#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 6.15 0.28 4.52 2.15 -1.26 -4.88 116.67 123.64 1wuq s ASP 34 Ca 0.00 -0.45 -0.02 0.00 0.43 0.00 0.00 52.55 52.52 1wuq s ASP 34 Cb 0.00 -2.56 0.40 0.00 -0.30 0.00 0.00 42.92 40.46 1wuq s ASP 34 CO 0.00 -1.84 1.85 -0.07 -0.17 0.00 0.00 175.17 174.93 1wuq h LEU 35 N 13.07 0.82 -1.09 -1.34 3.38 -2.00 -2.77 115.31 125.38 1wuq h LEU 35 Ca -0.28 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.58 1wuq h LEU 35 Cb 1.05 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.54 1wuq h LEU 35 CO 1.28 0.76 0.62 -0.33 0.09 0.00 0.00 178.44 180.85 1wuq h GLU 36 N 0.88 1.22 -0.38 1.13 4.39 -1.99 -0.47 114.58 119.35 1wuq h GLU 36 Ca 0.20 -0.07 -0.14 0.00 0.34 0.00 0.00 59.36 59.68 1wuq h GLU 36 Cb 0.21 -0.28 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1wuq h GLU 36 CO -0.01 0.81 -0.33 -0.09 -1.16 0.00 0.00 179.01 178.22 1wuq h ARG 37 N 1.26 0.87 -0.54 2.33 2.43 -1.91 -2.46 114.38 116.35 1wuq h ARG 37 Ca 0.34 -0.42 -0.11 0.00 -0.81 0.00 0.00 59.98 58.98 1wuq h ARG 37 Cb -0.15 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 1wuq h ARG 37 CO -0.07 1.07 -0.11 -0.07 -1.51 0.00 0.00 179.97 179.28 1wuq h LEU 38 N 0.72 1.02 -0.82 3.80 3.38 -1.22 -1.70 115.31 120.50 1wuq h LEU 38 Ca 0.07 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1wuq h LEU 38 Cb 0.90 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 1wuq h LEU 38 CO 0.08 1.13 0.54 1.56 0.09 0.00 0.00 178.44 181.84 1wuq h GLN 39 N 0.91 1.06 -0.47 1.13 4.20 -0.97 0.21 115.11 121.18 1wuq h GLN 39 Ca 0.14 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.68 1wuq h GLN 39 Cb 0.67 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 1wuq h GLN 39 CO 0.05 0.70 -0.13 0.00 -0.67 0.00 0.00 178.83 178.78 1wuq h ALA 40 N 1.30 0.65 -0.30 3.87 0.00 -1.26 -1.05 119.26 122.47 1wuq h ALA 40 Ca 0.30 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1wuq h ALA 40 Cb -0.11 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1wuq h ALA 40 CO -0.07 0.56 0.05 -0.07 0.00 0.00 0.00 179.25 179.73 1wuq h LEU 41 N 0.76 0.47 -1.20 0.00 3.38 -0.79 -2.05 115.31 115.87 1wuq h LEU 41 Ca 0.12 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 1wuq h LEU 41 Cb 0.69 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1wuq h LEU 41 CO 0.05 0.60 -0.14 0.00 0.09 0.00 0.00 178.44 179.04 1wuq h ALA 42 N 0.88 1.34 -0.50 1.53 0.00 -0.55 0.07 119.26 122.04 1wuq h ALA 42 Ca 0.09 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1wuq h ALA 42 Cb 0.33 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1wuq h ALA 42 CO 0.00 0.45 0.03 0.00 0.00 0.00 0.00 179.25 179.73 1wuq h ALA 43 N 1.50 0.67 -0.03 0.00 0.00 -0.97 -1.87 119.26 118.55 1wuq h ALA 43 Ca 0.07 -0.27 -0.15 0.00 0.00 0.00 0.00 54.91 54.56 1wuq h ALA 43 Cb 0.46 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1wuq h ALA 43 CO 0.03 0.45 -0.68 1.49 0.00 0.00 0.00 179.25 180.54 1wuq h GLU 44 N 0.73 0.15 -0.66 0.00 4.81 -1.03 -3.10 114.58 115.48 1wuq h GLU 44 Ca 0.14 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1wuq h GLU 44 Cb 0.48 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.85 1wuq h GLU 44 CO 0.02 0.77 0.37 2.35 -0.73 0.00 0.00 179.01 181.79 1wuq h TRP 45 N 0.10 0.90 -0.85 0.92 2.91 -0.68 -2.35 115.95 116.90 1wuq h TRP 45 Ca -0.01 -0.02 0.03 0.00 1.13 0.00 0.00 58.89 60.02 1wuq h TRP 45 Cb 1.20 -0.29 -0.05 0.00 -0.51 0.00 0.00 29.16 29.52 1wuq h TRP 45 CO 0.02 0.64 0.55 -0.07 -1.03 0.00 0.00 178.44 178.54 1wuq h LEU 46 N 0.90 0.92 -0.13 0.65 3.38 -1.27 -2.76 115.31 117.00 1wuq h LEU 46 Ca 0.23 -0.01 -0.24 0.00 0.09 0.00 0.00 57.88 57.96 1wuq h LEU 46 Cb 0.03 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 40.58 1wuq h LEU 46 CO -0.04 0.64 -0.93 0.06 0.09 0.00 0.00 178.44 178.26 1wuq h GLN 47 N 1.08 0.58 -0.63 1.13 3.07 -1.52 -1.01 115.11 117.81 1wuq h GLN 47 Ca 0.33 -0.58 -0.02 0.00 0.09 0.00 0.00 58.65 58.47 1wuq h GLN 47 Cb -0.02 0.15 -0.03 0.00 0.08 0.00 0.00 27.48 27.66 1wuq h GLN 47 CO -0.11 1.20 0.30 0.28 0.09 0.00 0.00 178.83 180.59 1wuq h VAL 48 N 0.34 1.21 0.00 1.86 2.07 -1.30 -1.68 116.25 118.75 1wuq h VAL 48 Ca -0.09 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.85 1wuq h VAL 48 Cb 1.57 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1wuq h VAL 48 CO 0.17 0.24 0.00 2.30 0.02 0.00 0.00 177.57 180.31 1wuq n ILE 49 N -4.35 0.17 0.00 4.57 -5.35 -1.05 -4.87 119.36 108.48 1wuq n ILE 49 Ca 0.06 0.04 0.00 0.00 -0.27 0.00 0.00 62.75 62.58 1wuq n ILE 49 Cb 0.13 -0.62 0.00 0.00 -1.74 0.00 0.00 39.64 37.41 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 0.84 0.88 3.97 3.28 0.00 -0.63 -5.11 105.19 108.41 1wuq n GLY 50 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.65 2.61 -0.47 1.61 0.41 -0.38 -5.01 118.70 116.82 1wuq s GLU 51 Ca 0.00 -0.70 -0.11 0.00 -0.41 0.00 0.00 54.97 53.76 1wuq s GLU 51 Cb 0.00 -2.48 0.11 0.00 -1.78 0.00 0.00 34.13 29.98 1wuq s GLU 51 CO 0.00 -0.68 0.35 0.34 -0.49 0.00 0.00 175.26 174.78 1wuq s ASP 52 N -4.40 5.79 0.44 -0.19 2.15 -1.26 -3.98 116.67 115.22 1wuq s ASP 52 Ca 0.56 -1.75 0.30 0.00 0.43 0.00 0.00 52.55 52.09 1wuq s ASP 52 Cb -0.10 -2.05 1.61 0.00 -0.30 0.00 0.00 42.92 42.08 1wuq s ASP 52 CO 0.39 -0.67 1.90 -0.65 -0.17 0.00 0.00 175.17 175.97 1wuq h PRO 53 N 8.52 0.00 -0.02 4.34 0.11 -1.89 0.25 132.00 143.32 1wuq h PRO 53 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1wuq h PRO 53 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1wuq h PRO 53 CO 0.86 0.00 -0.09 0.41 -0.21 0.00 0.00 178.00 178.97 1wuq n GLY 54 N -1.22 0.07 3.77 -0.55 0.00 -1.26 -4.11 105.19 101.89 1wuq n GLY 54 Ca -0.02 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.11 1wuq n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wuq s ARG 55 N -2.14 4.04 0.16 1.61 3.52 0.07 -4.84 118.95 121.37 1wuq s ARG 55 Ca 0.32 2.03 -0.30 0.00 -0.13 0.00 0.00 55.73 57.64 1wuq s ARG 55 Cb 0.20 -2.75 -0.05 0.00 -1.56 0.00 0.00 34.95 30.79 1wuq s ARG 55 CO 0.39 -0.39 1.54 1.49 -0.81 0.00 0.00 175.30 177.52 1wuq h GLU 56 N 2.73 -0.02 0.00 5.12 4.57 -1.92 -0.61 114.58 124.45 1wuq h GLU 56 Ca -0.49 