#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oq4 n GLN 2 N 0.00 1.23 0.00 -0.52 10.64 -1.26 -4.96 117.38 122.52 2oq4 n GLN 2 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2oq4 n GLN 2 Cb 0.00 -0.10 0.00 0.00 -0.86 0.00 0.00 30.24 29.28 2oq4 n GLN 2 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2oq4 n GLY 3 N 0.00 -2.00 0.28 2.61 0.00 -0.89 -4.02 105.19 101.18 2oq4 n GLY 3 Ca 0.00 0.69 0.12 0.00 0.00 0.00 0.00 46.02 46.82 2oq4 n GLY 3 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2oq4 h PRO 4 N 0.00 0.00 0.00 1.61 0.11 -1.86 -1.68 132.00 130.18 2oq4 h PRO 4 Ca 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.06 2oq4 h PRO 4 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2oq4 h PRO 4 CO 0.00 0.00 -0.18 0.93 -0.21 0.00 0.00 178.00 178.54 2oq4 h GLU 5 N 0.00 0.12 -0.48 1.05 3.07 -1.93 -2.58 114.58 113.83 2oq4 h GLU 5 Ca 0.00 -0.13 -0.01 0.00 -0.50 0.00 0.00 59.36 58.73 2oq4 h GLU 5 Cb 0.02 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 27.95 2oq4 h GLU 5 CO -0.00 0.90 0.28 0.82 -1.40 0.00 0.00 179.01 179.61 2oq4 h ILE 6 N -0.61 1.16 -0.71 3.13 2.04 -1.80 0.13 117.51 120.84 2oq4 h ILE 6 Ca -0.02 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 2oq4 h ILE 6 Cb 0.96 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 2oq4 h ILE 6 CO 0.04 0.16 0.33 -0.09 0.00 0.00 0.00 178.15 178.59 2oq4 h ARG 7 N 0.64 1.04 -0.88 2.37 9.65 -1.45 0.36 114.38 126.11 2oq4 h ARG 7 Ca 0.17 -0.16 0.01 0.00 -1.10 0.00 0.00 59.98 58.91 2oq4 h ARG 7 Cb 0.01 -0.18 -0.05 0.00 -1.39 0.00 0.00 29.97 28.37 2oq4 h ARG 7 CO -0.03 0.82 0.58 -0.09 2.80 0.00 0.00 179.97 184.05 2oq4 h ARG 8 N 1.00 1.14 -0.02 0.20 2.43 -0.95 -0.85 114.38 117.33 2oq4 h ARG 8 Ca 0.24 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.31 2oq4 h ARG 8 Cb 0.13 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 2oq4 h ARG 8 CO -0.03 0.76 -0.11 0.00 -1.51 0.00 0.00 179.97 179.08 2oq4 h ALA 9 N 1.46 0.04 -0.98 2.80 0.00 0.02 -3.19 119.26 119.41 2oq4 h ALA 9 Ca 0.33 -0.37 0.29 0.00 0.00 0.00 0.00 54.91 55.16 2oq4 h ALA 9 Cb -0.10 -0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.54 2oq4 h ALA 9 CO -0.08 -0.05 0.53 0.00 0.00 0.00 0.00 179.25 179.65 2oq4 h ALA 10 N 0.36 1.82 -0.56 0.00 0.00 0.25 0.98 119.26 122.10 2oq4 h ALA 10 Ca -0.01 0.18 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2oq4 h ALA 10 Cb 0.77 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2oq4 h ALA 10 CO 0.02 -0.48 0.08 -0.44 0.00 0.00 0.00 179.25 178.43 2oq4 h ASP 11 N 0.37 0.86 -0.31 0.00 3.32 -1.19 -2.55 116.42 116.92 2oq4 h ASP 11 Ca 0.69 -0.19 -0.10 0.00 0.02 0.00 0.00 57.03 57.45 2oq4 h ASP 11 Cb 1.48 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.79 2oq4 h ASP 11 CO -0.58 0.87 -0.14 0.78 -1.72 0.00 0.00 179.24 178.46 2oq4 h ASN 12 N 0.85 0.74 -0.07 6.45 2.35 0.95 -2.71 115.58 124.14 2oq4 h ASN 12 Ca 0.17 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2oq4 h ASN 12 Cb 0.39 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 2oq4 h ASN 12 CO 0.01 0.89 0.02 -0.07 -1.65 0.00 0.00 177.43 176.62 2oq4 h LEU 13 N 0.67 0.10 0.33 1.61 3.38 -0.97 -2.73 115.31 117.70 2oq4 h LEU 13 Ca 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2oq4 h LEU 13 Cb 0.61 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 2oq4 h LEU 13 CO 0.04 0.31 -0.22 -0.33 0.09 0.00 0.00 178.44 178.33 2oq4 h GLU 14 N -0.11 -0.50 -1.63 1.13 5.08 -1.39 0.14 114.58 117.30 2oq4 h GLU 14 Ca 0.02 0.03 0.48 0.00 -1.00 0.00 0.00 59.36 58.90 2oq4 h GLU 14 Cb 0.25 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.53 2oq4 h GLU 14 CO 0.00 -0.33 1.15 0.00 -1.00 0.00 0.00 179.01 178.83 2oq4 h ALA 15 N -1.55 3.43 0.00 3.43 0.00 -1.58 0.90 119.26 123.90 2oq4 h ALA 15 Ca -0.04 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.60 2oq4 h ALA 15 Cb 0.42 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2oq4 h ALA 15 CO 0.03 -1.95 -1.33 0.00 0.00 0.00 0.00 179.25 176.00 2oq4 h ALA 16 N 1.24 0.59 0.00 0.00 0.00 -1.06 -3.43 119.26 116.59 2oq4 h ALA 16 Ca 0.81 -1.14 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2oq4 h ALA 16 Cb 3.11 0.18 0.00 0.00 0.00 0.00 0.00 17.79 21.08 2oq4 h ALA 16 CO -0.09 1.36 0.00 0.44 0.00 0.00 0.00 179.25 180.95 2oq4 n ILE 17 N -3.17 0.00 -1.69 0.00 -5.35 0.26 -4.50 119.36 104.91 2oq4 n ILE 17 Ca -0.08 0.00 -0.43 0.00 -0.27 0.00 0.00 62.75 61.96 2oq4 n ILE 17 Cb 0.98 1.46 -0.02 0.00 -1.74 0.00 0.00 39.64 40.32 2oq4 n ILE 17 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 2oq4 n LYS 18 N 0.00 2.16 -0.65 6.28 4.81 0.18 -1.90 118.16 129.05 2oq4 n LYS 18 Ca 0.00 0.76 0.00 0.00 -0.87 0.00 0.00 58.31 58.20 2oq4 n LYS 18 Cb 0.32 -2.41 0.00 0.00 0.02 0.00 0.00 35.03 32.96 2oq4 n LYS 18 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2oq4 n GLY 19 N 1.60 0.21 3.70 3.14 0.00 -0.41 -4.94 105.19 108.47 2oq4 n GLY 19 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2oq4 n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oq4 s LYS 20 N -0.86 4.21 0.13 1.61 1.02 -0.80 -4.93 119.74 120.11 2oq4 s LYS 20 Ca 0.00 0.09 -0.32 0.00 0.02 0.00 0.00 55.97 55.76 2oq4 s LYS 20 Cb 0.00 -3.48 -0.11 0.00 -0.52 0.00 0.00 37.83 33.71 2oq4 s LYS 20 CO 0.00 0.11 1.79 -2.30 -0.92 0.00 0.00 175.35 174.04 2oq4 n PRO 21 N 4.00 2.68 -2.18 -1.68 -0.02 -1.26 -4.35 135.00 132.19 2oq4 n PRO 21 Ca -0.11 0.97 -0.42 0.00 -2.02 0.00 0.00 63.50 61.92 2oq4 n PRO 21 Cb 0.52 -2.84 -0.03 0.00 -0.02 0.00 0.00 33.50 31.12 2oq4 n PRO 21 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2oq4 s LEU 22 N 2.36 4.35 0.21 2.45 1.43 -0.30 -4.39 118.68 124.80 2oq4 s LEU 22 Ca 0.81 2.26 0.22 0.00 -1.03 0.00 0.00 54.13 56.39 2oq4 s LEU 22 Cb -0.52 -3.58 0.02 0.00 0.03 0.00 0.00 46.19 42.14 2oq4 s LEU 22 CO 0.37 -0.68 1.08 0.71 0.23 0.00 0.00 176.35 178.07 2oq4 h THR 23 N 4.49 0.06 -2.39 5.49 1.35 -0.70 -2.79 112.91 118.42 2oq4 h THR 23 Ca -0.41 -1.12 -0.07 0.00 -0.55 0.00 0.00 66.41 64.27 2oq4 h THR 23 Cb 1.20 1.62 -0.24 0.00 -1.73 0.00 0.00 68.15 69.00 2oq4 h THR 23 CO 0.88 0.04 -0.15 -0.62 -0.25 0.00 0.00 175.52 175.41 2oq4 s ASP 24 N -5.50 -0.67 -0.18 5.36 2.15 -1.18 -4.98 116.67 111.67 2oq4 s ASP 24 Ca 0.00 1.14 0.00 0.00 0.43 0.00 0.00 52.55 54.12 2oq4 s ASP 24 Cb 0.09 1.04 0.01 0.00 -0.30 0.00 0.00 42.92 43.76 2oq4 s ASP 24 CO 0.78 -0.21 -0.17 -0.69 -0.17 0.00 0.00 175.17 174.71 2oq4 s VAL 25 N 1.27 2.37 -0.02 1.11 1.01 -1.26 -1.76 120.40 123.11 2oq4 s VAL 25 Ca -0.08 -0.84 0.03 0.00 0.00 0.00 0.00 61.98 61.09 2oq4 s VAL 25 Cb -0.06 -2.01 -0.00 0.00 0.00 0.00 0.00 36.38 34.31 2oq4 s VAL 25 CO -0.13 0.52 -0.11 0.86 0.00 0.00 0.00 175.10 176.24 2oq4 s TRP 26 N 1.21 1.07 0.08 5.22 -0.00 -0.56 -4.70 118.94 121.26 2oq4 s TRP 26 Ca 0.02 -0.26 0.06 0.00 -0.00 0.00 0.00 56.10 55.93 2oq4 s TRP 26 Cb -0.14 -0.74 -0.03 0.00 -0.00 0.00 0.00 33.47 32.56 2oq4 s TRP 26 CO -0.08 -0.09 -0.17 -0.06 -0.00 0.00 0.00 176.95 176.54 2oq4 s PHE 27 N 0.08 1.47 -0.15 5.86 0.08 -1.26 -1.64 117.98 122.41 2oq4 s PHE 27 Ca -0.02 -0.43 -0.02 0.00 0.12 0.00 0.00 56.93 56.58 2oq4 s PHE 27 Cb -0.08 -0.82 -0.23 0.00 -0.57 0.00 0.00 43.02 41.31 2oq4 s PHE 27 CO 0.01 0.12 0.23 0.00 -0.10 0.00 0.00 175.22 175.47 2oq4 n ALA 28 N 1.27 1.11 -1.02 5.36 0.00 -0.94 -4.88 120.51 121.41 2oq4 n ALA 28 Ca -0.20 -0.77 -0.34 0.00 0.00 0.00 0.00 53.44 52.13 2oq4 n ALA 28 Cb 0.54 -0.53 0.11 0.00 0.00 0.00 0.00 19.45 19.58 2oq4 n ALA 28 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2oq4 n PHE 29 N -3.35 -0.11 0.03 0.00 3.01 -1.26 -4.95 117.46 110.82 2oq4 n PHE 29 Ca -0.34 0.34 -0.11 0.00 1.01 0.00 0.00 57.45 58.35 2oq4 n PHE 29 Cb 1.04 -1.95 -0.13 0.00 -0.01 0.00 0.00 39.48 38.42 2oq4 n PHE 29 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2oq4 h PRO 30 N -1.03 0.08 -0.19 -1.08 0.13 -2.03 -3.35 132.00 124.53 2oq4 h PRO 30 Ca -0.45 