#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cwc h GLU 6 N 0.00 0.39 -0.27 1.64 4.22 -2.06 0.23 114.58 118.72 2cwc h GLU 6 Ca 0.00 -0.02 -0.09 0.00 0.08 0.00 0.00 59.36 59.33 2cwc h GLU 6 Cb 0.00 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2cwc h GLU 6 CO 0.00 0.25 -0.18 0.00 -2.18 0.00 0.00 179.01 176.91 2cwc h ARG 7 N 0.40 0.61 -0.74 1.92 3.08 -2.02 -3.00 114.38 114.63 2cwc h ARG 7 Ca 0.22 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 2cwc h ARG 7 Cb 0.18 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 2cwc h ARG 7 CO -0.19 0.87 0.42 1.96 -1.07 0.00 0.00 179.97 181.96 2cwc h GLN 8 N 0.34 1.01 -0.98 0.04 4.20 -1.91 -2.46 115.11 115.36 2cwc h GLN 8 Ca 0.06 -0.10 0.15 0.00 0.06 0.00 0.00 58.65 58.82 2cwc h GLN 8 Cb 0.71 -0.21 -0.09 0.00 0.30 0.00 0.00 27.48 28.20 2cwc h GLN 8 CO 0.05 0.73 0.61 0.22 -0.67 0.00 0.00 178.83 179.78 2cwc h ASP 9 N 1.03 0.79 -0.40 1.46 -0.00 -0.41 -0.60 116.42 118.29 2cwc h ASP 9 Ca 0.26 0.06 -0.14 0.00 -0.00 0.00 0.00 57.03 57.21 2cwc h ASP 9 Cb 0.00 -0.09 -0.01 0.00 -0.00 0.00 0.00 39.33 39.23 2cwc h ASP 9 CO -0.05 0.37 -0.29 0.03 -0.00 0.00 0.00 179.24 179.30 2cwc h ARG 10 N 0.82 0.93 -0.25 0.28 3.08 -1.39 -0.11 114.38 117.73 2cwc h ARG 10 Ca 0.51 -0.43 -0.14 0.00 0.07 0.00 0.00 59.98 59.99 2cwc h ARG 10 Cb 0.72 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.75 2cwc h ARG 10 CO -0.28 1.09 -0.39 0.00 -1.07 0.00 0.00 179.97 179.32 2cwc h ARG 11 N 0.79 0.71 -0.69 0.04 -0.00 -1.32 -1.71 114.38 112.21 2cwc h ARG 11 Ca 0.09 -0.43 -0.06 0.00 -0.50 0.00 0.00 59.98 59.08 2cwc h ARG 11 Cb 0.86 0.04 -0.03 0.00 0.00 0.00 0.00 29.97 30.85 2cwc h ARG 11 CO 0.08 1.05 0.20 -0.07 0.00 0.00 0.00 179.97 181.22 2cwc h LEU 12 N 0.44 1.00 -0.60 3.04 -0.00 -1.13 -2.38 115.31 115.68 2cwc h LEU 12 Ca 0.02 -0.19 -0.04 0.00 -0.00 0.00 0.00 57.88 57.67 2cwc h LEU 12 Cb 0.98 -0.26 -0.03 0.00 -0.00 0.00 0.00 40.66 41.35 2cwc h LEU 12 CO 0.09 0.94 0.22 1.23 -0.00 0.00 0.00 178.44 180.93 2cwc h GLY 13 N 1.08 0.98 1.01 0.83 0.00 -0.93 -0.14 103.07 105.90 2cwc h GLY 13 Ca 0.22 -0.55 -0.06 0.00 0.00 0.00 0.00 47.33 46.94 2cwc h GLY 13 CO -0.00 0.52 0.12 0.00 0.00 0.00 0.00 176.54 177.17 2cwc h ALA 14 N 1.08 0.76 0.22 3.60 0.00 -1.14 0.19 119.26 123.97 2cwc h ALA 14 Ca 0.20 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2cwc h ALA 14 Cb 0.23 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2cwc h ALA 14 CO -0.01 0.48 -0.11 0.35 0.00 0.00 0.00 179.25 179.96 2cwc h PHE 15 N 0.83 -0.27 -0.03 0.00 3.57 -1.27 -2.83 116.94 116.94 2cwc h PHE 15 Ca 0.18 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 2cwc h PHE 15 Cb 0.38 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 2cwc h PHE 15 CO 0.03 0.12 -0.42 -0.07 -2.23 0.00 0.00 178.31 175.73 2cwc h LEU 16 N -0.81 0.06 -1.27 0.59 4.07 -1.08 -2.74 115.31 114.12 2cwc h LEU 16 Ca -0.03 -0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.90 2cwc h LEU 16 Cb 0.51 -0.02 -0.03 0.00 1.08 0.00 0.00 40.66 42.20 2cwc h LEU 16 CO 0.05 0.47 0.40 1.23 -1.08 0.00 0.00 178.44 179.51 2cwc h GLY 17 N 1.26 0.96 0.86 0.83 0.00 -0.66 0.17 103.07 106.49 2cwc h GLY 17 Ca 0.00 -0.39 0.01 0.00 0.00 0.00 0.00 47.33 46.96 2cwc h GLY 17 CO 0.06 0.38 -0.02 -2.00 0.00 0.00 0.00 176.54 174.96 2cwc h LEU 18 N 0.91 -0.06 -0.62 3.11 6.46 -1.22 -0.64 115.31 123.24 2cwc h LEU 18 Ca 0.24 0.02 -0.12 0.00 -0.12 0.00 0.00 57.88 57.90 2cwc h LEU 18 Cb -0.04 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 39.92 2cwc h LEU 18 CO -0.05 -0.02 -0.20 0.00 -0.62 0.00 0.00 178.44 177.55 2cwc h ALA 19 N 1.07 0.81 -0.31 1.25 0.00 -1.42 -1.62 119.26 119.03 2cwc h ALA 19 Ca 0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2cwc h ALA 19 Cb 0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2cwc h ALA 19 CO -0.07 0.65 0.17 0.28 0.00 0.00 0.00 179.25 180.28 2cwc h VAL 20 N 0.77 1.14 -0.60 0.00 2.07 -0.79 -0.52 116.25 118.31 2cwc h VAL 20 Ca 0.11 -0.37 -0.07 0.00 0.82 0.00 0.00 66.70 67.19 2cwc h VAL 20 Cb 0.74 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 2cwc h VAL 20 CO 0.06 0.14 0.09 1.23 0.02 0.00 0.00 177.57 179.11 2cwc h GLY 21 N 0.39 1.04 0.92 2.17 0.00 -1.01 -1.27 103.07 105.30 2cwc h GLY 21 Ca 0.11 -0.67 -0.04 0.00 0.00 0.00 0.00 47.33 46.73 2cwc h GLY 21 CO -0.02 0.62 0.07 -1.80 0.00 0.00 0.00 176.54 175.41 2cwc h ASP 22 N 0.91 0.57 -0.30 0.19 3.58 -1.05 -0.49 116.42 119.83 2cwc h ASP 22 Ca 0.18 -0.25 -0.03 0.00 0.42 0.00 0.00 57.03 57.36 2cwc h ASP 22 Cb 0.40 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 2cwc h ASP 22 CO 0.01 0.67 0.08 0.00 -2.88 0.00 0.00 179.24 177.12 2cwc h ALA 23 N 0.92 0.40 -0.26 -0.78 0.00 -0.87 -1.29 119.26 117.38 2cwc h ALA 23 Ca 0.11 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2cwc h ALA 23 Cb 0.34 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2cwc h ALA 23 CO 0.00 0.06 -0.03 -0.07 0.00 0.00 0.00 179.25 179.21 2cwc h LEU 24 N 0.33 0.47 -1.25 0.00 3.38 -1.20 -3.13 115.31 113.91 2cwc h LEU 24 Ca 0.10 -0.34 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 2cwc h LEU 24 Cb 0.28 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2cwc h LEU 24 CO 0.00 0.70 -0.09 1.23 0.09 0.00 0.00 178.44 180.38 2cwc h GLY 25 N 0.23 0.44 2.00 0.83 0.00 -1.06 -2.40 103.07 103.11 2cwc h GLY 25 Ca 0.07 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 2cwc h GLY 25 CO 0.02 0.26 -0.02 0.00 0.00 0.00 0.00 176.54 176.80 2cwc h ALA 26 N 1.53 1.46 0.00 3.60 0.00 -1.17 -1.64 119.26 123.03 2cwc h ALA 26 Ca 0.08 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2cwc h ALA 26 Cb 0.40 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2cwc h ALA 26 CO 0.02 0.02 -0.14 1.96 0.00 0.00 0.00 179.25 181.11 2cwc h GLN 27 N 0.00 0.00 0.00 0.00 4.20 -1.47 -3.09 115.11 114.75 2cwc h GLN 27 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2cwc h GLN 27 Cb 0.05 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 2cwc h GLN 27 CO 0.00 0.14 -0.26 1.33 -0.67 0.00 0.00 178.83 179.37 2cwc n VAL 28 N -4.26 1.56 -1.70 -0.54 0.24 -0.66 -3.19 118.33 109.77 2cwc n VAL 28 Ca -0.02 -2.08 -0.44 0.00 -2.04 0.00 0.00 64.34 59.76 2cwc n VAL 28 Cb 0.22 -0.05 -0.03 0.00 -1.47 0.00 0.00 33.84 32.51 2cwc n VAL 28 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2cwc n GLU 29 N -1.02 2.47 -0.25 7.34 2.13 -0.95 -2.12 120.64 128.23 2cwc n GLU 29 Ca 0.14 0.89 0.00 0.00 0.66 0.00 0.00 57.16 58.84 2cwc n GLU 29 Cb 0.69 -2.67 0.00 0.00 0.27 0.00 0.00 31.44 29.73 2cwc n GLU 29 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2cwc n GLY 30 N 3.17 1.73 3.75 8.31 0.00 0.66 -4.71 105.19 118.11 2cwc n GLY 30 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2cwc n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cwc s LEU 31 N 0.00 4.41 0.40 0.99 1.43 -0.90 -4.67 118.68 120.34 2cwc s LEU 31 Ca 0.00 1.21 -0.26 0.00 -1.03 0.00 0.00 54.13 54.05 2cwc s LEU 31 Cb 0.00 -2.99 -0.09 0.00 0.03 0.00 0.00 46.19 43.14 2cwc s LEU 31 CO 0.00 0.06 1.32 -2.84 0.23 0.00 0.00 176.35 175.12 2cwc s PRO 32 N -0.06 4.01 0.40 1.29 0.02 -1.26 -0.89 135.00 138.50 2cwc s PRO 32 Ca 0.33 2.19 -0.26 0.00 0.02 0.00 0.00 61.00 63.28 2cwc s PRO 32 Cb -0.19 -2.80 -0.10 0.00 0.02 0.00 0.00 34.50 31.43 2cwc s PRO 32 CO 0.18 -0.47 1.28 1.17 -0.33 0.00 0.00 177.00 178.83 2cwc n LYS 33 N 0.21 2.02 -1.15 5.54 4.81 -1.24 -2.71 118.16 125.63 2cwc n LYS 33 Ca 0.03 0.71 -0.05 0.00 -0.87 0.00 0.00 58.31 58.13 2cwc n LYS 33 Cb 0.43 -2.38 -0.02 0.00 0.02 0.00 0.00 35.03 33.08 2cwc n LYS 33 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2cwc n GLY 34 N 0.78 0.73 0.35 3.14 0.00 -1.26 -4.88 105.19 104.05 2cwc n GLY 34 Ca 0.06 -0.36 0.03 0.00 0.00 0.00 0.00 46.02 45.76 2cwc n GLY 34 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cwc n THR 35 N -2.67 0.61 -3.92 2.61 -2.24 -1.10 -5.01 114.28 102.55 2cwc n THR 35 Ca -0.05 -0.80 -0.10 0.00 -2.27 0.00 0.00 64.05 60.83 2cwc n THR 35 Cb 0.26 0.75 -0.10 0.00 -2.10 0.00 0.00 70.33 69.14 2cwc n THR 35 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 2cwc s PHE 36 N -0.83 0.15 0.59 4.78 -0.12 -1.26 -5.03 117.98 116.26 2cwc s PHE 36 Ca 0.12 -0.35 -0.20 0.00 -0.05 0.00 0.00 56.93 56.46 2cwc s PHE 36 Cb 0.07 -0.12 -0.04 0.00 -0.63 0.00 0.00 43.02 42.30 2cwc s PHE 36 CO 0.09 -0.27 1.21 -2.30 -0.05 0.00 0.00 175.22 173.89 2cwc n PRO 37 N 1.34 1.25 -1.67 1.99 -0.02 -1.26 -4.85 135.00 131.77 2cwc n PRO 37 Ca -0.22 0.47 -0.47 0.00 -2.02 0.00 0.00 63.50 61.26 2cwc n PRO 37 Cb 0.56 -2.42 -0.04 0.00 -0.02 0.00 0.00 33.50 31.58 2cwc n PRO 37 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2cwc n GLU 38 N -1.26 2.08 -2.97 -0.52 2.13 -1.26 -4.94 120.64 113.90 2cwc n GLU 38 Ca 0.13 0.75 -0.40 0.00 0.66 0.00 0.00 57.16 58.30 2cwc n GLU 38 Cb 0.46 -2.53 -0.04 0.00 0.27 0.00 0.00 31.44 29.60 2cwc n GLU 38 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2cwc s VAL 39 N 1.50 4.98 0.00 6.31 1.01 -1.26 -4.90 120.40 128.05 2cwc s VAL 39 Ca 0.82 1.59 0.00 0.00 0.00 0.00 0.00 61.98 64.39 2cwc s VAL 39 Cb -0.70 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 31.57 2cwc s VAL 39 CO 0.41 0.24 0.00 0.54 0.00 0.00 0.00 175.10 176.30 2cwc n ARG 40 N 3.71 3.82 -4.34 2.72 1.74 -1.26 -4.85 116.66 118.20 2cwc n ARG 40 Ca 0.00 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.91 2cwc n ARG 40 Cb 0.51 -0.39 -0.10 0.00 -1.02 0.00 0.00 32.46 31.45 2cwc n ARG 40 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2cwc s GLU 41 N -0.20 1.38 -1.04 5.56 0.41 -1.26 -5.07 118.70 118.48 2cwc s GLU 41 Ca 0.00 -1.71 -0.23 0.00 -0.41 0.00 0.00 54.97 52.62 2cwc s GLU 41 Cb 0.00 -0.60 0.05 0.00 -1.78 0.00 0.00 34.13 31.80 2cwc s GLU 41 CO 0.00 -0.13 1.46 -1.64 -0.49 0.00 0.00 175.26 174.46 2cwc s MET 42 N -3.89 3.62 0.00 1.61 -1.94 -1.26 -4.71 119.30 112.73 2cwc s MET 42 Ca 0.30 -1.20 0.14 0.00 -1.71 0.00 0.00 55.69 53.22 2cwc s MET 42 Cb 0.06 -5.36 -0.05 0.00 2.01 0.00 0.00 34.83 31.49 2cwc s MET 42 CO 0.10 -2.20 0.73 1.63 -0.01 0.00 0.00 175.02 175.26 2cwc n LYS 43 N 8.80 2.01 0.00 2.03 4.76 -1.26 -4.64 118.16 129.85 2cwc n LYS 43 Ca 0.34 -0.52 0.00 0.00 -2.87 0.00 0.00 58.31 55.26 2cwc n LYS 43 Cb 0.51 -1.20 0.00 0.00 -1.84 0.00 0.00 35.03 32.50 2cwc n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2cwc n GLY 44 N 1.15 -0.56 0.00 0.72 0.00 -1.26 -4.40 105.19 100.85 2cwc n GLY 44 Ca 0.05 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.95 2cwc n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cwc n GLY 45 N 0.00 0.84 0.13 -0.02 0.00 0.47 -4.71 105.19 101.89 2cwc n GLY 45 Ca 0.00 -1.68 0.01 0.00 0.00 0.00 0.00 46.02 44.35 2cwc n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cwc n GLY 46 N 0.00 -2.26 0.21 -0.02 0.00 -1.19 -1.64 105.19 100.29 2cwc n GLY 46 Ca 0.00 -1.53 0.14 0.00 0.00 0.00 0.00 46.02 44.63 2cwc n GLY 46 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cwc h PRO 47 N 0.00 0.00 -0.23 1.61 0.13 -1.84 -2.54 132.00 129.13 2cwc h PRO 47 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 2cwc h PRO 47 Cb 0.04 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.15 2cwc h PRO 47 CO 0.00 0.00 -0.01 0.72 -0.23 0.00 0.00 178.00 178.48 2cwc n HIS 48 N -2.48 0.80 -4.38 1.56 8.25 -1.26 -4.98 115.22 112.73 2cwc n HIS 48 Ca -0.02 -0.98 -0.35 0.00 -0.26 0.00 0.00 57.72 56.12 2cwc n HIS 48 Cb 0.05 -0.31 -0.09 0.00 1.12 0.00 0.00 29.99 30.77 2cwc n HIS 48 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2cwc n ARG 49 N -0.74 -1.06 -1.99 -0.41 1.74 -0.96 -4.86 116.66 108.39 2cwc n ARG 49 Ca 0.22 0.13 -0.39 0.00 -0.77 0.00 0.00 57.85 57.04 2cwc n ARG 49 Cb 0.87 -4.08 0.00 0.00 -1.02 0.00 0.00 32.46 28.23 2cwc n ARG 49 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2cwc s LEU 50 N -7.32 4.18 0.79 0.55 1.43 -0.65 -4.64 118.68 113.02 2cwc s LEU 50 Ca 0.32 2.72 -0.11 0.00 -1.03 0.00 0.00 54.13 56.03 2cwc s LEU 50 Cb -0.18 -3.92 0.07 0.00 0.03 0.00 0.00 46.19 42.18 2cwc s LEU 50 CO 1.00 -0.94 1.09 -2.84 0.23 0.00 0.00 176.35 174.89 2cwc s PRO 51 N -2.31 2.13 0.33 1.29 0.02 -1.26 -0.40 135.00 134.80 2cwc s PRO 51 Ca 0.58 1.08 -0.29 0.00 0.02 0.00 0.00 61.00 62.39 2cwc s PRO 51 Cb -0.39 -1.89 -0.12 0.00 0.02 0.00 0.00 34.50 32.12 2cwc s PRO 51 CO 0.51 -1.71 1.46 -2.30 -0.33 0.00 0.00 177.00 174.63 2cwc n PRO 52 N -3.55 2.48 -0.48 5.54 -0.02 -1.26 -1.86 135.00 135.85 2cwc n PRO 52 Ca 0.09 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 2cwc n PRO 52 Cb 0.53 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 2cwc n PRO 52 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cwc n GLY 53 N 1.22 1.66 3.81 -1.23 0.00 -1.26 -4.78 105.19 104.62 2cwc n GLY 53 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 2cwc n GLY 53 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cwc s PHE 54 N -3.33 3.72 0.43 1.61 0.40 -0.78 -1.30 117.98 118.73 2cwc s PHE 54 Ca 0.00 1.33 0.04 0.00 -0.60 0.00 0.00 56.93 57.69 2cwc s PHE 54 Cb 0.00 -2.56 0.04 0.00 0.51 0.00 0.00 43.02 41.00 2cwc s PHE 54 CO 0.00 0.44 0.29 -2.67 0.70 0.00 0.00 175.22 173.98 2cwc n TRP 55 N 1.10 -0.59 -2.65 0.36 4.27 -1.26 -4.39 117.44 114.28 2cwc n TRP 55 Ca -0.05 -1.86 -0.22 0.00 -3.89 0.00 0.00 57.50 51.47 2cwc n TRP 55 Cb 0.51 -0.35 0.08 0.00 -1.36 0.00 0.00 31.31 30.19 2cwc n TRP 55 CO 0.00 0.00 0.00 0.95 -2.29 0.00 0.00 177.69 176.35 2cwc s THR 56 N -2.19 2.31 0.31 -1.67 -4.23 -1.26 -4.96 115.64 103.95 2cwc s THR 56 Ca 0.22 -0.66 0.35 0.00 -1.18 0.00 0.00 61.69 60.43 2cwc s THR 56 Cb -0.02 -2.66 0.35 0.00 1.34 0.00 0.00 72.50 71.52 2cwc s THR 56 CO 0.14 0.00 2.08 0.44 -0.54 0.00 0.00 174.62 176.74 2cwc h ASP 57 N -0.26 0.00 -0.35 3.99 3.45 -2.01 -1.36 116.42 119.88 2cwc h ASP 57 Ca -0.38 0.00 -0.16 0.00 0.43 0.00 0.00 57.03 56.92 2cwc h ASP 57 Cb 1.28 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 40.04 2cwc h ASP 57 CO 0.44 0.00 -0.42 0.44 -1.57 0.00 0.00 179.24 178.14 2cwc h ASP 58 N 0.00 0.98 0.48 6.45 3.45 -1.98 -1.29 116.42 124.50 2cwc h ASP 58 Ca 0.00 -0.46 -0.12 0.00 0.43 0.00 0.00 57.03 56.88 2cwc h ASP 58 Cb 0.01 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 38.49 2cwc h ASP 58 CO 0.00 1.26 -0.55 0.74 -1.57 0.00 0.00 179.24 179.12 2cwc h THR 59 N 0.74 1.39 -0.86 0.35 2.02 -1.58 -2.26 112.91 112.70 2cwc h THR 59 Ca 0.05 -1.87 0.00 0.00 0.77 0.00 0.00 66.41 65.37 2cwc h THR 59 Cb 1.01 1.98 -0.04 0.00 -1.74 0.00 0.00 68.15 69.36 2cwc h THR 59 CO 0.10 0.54 0.55 0.28 0.37 0.00 0.00 175.52 177.36 2cwc h SER 60 N 0.06 1.00 -0.54 4.18 0.02 -1.19 -0.97 113.55 116.12 2cwc h SER 60 Ca -0.00 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.88 2cwc h SER 60 Cb 0.99 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.25 2cwc h SER 60 CO 0.08 0.74 0.22 1.56 -1.14 0.00 0.00 176.83 178.29 2cwc h GLN 61 N 1.17 0.80 -0.90 3.45 4.20 -0.70 -0.82 115.11 122.30 2cwc h GLN 61 Ca 0.31 -0.14 0.03 0.00 0.06 0.00 0.00 58.65 58.91 2cwc h GLN 61 Cb -0.11 -0.13 -0.05 0.00 0.30 0.00 0.00 27.48 27.49 2cwc h GLN 61 CO -0.06 0.69 0.59 0.00 -0.67 0.00 0.00 178.83 179.38 2cwc h ALA 62 N 1.07 1.42 -0.47 3.87 0.00 -0.85 0.11 119.26 124.41 2cwc h ALA 62 Ca 0.18 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 2cwc h ALA 62 Cb 0.19 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2cwc h ALA 62 CO -0.02 0.49 -0.16 -0.07 0.00 0.00 0.00 179.25 179.50 2cwc h LEU 63 N 1.14 0.95 -0.70 0.00 3.38 -0.68 -0.95 115.31 118.44 2cwc h LEU 63 Ca 0.36 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2cwc h LEU 63 Cb 0.01 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 2cwc h LEU 63 CO -0.11 1.11 0.25 0.00 0.09 0.00 0.00 178.44 179.78 2cwc h LEU 65 N 1.02 0.60 -0.32 0.00 5.85 -0.65 -0.71 115.31 121.10 2cwc h LEU 65 Ca 0.23 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.85 2cwc h LEU 65 Cb 0.26 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 2cwc h LEU 65 CO -0.01 0.58 0.09 0.00 -0.34 0.00 0.00 178.44 178.75 2cwc h ALA 66 N 1.04 0.35 -0.72 1.25 0.00 -0.82 -0.19 119.26 120.17 2cwc h ALA 66 Ca 0.15 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2cwc h ALA 66 Cb 0.15 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2cwc h ALA 66 CO -0.02 -0.32 0.26 0.93 0.00 0.00 0.00 179.25 180.11 2cwc h GLU 67 N 0.21 1.08 -0.35 0.00 5.08 -1.05 -1.90 114.58 117.64 2cwc h GLU 67 Ca 0.15 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2cwc h GLU 67 Cb 0.14 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2cwc h GLU 67 CO -0.17 0.90 0.18 1.03 -1.00 0.00 0.00 179.01 179.94 2cwc h SER 68 N 1.05 0.45 -0.49 1.42 0.87 -0.42 -1.74 113.55 114.69 2cwc h SER 68 Ca 0.24 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 2cwc h SER 68 Cb 0.24 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 2cwc h SER 68 CO -0.02 0.43 0.28 -0.07 -0.53 0.00 0.00 176.83 176.92 2cwc h LEU 69 N 0.44 0.60 -0.99 2.23 3.38 -0.75 -0.73 115.31 119.48 2cwc h LEU 69 Ca 0.12 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 2cwc h LEU 69 Cb 0.08 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2cwc h LEU 69 CO -0.02 0.49 -0.19 -0.07 0.09 0.00 0.00 178.44 178.74 2cwc h LEU 70 N 0.65 0.50 0.20 1.67 3.38 -1.23 -1.26 115.31 119.21 2cwc h LEU 70 Ca 0.17 -0.15 -0.29 0.00 0.09 0.00 0.00 57.88 57.71 2cwc h LEU 70 Cb 0.02 -0.13 0.03 0.00 0.09 0.00 0.00 40.66 40.66 2cwc h LEU 70 CO -0.03 0.70 -1.30 -0.61 0.09 0.00 0.00 178.44 177.29 2cwc h GLN 71 N 0.46 0.42 -0.16 1.13 4.15 -1.09 -3.42 115.11 116.60 2cwc h GLN 71 Ca 0.07 -0.72 -0.20 0.00 0.77 0.00 0.00 58.65 58.57 2cwc h GLN 71 Cb 0.59 0.27 -0.38 0.00 0.21 0.00 0.00 27.48 28.18 2cwc h GLN 71 CO 0.04 1.35 -1.02 2.89 -1.93 0.00 0.00 178.83 180.16 2cwc n ARG 72 N -3.85 0.66 0.00 1.69 1.85 -0.30 -5.10 116.66 111.60 2cwc n ARG 72 Ca -0.18 -2.49 0.00 0.00 -1.00 0.00 0.00 57.85 54.19 2cwc n ARG 72 Cb 1.00 -0.55 0.00 0.00 -1.05 0.00 0.00 32.46 31.85 2cwc n ARG 72 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2cwc n GLY 73 N 0.03 0.98 3.54 2.89 0.00 -0.48 -4.31 105.19 107.85 2cwc n GLY 73 Ca 0.04 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 2cwc n GLY 73 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2cwc s PHE 74 N 0.00 2.62 -0.36 1.61 5.36 -1.26 -3.97 117.98 121.97 2cwc s PHE 74 Ca 0.00 0.08 0.00 0.00 -0.96 0.00 0.00 56.93 56.06 2cwc s PHE 74 Cb 0.00 -4.36 0.14 0.00 -0.34 0.00 0.00 43.02 38.46 2cwc s PHE 74 CO 0.00 -1.60 0.22 0.34 -1.46 0.00 0.00 175.22 172.71 2cwc s ASP 75 N 3.14 2.96 0.45 6.13 3.68 -1.26 -5.00 116.67 126.76 2cwc s ASP 75 Ca 0.35 -2.26 0.19 0.00 2.13 0.00 0.00 52.55 52.95 2cwc s ASP 75 Cb -0.10 -0.45 1.15 0.00 -1.45 0.00 0.00 42.92 42.06 2cwc s ASP 75 CO 0.20 -0.30 1.93 -0.65 0.13 0.00 0.00 175.17 176.48 2cwc h PRO 76 N 6.93 0.30 -0.36 4.34 0.11 -1.97 -0.77 132.00 140.58 2cwc h PRO 76 Ca 0.06 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.10 2cwc h PRO 76 Cb 0.96 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.99 2cwc h PRO 76 CO 0.29 0.20 0.02 -0.22 -0.21 0.00 0.00 178.00 178.07 2cwc h LYS 77 N 0.31 0.63 -0.30 1.05 3.64 -1.94 -1.62 116.57 118.33 2cwc h LYS 77 Ca 0.36 -0.19 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 2cwc h LYS 77 Cb 0.95 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.69 2cwc h LYS 77 CO -0.09 0.72 -0.26 0.22 -2.27 0.00 0.00 179.45 177.77 2cwc h ASP 78 N 0.45 0.60 -0.40 4.20 1.82 -1.63 -1.05 116.42 120.41 2cwc h ASP 78 Ca 0.11 -0.22 0.01 0.00 -0.39 0.00 0.00 57.03 56.54 2cwc h ASP 78 Cb 0.43 -0.17 -0.02 0.00 0.68 0.00 0.00 39.33 40.25 2cwc h ASP 78 CO 0.01 0.84 0.25 1.56 -1.61 0.00 0.00 179.24 180.30 2cwc h GLN 79 N 0.52 0.50 -0.14 0.28 