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 1wuq h GLU 56 Cb 1.24 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 1wuq h GLU 56 CO 0.63 -0.02 0.00 0.41 -1.18 0.00 0.00 179.01 178.85 1wuq n GLY 57 N -1.27 -0.97 0.12 1.92 0.00 -1.26 -3.07 105.19 100.65 1wuq n GLY 57 Ca 0.02 -0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.45 0.97 -0.18 0.99 4.77 -0.29 -4.60 117.00 117.20 1wuq n LEU 58 Ca 0.04 -0.59 -0.00 0.00 -0.03 0.00 0.00 56.01 55.43 1wuq n LEU 58 Cb 0.16 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.34 1wuq n LEU 58 CO 0.14 0.21 0.86 -0.07 -1.33 0.00 0.00 177.39 177.20 1wuq h LEU 59 N 0.57 -0.17 -1.58 2.23 3.38 -1.33 -1.67 115.31 116.74 1wuq h LEU 59 Ca 0.00 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1wuq h LEU 59 Cb 0.40 0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1wuq h LEU 59 CO 0.00 -0.06 0.00 0.29 0.09 0.00 0.00 178.44 178.76 1wuq n LYS 60 N -5.22 2.04 0.12 1.13 5.02 -1.26 -4.47 118.16 115.52 1wuq n LYS 60 Ca 0.07 -1.56 -0.13 0.00 -2.02 0.00 0.00 58.31 54.67 1wuq n LYS 60 Cb 0.31 -1.44 -0.08 0.00 -0.02 0.00 0.00 35.03 33.80 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 3.15 0.88 -0.99 -0.18 2.02 -1.55 -1.58 112.91 114.66 1wuq h THR 61 Ca 0.00 -0.25 0.19 0.00 0.77 0.00 0.00 66.41 67.12 1wuq h THR 61 Cb 0.69 1.03 -0.10 0.00 -1.74 0.00 0.00 68.15 68.04 1wuq h THR 61 CO 0.00 0.06 0.61 -0.65 0.37 0.00 0.00 175.52 175.91 1wuq h PRO 62 N -0.36 0.67 -0.04 6.66 0.11 -1.78 0.17 132.00 137.42 1wuq h PRO 62 Ca -0.02 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.03 1wuq h PRO 62 Cb 0.28 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.24 1wuq h PRO 62 CO 0.04 0.44 -0.05 1.49 -0.21 0.00 0.00 178.00 179.71 1wuq h GLU 63 N 0.69 0.10 -0.99 1.05 4.81 -1.83 -2.35 114.58 116.06 1wuq h GLU 63 Ca 0.55 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.78 1wuq h GLU 63 Cb 0.96 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.29 1wuq h GLU 63 CO -0.33 0.60 0.64 0.00 -0.73 0.00 0.00 179.01 179.20 1wuq h ARG 64 N -0.39 1.16 -0.34 1.92 3.08 -0.21 -2.05 114.38 117.55 1wuq h ARG 64 Ca 0.00 -0.07 -0.15 0.00 0.07 0.00 0.00 59.98 59.84 1wuq h ARG 64 Cb 0.59 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1wuq h ARG 64 CO 0.01 0.77 -0.37 0.28 -1.07 0.00 0.00 179.97 179.59 1wuq h VAL 65 N 1.19 1.28 -0.13 2.04 2.07 -0.75 -1.76 116.25 120.20 1wuq h VAL 65 Ca 0.41 -1.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.39 1wuq h VAL 65 Cb 0.10 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1wuq h VAL 65 CO -0.15 0.50 0.08 0.00 0.02 0.00 0.00 177.57 178.02 1wuq h ALA 66 N 0.93 0.17 -0.73 1.67 0.00 -0.84 -1.29 119.26 119.16 1wuq h ALA 66 Ca 0.06 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1wuq h ALA 66 Cb 0.92 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1wuq h ALA 66 CO 0.08 -0.32 0.24 0.87 0.00 0.00 0.00 179.25 180.12 1wuq h LYS 67 N 0.14 1.14 0.13 0.00 1.57 -1.37 -2.06 116.57 116.12 1wuq h LYS 67 Ca 0.05 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 1wuq h LYS 67 Cb 0.03 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1wuq h LYS 67 CO -0.01 0.96 -0.12 0.00 -0.57 0.00 0.00 179.45 179.72 1wuq h ALA 68 N 1.12 -0.24 0.00 3.86 0.00 -1.05 -1.99 119.26 120.96 1wuq h ALA 68 Ca 0.24 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1wuq h ALA 68 Cb 0.30 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1wuq h ALA 68 CO -0.01 -0.65 -0.19 -1.49 0.00 0.00 0.00 179.25 176.91 1wuq h TRP 69 N -0.27 0.00 -0.33 0.00 4.06 -1.13 0.16 115.95 118.44 1wuq h TRP 69 Ca 0.00 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.84 1wuq h TRP 69 Cb 0.25 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.41 1wuq h TRP 69 CO -0.12 0.19 -0.21 0.00 -3.56 0.00 0.00 178.44 174.75 1wuq h ALA 70 N 1.81 0.47 -0.27 1.49 0.00 -1.03 -2.34 119.26 119.39 1wuq h ALA 70 Ca -0.00 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.39 1wuq h ALA 70 Cb 0.47 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1wuq h ALA 70 CO 0.02 0.43 -0.41 0.35 0.00 0.00 0.00 179.25 179.65 1wuq h PHE 71 N 0.50 0.93 0.00 0.00 3.57 -0.74 -2.19 116.94 119.00 1wuq h PHE 71 Ca 0.07 -0.31 0.00 0.00 3.53 0.00 0.00 57.97 61.26 1wuq h PHE 71 Cb 0.76 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.32 1wuq h PHE 71 CO 0.06 1.10 0.00 1.28 -2.23 0.00 0.00 178.31 178.52 1wuq n LEU 72 N -4.17 0.01 0.00 0.59 4.77 0.51 -2.38 117.00 116.33 1wuq n LEU 72 Ca -0.04 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 1wuq n LEU 72 Cb 0.54 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1wuq n LEU 72 CO 0.47 -0.28 0.41 0.35 -1.33 0.00 0.00 177.39 177.01 1wuq n THR 73 N -1.51 0.67 0.28 -5.08 -2.24 -0.89 -3.02 114.28 102.49 1wuq n THR 73 Ca 0.03 -0.75 0.19 0.00 -2.27 0.00 0.00 64.05 61.25 1wuq n THR 73 Cb 0.15 0.70 0.98 0.00 -2.10 0.00 0.00 70.33 70.07 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 0.00 0.00 -0.47 -0.78 0.11 -1.02 -2.69 114.38 109.53 1wuq h ARG 74 Ca 0.00 0.00 0.02 0.00 0.10 0.00 0.00 59.98 60.10 1wuq h ARG 74 Cb 0.48 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.53 1wuq h ARG 74 CO 0.00 0.00 0.31 0.78 0.10 0.00 0.00 179.97 181.16 1wuq h GLY 75 N 0.11 0.61 1.93 0.08 0.00 -1.50 -1.69 103.07 102.61 1wuq h GLY 75 Ca 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 47.33 47.07 1wuq h GLY 75 CO 0.00 0.20 -0.15 -0.97 0.00 0.00 0.00 176.54 175.62 1wuq h TYR 76 N 0.56 0.09 -0.52 5.60 0.05 -1.63 -2.84 116.97 118.28 1wuq h TYR 76 Ca 0.18 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.96 1wuq h TYR 76 Cb 0.05 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 37.76 1wuq h TYR 76 CO -0.00 0.24 0.00 0.54 -1.05 0.00 0.00 178.16 177.89 1wuq n ARG 77 N -4.32 2.46 -3.97 4.88 1.74 -0.64 -4.93 116.66 111.88 1wuq n ARG 77 Ca -0.02 -1.99 -0.24 0.00 -0.77 0.00 0.00 57.85 54.83 1wuq n ARG 77 Cb 0.24 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.15 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 -1.41 3.37 -0.13 5.56 -0.21 -1.07 -5.11 119.66 120.66 1wuq s GLN 78 Ca 0.37 -0.70 0.02 0.00 0.02 0.00 0.00 55.36 55.07 1wuq s GLN 78 Cb 0.20 -2.89 -0.00 0.00 1.00 