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 2oq4 h PRO 30 Cb 1.30 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2oq4 h PRO 30 CO 0.41 0.85 0.00 0.00 -0.23 0.00 0.00 178.00 179.03 2oq4 n GLN 31 N -3.27 1.27 0.00 0.86 0.00 -1.26 -3.61 117.38 111.37 2oq4 n GLN 31 Ca -0.12 -0.38 0.00 0.00 0.00 0.00 0.00 57.00 56.50 2oq4 n GLN 31 Cb 1.02 -1.14 0.00 0.00 0.00 0.00 0.00 30.24 30.12 2oq4 n GLN 31 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2oq4 n LEU 32 N -0.17 0.26 0.29 2.61 4.77 -1.26 -4.79 117.00 118.71 2oq4 n LEU 32 Ca 0.04 -0.35 0.19 0.00 -0.03 0.00 0.00 56.01 55.86 2oq4 n LEU 32 Cb 0.12 0.00 0.84 0.00 -2.33 0.00 0.00 43.42 42.05 2oq4 n LEU 32 CO 0.03 0.06 1.05 0.11 -1.33 0.00 0.00 177.39 177.31 2oq4 h LYS 33 N 0.00 0.00 0.00 3.23 1.57 -1.69 -1.90 116.57 117.77 2oq4 h LYS 33 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2oq4 h LYS 33 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 2oq4 h LYS 33 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.88 2oq4 h THR 34 N 0.00 0.00 -0.10 -0.16 1.03 -1.87 -1.70 112.91 110.11 2oq4 h THR 34 Ca 0.00 -0.25 0.00 0.00 -0.01 0.00 0.00 66.41 66.15 2oq4 h THR 34 Cb 0.36 1.12 0.00 0.00 -1.07 0.00 0.00 68.15 68.55 2oq4 h THR 34 CO 0.00 0.00 0.00 -1.22 -0.01 0.00 0.00 175.52 174.29 2oq4 n TYR 35 N -2.78 0.12 0.22 0.00 4.01 -0.72 -4.34 117.16 113.68 2oq4 n TYR 35 Ca -0.00 -0.06 -0.13 0.00 -0.16 0.00 0.00 57.90 57.54 2oq4 n TYR 35 Cb 0.19 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.15 2oq4 n TYR 35 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 2oq4 h GLN 36 N 1.80 -0.56 -0.34 -0.72 4.20 -1.47 -3.23 115.11 114.79 2oq4 h GLN 36 Ca 0.00 0.04 -0.12 0.00 0.06 0.00 0.00 58.65 58.63 2oq4 h GLN 36 Cb 0.39 0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 2oq4 h GLN 36 CO 0.00 -0.26 -0.29 0.66 -0.67 0.00 0.00 178.83 178.28 2oq4 h SER 37 N -0.95 0.73 0.00 1.46 4.64 -1.80 -3.15 113.55 114.48 2oq4 h SER 37 Ca -0.06 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 2oq4 h SER 37 Cb 0.57 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2oq4 h SER 37 CO 0.10 0.97 0.07 -0.61 -0.87 0.00 0.00 176.83 176.49 2oq4 h GLN 38 N 0.60 0.00 0.00 4.77 4.15 -1.75 -2.92 115.11 119.96 2oq4 h GLN 38 Ca 0.07 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.49 2oq4 h GLN 38 Cb 0.79 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.48 2oq4 h GLN 38 CO 0.07 0.00 -1.64 1.28 -1.93 0.00 0.00 178.83 176.60 2oq4 n LEU 39 N -2.56 0.00 -4.62 -2.39 4.77 -1.19 -4.80 117.00 106.20 2oq4 n LEU 39 Ca -0.02 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.53 2oq4 n LEU 39 Cb 0.12 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 2oq4 n LEU 39 CO 0.13 0.00 1.69 -0.63 -1.33 0.00 0.00 177.39 177.25 2oq4 s ILE 40 N -2.97 3.13 0.00 -0.08 1.01 -1.11 0.15 121.20 121.33 2oq4 s ILE 40 Ca -0.05 0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.74 2oq4 s ILE 40 Cb 0.09 -3.14 0.00 0.00 0.01 0.00 0.00 42.46 39.42 2oq4 s ILE 40 CO 0.58 -0.07 0.00 0.61 0.00 0.00 0.00 174.94 176.07 2oq4 n GLY 41 N 5.20 2.51 3.26 6.18 0.00 -1.06 -4.98 105.19 116.31 2oq4 n GLY 41 Ca 0.25 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.05 2oq4 n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2oq4 n GLN 42 N -0.63 -0.43 -3.78 1.61 1.13 0.12 -4.71 117.38 110.70 2oq4 n GLN 42 Ca 0.00 -2.07 -0.10 0.00 -1.94 0.00 0.00 57.00 52.89 2oq4 n GLN 42 Cb 0.00 -0.79 -0.05 0.00 0.11 0.00 0.00 30.24 29.51 2oq4 n GLN 42 CO 0.00 0.00 0.00 -3.38 -1.44 0.00 0.00 177.06 172.24 2oq4 s HIS 43 N -2.91 0.01 0.00 1.08 -3.43 -1.26 -1.16 115.29 107.62 2oq4 s HIS 43 Ca 0.59 -0.36 -0.30 0.00 -0.80 0.00 0.00 55.06 54.18 2oq4 s HIS 43 Cb -0.03 0.21 -0.04 0.00 -1.43 0.00 0.00 32.58 31.30 2oq4 s HIS 43 CO 0.40 -0.79 1.12 0.08 -2.00 0.00 0.00 174.74 173.55 2oq4 s VAL 44 N -3.88 4.38 -0.05 -5.38 1.01 -1.26 -2.17 120.40 113.05 2oq4 s VAL 44 Ca 0.10 1.70 -0.24 0.00 0.00 0.00 0.00 61.98 63.54 