4.20 -0.96 -1.58 115.11 117.92 2cwc h GLN 79 Ca 0.07 -0.03 -0.12 0.00 0.06 0.00 0.00 58.65 58.63 2cwc h GLN 79 Cb 0.72 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 2cwc h GLN 79 CO 0.06 0.33 -0.45 0.52 -0.67 0.00 0.00 178.83 178.61 2cwc h MET 80 N 0.51 0.35 -0.59 1.46 2.86 -1.08 -1.24 114.93 117.21 2cwc h MET 80 Ca 0.15 -0.19 0.01 0.00 -2.06 0.00 0.00 59.70 57.62 2cwc h MET 80 Cb -0.02 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 2cwc h MET 80 CO -0.05 0.74 0.39 -0.44 1.06 0.00 0.00 176.91 178.60 2cwc h ASP 81 N 0.29 0.67 -0.30 1.22 3.32 -0.72 0.75 116.42 121.64 2cwc h ASP 81 Ca 0.02 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 2cwc h ASP 81 Cb 0.91 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 2cwc h ASP 81 CO 0.08 0.48 -0.07 0.03 -1.72 0.00 0.00 179.24 178.04 2cwc h ARG 82 N 0.79 0.57 -0.49 3.56 3.08 -1.06 -0.76 114.38 120.07 2cwc h ARG 82 Ca 0.22 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2cwc h ARG 82 Cb -0.08 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 2cwc h ARG 82 CO -0.05 0.76 0.29 1.88 -1.07 0.00 0.00 179.97 181.78 2cwc h TYR 83 N 0.34 0.65 -0.51 3.04 0.05 -0.94 -0.62 116.97 118.96 2cwc h TYR 83 Ca 0.08 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 2cwc h TYR 83 Cb 0.55 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 38.05 2cwc h TYR 83 CO 0.05 0.45 0.25 1.25 -1.05 0.00 0.00 178.16 179.11 2cwc h LEU 84 N 0.65 0.67 -0.73 3.88 5.85 -0.78 0.35 115.31 125.20 2cwc h LEU 84 Ca 0.18 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 2cwc h LEU 84 Cb -0.01 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 2cwc h LEU 84 CO -0.03 0.60 0.27 -0.09 -0.34 0.00 0.00 178.44 178.84 2cwc h ARG 85 N 0.68 1.11 -0.28 1.25 2.43 -0.89 -0.79 114.38 117.89 2cwc h ARG 85 Ca 0.18 -0.22 -0.14 0.00 -0.81 0.00 0.00 59.98 58.99 2cwc h ARG 85 Cb 0.10 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2cwc h ARG 85 CO -0.02 0.93 -0.39 2.35 -1.51 0.00 0.00 179.97 181.32 2cwc h TRP 86 N 1.06 0.78 -0.15 2.20 2.91 -0.78 -2.41 115.95 119.58 2cwc h TRP 86 Ca 0.24 -0.23 -0.01 0.00 1.13 0.00 0.00 58.89 60.03 2cwc h TRP 86 Cb 0.25 -0.17 -0.01 0.00 -0.51 0.00 0.00 29.16 28.73 2cwc h TRP 86 CO 0.02 0.95 0.06 -0.92 -1.03 0.00 0.00 178.44 177.52 2cwc h TYR 87 N 0.54 0.22 0.00 2.65 3.20 0.15 -2.98 116.97 120.74 2cwc h TYR 87 Ca 0.05 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 2cwc h TYR 87 Cb 0.91 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.11 2cwc h TYR 87 CO 0.04 0.28 -0.36 0.00 -1.64 0.00 0.00 178.16 176.48 2cwc h ARG 88 N 0.09 0.00 0.00 1.82 3.08 -1.15 -2.48 114.38 115.74 2cwc h ARG 88 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2cwc h ARG 88 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 2cwc h ARG 88 CO -0.00 0.36 0.00 0.39 -1.07 0.00 0.00 179.97 179.64 2cwc n GLU 89 N -3.72 0.61 -3.98 0.04 1.02 -0.91 -4.78 120.64 108.93 2cwc n GLU 89 Ca -0.01 0.02 -0.27 0.00 -0.02 0.00 0.00 57.16 56.88 2cwc n GLU 89 Cb 0.45 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.36 2cwc n GLU 89 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2cwc s GLY 90 N -2.20 2.45 -0.41 0.62 0.00 -0.94 -5.08 107.32 101.77 2cwc s GLY 90 Ca 0.31 -1.09 0.06 0.00 0.00 0.00 0.00 44.72 44.01 2cwc s GLY 90 CO 0.31 -1.98 0.44 -1.72 0.00 0.00 0.00 173.10 170.15 2cwc n TYR 91 N -1.75 -0.83 0.00 1.90 4.02 -1.26 -5.03 117.16 114.21 2cwc n TYR 91 Ca -0.04 -3.33 0.00 0.00 -0.01 0.00 0.00 57.90 54.52 2cwc n TYR 91 Cb 0.65 0.06 0.00 0.00 -0.02 0.00 0.00 39.34 40.03 2cwc n TYR 91 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2cwc n ALA 104 N 2.19 0.00 0.10 -0.72 0.00 -1.26 -5.18 120.51 115.65 2cwc n ALA 104 Ca 0.25 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.51 2cwc n ALA 104 Cb 0.51 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.84 2cwc n ALA 104 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2cwc h THR 105 N 0.00 1.39 -0.08 0.00 2.02 -1.99 -2.52 112.91 111.73 2cwc h THR 105 Ca 0.00 -2.74 -0.09 0.00 0.77 0.00 0.00 66.41 64.35 2cwc h THR 105 Cb 0.00 2.80 -0.01 0.00 -1.74 0.00 0.00 68.15 69.20 2cwc h THR 105 CO 0.00 0.81 -0.35 0.08 0.37 0.00 0.00 175.52 176.43 2cwc h ARG 106 N 0.16 0.16 -0.53 6.66 0.11 -1.98 0.32 114.38 119.28 2cwc h ARG 106 Ca -0.16 -0.06 -0.12 0.00 0.10 0.00 0.00 59.98 59.74 2cwc h ARG 106 Cb 1.92 -0.01 -0.02 0.00 1.11 0.00 0.00 29.97 32.97 2cwc h ARG 106 CO 0.22 0.50 -0.13 -0.09 0.10 0.00 0.00 179.97 180.56 2cwc h ARG 107 N 0.14 1.02 -0.52 0.08 2.43 -1.97 0.01 114.38 115.56 2cwc h ARG 107 Ca 0.02 -0.40 -0.05 0.00 -0.81 0.00 0.00 59.98 58.74 2cwc h ARG 107 Cb 0.69 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 2cwc h ARG 107 CO 0.05 1.08 0.13 0.00 -1.51 0.00 0.00 179.97 179.73 2cwc h ALA 108 N 0.91 0.69 -0.65 2.80 0.00 -0.92 0.52 119.26 122.61 2cwc h ALA 108 Ca 0.13 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2cwc h ALA 108 Cb 0.71 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 2cwc h ALA 108 CO 0.05 0.38 0.15 -0.07 0.00 0.00 0.00 179.25 179.77 2cwc h LEU 109 N 0.73 1.00 -0.90 0.00 3.38 -0.68 -0.37 115.31 118.46 2cwc h LEU 109 Ca 0.16 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 2cwc h LEU 109 Cb 0.33 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2cwc h LEU 109 CO 0.00 0.98 -0.55 -0.33 0.09 0.00 0.00 178.44 178.63 2cwc h GLU 110 N 0.97 0.00 -0.31 1.13 4.39 -0.79 -0.46 114.58 119.50 2cwc h GLU 110 Ca 0.20 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.83 2cwc h GLU 110 Cb 0.37 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2cwc h GLU 110 CO 0.00 0.55 -0.11 -0.09 -1.16 0.00 0.00 179.01 178.21 2cwc h ARG 111 N 0.00 0.62 -0.56 2.33 2.43 -0.47 -2.19 114.38 116.54 2cwc h ARG 111 Ca -0.01 -0.25 -0.05 0.00 -0.81 0.00 0.00 59.98 58.87 2cwc h ARG 111 Cb 0.98 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 2cwc h ARG 111 CO 0.07 0.83 0.17 -0.92 -1.51 0.00 0.00 179.97 178.61 2cwc h TYR 112 N 0.39 0.91 -0.51 2.20 3.20 -0.83 -0.53 116.97 121.80 2cwc h TYR 112 Ca 0.07 -0.09 0.01 0.00 3.14 0.00 0.00 58.73 61.86 2cwc h TYR 112 Cb 0.62 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 2cwc h TYR 112 CO 0.06 0.76 0.34 0.00 -1.64 0.00 0.00 178.16 177.68 2cwc h ALA 113 N 1.04 1.66 0.07 1.82 0.00 -0.96 0.87 119.26 123.77 2cwc h ALA 113 Ca 0.18 -0.03 -0.30 0.00 0.00 0.00 0.00 54.91 54.75 2cwc h ALA 113 Cb 0.29 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2cwc h ALA 113 CO -0.01 0.30 -1.63 0.00 0.00 0.00 0.00 179.25 177.92 2cwc h ALA 114 N 1.69 0.47 0.00 0.00 0.00 -1.11 -3.41 119.26 116.90 2cwc h ALA 114 Ca 0.19 -1.26 -0.06 0.00 0.00 0.00 0.00 54.91 53.79 2cwc h ALA 114 Cb -0.04 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2cwc h ALA 114 CO -0.04 1.32 -1.70 0.25 0.00 0.00 0.00 179.25 179.08 2cwc n THR 115 N -3.32 0.21 -0.54 0.00 -2.24 -0.23 -5.00 114.28 103.15 2cwc n THR 115 Ca -0.18 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.22 2cwc n THR 115 Cb 1.04 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 2cwc n THR 115 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cwc n GLY 116 N 1.82 1.13 3.61 3.38 0.00 0.29 -5.01 105.19 110.42 2cwc n GLY 116 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 2cwc n GLY 116 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cwc s ASP 117 N -3.09 6.64 0.40 1.61 2.15 -1.26 -4.92 116.67 118.21 2cwc s ASP 117 Ca 0.00 0.59 0.10 0.00 0.43 0.00 0.00 52.55 53.66 2cwc s ASP 117 Cb 0.00 -2.55 0.83 0.00 -0.30 0.00 0.00 42.92 40.90 2cwc s ASP 117 CO 0.00 -1.22 1.95 1.55 -0.17 0.00 0.00 175.17 177.28 2cwc h PRO 118 N 9.22 0.27 -3.22 4.34 0.13 -1.92 -3.22 132.00 137.61 2cwc h PRO 118 Ca -0.23 -0.05 -0.75 0.00 -0.87 0.00 0.00 66.00 64.10 2cwc h PRO 118 Cb 1.06 -0.04 -0.14 0.00 0.13 0.00 0.00 31.00 32.01 2cwc h PRO 118 CO 1.11 0.35 2.19 0.66 -0.23 0.00 0.00 178.00 182.08 2cwc n TYR 119 N -4.33 2.81 1.42 1.56 4.01 -1.26 -4.31 117.16 117.06 2cwc n TYR 119 Ca -0.00 -2.80 0.03 0.00 -0.16 0.00 0.00 57.90 54.96 2cwc n TYR 119 Cb 0.22 -1.92 0.08 0.00 -0.31 0.00 0.00 39.34 37.41 2cwc n TYR 119 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2cwc n ALA 120 N 3.21 2.48 -1.81 -0.72 0.00 -1.15 -4.83 120.51 117.69 2cwc n ALA 120 Ca 0.47 -0.31 -0.34 0.00 0.00 0.00 0.00 53.44 53.27 2cwc n ALA 120 Cb 0.32 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.73 2cwc n ALA 120 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2cwc s GLY 121 N -0.98 2.47 0.34 0.00 0.00 -0.57 -4.50 107.32 104.08 2cwc s GLY 121 Ca 0.12 0.48 0.09 0.00 0.00 0.00 0.00 44.72 45.41 2cwc s GLY 121 CO 0.08 0.79 0.08 0.51 0.00 0.00 0.00 173.10 174.56 2cwc s ASP 122 N -2.06 4.44 0.44 1.64 1.47 -1.26 -4.31 116.67 117.02 2cwc s ASP 122 Ca 0.63 -0.88 0.28 0.00 1.18 0.00 0.00 52.55 53.75 2cwc s ASP 122 Cb -0.12 -0.63 1.50 0.00 -0.34 0.00 0.00 42.92 43.33 2cwc s ASP 122 CO 0.16 -0.27 1.84 -0.33 0.68 0.00 0.00 175.17 177.25 2cwc h GLU 123 N 1.67 0.00 -0.00 2.11 5.08 -1.96 0.65 114.58 122.13 2cwc h GLU 123 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2cwc h GLU 123 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2cwc h GLU 123 CO 0.65 0.00 -0.22 0.00 -1.00 0.00 0.00 179.01 178.44 2cwc n ALA 124 N -1.85 2.93 -2.80 3.43 0.00 -1.26 -4.00 120.51 116.97 2cwc n ALA 124 Ca -0.02 -0.25 -0.43 0.00 0.00 0.00 0.00 53.44 52.74 2cwc n ALA 124 Cb 0.09 -1.29 -0.02 0.00 0.00 0.00 0.00 19.45 18.23 2cwc n ALA 124 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2cwc s GLY 125 N -2.82 1.83 0.00 0.00 0.00 0.07 -4.69 107.32 101.70 2cwc s GLY 125 Ca 0.18 -2.78 0.13 0.00 0.00 0.00 0.00 44.72 42.24 2cwc s GLY 125 CO 0.57 2.28 1.30 0.00 0.00 0.00 0.00 173.10 177.25 2cwc n ALA 126 N 7.17 2.22 -0.76 3.20 0.00 -1.26 -1.89 120.51 129.19 2cwc n ALA 126 Ca 0.32 -1.17 -0.29 