0.00 0.00 33.01 31.32 1wuq s GLN 78 CO 0.23 0.48 -0.20 1.03 -2.12 0.00 0.00 175.29 174.71 1wuq s ARG 79 N -3.51 3.14 0.43 2.91 0.52 -1.26 -5.01 118.95 116.16 1wuq s ARG 79 Ca 0.34 -0.81 0.21 0.00 -0.52 0.00 0.00 55.73 54.95 1wuq s ARG 79 Cb -0.10 -2.46 1.16 0.00 0.52 0.00 0.00 34.95 34.07 1wuq s ARG 79 CO 0.28 0.10 1.81 1.25 0.02 0.00 0.00 175.30 178.76 1wuq h LEU 80 N 6.99 0.36 -0.68 2.53 5.85 -1.98 0.26 115.31 128.63 1wuq h LEU 80 Ca -0.26 0.06 -0.12 0.00 0.84 0.00 0.00 57.88 58.39 1wuq h LEU 80 Cb 1.21 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 1wuq h LEU 80 CO 0.53 0.10 -0.28 -0.08 -0.34 0.00 0.00 178.44 178.36 1wuq h GLU 81 N 0.34 0.71 0.08 1.25 4.81 -1.95 -1.96 114.58 117.87 1wuq h GLU 81 Ca 0.54 -0.31 -0.27 0.00 -0.13 0.00 0.00 59.36 59.20 1wuq h GLU 81 Cb 1.48 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.85 1wuq h GLU 81 CO -0.21 0.91 -1.14 0.93 -0.73 0.00 0.00 179.01 178.77 1wuq h GLU 82 N 0.61 0.43 -0.40 1.92 5.08 -1.36 -2.68 114.58 118.18 1wuq h GLU 82 Ca 0.08 -0.57 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 1wuq h GLU 82 Cb 0.79 0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 1wuq h GLU 82 CO 0.06 1.23 0.23 0.28 -1.00 0.00 0.00 179.01 179.81 1wuq h VAL 83 N 0.19 1.15 0.00 3.13 2.07 -1.03 -2.67 116.25 119.09 1wuq h VAL 83 Ca -0.13 -0.37 -0.07 0.00 0.82 0.00 0.00 66.70 66.95 1wuq h VAL 83 Cb 1.82 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 1wuq h VAL 83 CO 0.20 0.15 -0.35 0.58 0.02 0.00 0.00 177.57 178.17 1wuq h VAL 84 N 0.52 0.70 0.00 2.57 2.07 -1.45 -3.47 116.25 117.20 1wuq h VAL 84 Ca 0.14 -1.62 0.00 0.00 0.82 0.00 0.00 66.70 66.04 1wuq h VAL 84 Cb 0.04 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1wuq h VAL 84 CO -0.02 0.34 0.00 0.61 0.02 0.00 0.00 177.57 178.52 1wuq n GLY 85 N 0.64 2.85 0.77 2.17 0.00 -1.01 -2.59 105.19 108.02 1wuq n GLY 85 Ca 0.01 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 3.39 2.53 -0.02 0.00 -1.26 -4.87 105.19 104.96 1wuq n GLY 86 Ca 0.00 -0.70 -0.14 0.00 0.00 0.00 0.00 46.02 45.18 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 0.01 3.90 -3.99 4.61 0.00 -1.07 -4.75 120.51 119.22 1wuq n ALA 87 Ca 0.16 -1.38 -0.31 0.00 0.00 0.00 0.00 53.44 51.92 1wuq n ALA 87 Cb 0.66 -2.69 -0.16 0.00 0.00 0.00 0.00 19.45 17.26 1wuq n ALA 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1wuq s VAL 88 N 3.09 1.68 0.35 0.00 -7.23 -1.26 -1.17 120.40 115.86 1wuq s VAL 88 Ca 0.33 -1.11 0.08 0.00 -1.81 0.00 0.00 61.98 59.47 1wuq s VAL 88 Cb 0.11 -1.79 -0.05 0.00 0.56 0.00 0.00 36.38 35.21 1wuq s VAL 88 CO -0.02 0.10 0.10 -0.36 -0.31 0.00 0.00 175.10 174.61 1wuq s PHE 89 N 1.36 2.64 0.40 2.82 0.08 -0.20 -4.94 117.98 120.14 1wuq s PHE 89 Ca -0.03 -0.42 -0.25 0.00 0.12 0.00 0.00 56.93 56.35 1wuq s PHE 89 Cb -0.17 -1.61 -0.08 0.00 -0.57 0.00 0.00 43.02 40.59 1wuq s PHE 89 CO -0.08 0.38 1.20 -2.14 -0.10 0.00 0.00 175.22 174.49 1wuq s PRO 90 N -3.80 4.04 0.17 0.24 0.02 -1.26 -0.55 135.00 133.85 1wuq s PRO 90 Ca 0.37 1.92 -0.31 0.00 0.02 0.00 0.00 61.00 63.00 1wuq s PRO 90 Cb -0.01 -2.70 -0.09 0.00 0.02 0.00 0.00 34.50 31.71 1wuq s PRO 90 CO 0.21 -0.36 1.44 0.00 -0.33 0.00 0.00 177.00 177.96 1wuq s ALA 91 N -1.37 3.64 -0.44 -1.55 0.00 -0.41 -4.57 121.76 117.07 1wuq s ALA 91 Ca 0.57 1.24 0.23 0.00 0.00 0.00 0.00 51.96 54.00 1wuq s ALA 91 Cb -0.33 -3.56 0.31 0.00 0.00 0.00 0.00 23.12 19.55 1wuq s ALA 91 CO 0.41 -0.68 1.45 0.93 0.00 0.00 0.00 175.76 177.88 1wuq h GLU 92 N 6.16 0.00 0.00 0.00 4.39 -1.93 -3.48 114.58 119.72 1wuq h GLU 92 Ca -0.44 0.00 0.17 0.00 0.34 0.00 0.00 59.36 59.43 1wuq h GLU 92 Cb 1.21 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.83 1wuq h GLU 92 CO 0.84 0.00 0.61 0.41 -1.16 0.00 0.00 179.01 179.71 1wuq n GLY 93 N 1.17 0.57 0.92 -3.84 0.00 -1.26 -5.04 105.19 97.71 1wuq n GLY 93 Ca 0.03 -1.15 0.09 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.30 3.17 -4.85 1.61 3.41 -1.26 -4.82 113.62 109.58 1wuq n SER 94 Ca -0.02 -1.92 -0.32 0.00 -0.26 0.00 0.00 58.87 56.35 1wuq n SER 94 Cb 0.59 -0.26 -0.00 0.00 -0.26 0.00 0.00 64.21 64.27 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 -1.13 3.66 0.41 4.33 0.41 -1.26 -4.63 118.70 120.48 1wuq s GLU 95 Ca 0.32 0.88 -0.27 0.00 -0.41 0.00 0.00 54.97 55.49 1wuq s GLU 95 Cb 0.18 -2.09 -0.09 0.00 -1.78 0.00 0.00 34.13 30.34 1wuq s GLU 95 CO 0.24 -0.52 1.41 1.41 -0.49 0.00 0.00 175.26 177.31 1wuq s MET 96 N -4.67 3.95 -0.11 1.61 0.00 -1.26 -4.54 119.30 114.28 1wuq s MET 96 Ca 0.57 2.39 0.03 0.00 0.00 0.00 0.00 55.69 58.68 1wuq s MET 96 Cb -0.11 -2.82 -0.00 0.00 0.00 0.00 0.00 34.83 31.90 1wuq s MET 96 CO 0.44 -0.59 -0.21 0.08 0.00 0.00 0.00 175.02 174.74 1wuq s VAL 97 N -1.18 2.31 -0.13 10.11 1.01 0.10 -4.97 120.40 127.65 1wuq s VAL 97 Ca 0.56 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.63 1wuq s VAL 97 Cb -0.43 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.06 1wuq s VAL 97 CO 0.57 0.55 -0.15 -0.69 0.00 0.00 0.00 175.10 175.37 1wuq s VAL 98 N 0.40 1.57 -0.40 2.92 1.01 -1.26 -1.13 120.40 123.51 1wuq s VAL 98 Ca -0.16 -0.65 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 1wuq s VAL 98 Cb -0.17 -1.45 0.10 0.00 0.00 0.00 0.00 36.38 34.85 1wuq s VAL 98 CO 0.07 0.46 0.18 -0.69 0.00 0.00 0.00 175.10 175.12 1wuq s VAL 99 N 1.27 3.35 0.28 2.92 1.01 0.14 -4.99 120.40 124.38 1wuq s VAL 99 Ca 0.00 -1.91 0.07 0.00 0.00 0.00 0.00 61.98 60.15 1wuq s VAL 99 Cb -0.14 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 1wuq s VAL 99 CO -0.07 -0.60 0.21 -1.59 0.00 0.00 0.00 175.10 173.05 1wuq s LYS 100 N 1.18 2.78 -0.89 2.72 -2.85 -1.26 -0.57 119.74 120.84 1wuq s LYS 100 Ca 0.06 -1.19 0.00 0.00 -1.00 0.00 0.00 55.97 53.84 1wuq s LYS 100 Cb -0.22 -2.48 0.00 0.00 -2.06 0.00 0.00 37.83 33.06 1wuq s LYS 100 CO -0.03 0.28 0.00 0.41 0.10 0.00 0.00 175.35 176.11 1wuq n GLY 101 N -1.22 0.38 3.57 0.59 0.00 -1.19 -4.96 105.19 102.36 1wuq n GLY 101 Ca -0.05 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.44 3.75 0.52 1.61 1.01 -0.57 -4.81 120.40 119.46 1wuq s VAL 102 Ca 0.00 0.58 -0.22 0.00 0.00 0.00 0.00 61.98 62.34 1wuq s VAL 102 Cb 0.00 -4.55 -0.06 0.00 0.00 