1.94 -1.26 -0.89 119.30 119.03 1wuq s MET 197 Ca -0.09 -0.62 0.08 0.00 -1.71 0.00 0.00 55.69 53.34 1wuq s MET 197 Cb -0.10 -2.01 -0.04 0.00 2.01 0.00 0.00 34.83 34.69 1wuq s MET 197 CO -0.09 -0.06 -0.17 -0.51 -0.01 0.00 0.00 175.02 174.18 1wuq s LEU 198 N 0.97 2.42 0.00 -0.03 1.43 0.65 -4.39 118.68 119.73 1wuq s LEU 198 Ca -0.06 -0.84 0.00 0.00 -1.03 0.00 0.00 54.13 52.20 1wuq s LEU 198 Cb -0.15 -0.75 0.00 0.00 0.03 0.00 0.00 46.19 45.32 1wuq s LEU 198 CO -0.02 -0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.11 1wuq n GLY 199 N 0.39 3.33 0.29 -3.19 0.00 -1.26 -1.63 105.19 103.11 1wuq n GLY 199 Ca -0.14 -0.22 0.19 0.00 0.00 0.00 0.00 46.02 45.85 1wuq n GLY 199 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1wuq h VAL 200 N 0.00 0.00 0.00 1.61 -1.51 -1.51 -1.40 116.25 113.44 1wuq h VAL 200 Ca 0.00 -0.15 -0.13 0.00 -1.23 0.00 0.00 66.70 65.19 1wuq h VAL 200 Cb 0.00 1.07 -0.02 0.00 -2.13 0.00 0.00 31.29 30.21 1wuq h VAL 200 CO 0.00 0.00 -0.63 -0.26 -1.23 0.00 0.00 177.57 175.45 1wuq h PHE 201 N 0.00 0.00 0.15 5.19 0.05 -1.72 0.12 116.94 120.73 1wuq h PHE 201 Ca 0.00 0.00 -0.27 0.00 3.82 0.00 0.00 57.97 61.52 1wuq h PHE 201 Cb 0.16 0.00 0.01 0.00 2.00 0.00 0.00 35.95 38.12 1wuq h PHE 201 CO 0.00 0.63 -1.28 -0.09 -0.18 0.00 0.00 178.31 177.39 1wuq h ARG 202 N 0.00 0.32 -0.02 1.51 2.43 -1.37 -3.40 114.38 113.84 1wuq h ARG 202 Ca -0.01 -0.54 -0.25 0.00 -0.81 0.00 0.00 59.98 58.37 1wuq h ARG 202 Cb 1.13 0.20 0.01 0.00 -0.42 0.00 0.00 29.97 30.89 1wuq h ARG 202 CO 0.08 1.26 -0.98 0.93 -1.51 0.00 0.00 179.97 179.75 1wuq h GLU 203 N -0.22 0.64 -4.29 0.20 5.08 -1.38 -3.42 114.58 111.18 1wuq h GLU 203 Ca -0.25 -0.66 -0.74 0.00 -1.00 0.00 0.00 59.36 56.71 1wuq h GLU 203 Cb 1.82 0.18 -0.24 0.00 0.50 0.00 0.00 28.75 31.01 1wuq h GLU 203 CO 0.13 1.26 -0.33 1.21 -1.00 0.00 0.00 179.01 180.27 1wuq s ASN 204 N -7.21 6.06 0.23 1.42 3.04 0.42 -4.96 114.94 113.94 1wuq s ASN 204 Ca -0.09 -1.47 -0.06 0.00 0.04 0.00 0.00 52.86 51.29 1wuq s ASN 204 Cb 0.08 -2.15 0.36 0.00 -1.54 0.00 0.00 41.25 37.99 1wuq s ASN 204 CO 0.90 -0.67 1.80 -0.61 -3.04 0.00 0.00 177.10 175.48 1wuq h GLN 205 N 8.71 0.68 -0.22 0.43 -0.00 -1.83 -1.60 115.11 121.28 1wuq h GLN 205 Ca -0.28 -0.04 -0.08 0.00 -0.00 0.00 0.00 58.65 58.25 1wuq h GLN 205 Cb 1.10 -0.15 -0.01 0.00 0.00 0.00 0.00 27.48 28.42 1wuq h GLN 205 CO 0.89 0.45 -0.22 0.87 0.00 0.00 0.00 178.83 180.81 1wuq h LYS 206 N 0.70 0.40 -0.32 1.69 1.79 -1.94 -0.15 116.57 118.74 1wuq h LYS 206 Ca 0.37 -0.14 -0.10 0.00 -2.18 0.00 0.00 60.65 58.61 1wuq h LYS 206 Cb 0.35 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.96 1wuq h LYS 206 CO -0.25 0.61 -0.17 1.15 -1.08 0.00 0.00 