2oq4 s VAL 44 Cb 0.01 -4.09 -0.24 0.00 0.00 0.00 0.00 36.38 32.06 2oq4 s VAL 44 CO -0.05 0.09 1.02 0.71 0.00 0.00 0.00 175.10 176.88 2oq4 h THR 45 N 4.76 1.53 -1.14 3.92 1.35 -0.88 -1.09 112.91 121.36 2oq4 h THR 45 Ca -0.39 -2.01 0.24 0.00 -0.55 0.00 0.00 66.41 63.71 2oq4 h THR 45 Cb 1.20 2.78 -0.25 0.00 -1.73 0.00 0.00 68.15 70.14 2oq4 h THR 45 CO 0.82 0.55 0.91 -1.38 -0.25 0.00 0.00 175.52 176.17 2oq4 s HIS 46 N -3.08 -0.07 -0.11 4.73 -3.43 -1.26 -4.69 115.29 107.38 2oq4 s HIS 46 Ca -0.15 0.11 -0.12 0.00 -0.80 0.00 0.00 55.06 54.10 2oq4 s HIS 46 Cb 0.01 0.49 -0.05 0.00 -1.43 0.00 0.00 32.58 31.61 2oq4 s HIS 46 CO 0.76 -0.08 0.27 0.08 -2.00 0.00 0.00 174.74 173.77 2oq4 s VAL 47 N -1.28 5.30 0.03 -5.38 1.01 -1.26 -2.59 120.40 116.23 2oq4 s VAL 47 Ca 0.08 0.50 0.06 0.00 0.00 0.00 0.00 61.98 62.62 2oq4 s VAL 47 Cb -0.01 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 2oq4 s VAL 47 CO -0.06 0.50 -0.14 -0.70 0.00 0.00 0.00 175.10 174.70 2oq4 s GLU 48 N -0.32 2.24 -0.11 2.72 2.12 0.16 -4.95 118.70 120.55 2oq4 s GLU 48 Ca 0.17 -0.89 0.03 0.00 0.36 0.00 0.00 54.97 54.64 2oq4 s GLU 48 Cb -0.13 -2.29 0.01 0.00 0.26 0.00 0.00 34.13 31.97 2oq4 s GLU 48 CO 0.06 0.56 -0.20 0.95 -0.54 0.00 0.00 175.26 176.09 2oq4 s THR 49 N -0.95 1.80 -0.49 -1.70 -4.23 -1.26 0.32 115.64 109.14 2oq4 s THR 49 Ca 0.15 -0.85 0.03 0.00 -1.18 0.00 0.00 61.69 59.85 2oq4 s THR 49 Cb -0.11 -1.60 0.15 0.00 1.34 0.00 0.00 72.50 72.28 2oq4 s THR 49 CO 0.06 0.50 0.30 -0.13 -0.54 0.00 0.00 174.62 174.81 2oq4 s ARG 50 N 0.66 1.47 7.81 3.99 0.52 -0.72 -4.98 118.95 127.69 2oq4 s ARG 50 Ca -0.12 -2.29 0.00 0.00 -0.52 0.00 0.00 55.73 52.80 2oq4 s ARG 50 Cb -0.16 -2.43 0.00 0.00 0.52 0.00 0.00 34.95 32.88 2oq4 s ARG 50 CO 0.03 -1.22 0.00 0.41 0.02 0.00 0.00 175.30 174.54 2oq4 n GLY 51 N 3.14 2.92 1.30 -3.53 0.00 -1.26 -1.76 105.19 105.99 2oq4 n GLY 51 Ca 0.14 -0.24 0.09 0.00 0.00 0.00 0.00 46.02 46.00 2oq4 n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2oq4 n LYS 52 N 12.85 2.96 -3.47 1.61 5.02 -1.26 -4.58 118.16 131.28 2oq4 n LYS 52 Ca 0.00 -2.36 -0.37 0.00 -2.02 0.00 0.00 58.31 53.56 2oq4 n LYS 52 Cb 0.00 -1.67 -0.07 0.00 -0.02 0.00 0.00 35.03 33.27 2oq4 n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2oq4 s ALA 53 N -1.53 3.56 -0.29 7.82 0.00 -0.72 -4.52 121.76 126.08 2oq4 s ALA 53 Ca 0.43 -0.46 -0.10 0.00 0.00 0.00 0.00 51.96 51.83 2oq4 s ALA 53 Cb 0.25 -2.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.85 2oq4 s ALA 53 CO 0.24 -0.05 0.17 -1.17 0.00 0.00 0.00 175.76 174.96 2oq4 s LEU 54 N 0.76 4.04 -0.42 0.00 2.96 -0.53 -1.76 118.68 123.73 2oq4 s LEU 54 Ca 0.18 -0.25 0.01 0.00 -0.22 0.00 0.00 54.13 53.85 2oq4 s LEU 54 Cb -0.14 -2.06 0.11 0.00 0.50 0.00 0.00 46.19 44.61 2oq4 s LEU 54 CO 0.06 -0.12 0.18 -0.76 -1.32 0.00 0.00 176.35 174.39 2oq4 s LEU 55 N 1.69 4.94 -0.23 -0.68 1.02 0.15 -1.77 118.68 123.80 2oq4 s LEU 55 Ca 0.06 -2.31 -0.22 0.00 0.02 0.00 0.00 54.13 51.69 2oq4 s LEU 55 Cb -0.16 -1.73 -0.02 0.00 0.02 0.00 0.00 46.19 44.30 2oq4 s LEU 55 CO 0.08 -0.42 0.69 -0.89 0.02 0.00 0.00 176.35 175.84 2oq4 s THR 56 N 0.72 4.95 -0.06 5.49 2.01 -0.90 0.40 115.64 128.24 2oq4 s THR 56 Ca 0.11 1.28 -0.15 0.00 0.31 0.00 0.00 61.69 63.25 2oq4 s THR 56 Cb -0.21 -3.99 -0.05 0.00 0.01 0.00 0.00 72.50 68.25 2oq4 s THR 56 CO -0.05 0.03 0.40 -1.00 -0.69 0.00 0.00 174.62 173.30 2oq4 s HIS 57 N 2.40 3.63 0.57 4.92 3.76 -1.07 -1.97 115.29 127.54 2oq4 s HIS 57 Ca 0.30 0.89 0.08 0.00 -0.15 0.00 0.00 55.06 56.17 2oq4 s HIS 57 Cb -0.16 -2.35 0.07 0.00 1.11 0.00 0.00 32.58 31.26 2oq4 s HIS 57 CO 0.09 0.47 0.63 -0.06 -0.85 0.00 0.00 174.74 175.02 2oq4 s PHE 58 N -0.43 1.42 0.15 1.40 0.08 -0.28 -0.26 117.98 120.06 2oq4 s PHE 58 Ca 0.23 -0.80 -0.01 0.00 0.12 0.00 0.00 56.93 56.47 2oq4 s PHE 58 Cb -0.16 -2.06 -0.05 0.00 -0.57 0.00 0.00 43.02 40.18 2oq4 s PHE 58 CO 0.11 -0.89 1.34 0.77 -0.10 0.00 0.00 175.22 176.45 2oq4 h SER 59 