0.00 0.00 36.38 31.77 1wuq s VAL 102 CO 0.00 -1.35 1.30 -1.83 0.00 0.00 0.00 175.10 173.22 1wuq s GLU 103 N 5.67 3.35 0.05 2.72 1.03 -1.26 -0.22 118.70 130.03 1wuq s GLU 103 Ca 0.48 2.10 -0.04 0.00 0.03 0.00 0.00 54.97 57.54 1wuq s GLU 103 Cb -0.10 -2.31 -0.02 0.00 -0.80 0.00 0.00 34.13 30.89 1wuq s GLU 103 CO 0.22 -0.98 0.04 -0.59 -1.33 0.00 0.00 175.26 172.62 1wuq s PHE 104 N -1.38 0.35 -0.01 4.83 -0.12 -0.57 -4.85 117.98 116.23 1wuq s PHE 104 Ca 0.69 -0.80 0.00 0.00 -0.05 0.00 0.00 56.93 56.77 1wuq s PHE 104 Cb -0.37 -0.25 0.01 0.00 -0.63 0.00 0.00 43.02 41.78 1wuq s PHE 104 CO 0.44 -0.40 -0.01 0.71 -0.05 0.00 0.00 175.22 175.91 1wuq s TYR 105 N -3.44 0.19 0.32 3.49 2.02 -1.26 -1.99 117.35 116.68 1wuq s TYR 105 Ca 0.02 0.00 0.03 0.00 -0.37 0.00 0.00 57.07 56.75 1wuq s TYR 105 Cb 0.04 -0.21 -0.01 0.00 -0.40 0.00 0.00 41.96 41.38 1wuq s TYR 105 CO -0.08 -0.05 0.37 0.45 -1.57 0.00 0.00 175.55 174.66 1wuq n SER 106 N 3.52 -0.99 -4.00 2.29 2.88 0.35 -4.33 113.62 113.34 1wuq n SER 106 Ca -0.19 -2.92 -0.26 0.00 -1.33 0.00 0.00 58.87 54.17 1wuq n SER 106 Cb 0.55 2.01 -0.17 0.00 -0.75 0.00 0.00 64.21 65.85 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 -3.00 1.75 0.17 -1.46 -1.94 -1.23 -1.21 119.30 112.37 1wuq s MET 107 Ca 0.32 -0.40 -0.30 0.00 -1.71 0.00 0.00 55.69 53.60 1wuq s MET 107 Cb 0.00 -1.55 -0.08 0.00 2.01 0.00 0.00 34.83 35.21 1wuq s MET 107 CO 0.23 -0.08 1.31 0.00 -0.01 0.00 0.00 175.02 176.47 1wuq h GLU 109 N 5.77 0.00 0.22 0.00 4.11 -1.24 0.84 114.58 124.27 1wuq h GLU 109 Ca -0.44 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 58.68 1wuq h GLU 109 Cb 1.21 0.00 0.04 0.00 0.50 0.00 0.00 28.75 30.50 1wuq h GLU 109 CO 0.79 0.00 -1.33 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 -3.40 115.15 116.69 1wuq h HIS 110 Ca 0.00 -0.66 0.00 0.00 -1.16 0.00 0.00 60.37 58.55 1wuq h HIS 110 Cb 0.30 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.73 1wuq h HIS 110 CO 0.00 1.51 0.00 0.72 0.86 0.00 0.00 177.93 181.02 1wuq n HIS 111 N -3.80 0.00 -3.07 2.45 8.25 -1.19 -5.01 115.22 112.85 1wuq n HIS 111 Ca -0.16 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.07 1wuq n HIS 111 Cb 1.04 0.00 0.04 0.00 1.12 0.00 0.00 29.99 32.19 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 -0.54 -2.76 -4.47 2.41 4.32 0.28 -4.99 117.00 111.25 1wuq n LEU 112 Ca 0.00 -0.31 -0.31 0.00 -0.02 0.00 0.00 56.01 55.37 1wuq n LEU 112 Cb 0.01 -3.00 -0.12 0.00 -1.62 0.00 0.00 43.42 38.69 1wuq n LEU 112 CO 0.00 0.27 -0.48 -0.76 -1.22 0.00 0.00 177.39 175.20 1wuq s LEU 113 N -6.76 2.66 0.48 2.23 1.43 -1.26 -4.88 118.68 112.59 1wuq s LEU 113 Ca 0.33 -0.41 -0.23 0.00 -1.03 0.00 0.00 54.13 52.79 1wuq s LEU 113 Cb -0.14 -1.55 -0.07 0.00 0.03 0.00 0.00 46.19 44.46 1wuq s LEU 113 CO 0.41 0.25 1.27 -2.84 0.23 0.00 0.00 176.35 175.67 1wuq s PRO 114 N -1.49 3.58 -0.01 1.29 0.02 -1.26 -1.46 135.00 135.67 1wuq s PRO 114 Ca 0.15 2.05 0.01 0.00 0.02 0.00 0.00 61.00 63.23 1wuq s PRO 114 Cb -0.11 -2.44 -0.00 0.00 0.02 0.00 0.00 34.50 31.98 1wuq s PRO 114 CO 0.06 -0.78 -0.03 -0.59 -0.33 0.00 0.00 177.00 175.33 1wuq s PHE 115 N -1.38 0.33 0.24 6.54 -0.71 -0.35 -2.11 117.98 120.53 1wuq s PHE 115 Ca 0.65 -0.06 -0.17 0.00 -1.04 0.00 0.00 56.93 56.31 1wuq s PHE 115 Cb -0.35 -0.23 0.01 0.00 -1.21 0.00 0.00 43.02 41.24 1wuq s PHE 115 CO 0.43 -0.02 0.57 -0.59 -1.34 0.00 0.00 175.22 174.27 1wuq s PHE 116 N -0.00 0.04 0.00 3.49 -0.71 -0.46 -0.50 117.98 119.85 1wuq s PHE 116 Ca 0.00 -0.43 0.00 0.00 -1.04 0.00 0.00 56.93 55.47 1wuq s PHE 116 Cb -0.02 0.41 0.00 0.00 -1.21 0.00 0.00 43.02 42.20 1wuq s PHE 116 CO -0.00 -1.05 0.00 0.41 -1.34 0.00 0.00 175.22 173.24 1wuq n GLY 117 N -0.39 -0.45 3.05 1.99 0.00 -0.84 -0.33 105.19 108.22 1wuq n GLY 117 Ca -0.05 0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 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 0.48 -0.06 1.61 1.02 -0.43 -1.51 119.74 120.84 1wuq s LYS 118 Ca 0.00 -0.83 0.06 0.00 0.02 0.00 0.00 55.97 55.21 1wuq s LYS 118 Cb 0.00 0.18 -0.01 0.00 -0.52 0.00 0.00 37.83 37.48 1wuq s LYS 118 CO 0.00 -0.10 -0.24 0.08 -0.92 0.00 0.00 175.35 174.17 1wuq s VAL 119 N -2.54 2.12 -0.12 3.17 1.01 0.69 -1.49 120.40 123.25 1wuq s VAL 119 Ca -0.06 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 60.91 1wuq s VAL 119 Cb -0.02 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.59 1wuq s VAL 119 CO -0.05 0.57 -0.21 -1.00 0.00 0.00 0.00 175.10 174.41 1wuq s HIS 120 N -0.12 2.64 -0.04 5.22 0.09 0.48 -1.51 115.29 122.04 1wuq s HIS 120 Ca -0.05 -1.08 0.06 0.00 -0.00 0.00 0.00 55.06 53.99 1wuq s HIS 120 Cb -0.14 -1.77 -0.01 0.00 -0.00 0.00 0.00 32.58 30.66 1wuq s HIS 120 CO 0.04 -0.45 -0.22 0.42 -0.00 0.00 0.00 174.74 174.53 1wuq s ILE 121 N 0.51 1.82 0.00 0.60 1.01 0.26 -0.82 121.20 124.58 1wuq s ILE 121 Ca -0.14 -0.95 0.01 0.00 0.00 0.00 0.00 60.65 59.58 1wuq s ILE 121 Cb -0.17 -1.53 -0.00 0.00 0.01 0.00 0.00 42.46 40.76 1wuq s ILE 121 CO 0.05 0.51 -0.04 -0.83 0.00 0.00 0.00 174.94 174.63 1wuq s GLY 122 N -0.21 0.21 0.01 6.18 0.00 0.12 0.26 107.32 113.89 1wuq s GLY 122 Ca -0.00 -0.21 -0.24 0.00 0.00 0.00 0.00 44.72 44.26 1wuq s GLY 122 CO 0.02 -0.19 0.55 -2.52 0.00 0.00 0.00 173.10 170.96 1wuq s TYR 123 N -0.20 -0.48 -0.28 1.90 -0.85 -0.28 0.34 117.35 117.50 1wuq s TYR 123 Ca 0.00 0.67 -0.02 0.00 -0.52 0.00 0.00 57.07 57.20 1wuq s TYR 123 Cb -0.02 0.34 0.04 0.00 0.38 0.00 0.00 41.96 42.70 1wuq s TYR 123 CO -0.00 -0.61 -0.02 0.42 -1.52 0.00 0.00 175.55 173.82 1wuq s ILE 124 N -1.92 3.01 0.56 -3.49 1.01 -1.03 -0.72 121.20 118.63 1wuq s ILE 124 Ca -0.08 -1.21 -0.19 0.00 0.00 0.00 0.00 60.65 59.17 1wuq s ILE 124 Cb -0.01 -2.64 -0.05 0.00 0.01 0.00 0.00 42.46 39.77 1wuq s ILE 124 CO 0.03 0.02 1.18 -2.16 0.00 0.00 0.00 174.94 174.01 1wuq s PRO 125 N 1.30 3.18 -0.19 2.79 0.04 -1.26 -0.74 135.00 140.11 1wuq s PRO 125 Ca -0.03 1.76 -0.06 0.00 0.04 0.00 0.00 61.00 62.71 1wuq s PRO 125 Cb -0.18 -2.00 -0.21 0.00 0.04 0.00 0.00 34.50 32.14 1wuq s PRO 125 CO -0.02 -1.02 0.11 -3.47 0.04 0.00 0.00 177.00 172.63 1wuq n ASP 126 N -1.38 2.04 0.00 6.66 2.03 -1.26 -4.45 116.55 120.19 1wuq n ASP 126 Ca 0.12 