0.00 0.00 0.00 0.00 53.44 52.31 2cwc n ALA 126 Cb 0.48 -0.53 0.24 0.00 0.00 0.00 0.00 19.45 19.64 2cwc n ALA 126 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2cwc s GLY 127 N -1.00 1.53 0.00 0.00 0.00 -1.26 -1.45 107.32 105.14 2cwc s GLY 127 Ca 0.28 -0.40 0.20 0.00 0.00 0.00 0.00 44.72 44.80 2cwc s GLY 127 CO 0.19 0.36 1.58 1.16 0.00 0.00 0.00 173.10 176.38 2cwc n ASN 128 N -4.82 1.29 -0.27 1.64 0.23 -0.59 -4.11 115.26 108.63 2cwc n ASN 128 Ca 0.06 -1.65 0.09 0.00 -0.53 0.00 0.00 54.58 52.54 2cwc n ASN 128 Cb 0.57 -0.08 0.23 0.00 -2.08 0.00 0.00 39.78 38.41 2cwc n ASN 128 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2cwc h GLY 129 N 5.11 1.17 2.00 4.83 0.00 -1.92 -1.32 103.07 112.94 2cwc h GLY 129 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 2cwc h GLY 129 CO 0.00 -0.26 -0.07 -2.55 0.00 0.00 0.00 176.54 173.66 2cwc h PRO 130 N 0.26 0.00 0.00 4.80 0.11 -1.90 -2.10 132.00 133.17 2cwc h PRO 130 Ca 0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 2cwc h PRO 130 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2cwc h PRO 130 CO -0.56 0.07 0.00 -0.07 -0.21 0.00 0.00 178.00 177.22 2cwc h LEU 131 N 0.00 0.00 -0.75 2.35 3.38 -1.58 -2.98 115.31 115.74 2cwc h LEU 131 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2cwc h LEU 131 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2cwc h LEU 131 CO 0.01 0.00 0.00 0.24 0.09 0.00 0.00 178.44 178.78 2cwc h MET 132 N 0.00 0.00 -0.38 1.13 2.86 -1.42 -3.30 114.93 113.82 2cwc h MET 132 Ca 0.00 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.35 2cwc h MET 132 Cb 0.52 0.00 -0.33 0.00 0.06 0.00 0.00 31.60 31.85 2cwc h MET 132 CO 0.00 0.00 -0.88 2.89 1.06 0.00 0.00 176.91 179.98 2cwc n ARG 133 N -2.45 2.07 -0.04 1.72 1.85 -1.12 -4.70 116.66 113.99 2cwc n ARG 133 Ca 0.02 -3.45 -0.12 0.00 -1.00 0.00 0.00 57.85 53.31 2cwc n ARG 133 Cb 0.28 -1.58 -0.10 0.00 -1.05 0.00 0.00 32.46 30.01 2cwc n ARG 133 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 2cwc h LEU 134 N 1.86 -0.03 -0.97 2.89 -0.00 -1.69 -3.39 115.31 113.98 2cwc h LEU 134 Ca 0.05 -0.68 0.16 0.00 -0.00 0.00 0.00 57.88 57.40 2cwc h LEU 134 Cb 1.41 0.01 -0.16 0.00 -0.00 0.00 0.00 40.66 41.92 2cwc h LEU 134 CO 0.33 0.74 -0.36 0.00 -0.00 0.00 0.00 178.44 179.16 2cwc n ALA 135 N -2.57 -0.07 -0.18 1.53 0.00 -1.26 -1.05 120.51 116.91 2cwc n ALA 135 Ca -0.08 0.98 -0.01 0.00 0.00 0.00 0.00 53.44 54.33 2cwc n ALA 135 Cb 0.35 -0.46 0.09 0.00 0.00 0.00 0.00 19.45 19.42 2cwc n ALA 135 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2cwc h PRO 136 N 0.00 0.27 -0.23 0.00 0.11 -1.89 0.42 132.00 130.67 2cwc h PRO 136 Ca 0.36 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.44 2cwc h PRO 136 Cb 0.60 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 2cwc h PRO 136 CO -0.97 0.18 0.09 1.25 -0.21 0.00 0.00 178.00 178.34 2cwc h LEU 137 N 0.28 0.33 -0.79 2.35 5.85 -1.28 -2.77 115.31 119.27 2cwc h LEU 137 Ca 0.28 -0.17 -0.10 0.00 0.84 0.00 0.00 57.88 58.72 2cwc h LEU 137 Cb 0.38 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2cwc h LEU 137 CO -0.34 0.41 -0.20 0.58 -0.34 0.00 0.00 178.44 178.55 2cwc h VAL 138 N 0.22 1.27 -0.91 1.05 2.07 -1.02 0.94 116.25 119.86 2cwc h VAL 138 Ca 0.08 -1.27 0.03 0.00 0.82 0.00 0.00 66.70 66.35 2cwc h VAL 138 Cb 0.19 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 2cwc h VAL 138 CO -0.01 0.42 0.60 -0.07 0.02 0.00 0.00 177.57 178.53 2cwc h LEU 139 N 0.62 1.01 0.02 2.57 4.07 -0.82 0.38 115.31 123.16 2cwc h LEU 139 Ca 0.09 -0.01 -0.27 0.00 0.08 0.00 0.00 57.88 57.77 2cwc h LEU 139 Cb 0.68 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 42.14 2cwc h LEU 139 CO 0.05 0.71 -1.47 0.00 -1.08 0.00 0.00 178.44 176.65 2cwc h ALA 140 N 1.36 0.56 -0.13 1.53 0.00 -1.28 -3.37 119.26 117.94 2cwc h ALA 140 Ca 0.35 -1.24 -0.05 0.00 0.00 0.00 0.00 54.91 53.98 2cwc h ALA 140 Cb -0.05 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2cwc h ALA 140 CO -0.10 1.41 -0.17 0.66 0.00 0.00 0.00 179.25 181.05 2cwc n TYR 141 N -3.21 0.43 -0.27 0.00 4.01 0.31 -3.65 117.16 114.77 2cwc n TYR 141 Ca -0.12 -1.29 0.08 0.00 -0.16 0.00 0.00 57.90 56.41 2cwc n TYR 141 Cb 1.01 -0.29 0.20 0.00 -0.31 0.00 0.00 39.34 39.95 2cwc n TYR 141 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 2cwc h GLU 142 N 0.84 0.15 -0.07 -0.72 4.81 -1.11 -1.37 114.58 117.12 2cwc h GLU 142 Ca 0.06 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2cwc h GLU 142 Cb 1.24 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.59 2cwc h GLU 142 CO 0.14 0.10 0.00 0.09 -0.73 0.00 0.00 179.01 178.60 2cwc n ASN 143 N -5.29 1.82 -4.73 1.04 3.02 -1.26 -4.92 115.26 104.94 2cwc n ASN 143 Ca 0.16 -1.64 -0.42 0.00 -0.03 0.00 0.00 54.58 52.66 2cwc n ASN 143 Cb 0.54 -0.04 -0.03 0.00 -0.61 0.00 0.00 39.78 39.65 2cwc n ASN 143 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2cwc s HIS 144 N -1.93 3.27 0.52 3.10 2.46 -0.52 -4.91 115.29 117.29 2cwc s HIS 144 Ca 0.35 1.14 0.29 0.00 0.47 0.00 0.00 55.06 57.32 2cwc s HIS 144 Cb 0.20 -3.61 1.70 0.00 -0.13 0.00 0.00 32.58 30.73 2cwc s HIS 144 CO 0.31 -1.99 2.19 -1.00 -2.47 0.00 0.00 174.74 171.78 2cwc h PRO 145 N 5.94 0.00 -0.72 2.88 0.13 -1.91 -2.45 132.00 135.87 2cwc h PRO 145 Ca -0.44 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.34 2cwc h PRO 145 Cb 1.21 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.13 2cwc h PRO 145 CO 0.80 0.05 0.34 -0.25 -0.23 0.00 0.00 178.00 178.71 2cwc n ASP 146 N -3.75 3.36 -0.14 1.44 8.00 -1.26 -4.74 116.55 119.45 2cwc n ASP 146 Ca -0.03 -3.63 -0.04 0.00 0.71 0.00 0.00 54.79 51.80 2cwc n ASP 146 Cb 0.14 -0.75 0.03 0.00 -0.02 0.00 0.00 41.12 40.52 2cwc n ASP 146 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2cwc h LEU 147 N 1.15 -0.54 -1.21 0.64 5.85 -1.72 0.18 115.31 119.66 2cwc h LEU 147 Ca 0.44 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 59.31 2cwc h LEU 147 Cb 2.35 0.33 -0.04 0.00 0.37 0.00 0.00 40.66 43.68 2cwc h LEU 147 CO 0.79 -0.19 0.43 -0.07 -0.34 0.00 0.00 178.44 179.07 2cwc h LEU 148 N -0.05 0.85 -0.63 2.25 3.38 -1.87 0.41 115.31 119.66 2cwc h LEU 148 Ca 0.22 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 2cwc h LEU 148 Cb 0.39 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2cwc h LEU 148 CO -0.50 0.66 0.01 -1.28 0.09 0.00 0.00 178.44 177.41 2cwc h SER 149 N 0.98 1.06 -0.65 -0.43 0.87 -1.59 -1.32 113.55 112.47 2cwc h SER 149 Ca 0.26 -0.30 -0.08 0.00 -1.23 0.00 0.00 61.79 60.44 2cwc h SER 149 Cb -0.04 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.61 2cwc h SER 149 CO -0.05 1.10 0.09 -0.07 -0.53 0.00 0.00 176.83 177.37 2cwc h LEU 150 N 0.99 1.06 -0.80 2.23 3.38 -0.18 -1.57 115.31 120.41 2cwc h LEU 150 Ca 0.18 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2cwc h LEU 150 Cb 0.56 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2cwc h LEU 150 CO 0.03 1.06 0.38 0.00 0.09 0.00 0.00 178.44 180.00 2cwc h ALA 151 N 1.06 1.03 -0.44 1.53 0.00 -0.62 -0.22 119.26 121.60 2cwc h ALA 151 Ca 0.20 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2cwc h ALA 151 Cb 0.46 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2cwc h ALA 151 CO 0.02 0.60 0.13 -0.09 0.00 0.00 0.00 179.25 179.91 2cwc h ARG 152 N 1.13 0.70 -0.66 0.00 2.43 -0.90 -1.27 114.38 115.81 2cwc h ARG 152 Ca 0.27 -0.16 -0.03 0.00 -0.81 0.00 0.00 59.98 59.26 2cwc h ARG 152 Cb 0.13 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 2cwc h ARG 152 CO -0.03 0.68 0.29 0.00 -1.51 0.00 0.00 179.97 179.40 2cwc h ARG 153 N 0.58 0.97 -0.54 0.20 3.08 -0.91 -0.79 114.38 116.97 2cwc h ARG 153 Ca 0.14 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 2cwc h ARG 153 Cb 0.28 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 2cwc h ARG 153 CO -0.00 0.79 0.18 0.00 -1.07 0.00 0.00 179.97 179.87 2cwc h ALA 154 N 1.13 1.31 -0.42 0.04 0.00 -0.81 -2.42 119.26 118.10 2cwc h ALA 154 Ca 0.22 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 2cwc h ALA 154 Cb 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2cwc h ALA 154 CO -0.02 0.50 -0.25 0.00 0.00 0.00 0.00 179.25 179.48 2cwc h ALA 155 N 1.42 0.59 0.00 0.00 0.00 -0.76 -3.14 119.26 117.38 2cwc h ALA 155 Ca 0.18 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2cwc h ALA 155 Cb 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2cwc h ALA 155 CO -0.01 0.60 0.02 0.00 0.00 0.00 0.00 179.25 179.86 2cwc h ARG 156 N 0.73 0.00 -0.07 0.00 3.08 -0.64 -0.71 114.38 116.78 2cwc h ARG 156 Ca 0.09 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 2cwc h ARG 156 Cb 0.82 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 2cwc h ARG 156 CO 0.07 0.00 -0.16 1.79 -1.07 0.00 0.00 179.97 180.60 2cwc h THR 157 N 0.00 1.15 0.00 2.04 1.35 -1.48 -1.50 112.91 114.47 2cwc h THR 157 Ca 0.00 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 65.17 2cwc h THR 157 Cb 0.04 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 2cwc h THR 157 CO 0.00 0.21 -0.67 0.35 -0.25 0.00 0.00 175.52 175.16 2cwc n THR 158 N -4.30 0.00 -4.30 6.82 -2.24 -0.82 -2.95 114.28 106.49 2cwc n THR 158 Ca -0.02 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.56 2cwc n THR 158 Cb 0.25 0.24 -0.16 0.00 -2.10 0.00 0.00 70.33 68.56 2cwc n THR 158 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2cwc s HIS 159 N -1.37 0.87 -0.49 4.78 3.76 -0.33 -4.39 115.29 118.12 2cwc s HIS 159 Ca 0.00 -0.24 0.05 0.00 -0.15 0.00 0.00 55.06 54.72 2cwc s HIS 159 Cb 0.00 -0.67 0.01 0.00 1.11 0.00 0.00 32.58 33.02 2cwc s HIS 159 CO 0.00 -0.14 0.48 0.41 -0.85 0.00 0.00 174.74 174.64 2cwc n GLY 160 N 3.61 -0.35 3.76 -2.22 0.00 -0.30 -3.49 105.19 106.21 2cwc n GLY 160 Ca -0.21 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 2cwc n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cwc s ALA 161 N -0.84 