N 0.41 0.40 -0.23 1.36 0.02 -1.74 -3.26 113.55 110.51 2oq4 h SER 59 Ca -0.32 -0.32 -0.08 0.00 -0.84 0.00 0.00 61.79 60.23 2oq4 h SER 59 Cb 1.30 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 63.67 2oq4 h SER 59 CO 0.48 1.12 0.10 -0.46 -1.14 0.00 0.00 176.83 176.93 2oq4 n ASN 60 N -3.71 2.81 0.00 3.07 6.94 -1.26 -4.86 115.26 118.25 2oq4 n ASN 60 Ca -0.05 -2.37 0.00 0.00 -0.02 0.00 0.00 54.58 52.14 2oq4 n ASN 60 Cb 0.82 -0.58 0.00 0.00 -2.36 0.00 0.00 39.78 37.66 2oq4 n ASN 60 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2oq4 n ASP 61 N 0.10 -1.63 -4.86 0.53 8.00 -1.23 -5.00 116.55 112.46 2oq4 n ASP 61 Ca 0.13 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.31 2oq4 n ASP 61 Cb 0.69 -1.62 -0.04 0.00 -0.02 0.00 0.00 41.12 40.13 2oq4 n ASP 61 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2oq4 s LEU 62 N 0.00 3.85 -0.11 0.64 1.43 -1.26 -4.18 118.68 119.04 2oq4 s LEU 62 Ca 0.00 1.30 -0.01 0.00 -1.03 0.00 0.00 54.13 54.38 2oq4 s LEU 62 Cb 0.00 -4.17 0.03 0.00 0.03 0.00 0.00 46.19 42.08 2oq4 s LEU 62 CO 0.00 -0.39 -0.02 -0.89 0.23 0.00 0.00 176.35 175.28 2oq4 s THR 63 N -2.32 0.67 -0.17 5.49 2.01 0.39 -1.13 115.64 120.57 2oq4 s THR 63 Ca 0.54 -0.19 -0.24 0.00 0.31 0.00 0.00 61.69 62.11 2oq4 s THR 63 Cb -0.10 -0.85 -0.02 0.00 0.01 0.00 0.00 72.50 71.54 2oq4 s THR 63 CO 0.27 0.19 0.77 -0.22 -0.69 0.00 0.00 174.62 174.94 2oq4 s LEU 64 N 1.84 4.17 -0.15 4.42 0.20 -0.83 0.93 118.68 129.26 2oq4 s LEU 64 Ca 0.03 1.07 -0.06 0.00 0.69 0.00 0.00 54.13 55.87 2oq4 s LEU 64 Cb -0.13 -3.13 -0.04 0.00 -0.43 0.00 0.00 46.19 42.46 2oq4 s LEU 64 CO -0.07 -0.35 0.06 -0.47 -0.29 0.00 0.00 176.35 175.23 2oq4 s TYR 65 N 2.02 3.29 -0.14 5.38 5.04 -0.96 -2.13 117.35 129.86 2oq4 s TYR 65 Ca 0.35 0.17 -0.07 0.00 -2.44 0.00 0.00 57.07 55.08 2oq4 s TYR 65 Cb -0.16 -1.99 0.05 0.00 0.35 0.00 0.00 41.96 40.21 2oq4 s TYR 65 CO 0.12 0.32 0.33 -1.54 -1.34 0.00 0.00 175.55 173.44 2oq4 s SER 66 N -0.15 -0.39 -0.25 4.32 1.04 -0.73 -1.72 113.70 115.82 2oq4 s SER 66 Ca 0.07 0.70 0.00 0.00 0.48 0.00 0.00 55.95 57.21 2oq4 s SER 66 Cb -0.12 0.59 0.07 0.00 0.10 0.00 0.00 66.02 66.66 2oq4 s SER 66 CO 0.01 -0.18 -0.01 -2.28 0.98 0.00 0.00 173.24 171.77 2oq4 s HIS 67 N 1.33 2.27 -1.89 5.02 2.46 -0.76 -1.46 115.29 122.26 2oq4 s HIS 67 Ca -0.09 -1.78 0.02 0.00 0.47 0.00 0.00 55.06 53.68 2oq4 s HIS 67 Cb -0.09 -1.68 0.12 0.00 -0.13 0.00 0.00 32.58 30.80 2oq4 s HIS 67 CO -0.11 -0.79 0.66 0.09 -2.47 0.00 0.00 174.74 172.13 2oq4 n ASN 68 N 4.70 0.00 0.00 9.88 5.03 -1.26 -4.24 115.26 129.37 2oq4 n ASN 68 Ca -0.08 -0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.36 2oq4 n ASN 68 Cb 0.44 -0.05 0.00 0.00 -1.02 0.00 0.00 39.78 39.14 2oq4 n ASN 68 CO 0.00 0.00 0.00 1.67 -1.83 0.00 0.00 177.26 177.10 2oq4 n GLN 69 N -1.05 0.00 -0.00 3.52 7.27 -1.26 0.72 117.38 126.57 2oq4 n GLN 69 Ca 0.01 0.00 0.06 0.00 0.07 0.00 0.00 57.00 57.14 2oq4 n GLN 69 Cb 0.01 0.00 -0.08 0.00 2.41 0.00 0.00 30.24 32.58 2oq4 n GLN 69 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 2oq4 n LEU 70 N 0.00 0.40 0.00 1.69 0.00 -1.26 -4.75 117.00 113.09 2oq4 n LEU 70 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 56.01 55.66 2oq4 n LEU 70 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 2oq4 n LEU 70 CO 0.00 0.10 -0.08 0.00 0.00 0.00 0.00 177.39 177.41 2oq4 n TYR 71 N -1.49 0.00 -1.87 1.96 0.18 -0.48 -4.94 117.16 110.53 2oq4 n TYR 71 Ca 0.01 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.37 2oq4 n TYR 71 Cb 0.23 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.17 2oq4 n TYR 71 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 2oq4 s GLY 72 N -0.68 1.61 -0.02 -7.48 0.00 0.22 -4.62 107.32 96.35 2oq4 s GLY 72 Ca 0.00 1.45 0.01 0.00 0.00 0.00 0.00 44.72 46.18 2oq4 s GLY 72 CO 0.00 2.65 -0.03 -1.34 0.00 0.00 0.00 173.10 174.38 2oq4 s VAL 73 N 0.89 0.38 -0.00 1.40 -7.23 -1.08 -4.74 120.40 110.02 2oq4 s VAL 73 Ca 0.69 -0.10 -0.10 0.00 -1.81 0.00 0.00 61.98 60.67 2oq4 s VAL 73 Cb -0.46 -0.40 -0.05 0.00 0.56 0.00 0.00 36.38 36.04 2oq4 s VAL 73 CO 0.35 0.16 0.31 0.26 -0.31 0.00 0.00 175.10 175.87 2oq4 s TRP 74 N 0.54 3.63 -0.05 2.82 0.52 -1.26 -0.93 118.94 124.21 2oq4 s TRP 74 Ca -0.06 0.73 0.01 0.00 0.02 0.00 0.00 56.10 56.80 2oq4 s TRP 74 Cb -0.10 -2.10 0.02 0.00 -1.15 0.00 0.00 33.47 30.15 2oq4 s TRP 74 CO -0.00 0.63 -0.05 0.50 0.02 0.00 0.00 176.95 178.04 2oq4 s ARG 75 N -1.47 0.88 -0.19 4.98 6.06 -0.07 -4.97 118.95 124.17 2oq4 s ARG 75 Ca 0.25 -0.12 -0.10 0.00 -2.50 0.00 0.00 55.73 53.27 2oq4 s ARG 75 Cb -0.14 -0.88 -0.05 0.00 0.06 0.00 0.00 34.95 33.94 2oq4 s ARG 75 CO 0.13 -0.08 0.12 0.08 -2.50 0.00 0.00 175.30 173.06 2oq4 s VAL 76 N 0.92 5.35 0.26 7.11 1.01 -1.26 -0.14 120.40 133.64 2oq4 s VAL 76 Ca -0.11 0.17 -0.09 0.00 0.00 0.00 0.00 61.98 61.95 2oq4 s VAL 76 Cb -0.14 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 32.80 2oq4 s VAL 76 CO 0.00 0.45 0.42 0.68 0.00 0.00 0.00 175.10 176.66 2oq4 s VAL 77 N 0.27 0.00 0.39 2.92 -7.23 -1.20 -5.00 120.40 110.55 2oq4 s VAL 77 Ca 0.08 -1.54 -0.21 0.00 -1.81 0.00 0.00 61.98 58.50 2oq4 s VAL 77 Cb -0.11 -2.34 -0.10 0.00 0.56 0.00 0.00 36.38 34.38 2oq4 s VAL 77 CO -0.01 0.00 0.92 -1.81 -0.31 0.00 0.00 175.10 173.88 2oq4 s ASP 78 N -3.08 6.98 0.25 4.85 1.01 -1.26 -0.08 116.67 125.35 2oq4 s ASP 78 Ca 0.27 1.65 -0.30 0.00 0.71 0.00 0.00 52.55 54.88 2oq4 s ASP 78 Cb 0.01 -2.52 -0.14 0.00 1.01 0.00 0.00 42.92 41.27 2oq4 s ASP 78 CO 0.12 -0.28 1.12 0.41 0.21 0.00 0.00 175.17 176.74 2oq4 n THR 79 N -0.38 1.55 0.00 -1.27 -1.04 0.33 -2.27 114.28 111.20 2oq4 n THR 79 Ca 0.05 -0.39 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 2oq4 n THR 79 Cb 0.53 -1.04 0.00 0.00 -1.82 0.00 0.00 70.33 68.00 2oq4 n THR 79 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2oq4 n GLY 80 N 1.55 2.62 3.71 3.41 0.00 -1.26 -5.00 105.19 110.22 2oq4 n GLY 80 Ca 0.11 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2oq4 n GLY 80 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oq4 s GLU 81 N 0.00 4.53 -0.42 1.61 2.02 -0.96 -5.01 118.70 120.47 2oq4 s GLU 81 Ca 0.00 1.36 0.02 0.00 0.02 0.00 0.00 54.97 56.37 2oq4 s GLU 81 Cb 0.00 -3.47 0.14 0.00 0.10 0.00 0.00 34.13 30.90 2oq4 s GLU 81 CO 0.00 -0.07 0.23 -2.00 0.02 0.00 0.00 175.26 173.44 2oq4 s GLU 82 N 1.11 1.10 -0.28 1.61 2.12 -1.26 -4.73 118.70 118.36 2oq4 s GLU 82 Ca 0.50 -1.82 -0.32 0.00 0.36 0.00 0.00 54.97 53.69 2oq4 s GLU 82 Cb -0.20 -2.08 -0.09 0.00 0.26 0.00 0.00 34.13 32.02 2oq4 s GLU 82 CO 0.26 -1.17 2.20 -2.30 -0.54 0.00 0.00 175.26 173.71 2oq4 n PRO 83 N 3.69 1.49 -1.39 4.30 -0.02 -1.26 -4.90 135.00 136.92 2oq4 n PRO 83 Ca 0.09 0.41 -0.44 0.00 -2.02 0.00 0.00 63.50 61.54 2oq4 n PRO 83 Cb 0.35 -2.81 -0.01 0.00 -0.02 0.00 0.00 33.50 31.01 2oq4 n PRO 83 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oq4 n GLN 84 N 8.42 0.23 -3.65 -0.52 10.64 -1.26 -4.95 117.38 126.29 2oq4 n GLN 84 Ca 0.36 0.08 -0.01 0.00 -1.83 0.00 0.00 57.00 55.61 2oq4 n GLN 84 Cb 0.33 -1.18 -0.01 0.00 -0.86 0.00 0.00 30.24 28.52 2oq4 n GLN 84 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.06 175.15 2oq4 s THR 85 N -1.34 0.00 -2.54 -0.39 -1.32 -1.26 -5.05 115.64 103.74 2oq4 s THR 85 Ca 0.62 -0.31 0.23 0.00 -1.21 0.00 0.00 61.69 61.02 2oq4 s THR 85 Cb -0.74 -1.87 0.39 0.00 -1.51 0.00 0.00 72.50 68.78 2oq4 s THR 85 CO 0.59 0.00 1.42 1.07 -2.21 0.00 0.00 174.62 175.49 2oq4 n THR 86 N -0.44 0.33 -3.37 5.08 5.66 -1.26 -4.95 114.28 115.33 2oq4 n THR 86 Ca -0.07 -0.60 -0.30 0.00 -3.05 0.00 0.00 64.05 60.03 2oq4 n THR 86 Cb 0.62 0.93 -0.04 0.00 -1.55 0.00 0.00 70.33 70.29 2oq4 n THR 86 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2oq4 s ARG 87 N -1.67 3.69 -0.09 1.09 0.52 -1.26 -5.07 118.95 116.16 2oq4 s ARG 87 Ca 0.35 0.10 -0.21 0.00 -0.52 0.00 0.00 55.73 55.46 2oq4 s ARG 87 Cb 0.21 -2.65 -0.04 0.00 0.52 0.00 0.00 34.95 