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.57 1wuq n ASP 126 Cb 0.50 -0.73 0.00 0.00 -0.72 0.00 0.00 41.12 40.17 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 1.96 0.80 3.06 0.27 0.00 -1.26 -5.01 105.19 105.01 1wuq n GLY 127 Ca -0.38 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.44 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 0.00 0.93 0.10 1.61 1.02 -1.26 -1.28 119.74 120.86 1wuq s LYS 128 Ca 0.00 -0.40 0.08 0.00 0.02 0.00 0.00 55.97 55.67 1wuq s LYS 128 Cb 0.00 -0.90 -0.04 0.00 -0.52 0.00 0.00 37.83 36.38 1wuq s LYS 128 CO 0.00 0.23 -0.17 0.96 -0.92 0.00 0.00 175.35 175.46 1wuq s ILE 129 N -0.23 2.93 0.14 2.17 -4.36 0.28 -4.72 121.20 117.42 1wuq s ILE 129 Ca 0.04 -1.38 -0.04 0.00 -0.26 0.00 0.00 60.65 59.01 1wuq s ILE 129 Cb -0.05 -2.32 -0.05 0.00 1.25 0.00 0.00 42.46 41.29 1wuq s ILE 129 CO -0.00 0.16 0.36 -0.22 0.24 0.00 0.00 174.94 175.48 1wuq s LEU 130 N -1.99 4.27 0.18 0.37 2.96 -1.26 -1.04 118.68 122.18 1wuq s LEU 130 Ca 0.18 0.53 -0.31 0.00 -0.22 0.00 0.00 54.13 54.31 1wuq s LEU 130 Cb -0.11 -3.26 -0.10 0.00 0.50 0.00 0.00 46.19 43.22 1wuq s LEU 130 CO 0.10 0.05 1.56 -0.83 -1.32 0.00 0.00 176.35 175.90 1wuq s GLY 131 N -2.52 1.69 0.23 7.98 0.00 -0.31 -4.90 107.32 109.49 1wuq s GLY 131 Ca 0.40 1.38 -0.10 0.00 0.00 0.00 0.00 44.72 46.40 1wuq s GLY 131 CO 0.26 2.58 1.63 1.41 0.00 0.00 0.00 173.10 178.98 1wuq h LEU 132 N 6.45 -0.49 -2.07 0.66 3.38 -1.96 -1.28 115.31 119.99 1wuq h LEU 132 Ca -0.43 0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 1wuq h LEU 132 Cb 1.21 0.38 -0.00 0.00 0.09 0.00 0.00 40.66 42.34 1wuq h LEU 132 CO 0.89 -0.20 -0.08 0.77 0.09 0.00 0.00 178.44 179.91 1wuq h SER 133 N 0.05 0.00 0.29 -0.43 4.64 -2.00 -2.30 113.55 113.79 1wuq h SER 133 Ca 0.37 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.66 1wuq h SER 133 Cb 0.61 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1wuq h SER 133 CO -0.68 0.08 -0.15 0.11 -0.87 0.00 0.00 176.83 175.32 1wuq h LYS 134 N 0.00 0.00 -0.66 4.77 1.79 -1.58 -0.99 116.57 119.90 1wuq h LYS 134 Ca -0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1wuq h LYS 134 Cb 0.26 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.88 1wuq h LYS 134 CO 0.01 0.15 0.24 0.74 -1.08 0.00 0.00 179.45 179.51 1wuq h PHE 135 N 0.00 1.02 -0.51 -1.35 0.04 -1.50 -0.26 116.94 114.38 1wuq h PHE 135 Ca -0.00 -0.09 -0.11 0.00 2.80 0.00 0.00 57.97 60.57 1wuq h PHE 135 Cb 0.33 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.16 1wuq h PHE 135 CO 0.00 0.81 -0.12 0.00 -0.60 0.00 0.00 178.31 178.40 1wuq h ALA 136 N 1.10 0.83 -0.46 2.45 0.00 -1.35 -1.36 119.26 120.46 1wuq h ALA 136 Ca 0.22 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1wuq h ALA 136 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1wuq h ALA 136 CO -0.01 0.66 -0.14 0.00 0.00 0.00 0.00 179.25 179.76 1wuq h ARG 137 N 0.85 0.86 -0.42 0.00 3.08 -0.94 -1.60 114.38 116.22 1wuq h ARG 137 Ca 0.13 -0.31 -0.06 0.00 0.07 0.00 0.00 59.98 59.82 1wuq h ARG 137 Cb 0.67 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 1wuq h ARG 137 CO 0.05 0.94 0.04 0.82 -1.07 0.00 0.00 179.97 180.75 1wuq h ILE 138 N 0.77 1.25 -0.42 2.04 2.04 -0.80 -1.08 117.51 121.30 1wuq h ILE 138 Ca 0.12 -0.93 0.04 0.00 1.00 0.00 0.00 64.86 65.09 1wuq h ILE 138 Cb 0.65 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.74 1wuq h ILE 138 CO 0.05 0.32 0.20 0.58 0.00 0.00 0.00 178.15 179.29 1wuq h VAL 139 N 0.55 0.95 -0.51 1.67 2.07 -1.07 -2.26 116.25 117.64 1wuq h VAL 139 Ca 0.12 -0.14 -0.06 0.00 0.82 0.00 0.00 66.70 67.45 1wuq h VAL 139 Cb 0.41 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1wuq h VAL 139 CO 0.01 0.07 0.08 0.44 0.02 0.00 0.00 177.57 178.19 1wuq h ASP 140 N 0.40 0.76 -0.76 0.57 3.32 -1.09 -0.05 116.42 119.57 1wuq h ASP 140 Ca 0.18 -0.15 0.06 0.00 0.02 0.00 0.00 57.03 57.14 1wuq h ASP 140 Cb 0.11 -0.20 -0.06 0.00 0.22 0.00 0.00 39.33 39.40 1wuq h ASP 140 CO -0.14 0.78 0.45 -0.03 -1.72 0.00 0.00 179.24 178.58 1wuq h MET 141 N 0.77 0.79 0.00 3.56 4.05 -0.61 -1.50 114.93 121.99 1wuq h MET 141 Ca 0.16 -0.05 -0.16 0.00 -0.28 0.00 0.00 59.70 59.37 1wuq h MET 141 Cb 0.36 -0.18 -0.03 0.00 -0.80 0.00 0.00 31.60 30.95 1wuq h MET 141 CO 0.01 0.52 -1.35 0.74 0.23 0.00 0.00 176.91 177.06 1wuq h PHE 142 N 0.82 0.00 -0.08 1.39 0.04 -1.31 -3.37 116.94 114.43 1wuq h PHE 142 Ca 0.34 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.93 1wuq h PHE 142 Cb 0.20 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.34 1wuq h PHE 142 CO -0.06 0.56 -0.71 0.00 -0.60 0.00 0.00 178.31 177.50 1wuq h ALA 143 N 1.44 0.63 -0.29 2.45 0.00 -0.80 -3.33 119.26 119.37 1wuq h ALA 143 Ca -0.15 -0.60 -0.71 0.00 0.00 0.00 0.00 54.91 53.45 1wuq h ALA 143 Cb 1.56 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.24 1wuq h ALA 143 CO 0.05 0.76 3.15 0.54 0.00 0.00 0.00 179.25 183.74 1wuq n ARG 144 N -3.84 3.86 -3.95 0.00 1.74 -0.58 -4.26 116.66 109.63 1wuq n ARG 144 Ca -0.04 -2.77 -0.12 0.00 -0.77 0.00 0.00 57.85 54.15 1wuq n ARG 144 Cb 0.69 -2.83 -0.01 0.00 -1.02 0.00 0.00 32.46 29.30 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 1.11 2.05 -0.15 5.56 0.52 -1.17 -1.69 118.95 125.18 1wuq s ARG 145 Ca 0.59 -1.57 -0.22 0.00 -0.52 0.00 0.00 55.73 54.01 1wuq s ARG 145 Cb 0.17 0.53 -0.03 0.00 0.52 0.00 0.00 34.95 36.14 1wuq s ARG 145 CO -0.07 -0.91 0.65 -0.51 0.02 0.00 0.00 175.30 174.49 1wuq s LEU 146 N -3.14 4.21 0.00 2.53 1.43 -1.26 -3.52 118.68 118.92 1wuq s LEU 146 Ca 0.23 0.97 0.06 0.00 -1.03 0.00 0.00 54.13 54.35 1wuq s LEU 146 Cb -0.03 -2.96 -0.02 0.00 0.03 0.00 0.00 46.19 43.21 1wuq s LEU 146 CO 0.15 -0.21 0.22 0.00 0.23 0.00 0.00 176.35 176.75 1wuq n GLN 147 N 4.56 0.47 -4.02 1.70 1.13 0.18 -4.71 117.38 116.68 1wuq n GLN 147 Ca -0.01 -3.33 -0.17 0.00 -1.94 0.00 0.00 57.00 51.55 1wuq n GLN 147 Cb 0.50 2.36 -0.16 0.00 0.11 0.00 0.00 30.24 33.05 1wuq n GLN 147 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1wuq s VAL 148 N -3.23 0.28 0.43 5.09 -7.23 -1.26 -0.78 120.40 113.70 1wuq s VAL 148 Ca 0.32 -0.03 0.13 0.00 -1.81 0.00 0.00 61.98 60.59 1wuq s VAL 148 Cb 0.02 -0.32 0.32 0.00 0.56 0.00 