3.50 0.20 4.61 0.00 -0.79 -4.46 121.76 123.98 2cwc s ALA 161 Ca 0.04 1.22 -0.17 0.00 0.00 0.00 0.00 51.96 53.06 2cwc s ALA 161 Cb 0.04 -3.47 0.19 0.00 0.00 0.00 0.00 23.12 19.87 2cwc s ALA 161 CO 0.12 -0.60 1.61 -0.09 0.00 0.00 0.00 175.76 176.80 2cwc h ARG 162 N 3.79 -0.08 0.00 0.00 2.43 -1.89 -0.97 114.38 117.65 2cwc h ARG 162 Ca -0.48 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 58.65 2cwc h ARG 162 Cb 1.22 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.79 2cwc h ARG 162 CO 0.68 -0.05 -0.20 1.05 -1.51 0.00 0.00 179.97 179.93 2cwc h GLU 163 N -0.08 0.00 -0.04 0.20 9.09 -1.94 -0.55 114.58 121.25 2cwc h GLU 163 Ca 0.27 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.43 2cwc h GLU 163 Cb 0.51 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.63 2cwc h GLU 163 CO -0.66 0.20 -0.97 0.00 0.05 0.00 0.00 179.01 177.64 2cwc h ALA 164 N 1.80 0.18 -0.38 1.06 0.00 -1.48 -1.10 119.26 119.33 2cwc h ALA 164 Ca -0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 54.91 54.19 2cwc h ALA 164 Cb 0.41 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2cwc h ALA 164 CO 0.03 0.68 0.05 -0.07 0.00 0.00 0.00 179.25 179.93 2cwc h LEU 165 N 0.43 0.62 -0.63 0.00 3.38 -0.93 -1.89 115.31 116.29 2cwc h LEU 165 Ca -0.11 -0.27 -0.13 0.00 0.09 0.00 0.00 57.88 57.46 2cwc h LEU 165 Cb 1.62 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.19 2cwc h LEU 165 CO 0.19 0.73 -0.29 -0.33 0.09 0.00 0.00 178.44 178.83 2cwc h GLU 166 N 0.47 0.76 -0.45 1.13 5.08 -1.15 -2.20 114.58 118.22 2cwc h GLU 166 Ca 0.11 -0.34 -0.04 0.00 -1.00 0.00 0.00 59.36 58.09 2cwc h GLU 166 Cb 0.39 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 2cwc h GLU 166 CO 0.01 0.96 0.11 0.00 -1.00 0.00 0.00 179.01 179.09 2cwc h ALA 167 N 1.02 1.35 -0.56 3.43 0.00 -1.08 -0.81 119.26 122.61 2cwc h ALA 167 Ca 0.08 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2cwc h ALA 167 Cb 0.82 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2cwc h ALA 167 CO 0.07 0.46 -0.05 1.15 0.00 0.00 0.00 179.25 180.88 2cwc h THR 168 N 0.66 1.26 -0.63 0.00 2.02 -1.04 -1.31 112.91 113.88 2cwc h THR 168 Ca 0.15 -1.20 -0.09 0.00 0.77 0.00 0.00 66.41 66.05 2cwc h THR 168 Cb 0.24 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 2cwc h THR 168 CO -0.00 0.43 0.05 -0.33 0.37 0.00 0.00 175.52 176.04 2cwc h GLU 169 N 0.91 1.07 -0.56 6.66 5.08 -0.75 -0.48 114.58 126.51 2cwc h GLU 169 Ca 0.15 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.16 2cwc h GLU 169 Cb 0.60 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 2cwc h GLU 169 CO 0.04 1.02 0.18 0.28 -1.00 0.00 0.00 179.01 179.53 2cwc h VAL 170 N 0.98 1.24 -0.32 3.13 2.07 -0.94 -1.56 116.25 120.85 2cwc h VAL 170 Ca 0.18 -0.79 -0.10 0.00 0.82 0.00 0.00 66.70 66.81 2cwc h VAL 170 Cb 0.50 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2cwc h VAL 170 CO 0.02 0.30 -0.21 0.25 0.02 0.00 0.00 177.57 177.95 2cwc h LEU 171 N 0.79 0.61 -0.49 2.57 5.85 -1.02 -0.35 115.31 123.27 2cwc h LEU 171 Ca 0.18 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.71 2cwc h LEU 171 Cb 0.27 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 2cwc h LEU 171 CO -0.01 0.82 0.32 0.00 -0.34 0.00 0.00 178.44 179.23 2cwc h ALA 172 N 1.23 0.62 -0.21 1.25 0.00 -0.70 0.47 119.26 121.92 2cwc h ALA 172 Ca 0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2cwc h ALA 172 Cb 0.66 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2cwc h ALA 172 CO 0.05 0.06 0.10 2.35 0.00 0.00 0.00 179.25 181.81 2cwc h TRP 173 N 0.65 0.30 -0.50 0.00 7.01 -0.90 -1.41 115.95 121.10 2cwc h TRP 173 Ca 0.18 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.23 2cwc h TRP 173 Cb -0.06 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 26.85 2cwc h TRP 173 CO -0.04 0.30 0.21 -0.07 -2.79 0.00 0.00 178.44 176.05 2cwc h LEU 174 N 0.21 0.25 -0.49 0.65 3.38 -0.59 -0.88 115.31 117.84 2cwc h LEU 174 Ca 0.07 0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 2cwc h LEU 174 Cb 0.11 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2cwc h LEU 174 CO -0.01 0.17 -0.09 -0.07 0.09 0.00 0.00 178.44 178.53 2cwc h LEU 175 N 0.41 0.93 -0.31 1.67 3.38 -0.76 -0.64 115.31 119.99 2cwc h LEU 175 Ca 0.23 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2cwc h LEU 175 Cb 0.21 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2cwc h LEU 175 CO -0.21 1.07 0.17 -0.09 0.09 0.00 0.00 178.44 179.46 2cwc h ARG 176 N 0.79 0.43 -0.60 1.13 2.43 -0.88 -0.40 114.38 117.28 2cwc h ARG 176 Ca 0.13 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.18 2cwc h ARG 176 Cb 0.64 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 2cwc h ARG 176 CO 0.04 0.37 0.11 0.93 -1.51 0.00 0.00 179.97 179.91 2cwc h GLU 177 N 0.38 0.99 -0.57 0.20 4.39 -1.09 -2.22 114.58 116.66 2cwc h GLU 177 Ca 0.11 -0.26 -0.03 0.00 0.34 0.00 0.00 59.36 59.52 2cwc h GLU 177 Cb 0.06 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.57 2cwc h GLU 177 CO -0.02 0.93 0.25 0.00 -1.16 0.00 0.00 179.01 179.00 2cwc h ALA 178 N 1.02 0.74 0.00 3.43 0.00 -0.89 -1.26 119.26 122.31 2cwc h ALA 178 Ca 0.18 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2cwc h ALA 178 Cb 0.41 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2cwc h ALA 178 CO 0.01 0.34 -0.10 -0.07 0.00 0.00 0.00 179.25 179.42 2cwc h LEU 179 N 0.78 0.00 -0.92 0.00 3.38 -0.87 -1.33 115.31 116.36 2cwc h LEU 179 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2cwc h LEU 179 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2cwc h LEU 179 CO -0.02 0.10 0.00 0.54 0.09 0.00 0.00 178.44 179.15 2cwc n ARG 180 N -3.93 1.60 -0.59 1.13 1.74 -0.76 -4.92 116.66 110.94 2cwc n ARG 180 Ca -0.02 -0.90 0.00 0.00 -0.77 0.00 0.00 57.85 56.15 2cwc n ARG 180 Cb 0.19 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 2cwc n ARG 180 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cwc n GLY 181 N 1.07 0.68 3.78 -0.13 0.00 -0.50 -5.04 105.19 105.05 2cwc n GLY 181 Ca 0.16 -0.21 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 2cwc n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cwc s ALA 182 N -2.00 3.49 0.63 4.61 0.00 -0.55 -4.96 121.76 122.97 2cwc s ALA 182 Ca 0.00 1.53 -0.15 0.00 0.00 0.00 0.00 51.96 53.34 2cwc s ALA 182 Cb 0.00 -3.60 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 2cwc s ALA 182 CO 0.00 -1.07 1.08 -1.25 0.00 0.00 0.00 175.76 174.51 2cwc s PRO 183 N -2.17 3.08 0.28 0.00 0.04 -1.26 -4.74 135.00 130.23 2cwc s PRO 183 Ca 0.55 1.26 0.02 0.00 0.04 0.00 0.00 61.00 62.87 2cwc s PRO 183 Cb -0.45 -2.00 0.65 0.00 0.04 0.00 0.00 34.50 32.74 2cwc s PRO 183 CO 0.61 -1.01 1.75 -0.22 0.04 0.00 0.00 177.00 178.17 2cwc h LYS 184 N 0.19 0.59 -0.95 4.56 3.64 -2.00 -0.70 116.57 121.90 2cwc h LYS 184 Ca -0.47 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 58.93 2cwc h LYS 184 Cb 1.23 -0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 32.86 2cwc h LYS 184 CO 0.56 0.39 0.62 1.05 -2.27 0.00 0.00 179.45 179.79 2cwc h GLU 185 N 0.61 1.13 -0.34 1.90 9.09 -1.99 -1.30 114.58 123.68 2cwc h GLU 185 Ca 0.53 -0.07 -0.16 0.00 0.05 0.00 0.00 59.36 59.71 2cwc h GLU 185 Cb 0.84 -0.26 -0.01 0.00 -1.65 0.00 0.00 28.75 27.68 2cwc h GLU 185 CO -0.41 0.75 -0.43 0.00 0.05 0.00 0.00 179.01 178.97 2cwc h ALA 186 N 1.41 0.60 -0.19 1.06 0.00 -1.51 -1.95 119.26 118.67 2cwc h ALA 186 Ca 0.39 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2cwc h ALA 186 Cb 0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2cwc h ALA 186 CO -0.14 0.68 0.11 -0.07 0.00 0.00 0.00 179.25 179.82 2cwc h LEU 187 N 0.69 0.24 -1.31 0.00 3.38 -0.89 -2.68 115.31 114.75 2cwc h LEU 187 Ca 0.05 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2cwc h LEU 187 Cb 1.01 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 2cwc h LEU 187 CO 0.10 0.26 -0.20 -0.07 0.09 0.00 0.00 178.44 178.61 2cwc h LEU 188 N 0.21 0.00 -1.23 1.67 3.38 -1.24 -2.82 115.31 115.28 2cwc h LEU 188 Ca 0.07 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 2cwc h LEU 188 Cb 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2cwc h LEU 188 CO -0.01 0.20 -0.30 0.00 0.09 0.00 0.00 178.44 178.42 2cwc h ALA 189 N 1.80 1.13 -6.93 1.53 0.00 -1.01 -3.47 119.26 112.31 2cwc h ALA 189 Ca -0.00 -0.28 -0.58 0.00 0.00 0.00 0.00 54.91 54.05 2cwc h ALA 189 Cb 0.65 -0.05 -0.24 0.00 0.00 0.00 0.00 17.79 18.16 2cwc h ALA 189 CO 0.03 0.38 -0.90 1.28 0.00 0.00 0.00 179.25 180.04 2cwc n LEU 190 N -3.64 -1.34 -0.27 0.00 4.77 -1.07 -4.83 117.00 110.62 2cwc n LEU 190 Ca -0.01 -1.15 -0.02 0.00 -0.03 0.00 0.00 56.01 54.80 2cwc n LEU 190 Cb 0.42 -1.84 0.04 0.00 -2.33 0.00 0.00 43.42 39.72 2cwc n LEU 190 CO 0.35 0.30 0.64 -0.08 -1.33 0.00 0.00 177.39 177.27 2cwc h GLU 191 N -1.44 -0.07 0.00 3.23 4.81 -1.89 -1.20 114.58 118.02 2cwc h GLU 191 Ca -0.62 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.62 2cwc h GLU 191 Cb 1.39 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.78 2cwc h GLU 191 CO 0.77 -0.05 0.00 -1.00 -0.73 0.00 0.00 179.01 178.01 2cwc h PRO 192 N -0.07 0.00 -0.00 0.92 0.13 -1.97 -2.26 132.00 128.75 2cwc h PRO 192 Ca 0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.44 2cwc h PRO 192 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 2cwc h PRO 192 CO -0.81 0.00 -0.91 1.19 -0.23 0.00 0.00 178.00 177.24 2cwc n PHE 193 N -2.29 0.00 -2.15 1.56 3.72 -0.47 -4.72 117.46 113.11 2cwc n PHE 193 Ca -0.01 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 2cwc n PHE 193 Cb 0.07 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.58 2cwc n PHE 193 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2cwc s ARG 194 N -2.84 4.15 0.00 -1.08 1.81 -0.85 -1.86 118.95 118.27 2cwc s ARG 194 Ca 0.08 1.95 0.00 0.00 -1.72 0.00 0.00 55.73 56.04 2cwc s ARG 194 Cb 0.15 -3.92 0.00 0.00 -0.45 0.00 0.00 