179.45 179.70 1wuq h THR 207 N 0.36 1.29 -0.37 -0.16 2.02 -1.67 -0.76 112.91 113.63 1wuq h THR 207 Ca 0.06 -1.29 -0.02 0.00 0.77 0.00 0.00 66.41 65.93 1wuq h THR 207 Cb 0.60 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.44 1wuq h THR 207 CO 0.04 0.42 0.16 -0.09 0.37 0.00 0.00 175.52 176.42 1wuq h ARG 208 N 0.44 0.55 -0.82 6.66 2.43 -1.03 -1.50 114.38 121.11 1wuq h ARG 208 Ca 0.07 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1wuq h ARG 208 Cb 0.71 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.13 1wuq h ARG 208 CO 0.05 0.51 0.48 1.49 -1.51 0.00 0.00 179.97 180.99 1wuq h GLU 209 N 0.46 1.13 -0.68 0.20 4.81 -0.95 -0.58 114.58 118.98 1wuq h GLU 209 Ca 0.13 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 59.20 1wuq h GLU 209 Cb 0.16 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 1wuq h GLU 209 CO -0.01 0.81 0.25 1.49 -0.73 0.00 0.00 179.01 180.82 1wuq h GLU 210 N 1.13 1.02 0.32 1.92 4.81 -0.88 -0.06 114.58 122.85 1wuq h GLU 210 Ca 0.29 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 1wuq h GLU 210 Cb -0.02 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.20 1wuq h GLU 210 CO -0.05 0.86 -0.15 0.35 -0.73 0.00 0.00 179.01 179.29 1wuq h PHE 211 N 0.97 -0.40 -0.65 0.92 3.57 -0.71 -2.54 116.94 118.09 1wuq h PHE 211 Ca 0.22 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.76 1wuq h PHE 211 Cb 0.23 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.07 1wuq h PHE 211 CO 0.02 -0.15 0.43 -0.07 -2.23 0.00 0.00 178.31 176.31 1wuq h LEU 212 N -0.59 0.63 -0.68 0.59 3.38 -1.01 -2.30 115.31 115.32 1wuq h LEU 212 Ca -0.04 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1wuq h LEU 212 Cb 0.43 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1wuq h LEU 212 CO 0.07 0.42 0.15 0.28 0.09 0.00 0.00 178.44 179.45 1wuq h SER 213 N 0.72 1.06 0.12 -0.43 0.02 -0.89 -1.68 113.55 112.47 1wuq h SER 213 Ca 0.27 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1wuq h SER 213 Cb 0.16 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.42 1wuq h SER 213 CO -0.08 1.03 0.00 0.45 -1.14 0.00 0.00 176.83 177.09 1wuq h HIS 214 N 1.04 0.00 0.00 3.45 3.86 -0.98 -1.43 115.15 121.10 1wuq h HIS 214 Ca 0.21 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 1wuq h HIS 214 Cb 0.40 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.87 1wuq h HIS 214 CO 0.03 0.00 -0.54 -0.07 0.86 0.00 0.00 177.93 178.21 1wuq h LEU 215 N 0.00 0.00 -0.87 2.43 3.38 -1.25 -3.52 115.31 115.48 1wuq h LEU 215 Ca 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1wuq h LEU 215 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1wuq h LEU 215 CO 0.00 0.05 0.00 0.54 0.09 0.00 0.00 178.44 179.12