0.00 36.38 36.96 1wuq s VAL 148 CO 0.22 0.14 1.98 -0.61 -0.31 0.00 0.00 175.10 176.53 1wuq h GLN 149 N 6.86 0.42 -0.91 4.82 4.15 -2.00 -2.09 115.11 126.36 1wuq h GLN 149 Ca -0.37 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.01 1wuq h GLN 149 Cb 1.16 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 28.71 1wuq h GLN 149 CO 0.49 0.28 0.51 0.93 -1.93 0.00 0.00 178.83 179.11 1wuq h GLU 150 N 0.43 1.27 -0.13 1.69 3.07 -1.97 -2.88 114.58 116.05 1wuq h GLU 150 Ca 0.27 -0.14 -0.21 0.00 -0.50 0.00 0.00 59.36 58.78 1wuq h GLU 150 Cb 0.49 -0.25 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 1wuq h GLU 150 CO -0.08 0.91 -0.75 -0.09 -1.40 0.00 0.00 179.01 177.61 1wuq h ARG 151 N 1.27 0.66 -0.42 2.33 2.43 -1.82 -3.23 114.38 115.62 1wuq h ARG 151 Ca 0.32 -0.53 0.06 0.00 -0.81 0.00 0.00 59.98 59.02 1wuq h ARG 151 Cb 0.01 0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.61 1wuq h ARG 151 CO -0.05 1.15 0.12 1.25 -1.51 0.00 0.00 179.97 180.93 1wuq h LEU 152 N 0.45 0.10 -0.62 3.80 5.85 -1.25 -0.01 115.31 123.64 1wuq h LEU 152 Ca -0.04 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1wuq h LEU 152 Cb 1.36 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.41 1wuq h LEU 152 CO 0.15 0.09 0.36 0.00 -0.34 0.00 0.00 178.44 178.69 1wuq h ALA 153 N 1.29 0.79 -0.08 1.25 0.00 -1.58 -1.93 119.26 118.99 1wuq h ALA 153 Ca 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1wuq h ALA 153 Cb 0.21 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1wuq h ALA 153 CO -0.22 0.29 0.01 0.28 0.00 0.00 0.00 179.25 179.61 1wuq h VAL 154 N 0.84 1.21 -0.70 0.00 2.07 -1.47 -1.97 116.25 116.23 1wuq h VAL 154 Ca 0.22 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 1wuq h VAL 154 Cb 0.01 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 1wuq h VAL 154 CO -0.04 0.19 0.38 1.56 0.02 0.00 0.00 177.57 179.67 1wuq h GLN 155 N -0.10 0.97 -0.29 1.57 4.20 -0.90 0.36 115.11 120.92 1wuq h GLN 155 Ca 0.03 -0.11 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 1wuq h GLN 155 Cb 0.28 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 1wuq h GLN 155 CO 0.00 0.72 0.01 0.82 -0.67 0.00 0.00 178.83 179.71 1wuq h ILE 156 N 0.98 1.25 -0.63 2.54 2.04 -1.29 -1.18 117.51 121.22 1wuq h ILE 156 Ca 0.25 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 1wuq h ILE 156 Cb 0.04 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1wuq h ILE 156 CO -0.04 0.29 0.23 0.00 0.00 0.00 0.00 178.15 178.64 1wuq h ALA 157 N 0.84 0.82 -0.57 1.87 0.00 -0.94 -2.21 119.26 119.07 1wuq h ALA 157 Ca 0.08 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 1wuq h ALA 157 Cb 0.41 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1wuq h ALA 157 CO 0.01 0.45 0.01 0.93 0.00 0.00 0.00 179.25 180.65 1wuq h GLU 158 N 0.88 0.97 -0.49 0.00 5.08 -0.85 -1.23 114.58 118.95 1wuq h GLU 158 Ca 0.21 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1wuq h GLU 158 Cb 0.23 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1wuq h GLU 158 CO -0.01 0.95 0.19 0.00 -1.00 0.00 0.00 179.01 179.14 1wuq h ALA 159 N 1.10 0.63 -0.59 3.43 0.00 -1.00 -0.37 119.26 122.46 1wuq h ALA 159 Ca 0.17 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1wuq h ALA 159 Cb 0.51 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1wuq h ALA 159 CO 0.03 0.25 -0.03 0.82 0.00 0.00 0.00 179.25 180.31 1wuq h ILE 160 N 0.65 1.27 -0.54 0.00 2.04 -1.23 -1.79 117.51 117.89 1wuq h ILE 160 Ca 0.16 -1.18 -0.01 0.00 1.00 0.00 0.00 64.86 64.83 1wuq h ILE 160 Cb 0.20 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 1wuq h ILE 160 CO -0.01 0.43 0.28 -0.61 0.00 0.00 0.00 178.15 178.24 1wuq h GLN 161 N 0.95 0.77 -0.64 2.37 5.75 -0.94 -1.17 115.11 122.20 1wuq h GLN 161 Ca 0.16 -0.10 -0.06 0.00 -0.15 0.00 0.00 58.65 58.50 1wuq h GLN 161 Cb 0.59 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.96 1wuq h GLN 161 CO 0.04 0.61 0.15 1.49 -2.65 0.00 0.00 178.83 178.47 1wuq h GLU 162 N 0.73 1.01 0.12 1.69 4.81 -0.87 0.28 114.58 122.36 1wuq h GLU 162 Ca 0.19 -0.23 -0.28 0.00 -0.13 0.00 0.00 59.36 58.91 1wuq h GLU 162 Cb 0.08 -0.14 0.02 0.00 0.63 0.00 0.00 28.75 29.34 1wuq h GLU 162 CO -0.03 0.90 -1.22 0.28 -0.73 0.00 0.00 179.01 178.21 1wuq h VAL 163 N 0.96 1.39 0.00 0.32 2.07 -1.12 -3.40 116.25 116.47 1wuq h VAL 163 Ca 0.20 -2.72 -0.18 0.00 0.82 0.00 0.00 66.70 64.83 1wuq h VAL 163 Cb 0.35 2.78 -0.03 0.00 -1.52 0.00 0.00 31.29 32.87 1wuq h VAL 163 CO 0.00 0.81 -1.81 0.18 0.02 0.00 0.00 177.57 176.77 1wuq n LEU 164 N -3.68 0.00 -3.71 2.57 4.77 -0.46 -5.02 117.00 111.48 1wuq n LEU 164 Ca -0.11 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.66 1wuq n LEU 164 Cb 0.99 0.24 0.03 0.00 -2.33 0.00 0.00 43.42 42.35 1wuq n LEU 164 CO 0.56 0.24 -0.07 -0.62 -1.33 0.00 0.00 177.39 176.16 1wuq n GLU 165 N -2.35 -4.86 -1.87 3.23 1.02 1.00 -4.71 120.64 112.09 1wuq n GLU 165 Ca -0.16 0.61 -0.30 0.00 -0.02 0.00 0.00 57.16 57.29 1wuq n GLU 165 Cb 0.78 -5.16 0.17 0.00 -0.02 0.00 0.00 31.44 27.22 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 -5.99 0.73 0.59 3.49 0.04 -1.26 -4.55 135.00 128.04 1wuq s PRO 166 Ca 0.00 -0.30 0.34 0.00 0.04 0.00 0.00 61.00 61.08 1wuq s PRO 166 Cb -0.00 -1.85 1.84 0.00 0.04 0.00 0.00 34.50 34.53 1wuq s PRO 166 CO 0.81 -2.37 2.20 1.96 0.04 0.00 0.00 177.00 179.64 1wuq h GLN 167 N -1.61 0.00 0.00 4.56 4.20 -1.15 -3.45 115.11 117.65 1wuq h GLN 167 Ca -0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1wuq h GLN 167 Cb 1.