34.95 30.73 2cwc s ARG 194 CO 0.80 -0.86 0.00 0.41 -0.68 0.00 0.00 175.30 174.97 2cwc n GLY 195 N 4.04 1.06 3.80 -3.53 0.00 -1.26 -5.03 105.19 104.26 2cwc n GLY 195 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2cwc n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cwc s ALA 196 N -3.32 2.69 -1.00 4.61 0.00 -0.78 -4.94 121.76 119.03 2cwc s ALA 196 Ca 0.00 0.35 -0.22 0.00 0.00 0.00 0.00 51.96 52.08 2cwc s ALA 196 Cb 0.00 -3.23 0.07 0.00 0.00 0.00 0.00 23.12 19.96 2cwc s ALA 196 CO 0.00 -0.95 1.38 0.34 0.00 0.00 0.00 175.76 176.53 2cwc s ASP 197 N -2.97 6.52 0.35 0.00 2.15 -1.26 -4.96 116.67 116.50 2cwc s ASP 197 Ca 0.63 -1.56 0.09 0.00 0.43 0.00 0.00 52.55 52.14 2cwc s ASP 197 Cb -0.16 -2.53 -0.06 0.00 -0.30 0.00 0.00 42.92 39.86 2cwc s ASP 197 CO 0.41 -1.42 -0.06 -0.76 -0.17 0.00 0.00 175.17 173.17 2cwc s LEU 198 N 4.51 2.82 0.36 -1.34 1.43 -1.26 -5.10 118.68 120.10 2cwc s LEU 198 Ca 0.43 -1.14 -0.28 0.00 -1.03 0.00 0.00 54.13 52.11 2cwc s LEU 198 Cb -0.01 -1.11 -0.12 0.00 0.03 0.00 0.00 46.19 44.98 2cwc s LEU 198 CO -0.10 -0.22 1.39 1.57 0.23 0.00 0.00 176.35 179.22 2cwc n HIS 199 N -0.85 2.66 -0.32 0.29 -0.00 -1.26 -4.67 115.22 111.07 2cwc n HIS 199 Ca -0.05 0.50 0.17 0.00 -0.00 0.00 0.00 57.72 58.34 2cwc n HIS 199 Cb 0.63 -2.48 0.37 0.00 -0.00 0.00 0.00 29.99 28.51 2cwc n HIS 199 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2cwc h PRO 200 N 2.76 0.29 -0.57 1.57 0.11 -1.98 0.69 132.00 134.87 2cwc h PRO 200 Ca -0.49 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 2cwc h PRO 200 Cb 1.26 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2cwc h PRO 200 CO 0.63 0.19 -0.04 0.00 -0.21 0.00 0.00 178.00 178.57 2cwc h ALA 201 N 1.80 0.77 -0.06 -0.75 0.00 -2.00 -1.79 119.26 117.22 2cwc h ALA 201 Ca 0.63 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 55.05 2cwc h ALA 201 Cb 1.32 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2cwc h ALA 201 CO -0.61 0.64 -0.68 1.25 0.00 0.00 0.00 179.25 179.85 2cwc h LEU 202 N 0.92 0.31 -0.78 0.00 5.85 -1.51 -2.85 115.31 117.24 2cwc h LEU 202 Ca 0.16 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2cwc h LEU 202 Cb 0.60 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 2cwc h LEU 202 CO 0.04 0.89 0.39 -0.09 -0.34 0.00 0.00 178.44 179.33 2cwc h ARG 203 N 0.18 1.11 -0.38 1.25 2.43 -0.69 -0.94 114.38 117.34 2cwc h ARG 203 Ca -0.02 -0.15 -0.03 0.00 -0.81 0.00 0.00 59.98 58.97 2cwc h ARG 203 Cb 1.22 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 2cwc h ARG 203 CO 0.11 0.85 0.11 0.00 -1.51 0.00 0.00 179.97 179.52 2cwc h ARG 204 N 1.10 0.56 0.08 0.20 3.08 -1.15 -1.00 114.38 117.24 2cwc h ARG 204 Ca 0.27 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.23 2cwc h ARG 204 Cb 0.09 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2cwc h ARG 204 CO -0.04 0.51 -0.04 0.28 -1.07 0.00 0.00 179.97 179.61 2cwc h VAL 205 N 0.55 1.15 -0.09 2.04 2.07 -1.12 -0.56 116.25 120.29 2cwc h VAL 205 Ca 0.13 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 66.80 2cwc h VAL 205 Cb 0.19 1.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.67 2cwc h VAL 205 CO -0.01 0.21 0.06 0.58 0.02 0.00 0.00 177.57 178.44 2cwc h VAL 206 N -0.50 0.97 -0.21 2.57 2.07 -0.96 -1.67 116.25 118.51 2cwc h VAL 206 Ca -0.01 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2cwc h VAL 206 Cb 0.43 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 2cwc h VAL 206 CO 0.02 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 176.99 2cwc n GLU 207 N -4.52 1.56 0.00 1.57 1.02 -0.40 -4.84 120.64 115.03 2cwc n GLU 207 Ca -0.01 -0.80 0.00 0.00 -0.02 0.00 0.00 57.16 56.33 2cwc n GLU 207 Cb 0.16 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 2cwc n GLU 207 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2cwc n GLY 208 N 0.79 1.33 0.30 0.62 0.00 -0.65 -5.00 105.19 102.58 2cwc n GLY 208 Ca 0.07 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.28 2cwc n GLY 208 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2cwc h GLY 209 N 0.00 0.00 1.94 -0.02 0.00 -0.81 -2.69 103.07 101.49 2cwc h GLY 209 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2cwc h GLY 209 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 176.54 178.51 2cwc n PHE 210 N -3.17 0.00 0.23 5.60 1.16 -1.26 -3.55 117.46 116.48 2cwc n PHE 210 Ca -0.01 0.00 0.10 0.00 -1.87 0.00 0.00 57.45 55.67 2cwc n PHE 210 Cb 0.19 -0.47 0.56 0.00 -1.61 0.00 0.00 39.48 38.15 2cwc n PHE 210 CO 0.00 0.00 0.00 -1.49 -1.87 0.00 0.00 176.76 173.40 2cwc h TRP 211 N 0.00 0.00 -3.16 2.97 4.06 -1.82 -3.33 115.95 114.66 2cwc h TRP 211 Ca 0.00 0.00 -0.59 0.00 2.06 0.00 0.00 58.89 60.36 2cwc h TRP 211 Cb 0.44 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.55 2cwc h TRP 211 CO 0.00 0.20 -0.10 -2.00 -3.56 0.00 0.00 178.44 172.98 2cwc s GLU 212 N -3.89 4.11 0.17 0.49 2.56 -1.23 -5.03 118.70 115.87 2cwc s GLU 212 Ca -0.01 0.60 -0.31 0.00 0.00 0.00 0.00 54.97 55.25 2cwc s GLU 212 Cb 0.12 -3.25 -0.10 0.00 2.00 0.00 0.00 34.13 32.90 2cwc s GLU 212 CO 0.62 0.61 1.54 0.00 -0.56 0.00 0.00 175.26 177.48 2cwc s ALA 213 N -0.94 3.75 0.64 6.30 0.00 -1.26 -4.97 121.76 125.28 2cwc s ALA 213 Ca 0.27 1.35 -0.14 0.00 0.00 0.00 0.00 51.96 53.44 2cwc s ALA 213 Cb -0.18 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.32 2cwc s ALA 213 CO 0.16 -0.76 1.06 -1.25 0.00 0.00 0.00 175.76 174.97 2cwc s PRO 214 N 0.97 3.09 0.00 0.00 0.04 -1.26 -4.94 135.00 132.90 2cwc s PRO 214 Ca 0.68 1.15 0.29 0.00 0.04 0.00 0.00 61.00 63.16 2cwc s PRO 214 Cb -0.43 -2.00 1.20 0.00 0.04 0.00 0.00 34.50 33.31 2cwc s PRO 214 CO 0.32 -0.99 1.85 0.39 0.04 0.00 0.00 177.00 178.62 2cwc n GLU 215 N -2.48 0.53 -3.60 4.56 -0.58 -1.26 -4.93 120.64 112.88 2cwc n GLU 215 Ca 0.09 -0.16 0.01 0.00 -0.42 0.00 0.00 57.16 56.67 2cwc n GLU 215 Cb 0.53 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.89 2cwc n GLU 215 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 2cwc s GLU 216 N -2.58 0.22 -0.56 3.49 4.04 -1.26 -4.48 118.70 117.57 2cwc s GLU 216 Ca 0.26 -0.11 -0.27 0.00 0.04 0.00 0.00 54.97 54.89 2cwc s GLU 216 Cb 0.20 0.08 0.03 0.00 0.02 0.00 0.00 34.13 34.46 2cwc s GLU 216 CO 0.50 -0.10 1.11 0.20 -1.84 0.00 0.00 175.26 175.12 2cwc s GLY 217 N -2.71 1.24 0.60 -3.83 0.00 -1.11 -4.97 107.32 96.53 2cwc s GLY 217 Ca 0.13 -0.90 -0.17 0.00 0.00 0.00 0.00 44.72 43.78 2cwc s GLY 217 CO -0.05 2.35 1.11 -4.14 0.00 0.00 0.00 173.10 172.37 2cwc s PRO 218 N 4.57 3.13 -0.01 2.90 0.02 -1.26 -1.17 135.00 143.18 2cwc s PRO 218 Ca 0.40 1.46 0.22 0.00 0.02 0.00 0.00 61.00 63.10 2cwc s PRO 218 Cb -0.09 -1.99 -0.25 0.00 0.02 0.00 0.00 34.50 32.19 2cwc s PRO 218 CO 0.24 -1.00 0.71 0.41 -0.33 0.00 0.00 177.00 177.04 2cwc n GLY 219 N -0.27 -1.03 3.71 0.52 0.00 -1.26 -4.30 105.19 102.56 2cwc n GLY 219 Ca 0.11 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 2cwc n GLY 219 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2cwc s TYR 220 N -3.28 3.40 0.19 1.61 5.04 -1.26 -1.54 117.35 121.51 2cwc s TYR 220 Ca -0.00 1.30 -0.21 0.00 -2.44 0.00 0.00 57.07 55.71 2cwc s TYR 220 Cb 0.15 -3.41 0.12 0.00 0.35 0.00 0.00 41.96 39.17 2cwc s TYR 220 CO 0.88 -1.23 1.57 0.00 -1.34 0.00 0.00 175.55 175.43 2cwc h ALA 221 N 6.94 -0.08 -0.88 3.97 0.00 -1.40 0.59 119.26 128.40 2cwc h ALA 221 Ca -0.40 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2cwc h ALA 221 Cb 1.20 0.88 -0.04 0.00 0.00 0.00 0.00 17.79 19.83 2cwc h ALA 221 CO 0.82 -0.71 0.55 -1.35 0.00 0.00 0.00 179.25 178.57 2cwc h PRO 222 N -0.15 1.17 -0.36 0.00 0.11 -1.84 -1.45 132.00 129.48 2cwc h PRO 222 Ca 0.24 -0.09 -0.11 0.00 0.11 0.00 0.00 66.00 66.15 2cwc h PRO 222 Cb 0.56 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 2cwc h PRO 222 CO -0.74 0.80 -0.22 0.78 -0.21 0.00 0.00 178.00 178.41 2cwc h GLY 223 N 1.21 0.77 0.95 -0.55 0.00 -1.60 -0.64 103.07 103.21 2cwc h GLY 223 Ca 0.32 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.95 2cwc h GLY 223 CO -0.06 0.59 0.02 -0.84 0.00 0.00 0.00 176.54 176.24 2cwc h THR 224 N 0.62 1.26 -0.47 4.70 2.02 -0.49 -0.51 112.91 120.04 2cwc h THR 224 Ca 0.09 -0.98 -0.02 0.00 0.77 0.00 0.00 66.41 66.28 2cwc h THR 224 Cb 0.70 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 2cwc h THR 224 CO 0.05 0.33 0.23 0.25 0.37 0.00 0.00 175.52 176.76 2cwc h LEU 225 N 0.56 0.61 -0.98 2.58 5.85 -1.10 -1.62 115.31 121.22 2cwc h LEU 225 Ca 0.12 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2cwc h LEU 225 Cb 0.45 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 2cwc h LEU 225 CO 0.02 0.57 0.48 0.00 -0.34 0.00 0.00 178.44 179.17 2cwc h ALA 226 N 1.07 1.22 -0.62 1.25 0.00 -0.91 -0.59 119.26 120.68 2cwc h ALA 226 Ca 0.16 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2cwc h ALA 226 Cb 0.11 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2cwc h ALA 226 CO -0.02 0.63 0.10 0.00 0.00 0.00 0.00 179.25 179.97 2cwc h ALA 227 N 1.33 0.83 -0.42 0.00 0.00 -0.70 -0.55 119.26 119.74 2cwc h ALA 227 Ca 0.31 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2cwc h ALA 227 Cb 0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2cwc h ALA 227 CO -0.05 0.59 -0.07 0.00 0.00 0.00 0.00 179.25 179.71 2cwc h ALA 228 N 1.03 0.58 -0.52 0.00 0.00 -0.85 -1.96 119.26 117.54 2cwc h ALA 228 Ca 0.19 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2cwc h ALA 228 Cb 0.43 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2cwc h ALA 228 CO 0.01 0.44 0.09 -0.07 0.00 0.00 0.00 179.25 179.72 2cwc h LEU 229 N 0.62 0.76 -0.07 0.00 3.38 -0.95 -0.44 115.31 118.61 2cwc h LEU 229 Ca 0.11 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2cwc h LEU 229 Cb 0.60 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 2cwc h LEU 229 CO 0.04 0.77 0.03 -0.25 0.09 0.00 0.00 178.44 179.12 2cwc h TRP 230 