32.99 2oq4 s ARG 87 CO 0.30 0.26 0.58 0.08 0.02 0.00 0.00 175.30 176.54 2oq4 s VAL 88 N -1.97 5.11 0.01 3.52 1.01 -1.26 -4.91 120.40 121.90 2oq4 s VAL 88 Ca 0.45 1.18 -0.30 0.00 0.00 0.00 0.00 61.98 63.31 2oq4 s VAL 88 Cb -0.11 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 2oq4 s VAL 88 CO 0.27 0.30 1.11 -0.22 0.00 0.00 0.00 175.10 176.56 2oq4 s LEU 89 N 0.62 4.35 -0.11 3.92 2.96 -1.26 -1.60 118.68 127.55 2oq4 s LEU 89 Ca 0.31 1.82 0.04 0.00 -0.22 0.00 0.00 54.13 56.08 2oq4 s LEU 89 Cb -0.16 -3.57 -0.09 0.00 0.50 0.00 0.00 46.19 42.86 2oq4 s LEU 89 CO 0.14 -0.41 -0.06 0.54 -1.32 0.00 0.00 176.35 175.24 2oq4 n ARG 90 N 4.20 1.06 -3.92 1.98 5.12 -0.39 -4.68 116.66 120.02 2oq4 n ARG 90 Ca 0.08 0.04 -0.11 0.00 -1.93 0.00 0.00 57.85 55.93 2oq4 n ARG 90 Cb 0.48 -1.25 -0.13 0.00 -1.16 0.00 0.00 32.46 30.40 2oq4 n ARG 90 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2oq4 s VAL 91 N -2.24 0.06 -0.14 1.55 1.01 -0.90 -2.21 120.40 117.53 2oq4 s VAL 91 Ca -0.12 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 2oq4 s VAL 91 Cb 0.04 -0.11 0.05 0.00 0.00 0.00 0.00 36.38 36.36 2oq4 s VAL 91 CO 0.32 -0.15 0.08 -0.75 0.00 0.00 0.00 175.10 174.61 2oq4 s LYS 92 N -0.46 0.04 -0.50 2.72 2.20 -0.65 0.17 119.74 123.24 2oq4 s LYS 92 Ca -0.05 0.01 -0.01 0.00 -0.36 0.00 0.00 55.97 55.57 2oq4 s LYS 92 Cb -0.03 -1.56 0.13 0.00 -1.51 0.00 0.00 37.83 34.86 2oq4 s LYS 92 CO -0.00 -0.60 0.29 -0.51 -0.36 0.00 0.00 175.35 174.17 2oq4 s LEU 93 N 2.14 5.02 0.14 5.43 1.43 -0.81 -1.50 118.68 130.54 2oq4 s LEU 93 Ca 0.03 -2.54 -0.02 0.00 -1.03 0.00 0.00 54.13 50.56 2oq4 s LEU 93 Cb -0.15 -1.78 -0.05 0.00 0.03 0.00 0.00 46.19 44.24 2oq4 s LEU 93 CO -0.08 -0.40 0.34 -1.58 0.23 0.00 0.00 176.35 174.86 2oq4 s GLN 94 N 0.39 3.54 0.34 1.70 0.74 -0.72 -2.67 119.66 122.98 2oq4 s GLN 94 Ca 0.13 -0.25 0.07 0.00 0.05 0.00 0.00 55.36 55.36 2oq4 s GLN 94 Cb -0.22 -2.89 -0.03 0.00 1.10 0.00 0.00 33.01 30.97 2oq4 s GLN 94 CO -0.04 0.48 0.27 0.95 -0.55 0.00 0.00 175.29 176.40 2oq4 s THR 95 N -1.69 0.06 0.40 -0.34 -4.23 -0.69 0.02 115.64 109.17 2oq4 s THR 95 Ca 0.39 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 59.06 2oq4 s THR 95 Cb -0.12 -2.48 0.37 0.00 1.34 0.00 0.00 72.50 71.62 2oq4 s THR 95 CO 0.27 0.00 1.83 0.00 -0.54 0.00 0.00 174.62 176.18 2oq4 h ALA 96 N 2.08 2.15 0.00 3.99 0.00 -1.96 -3.36 119.26 122.16 2oq4 h ALA 96 Ca -0.26 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2oq4 h ALA 96 Cb 1.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2oq4 h ALA 96 CO 0.38 -0.47 -0.95 -0.40 0.00 0.00 0.00 179.25 177.81 2oq4 n ASP 97 N -4.55 2.47 -4.69 0.00 5.75 -1.26 -4.73 116.55 109.54 2oq4 n ASP 97 Ca 0.21 0.00 -0.32 0.00 -0.01 0.00 0.00 54.79 54.67 2oq4 n ASP 97 Cb 0.72 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.72 2oq4 n ASP 97 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2oq4 s LYS 98 N -1.97 2.73 -0.32 0.11 -0.14 -1.26 -0.51 119.74 118.39 2oq4 s LYS 98 Ca 0.00 -0.67 -0.02 0.00 -1.36 0.00 0.00 55.97 53.92 2oq4 s LYS 98 Cb 0.00 -2.64 0.11 0.00 -1.68 0.00 0.00 37.83 33.62 2oq4 s LYS 98 CO 0.00 0.60 0.15 0.99 -0.76 0.00 0.00 175.35 176.33 2oq4 s THR 99 N -1.15 0.17 0.31 2.17 2.01 0.89 -1.71 115.64 118.34 2oq4 s THR 99 Ca 0.21 -1.18 -0.28 0.00 0.31 0.00 0.00 61.69 60.76 2oq4 s THR 99 Cb -0.12 -1.15 -0.09 0.00 0.01 0.00 0.00 72.50 71.15 2oq4 s THR 99 CO 0.13 -0.80 1.07 0.27 -0.69 0.00 0.00 174.62 174.59 2oq4 s ILE 100 N 1.68 3.62 0.03 1.82 -4.36 -1.09 -3.25 121.20 119.65 2oq4 s ILE 100 Ca 0.12 1.51 0.06 0.00 -0.26 0.00 0.00 60.65 62.08 2oq4 s ILE 100 Cb -0.18 -3.91 -0.02 0.00 1.25 0.00 0.00 42.46 39.59 2oq4 s ILE 100 CO -0.24 0.27 -0.18 -0.76 0.24 0.00 0.00 174.94 174.27 2oq4 s LEU 101 N -1.78 2.14 -0.30 0.37 1.43 0.80 -1.92 118.68 119.40 2oq4 s LEU 101 Ca 0.48 -0.45 -0.04 0.00 -1.03 0.00 0.00 54.13 53.09 2oq4 s LEU 101 Cb -0.28 -0.85 0.04 0.00 0.03 0.00 0.00 46.19 45.13 2oq4 s LEU 101 