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.03 1wuq h GLN 167 CO 0.42 0.04 0.00 0.41 -0.67 0.00 0.00 178.83 179.03 1wuq n GLY 168 N -0.86 1.35 3.02 3.46 0.00 -1.22 -0.11 105.19 110.83 1wuq n GLY 168 Ca -0.02 -0.59 -0.15 0.00 0.00 0.00 0.00 46.02 45.25 1wuq n GLY 168 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wuq s VAL 169 N -2.00 0.54 -0.05 1.61 1.01 -0.45 -2.46 120.40 118.59 1wuq s VAL 169 Ca 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.33 1wuq s VAL 169 Cb 0.00 -0.53 0.02 0.00 0.00 0.00 0.00 36.38 35.87 1wuq s VAL 169 CO 0.00 -0.11 -0.07 -0.83 0.00 0.00 0.00 175.10 174.09 1wuq s GLY 170 N -0.85 0.59 -0.07 4.51 0.00 0.15 -0.43 107.32 111.22 1wuq s GLY 170 Ca -0.03 -0.20 0.02 0.00 0.00 0.00 0.00 44.72 44.51 1wuq s GLY 170 CO 0.00 0.34 -0.12 0.14 0.00 0.00 0.00 173.10 173.47 1wuq s VAL 171 N 0.86 1.13 -0.12 1.40 1.01 0.18 -0.70 120.40 124.16 1wuq s VAL 171 Ca -0.12 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.41 1wuq s VAL 171 Cb -0.15 -1.04 0.02 0.00 0.00 0.00 0.00 36.38 35.20 1wuq s VAL 171 CO 0.01 0.36 -0.16 -0.69 0.00 0.00 0.00 175.10 174.62 1wuq s VAL 172 N 0.76 1.62 -0.12 2.92 1.01 -0.00 -0.82 120.40 125.76 1wuq s VAL 172 Ca -0.13 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.16 1wuq s VAL 172 Cb -0.16 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.74 1wuq s VAL 172 CO 0.03 0.46 -0.15 -0.69 0.00 0.00 0.00 175.10 174.75 1wuq s VAL 173 N 1.09 2.89 -0.10 2.92 1.01 0.11 -0.39 120.40 127.93 1wuq s VAL 173 Ca -0.04 -0.72 -0.00 0.00 0.00 0.00 0.00 61.98 61.22 1wuq s VAL 173 Cb -0.14 -2.20 0.02 0.00 0.00 0.00 0.00 36.38 34.06 1wuq s VAL 173 CO -0.04 0.53 -0.08 -0.70 0.00 0.00 0.00 175.10 174.81 1wuq s GLU 174 N 0.32 1.49 0.18 2.72 2.12 -0.55 -0.49 118.70 124.49 1wuq s GLU 174 Ca -0.12 -0.25 -0.11 0.00 0.36 0.00 0.00 54.97 54.85 1wuq s GLU 174 Cb -0.16 -1.52 -0.00 0.00 0.26 0.00 0.00 34.13 32.70 1wuq s GLU 174 CO 0.06 -0.23 0.36 0.20 -0.54 0.00 0.00 175.26 175.11 1wuq s GLY 175 N 1.59 0.38 -0.04 -1.50 0.00 -0.33 -1.32 107.32 106.10 1wuq s GLY 175 Ca 0.03 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 43.99 1wuq s GLY 175 CO -0.07 -0.69 -0.01 -1.34 0.00 0.00 0.00 173.10 170.99 1wuq s VAL 176 N -3.96 4.12 -0.25 1.40 -7.23 0.56 -1.25 120.40 113.79 1wuq s VAL 176 Ca 0.17 -0.46 -0.02 0.00 -1.81 0.00 0.00 61.98 59.85 1wuq s VAL 176 Cb 0.02 -2.77 0.02 0.00 0.56 0.00 0.00 36.38 34.20 1wuq s VAL 176 CO 0.01 0.49 -0.04 -1.00 -0.31 0.00 0.00 175.10 174.25 1wuq s HIS 177 N -0.97 3.07 0.52 2.82 3.76 -1.26 -1.35 115.29 121.88 1wuq s HIS 177 Ca 0.16 -1.44 0.27 0.00 -0.15 0.00 0.00 55.06 53.90 1wuq s HIS 177 Cb -0.11 -2.09 1.62 0.00 1.11 0.00 0.00 32.58 33.11 1wuq s HIS 177 CO 0.06 -0.70 2.17 -0.07 -0.85 0.00 0.00 174.74 175.36 1wuq h LEU 178 N 8.05 0.00 -2.00 0.89 3.38 -1.76 -2.04 115.31 121.83 1wuq h LEU 178 Ca -0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1wuq h LEU 178 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1wuq h LEU 178 CO 0.58 0.05 0.00 0.00 0.09 0.00 0.00 178.44 179.16 1wuq n MET 180 N -2.99 1.01 -0.08 0.00 0.00 -0.79 -4.31 117.12 109.97 1wuq n MET 180 Ca -0.01 -1.29 -0.16 0.00 0.00 0.00 0.00 57.70 56.24 1wuq n MET 180 Cb 0.20 -1.18 -0.05 0.00 0.00 0.00 0.00 33.22 32.19 1wuq n MET 180 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 175.97 174.64 1wuq n MET 181 N 0.43 0.35 -0.12 3.17 2.00 -0.68 -0.42 117.12 121.85 1wuq n MET 181 Ca 0.06 0.15 0.09 0.00 0.00 0.00 0.00 57.70 58.01 1wuq n MET 181 Cb 0.27 -1.10 0.30 0.00 0.00 0.00 0.00 33.22 32.69 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 -3.82 1.84 -3.63 0.03 3.85 0.41 -4.46 117.12 111.34 1wuq n MET 182 Ca -0.29 -1.28 -0.04 0.00 -1.00 0.00 0.00 57.70 55.09 1wuq n MET 182 Cb 0.67 -1.38 0.02 0.00 -1.05 0.00 0.00 33.22 31.48 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 0.51 0.68 0.00 3.17 1.85 -1.25 -5.01 116.66 116.60 1wuq n ARG 183 Ca 0.15 -1.49 0.00 0.00 -1.00 0.00 0.00 57.85 55.51 1wuq n ARG 183 Cb 0.35 1.98 0.00 0.00 -1.05 0.00 0.00 32.46 33.74 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 -0.63 4.09 0.28 2.89 0.00 -1.26 -1.37 105.19 109.20 1wuq n GLY 184 Ca -0.03 0.11 0.15 0.00 0.00 0.00 0.00 46.02 46.25 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 0.35 -5.67 1.61 -1.51 -1.85 -3.47 116.25 105.72 1wuq h VAL 185 Ca 0.00 -0.44 -0.43 0.00 -1.23 0.00 0.00 66.70 64.60 1wuq h VAL 185 Cb 0.00 1.32 -0.02 0.00 -2.13 0.00 0.00 31.29 30.46 1wuq h VAL 185 CO 0.00 0.07 -0.67 -0.62 -1.23 0.00 0.00 177.57 175.13 1wuq n GLU 186 N -3.42 -4.92 -2.56 5.19 1.02 -0.47 -4.95 120.64 110.52 1wuq n GLU 186 Ca -0.02 0.64 -0.40 0.00 -0.02 0.00 0.00 57.16 57.37 1wuq n GLU 186 Cb 0.22 -5.48 -0.05 0.00 -0.02 0.00 0.00 31.44 26.12 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 -6.25 4.63 -0.15 3.49 -0.14 0.44 -4.86 119.74 116.90 1wuq s LYS 187 Ca 0.52 1.68 0.10 0.00 -1.36 0.00 0.00 55.97 56.90 1wuq s LYS 187 Cb -0.26 -3.12 -0.16 0.00 -1.68 0.00 0.00 37.83 32.62 1wuq s LYS 187 CO 0.64 0.24 0.00 1.04 -0.76 0.00 0.00 175.35 176.51 1wuq n GLN 188 N 1.08 1.45 0.00 1.68 1.13 -1.26 -4.03 117.38 117.42 1wuq n GLN 188 Ca -0.00 0.02 0.13 0.00 -1.94 0.00 0.00 57.00 55.21 1wuq n GLN 188 Cb 0.46 -1.36 0.43 0.00 0.11 0.00 0.00 30.24 29.89 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 -2.63 0.00 -2.59 1.08 8.25 -1.26 -4.98 115.22 113.09 1wuq n HIS 189 Ca -0.25 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 56.83 1wuq n HIS 189 Cb 0.93 -0.09 -0.05 0.00 1.12 0.00 0.00 29.99 31.90 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 -2.35 7.14 0.01 0.41 0.15 -1.26 -5.07 113.70 112.72 1wuq s SER 190 Ca 0.29 2.06 0.00 0.00 0.70 0.00 0.00 55.95 59.00 1wuq s SER 190 Cb 0.20 -2.60 -0.01 0.00 -1.71 0.00 0.00 66.02 61.90 1wuq s SER 190 CO 0.46 -0.22 -0.02 -0.13 1.20 0.00 0.00 173.24 174.53 1wuq s ARG 191 N -1.93 0.19 -0.09 5.44 0.52 -1.26 -4.74 118.95 117.08 1wuq s ARG 191 Ca 0.50 -0.26 0.02 0.00 -0.52 0.00 0.00 55.73 55.48 1wuq s ARG 191 Cb -0.25 -0.05 -0.02 0.00 0.52 0.00 0.00 34.95 35.16 1wuq s ARG 191 CO 0.31 0.00 -0.16 0.99 0.02 0.00 0.00 175.30 176.47 1wuq s THR 192 N -0.54 2.82 -0.14 0.02 2.01 -0.38 -4.96 115.64 114.47 1wuq s THR 192 Ca -0.05 -0.77 0.01 0.00 0.31 0.00 0.00 61.69 61.18 1wuq s THR 192 Cb -0.04 -2.13 -0.00 0.00 0.01 0.00 0.00 72.50 70.34 1wuq s THR 192 CO -0.00 0.56 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.63 1wuq s VAL 193 N -0.10 2.62 0.12 3.82 1.01 -1.26 -1.18 120.40 125.44 1wuq s VAL 193 Ca -0.03 -0.79 0.07 0.00 0.00 0.00 0.00 61.98 61.23 1wuq s VAL 193 Cb -0.14 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 1wuq s VAL 193 CO 0.04 0.52 -0.17 0.42 0.00 0.00 0.00 175.10 175.91 1wuq s THR 194 N 0.67 1.57 0.24 3.92 -4.23 0.36 -4.98 115.64 113.17 1wuq s THR 194 Ca -0.08 -1.69 -0.06 0.00 -1.18 0.00 0.00 61.69 58.68 1wuq s THR 194 Cb -0.16 -1.59 -0.02 0.00 1.34 0.00 0.00 72.50 72.08 1wuq s THR 194 CO 0.02 -0.26 0.32 -0.94 -0.54 0.00 0.00 174.62 173.22 1wuq s SER 195 N -2.29 0.17 -0.19 3.99 1.04 -1.26 0.05 113.70 115.21 1wuq s SER 195 Ca 0.09 -1.21 -0.08 0.00 0.48 0.00 0.00 55.95 55.22 1wuq s SER 195 Cb -0.07 0.50 0.08 0.00 0.10 0.00 0.00 66.02 66.63 1wuq s SER 195 CO 0.04 -1.02 0.43 0.00 0.98 0.00 0.00 173.24 173.68 1wuq s ALA 196 N -3.97 -1.17 -0.15 5.32 0.00 -0.00 -4.67 121.76 117.12 1wuq s ALA 196 Ca 0.31 1.58 0.01 0.00 0.00 0.00 0.00 51.96 53.87 1wuq s ALA 196 Cb 0.03 -1.17 0.02 0.00 0.00 0.00 0.00 23.12 21.99 1wuq s ALA 196 CO 0.12 -0.53 -0.17 -1.64 0.00 0.00 0.00 175.76 173.53 1wuq s MET 197 N 2.05 2.61 0.16 0.00 -1.94 -1.26 -0.64 119.30 120.27 1wuq s MET 197 Ca -0.06 -0.69 0.10 0.00 -1.71 0.00 0.00 55.69 53.34 1wuq s MET 197 Cb -0.10 -2.26 -0.04 0.00 2.01 0.00 0.00 34.83 34.44 1wuq s MET 197 CO -0.13 -0.16 -0.22 -0.51 -0.01 0.00 0.00 175.02 173.98 1wuq s LEU 198 N 1.23 2.39 0.00 -0.03 1.43 0.42 -4.32 118.68 119.80 1wuq s LEU 198 Ca 0.01 -0.81 0.00 0.00 -1.03 0.00 0.00 54.13 52.30 1wuq s LEU 198 Cb -0.14 -1.03 0.00 0.00 0.03 0.00 0.00 46.19 45.05 1wuq s LEU 198 CO -0.08 0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.19 1wuq n GLY 199 N 0.53 3.09 0.32 -3.19 0.00 -1.26 -1.34 105.19 103.34 1wuq n GLY 199 Ca -0.15 -0.26 0.20 0.00 0.00 0.00 0.00 46.02 45.81 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 0.15 0.00 1.61 -1.51 -0.84 -0.60 116.25 115.06 1wuq h VAL 200 Ca 0.00 -0.11 -0.06 0.00 -1.23 0.00 0.00 66.70 65.30 1wuq h VAL 200 Cb 0.00 1.09 -0.01 0.00 -2.13 0.00 0.00 31.29 30.24 1wuq h VAL 200 CO 0.00 0.01 -0.31 -0.26 -1.23 0.00 0.00 177.57 175.78 1wuq h PHE 201 N 0.00 0.00 0.06 5.19 0.04 -1.72 -1.08 116.94 119.43 1wuq h PHE 201 Ca -0.00 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.43 1wuq h PHE 201 Cb 0.09 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.20 1wuq h PHE 201 CO 0.00 0.31 -1.96 -2.13 -0.60 0.00 0.00 178.31 173.93 1wuq n ARG 202 N -3.37 0.70 0.02 1.51 0.63 -0.36 -4.39 116.66 111.40 1wuq n ARG 202 Ca 0.01 0.25 -0.01 0.00 -0.92 0.00 0.00 57.85 57.18 1wuq n ARG 202 Cb 0.52 -1.71 -0.00 0.00 0.45 0.00 0.00 32.46 31.71 1wuq n ARG 202 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1wuq h GLU 203 N 0.04 -0.05 -6.61 -0.14 4.39 -1.18 -3.44 114.58 107.58 1wuq h GLU 203 Ca -0.39 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 58.75 1wuq h GLU 203 Cb 2.03 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 30.63 1wuq h GLU 203 CO 0.07 -0.03 0.95 1.21 -1.16 0.00 0.00 179.01 180.04 1wuq s ASN 204 N -3.11 6.61 0.38 1.42 2.47 -0.42 -4.90 114.94 117.40 1wuq s ASN 204 Ca -0.01 0.64 0.06 0.00 0.42 0.00 0.00 52.86 53.98 1wuq s ASN 204 Cb 0.00 -2.55 0.76 0.00 -1.45 0.00 0.00 41.25 38.02 1wuq s ASN 204 CO 0.02 -1.24 1.99 -0.61 -3.72 0.00 0.00 177.10 173.54 1wuq h GLN 205 N 9.40 0.53 -0.27 0.43 -0.00 -1.85 -2.08 115.11 121.27 1wuq h GLN 205 Ca -0.24 -0.06 -0.07 0.00 -0.00 0.00 0.00 58.65 58.28 1wuq h GLN 205 Cb 1.07 -0.11 -0.02 0.00 0.00 0.00 0.00 27.48 28.43 1wuq h GLN 205 CO 1.10 0.43 -0.14 0.87 0.00 0.00 0.00 178.83 181.10 1wuq h LYS 206 N 0.54 0.46 -0.04 1.69 1.79 -1.94 -0.33 116.57 118.74 1wuq h LYS 206 Ca 0.13 -0.13 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 1wuq h LYS 206 Cb 0.08 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 30.68 1wuq h LYS 206 CO -0.02 0.60 -0.07 1.15 -1.08 0.00 0.00 179.45 180.03 1wuq h THR 207 N 0.43 1.42 -0.85 -0.16 2.02 -1.69 -1.77 112.91 112.30 1wuq h THR 207 Ca 0.08 -1.34 0.03 0.00 0.77 0.00 0.00 66.41 65.94 1wuq h THR 207 Cb 0.50 2.22 -0.05 0.00 -1.74 0.00 0.00 68.15 69.08 1wuq h THR 207 CO 0.03 0.36 0.55 -0.09 0.37 0.00 0.00 175.52 176.75 1wuq h ARG 208 N -0.39 1.06 -0.46 6.66 2.43 -1.33 -1.61 114.38 120.75 1wuq h ARG 208 Ca 0.00 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1wuq h ARG 208 Cb 0.62 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1wuq h ARG 208 CO 0.02 0.70 0.27 1.49 -1.51 0.00 0.00 179.97 180.93 1wuq h GLU 209 N 1.09 0.63 -0.37 0.20 4.81 -1.04 -0.68 114.58 119.22 1wuq h GLU 209 Ca 0.33 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 1wuq h GLU 209 Cb -0.03 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 1wuq h GLU 209 CO -0.10 0.48 -0.03 1.49 -0.73 0.00 0.00 179.01 180.12 1wuq h GLU 210 N 0.61 0.59 -0.03 1.92 4.81 -0.86 -0.09 114.58 121.52 1wuq h GLU 210 Ca 0.16 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1wuq h GLU 210 Cb 0.02 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 1wuq h GLU 210 CO -0.03 0.63 -0.01 0.35 -0.73 0.00 0.00 179.01 179.22 1wuq h PHE 211 N 0.55 0.06 -0.04 0.92 -0.00 -0.80 -2.73 116.94 114.90 1wuq h PHE 211 Ca 0.11 -0.01 -0.04 0.00 -0.00 0.00 0.00 57.97 58.03 1wuq h PHE 211 Cb 0.39 -0.01 -0.01 0.00 -0.00 0.00 0.00 35.95 36.32 1wuq h PHE 211 CO 0.02 0.40 -0.16 -0.07 -0.00 0.00 0.00 178.31 178.50 1wuq h LEU 212 N -0.30 0.05 -0.86 0.59 3.38 -0.93 -2.40 115.31 114.84 1wuq h LEU 212 Ca 0.01 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 1wuq h LEU 212 Cb 0.38 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1wuq h LEU 212 CO 0.00 0.22 -0.28 0.28 0.09 0.00 0.00 178.44 178.75 1wuq h SER 213 N 0.05 0.53 0.37 -0.43 0.02 -0.91 -2.36 113.55 110.83 1wuq h SER 213 Ca 0.01 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.74 1wuq h SER 213 Cb 0.32 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.71 1wuq h SER 213 CO 0.02 0.80 -0.11 0.45 -1.14 0.00 0.00 176.83 176.85 1wuq h HIS 214 N 0.46 0.00 0.00 3.45 3.86 -1.12 -2.58 115.15 119.22 1wuq h HIS 214 Ca 0.06 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.25 1wuq h HIS 214 Cb 0.72 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.19 1wuq h HIS 214 CO 0.03 0.11 -0.09 -0.07 0.86 0.00 0.00 177.93 178.76 1wuq h LEU 215 N 0.00 0.00 -0.68 2.43 3.38 -1.39 -3.52 115.31 115.53 1wuq h LEU 215 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wuq h LEU 215 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1wuq h LEU 215 CO 0.01 0.09 0.00 0.54 0.09 0.00 0.00 178.44 179.18