N 0.77 0.11 -0.74 1.13 7.01 -0.91 0.88 115.95 124.20 2cwc h TRP 230 Ca 0.17 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.15 2cwc h TRP 230 Cb 0.33 -0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.33 2cwc h TRP 230 CO 0.02 0.22 0.43 0.00 -2.79 0.00 0.00 178.44 176.31 2cwc h ALA 231 N 0.88 1.36 -0.37 2.65 0.00 -1.08 -0.81 119.26 121.89 2cwc h ALA 231 Ca 0.02 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2cwc h ALA 231 Cb 0.15 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2cwc h ALA 231 CO -0.00 0.54 -0.10 0.35 0.00 0.00 0.00 179.25 180.04 2cwc h PHE 232 N 1.03 0.81 -0.58 0.00 3.57 -0.82 -0.25 116.94 120.70 2cwc h PHE 232 Ca 0.27 -0.18 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 2cwc h PHE 232 Cb -0.01 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.51 2cwc h PHE 232 CO 0.01 0.87 0.20 0.00 -2.23 0.00 0.00 178.31 177.15 2cwc h ALA 233 N 0.82 0.75 0.06 2.41 0.00 -0.30 -3.27 119.26 119.73 2cwc h ALA 233 Ca 0.09 -0.19 -0.27 0.00 0.00 0.00 0.00 54.91 54.54 2cwc h ALA 233 Cb 0.62 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2cwc h ALA 233 CO 0.04 0.40 -1.39 0.00 0.00 0.00 0.00 179.25 178.30 2cwc h ARG 234 N 0.81 0.12 -6.81 0.00 2.47 -1.15 -3.46 114.38 106.36 2cwc h ARG 234 Ca 0.19 -0.21 -0.52 0.00 -1.26 0.00 0.00 59.98 58.18 2cwc h ARG 234 Cb 0.26 0.08 0.05 0.00 -1.65 0.00 0.00 29.97 28.70 2cwc h ARG 234 CO -0.01 0.95 0.62 0.20 0.56 0.00 0.00 179.97 182.30 2cwc s GLY 235 N -4.90 2.84 0.10 0.04 0.00 -0.11 -4.93 107.32 100.36 2cwc s GLY 235 Ca -0.05 1.18 0.23 0.00 0.00 0.00 0.00 44.72 46.08 2cwc s GLY 235 CO 0.84 1.91 1.15 0.54 0.00 0.00 0.00 173.10 177.53 2cwc n ARG 236 N 1.37 0.33 -3.98 2.90 1.74 -1.26 -4.79 116.66 112.97 2cwc n ARG 236 Ca 0.02 0.05 -0.10 0.00 -0.77 0.00 0.00 57.85 57.05 2cwc n ARG 236 Cb 0.42 -1.66 -0.04 0.00 -1.02 0.00 0.00 32.46 30.16 2cwc n ARG 236 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2cwc s ASP 237 N -4.23 0.03 0.15 0.55 1.47 -1.26 -5.05 116.67 108.34 2cwc s ASP 237 Ca 0.04 -0.99 -0.21 0.00 1.18 0.00 0.00 52.55 52.57 2cwc s ASP 237 Cb 0.13 0.63 0.04 0.00 -0.34 0.00 0.00 42.92 43.38 2cwc s ASP 237 CO 0.77 -1.22 1.65 0.15 0.68 0.00 0.00 175.17 177.19 2cwc h PHE 238 N 2.19 -0.47 -0.23 2.11 3.57 -1.92 -2.21 116.94 119.99 2cwc h PHE 238 Ca -0.26 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.31 2cwc h PHE 238 Cb 1.25 0.25 -0.03 0.00 2.79 0.00 0.00 35.95 40.20 2cwc h PHE 238 CO 0.62 -0.26 0.02 1.49 -2.23 0.00 0.00 178.31 177.94 2cwc h GLU 239 N -0.17 0.09 -0.40 1.11 4.81 -1.98 -0.43 114.58 117.61 2cwc h GLU 239 Ca 0.14 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2cwc h GLU 239 Cb 0.39 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 2cwc h GLU 239 CO -0.37 0.06 0.19 1.49 -0.73 0.00 0.00 179.01 179.66 2cwc h GLU 240 N 0.10 0.57 -0.56 1.92 4.81 -1.92 -1.40 114.58 118.10 2cwc h GLU 240 Ca 0.11 -0.08 -0.07 0.00 -0.13 0.00 0.00 59.36 59.18 2cwc h GLU 240 Cb 0.12 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 2cwc h GLU 240 CO -0.16 0.50 0.05 0.78 -0.73 0.00 0.00 179.01 179.44 2cwc h GLY 241 N 0.50 0.99 0.97 1.92 0.00 -1.28 -1.89 103.07 104.29 2cwc h GLY 241 Ca 0.14 -0.66 -0.03 0.00 0.00 0.00 0.00 47.33 46.78 2cwc h GLY 241 CO -0.02 0.61 0.20 1.98 0.00 0.00 0.00 176.54 179.31 2cwc h MET 242 N 0.86 0.73 -0.71 4.80 1.85 -0.78 -0.80 114.93 120.89 2cwc h MET 242 Ca 0.17 -0.13 -0.04 0.00 -0.61 0.00 0.00 59.70 59.09 2cwc h MET 242 Cb 0.44 -0.12 -0.03 0.00 0.43 0.00 0.00 31.60 32.32 2cwc h MET 242 CO 0.02 0.65 0.29 0.00 -0.40 0.00 0.00 176.91 177.46 2cwc h ARG 243 N 0.65 1.04 -0.55 0.39 3.08 -1.05 -1.37 114.38 116.57 2cwc h ARG 243 Ca 0.16 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 2cwc h ARG 243 Cb 0.19 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 2cwc h ARG 243 CO -0.01 0.84 0.19 -0.07 -1.07 0.00 0.00 179.97 179.84 2cwc h LEU 244 N 1.02 0.78 0.37 3.04 3.38 -0.91 -2.04 115.31 120.94 2cwc h LEU 244 Ca 0.24 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2cwc h LEU 244 Cb 0.18 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2cwc h LEU 244 CO -0.02 0.77 -0.18 0.00 0.09 0.00 0.00 178.44 179.10 2cwc h ALA 245 N 1.05 -0.49 0.00 1.53 0.00 -0.71 -3.20 119.26 117.43 2cwc h ALA 245 Ca 0.18 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2cwc h ALA 245 Cb 0.25 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2cwc h ALA 245 CO -0.01 -0.72 -0.43 -0.39 0.00 0.00 0.00 179.25 177.70 2cwc h VAL 246 N -0.61 1.20 0.00 0.00 -1.51 -1.28 -2.90 116.25 111.15 2cwc h VAL 246 Ca -0.05 -1.53 0.00 0.00 -1.23 0.00 0.00 66.70 63.89 2cwc h VAL 246 Cb 0.45 1.85 0.00 0.00 -2.13 0.00 0.00 31.29 31.45 2cwc h VAL 246 CO 0.08 0.42 0.00 0.59 -1.23 0.00 0.00 177.57 177.43 2cwc n ASN 247 N -3.88 0.00 0.06 4.19 4.13 -0.77 -1.90 115.26 117.10 2cwc n ASN 247 Ca -0.01 -1.27 0.13 0.00 1.68 0.00 0.00 54.58 55.11 2cwc n ASN 247 Cb 0.48 0.00 0.40 0.00 -1.54 0.00 0.00 39.78 39.12 2cwc n ASN 247 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2cwc n LEU 248 N -0.68 0.58 0.00 3.41 4.77 -1.10 -4.45 117.00 119.52 2cwc n LEU 248 Ca 0.07 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.50 2cwc n LEU 248 Cb 0.03 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 2cwc n LEU 248 CO 0.05 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.63 2cwc n GLY 249 N 1.37 0.19 7.00 -0.72 0.00 -0.80 -2.86 105.19 109.38 2cwc n GLY 249 Ca 0.05 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.16 2cwc n GLY 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cwc n GLY 250 N 0.00 3.07 2.34 -0.02 0.00 -0.07 -2.76 105.19 107.75 2cwc n GLY 250 Ca 0.00 -0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 2cwc n GLY 250 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2cwc n ASP 251 N 4.56 8.55 0.21 1.61 -0.08 -0.32 -0.25 116.55 130.83 2cwc n ASP 251 Ca 0.00 -2.68 0.05 0.00 -1.51 0.00 0.00 54.79 50.65 2cwc n ASP 251 Cb 0.00 -1.52 0.48 0.00 2.34 0.00 0.00 41.12 42.42 2cwc n ASP 251 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2cwc h ALA 252 N 4.86 1.66 -0.37 -1.67 0.00 -1.74 -1.78 119.26 120.22 2cwc h ALA 252 Ca 0.83 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.53 2cwc h ALA 252 Cb 0.32 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2cwc h ALA 252 CO 1.69 0.25 0.11 0.38 0.00 0.00 0.00 179.25 181.68 2cwc h ASP 253 N 0.04 0.54 -0.03 0.00 -0.00 -1.81 0.14 116.42 115.30 2cwc h ASP 253 Ca 0.01 -0.21 -0.25 0.00 -0.00 0.00 0.00 57.03 56.57 2cwc h ASP 253 Cb 0.34 -0.14 0.02 0.00 -0.00 0.00 0.00 39.33 39.54 2cwc h ASP 253 CO 0.02 0.61 -0.98 0.74 -0.00 0.00 0.00 179.24 179.63 2cwc h THR 254 N 0.45 1.28 -0.47 1.15 2.02 -1.83 -0.68 112.91 114.84 2cwc h THR 254 Ca 0.12 -2.18 -0.03 0.00 0.77 0.00 0.00 66.41 65.09 2cwc h THR 254 Cb 0.26 2.31 -0.02 0.00 -1.74 0.00 0.00 68.15 68.96 2cwc h THR 254 CO -0.00 0.68 0.17 0.58 0.37 0.00 0.00 175.52 177.32 2cwc h VAL 255 N 0.40 1.21 -0.91 3.16 2.07 -1.33 0.16 116.25 121.02 2cwc h VAL 255 Ca -0.11 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 2cwc h VAL 255 Cb 1.63 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 2cwc h VAL 255 CO 0.19 0.25 0.54 1.23 0.02 0.00 0.00 177.57 179.81 2cwc h GLY 256 N 0.61 1.32 1.62 2.17 0.00 -0.69 -0.51 103.07 107.60 2cwc h GLY 256 Ca 0.15 -0.55 -0.14 0.00 0.00 0.00 0.00 47.33 46.79 2cwc h GLY 256 CO -0.01 0.53 -0.52 0.00 0.00 0.00 0.00 176.54 176.55 2cwc h ALA 257 N 1.34 0.84 -0.17 3.60 0.00 -0.68 0.14 119.26 124.34 2cwc h ALA 257 Ca 0.33 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 2cwc h ALA 257 Cb -0.05 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2cwc h ALA 257 CO -0.06 0.68 -0.25 0.28 0.00 0.00 0.00 179.25 179.89 2cwc h VAL 258 N 0.32 1.35 -0.73 0.00 2.07 -0.61 -2.10 116.25 116.55 2cwc h VAL 258 Ca 0.01 -1.47 -0.00 0.00 0.82 0.00 0.00 66.70 66.06 2cwc h VAL 258 Cb 1.02 1.90 -0.04 0.00 -1.52 0.00 0.00 31.29 32.66 2cwc h VAL 258 CO 0.09 0.44 0.46 0.22 0.02 0.00 0.00 177.57 178.80 2cwc h TYR 259 N 0.10 0.95 -0.95 1.57 3.20 -1.02 -2.61 116.97 118.21 2cwc h TYR 259 Ca 0.02 0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.96 2cwc h TYR 259 Cb 0.82 -0.31 -0.06 0.00 1.54 0.00 0.00 36.73 38.72 2cwc h TYR 259 CO 0.09 0.63 0.62 0.78 -1.64 0.00 0.00 178.16 178.63 2cwc h GLY 260 N 1.00 1.42 0.67 1.82 0.00 -0.55 0.16 103.07 107.59 2cwc h GLY 260 Ca 0.26 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 2cwc h GLY 260 CO -0.05 0.31 -0.02 1.46 0.00 0.00 0.00 176.54 178.24 2cwc h GLN 261 N 1.09 0.11 0.12 4.80 4.20 -1.02 0.10 115.11 124.51 2cwc h GLN 261 Ca 0.41 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 59.08 2cwc h GLN 261 Cb 0.20 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.98 2cwc h GLN 261 CO -0.16 0.46 -0.06 1.25 -0.67 0.00 0.00 178.83 179.65 2cwc h LEU 262 N -0.25 -0.13 -1.22 1.46 5.85 -1.21 -1.99 115.31 117.82 2cwc h LEU 262 Ca 0.01 -0.29 -0.07 0.00 0.84 0.00 0.00 57.88 58.38 2cwc h LEU 262 Cb 0.42 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2cwc h LEU 262 CO 0.01 0.23 -0.23 0.00 -0.34 0.00 0.00 178.44 178.10 2cwc h ALA 263 N 0.32 1.35 -0.51 1.25 0.00 -0.78 -1.23 119.26 119.66 2cwc h ALA 263 Ca -0.02 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 2cwc h ALA 263 Cb 0.41 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2cwc h ALA 263 CO 0.03 0.45 0.05 0.78 0.00 0.00 0.00 179.25 180.55 2cwc h GLY 264 N 0.93 0.93 1.44 0.00 0.00 -0.73 0.13 103.07 105.77 2cwc h GLY 264 Ca 0.04 -0.65 -0.13 0.00 0.00 0.00 0.00 47.33 46.59 2cwc h GLY 264 CO 0.04 0.60 -0.38 0.00 0.00 0.00 0.00 176.54 176.80 2cwc h ALA 265 N 0.96 0.84 -0.01 3.60 0.00 -1.06 0.85 119.26 124.45 2cwc h ALA 265 Ca 0.15 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2cwc h ALA 265 Cb 0.45 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2cwc h ALA 265 CO 0.02 0.64 -0.07 -0.92 0.00 0.00 0.00 179.25 178.92 2cwc h TYR 266 N 0.52 0.09 0.01 0.00 3.20 -1.01 -3.38 116.97 116.40 2cwc h TYR 266 Ca 0.05 -0.04 -0.27 0.00 3.14 0.00 0.00 58.73 61.60 2cwc h TYR 266 Cb 0.88 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 39.10 2cwc h TYR 266 CO 0.04 0.77 -1.52 1.88 -1.64 0.00 0.00 178.16 177.69 2cwc h TYR 267 N -0.62 0.04 0.00 -3.82 0.05 -0.84 -3.51 116.97 108.27 2cwc h TYR 267 Ca -0.01 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.74 2cwc h TYR 267 Cb 0.79 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.53 2cwc h TYR 267 CO 0.17 1.05 0.00 0.41 -1.05 0.00 0.00 178.16 178.74 2cwc n GLY 268 N 1.52 0.46 0.30 3.88 0.00 0.29 -4.31 105.19 107.33 2cwc n GLY 268 Ca -0.13 -1.70 0.03 0.00 0.00 0.00 0.00 46.02 44.23 2cwc n GLY 268 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2cwc h LEU 269 N 0.00 0.63 -2.72 0.99 5.85 -1.42 -1.48 115.31 117.16 2cwc h LEU 269 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2cwc h LEU 269 Cb 0.00 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 40.97 2cwc h LEU 269 CO 0.00 0.35 0.09 1.23 -0.34 0.00 0.00 178.44 179.77 2cwc h GLY 270 N 0.75 0.00 -0.38 3.75 0.00 -1.84 -1.41 103.07 103.94 2cwc h GLY 270 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.73 2cwc h GLY 270 CO -0.26 0.00 -0.22 0.00 0.00 0.00 0.00 176.54 176.06 2cwc n ALA 271 N -2.05 3.00 -2.65 3.60 0.00 -0.56 -4.87 120.51 116.99 2cwc n ALA 271 Ca -0.03 -0.49 -0.40 0.00 0.00 0.00 0.00 53.44 52.53 2cwc n ALA 271 Cb 0.15 -1.04 -0.05 0.00 0.00 0.00 0.00 19.45 18.51 2cwc n ALA 271 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2cwc s ILE 272 N -2.33 4.98 -0.24 0.00 1.01 -0.53 -4.57 121.20 119.51 2cwc s ILE 272 Ca 0.27 1.48 -0.41 0.00 0.00 0.00 0.00 60.65 61.98 2cwc s ILE 272 Cb 0.19 -4.05 -0.17 0.00 0.01 0.00 0.00 42.46 38.44 2cwc s ILE 272 CO 0.47 0.28 1.57 -2.65 0.00 0.00 0.00 174.94 174.60 2cwc n PRO 273 N 3.55 0.74 -0.26 2.79 -0.02 -1.26 -4.83 135.00 135.70 2cwc n PRO 273 Ca -0.02 0.27 0.10 0.00 -2.02 0.00 0.00 63.50 61.83 2cwc n PRO 273 Cb 0.51 -1.88 0.35 0.00 -0.02 0.00 0.00 33.50 32.46 2cwc n PRO 273 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2cwc h GLY 274 N 5.74 1.18 2.00 -1.23 0.00 -1.93 -0.97 103.07 107.85 2cwc h GLY 274 Ca -0.47 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 46.50 2cwc h GLY 274 CO 0.90 0.15 -0.23 0.07 0.00 0.00 0.00 176.54 177.43 2cwc h ARG 275 N 0.76 0.00 -0.12 4.80 0.11 -1.99 0.34 114.38 118.28 2cwc h ARG 275 Ca 0.41 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 60.28 2cwc h ARG 275 Cb 0.55 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.64 2cwc h ARG 275 CO -0.18 0.23 -0.77 -1.49 0.10 0.00 0.00 179.97 177.87 2cwc h TRP 276 N 0.00 1.01 -0.39 4.08 6.55 -1.54 -2.77 115.95 122.88 2cwc h TRP 276 Ca -0.00 -0.46 -0.12 0.00 0.95 0.00 0.00 58.89 59.26 2cwc h TRP 276 Cb 0.48 -0.15 -0.01 0.00 -0.86 0.00 0.00 29.16 28.63 2cwc h TRP 276 CO 0.00 1.29 -0.21 -0.07 -1.05 0.00 0.00 178.44 178.40 2cwc h LEU 277 N 0.44 0.85 -1.71 -4.49 3.38 -1.12 -2.01 115.31 110.65 2cwc h LEU 277 Ca -0.06 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.46 2cwc h LEU 277 Cb 1.41 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2cwc h LEU 277 CO 0.16 1.08 -0.18 0.03 0.09 0.00 0.00 178.44 179.62 2cwc h ARG 278 N 0.63 0.00 0.00 1.13 3.08 -0.99 -2.27 114.38 115.96 2cwc h ARG 278 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2cwc h ARG 278 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.82 2cwc h ARG 278 CO 0.06 0.18 -0.63 0.00 -1.07 0.00 0.00 179.97 178.51 2cwc h ALA 279 N 1.82 0.61 -2.52 0.04 0.00 -1.31 -3.47 119.26 114.43 2cwc h ALA 279 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2cwc h ALA 279 Cb 0.39 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.22 2cwc h ALA 279 CO 0.02 0.00 0.96 -1.17 0.00 0.00 0.00 179.25 179.06 2cwc s LEU 280 N -4.57 4.37 0.13 0.00 2.96 -0.77 -4.03 118.68 116.77 2cwc s LEU 280 Ca 0.05 2.57 -0.31 0.00 -0.22 0.00 0.00 54.13 56.22 2cwc s LEU 280 Cb 0.12 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 43.15 2cwc s LEU 280 CO 0.72 -0.87 1.43 -2.28 -1.32 0.00 0.00 176.35 174.03 2cwc s HIS 281 N 2.01 3.20 -1.42 5.38 5.65 -0.42 -2.90 115.29 126.79 2cwc s HIS 281 Ca 0.73 0.88 -0.00 0.00 0.25 0.00 0.00 55.06 56.91 2cwc s HIS 281 Cb -0.42 -3.74 0.00 0.00 -1.18 0.00 0.00 32.58 27.24 2cwc s HIS 281 CO 0.32 -2.63 0.02 1.28 -0.65 0.00 0.00 174.74 173.09 2cwc n LEU 282 N 3.95 -1.80 -0.02 8.88 4.77 -1.26 -4.94 117.00 126.59 2cwc n LEU 282 Ca 0.12 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.95 2cwc n LEU 282 Cb 0.41 -2.46 -0.06 0.00 -2.33 0.00 0.00 43.42 38.98 2cwc n LEU 282 CO 0.59 -0.16 0.58 -0.09 -1.33 0.00 0.00 177.39 176.98 2cwc h ARG 283 N -0.05 -0.46 -1.01 3.23 2.43 -1.85 -1.16 114.38 115.50 2cwc h ARG 283 Ca -0.40 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 58.82 2cwc h ARG 283 Cb 1.29 0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 30.90 2cwc h ARG 283 CO 0.47 -0.31 0.66 0.93 -1.51 0.00 0.00 179.97 180.22 2cwc h GLU 284 N -0.48 1.30 -0.76 0.20 3.07 -1.92 -0.95 114.58 115.05 2cwc h GLU 284 Ca 0.08 -0.08 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 2cwc h GLU 284 Cb 0.63 -0.29 -0.03 0.00 -0.84 0.00 0.00 28.75 28.21 2cwc h GLU 284 CO -0.42 0.86 0.28 0.93 -1.40 0.00 0.00 179.01 179.26 2cwc h GLU 285 N 1.34 1.14 -0.27 2.33 3.07 -1.84 -1.87 114.58 118.49 2cwc h GLU 285 Ca 0.38 -0.22 -0.15 0.00 -0.50 0.00 0.00 59.36 58.87 2cwc h GLU 285 Cb -0.12 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 27.60 2cwc h GLU 285 CO -0.09 0.94 -0.43 0.52 -1.40 0.00 0.00 179.01 178.55 2cwc h MET 286 N 1.11 0.67 -0.75 2.33 2.86 -0.64 -2.01 114.93 118.50 2cwc h MET 286 Ca 0.25 -0.36 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 2cwc h MET 286 Cb 0.24 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 2cwc h MET 286 CO -0.02 0.97 0.38 0.93 1.06 0.00 0.00 176.91 180.23 2cwc h GLU 287 N 0.54 1.06 -0.36 1.72 5.08 -0.88 0.39 114.58 122.13 2cwc h GLU 287 Ca 0.04 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 2cwc h GLU 287 Cb 0.97 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 2cwc h GLU 287 CO 0.09 0.82 0.12 0.00 -1.00 0.00 0.00 179.01 179.04 2cwc h ALA 288 N 1.19 0.47 -0.35 3.43 0.00 -1.22 -2.03 119.26 120.75 2cwc h ALA 288 Ca 0.26 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2cwc h ALA 288 Cb 0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2cwc h ALA 288 CO -0.04 0.11 0.20 -0.07 0.00 0.00 0.00 179.25 179.45 2cwc h LEU 289 N 0.44 0.43 -0.45 0.00 3.38 -0.99 -1.30 115.31 116.83 2cwc h LEU 289 Ca 0.12 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2cwc h LEU 289 Cb 0.24 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 2cwc h LEU 289 CO -0.01 0.38 0.25 0.00 0.09 0.00 0.00 178.44 179.16 2cwc h ALA 290 N 1.07 0.57 -0.60 1.53 0.00 -0.81 0.16 119.26 121.18 2cwc h ALA 290 Ca 0.13 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2cwc h ALA 290 Cb 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2cwc h ALA 290 CO -0.02 -0.07 0.09 1.25 0.00 0.00 0.00 179.25 180.50 2cwc h LEU 291 N 0.51 0.93 -0.59 0.00 5.85 -1.20 -1.11 115.31 119.70 2cwc h LEU 291 Ca 0.18 -0.21 -0.07 0.00 0.84 0.00 0.00 57.88 58.62 2cwc h LEU 291 Cb 0.04 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 2cwc h LEU 291 CO -0.10 0.94 0.09 0.00 -0.34 0.00 0.00 178.44 179.03 2cwc h ALA 292 N 1.17 0.79 -0.58 1.25 0.00 -0.69 -0.57 119.26 120.63 2cwc h ALA 292 Ca 0.19 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 2cwc h ALA 292 Cb 0.41 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2cwc h ALA 292 CO 0.01 0.55 0.06 -0.07 0.00 0.00 0.00 179.25 179.80 2cwc h LEU 293 N 0.89 0.94 -0.51 0.00 3.38 -0.69 -1.53 115.31 117.80 2cwc h LEU 293 Ca 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2cwc h LEU 293 Cb 0.43 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2cwc h LEU 293 CO 0.01 0.98 0.27 0.22 0.09 0.00 0.00 178.44 180.02 2cwc h TYR 294 N 0.87 0.70 -0.98 1.13 3.20 -0.95 -1.95 116.97 119.00 2cwc h TYR 294 Ca 0.17 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.08 2cwc h TYR 294 Cb 0.46 -0.22 -0.06 0.00 1.54 0.00 0.00 36.73 38.44 2cwc h TYR 294 CO 0.03 0.53 0.64 0.00 -1.64 0.00 0.00 178.16 177.72 2cwc h ARG 295 N 0.67 1.14 -0.31 1.82 -0.00 -0.84 -1.41 114.38 115.45 2cwc h ARG 295 Ca 0.18 -0.07 -0.04 0.00 -0.50 0.00 0.00 59.98 59.55 2cwc h ARG 295 Cb 0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 29.97 29.76 2cwc h ARG 295 CO -0.03 0.76 0.03 1.98 0.00 0.00 0.00 179.97 182.71 2cwc h MET 296 N 1.18 0.45 0.00 0.04 4.05 -0.60 -2.26 114.93 117.79 2cwc h MET 296 Ca 0.41 -0.08 -0.02 0.00 -0.28 0.00 0.00 59.70 59.73 2cwc h MET 296 Cb 0.12 -0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 30.84 2cwc h MET 296 CO -0.16 0.46 -0.12 0.66 0.23 0.00 0.00 176.91 177.98 2cwc h SER 297 N 0.44 0.00 0.04 1.39 4.64 -0.54 -2.95 113.55 116.58 2cwc h SER 297 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2cwc h SER 297 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2cwc h SER 297 CO 0.00 0.12 -0.27 0.23 -0.87 0.00 0.00 176.83 176.04 2cwc n MET 298 N -3.22 1.41 -0.34 4.77 2.00 -0.88 -4.78 117.12 116.08 2cwc n MET 298 Ca 0.01 -1.07 0.00 0.00 0.00 0.00 0.00 57.70 56.64 2cwc n MET 298 Cb 0.41 -1.48 0.00 0.00 0.00 0.00 0.00 33.22 32.15 2cwc n MET 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2cwc n ALA 299 N 0.14 0.00 0.00 3.04 0.00 -1.06 -5.11 120.51 117.52 2cwc n ALA 299 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2cwc n ALA 299 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 2cwc n ALA 299 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95