CO 0.36 0.14 0.03 -0.22 0.23 0.00 0.00 176.35 176.89 2oq4 s LEU 102 N -0.98 3.92 0.44 1.79 2.96 0.13 -0.90 118.68 126.04 2oq4 s LEU 102 Ca 0.06 -1.13 0.00 0.00 -0.22 0.00 0.00 54.13 52.84 2oq4 s LEU 102 Cb -0.08 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.84 2oq4 s LEU 102 CO 0.01 -0.26 0.66 -0.31 -1.32 0.00 0.00 176.35 175.13 2oq4 s TYR 103 N 1.33 3.24 0.00 5.38 1.51 -0.11 -1.27 117.35 127.44 2oq4 s TYR 103 Ca -0.03 0.23 0.00 0.00 -1.01 0.00 0.00 57.07 56.26 2oq4 s TYR 103 Cb -0.19 -2.27 0.00 0.00 -0.11 0.00 0.00 41.96 39.39 2oq4 s TYR 103 CO -0.00 -0.31 0.00 0.45 -1.11 0.00 0.00 175.55 174.58 2oq4 n SER 104 N -2.05 0.00 -4.61 2.29 2.88 -0.63 -2.63 113.62 108.87 2oq4 n SER 104 Ca 0.01 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.12 2oq4 n SER 104 Cb 0.57 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.03 2oq4 n SER 104 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2oq4 n ALA 105 N 0.00 0.14 0.23 -1.46 0.00 -1.26 -4.74 120.51 113.42 2oq4 n ALA 105 Ca 0.00 0.33 0.04 0.00 0.00 0.00 0.00 53.44 53.81 2oq4 n ALA 105 Cb 0.00 -2.07 -0.05 0.00 0.00 0.00 0.00 19.45 17.32 2oq4 n ALA 105 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2oq4 n SER 106 N 0.94 1.45 -4.39 0.00 3.41 -1.26 -4.87 113.62 108.89 2oq4 n SER 106 Ca 0.09 -0.42 -0.44 0.00 -0.26 0.00 0.00 58.87 57.83 2oq4 n SER 106 Cb 0.35 1.15 -0.04 0.00 -0.26 0.00 0.00 64.21 65.40 2oq4 n SER 106 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2oq4 s ASP 107 N -2.23 6.18 -0.21 4.04 1.01 -1.26 -4.97 116.67 119.23 2oq4 s ASP 107 Ca 0.01 -1.34 -0.04 0.00 0.71 0.00 0.00 52.55 51.88 2oq4 s ASP 107 Cb 0.06 -2.32 0.11 0.00 1.01 0.00 0.00 42.92 41.77 2oq4 s ASP 107 CO 0.34 -1.18 0.35 -0.63 0.21 0.00 0.00 175.17 174.25 2oq4 s ILE 108 N 2.95 -0.54 0.49 0.77 1.01 -1.26 -1.83 121.20 122.79 2oq4 s ILE 108 Ca 0.14 0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.83 2oq4 s ILE 108 Cb -0.23 -0.71 -0.02 0.00 0.01 0.00 0.00 42.46 41.51 2oq4 s ILE 108 CO 0.07 -0.06 0.00 -1.61 0.00 0.00 0.00 174.94 173.34 2oq4 s GLU 109 N 2.51 2.15 -0.19 2.79 2.02 -0.70 -4.98 118.70 122.30 2oq4 s GLU 109 Ca 0.07 -2.35 0.00 0.00 0.02 0.00 0.00 54.97 52.72 2oq4 s GLU 109 Cb -0.14 -1.55 0.04 0.00 0.10 0.00 0.00 34.13 32.57 2oq4 s GLU 109 CO -0.14 -0.31 -0.09 1.41 0.02 0.00 0.00 175.26 176.16 2oq4 s MET 110 N -3.85 1.86 -0.12 1.61 -2.45 -1.26 -2.26 119.30 112.83 2oq4 s MET 110 Ca 0.11 -0.73 -0.04 0.00 -1.25 0.00 0.00 55.69 53.78 2oq4 s MET 110 Cb 0.03 -2.27 -0.04 0.00 1.25 0.00 0.00 34.83 33.80 2oq4 s MET 110 CO 0.06 -0.42 0.04 -0.51 1.05 0.00 0.00 175.02 175.24 2oq4 s LEU 111 N 1.47 3.75 0.18 4.11 1.43 0.26 -4.95 118.68 124.93 2oq4 s LEU 111 Ca -0.00 0.16 0.01 0.00 -1.03 0.00 0.00 54.13 53.26 2oq4 s LEU 111 Cb -0.16 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 2oq4 s LEU 111 CO -0.08 0.31 0.33 -0.13 0.23 0.00 0.00 176.35 177.01 2oq4 s ARG 112 N -0.45 3.47 0.29 1.70 0.52 -1.26 -0.46 118.95 122.77 2oq4 s ARG 112 Ca 0.09 -0.49 -0.02 0.00 -0.52 0.00 0.00 55.73 54.79 2oq4 s ARG 112 Cb -0.12 -2.91 0.63 0.00 0.52 0.00 0.00 34.95 33.07 2oq4 s ARG 112 CO 0.02 0.46 1.59 -1.35 0.02 0.00 0.00 175.30 176.04 2oq4 h PRO 113 N 2.03 0.04 -0.01 3.54 0.11 -1.98 1.87 132.00 137.60 2oq4 h PRO 113 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2oq4 h PRO 113 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2oq4 h PRO 113 CO 0.68 0.03 0.00 0.39 -0.21 0.00 0.00 178.00 178.89 2oq4 n GLU 114 N -5.46 1.06 -0.02 1.05 1.02 -1.26 -3.07 120.64 113.97 2oq4 n GLU 114 Ca 0.20 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 2oq4 n GLU 114 Cb 0.65 -1.41 -0.05 0.00 -0.02 0.00 0.00 31.44 30.61 2oq4 n GLU 114 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 2oq4 n GLN 115 N -0.81 1.65 0.00 3.49 7.27 0.53 -4.67 117.38 124.83 2oq4 n GLN 115 Ca 0.19 -0.03 0.00 0.00 0.07 0.00 0.00 57.00 57.23 2oq4 n GLN 115 Cb 0.11 -1.15 0.00 0.00 2.41 0.00 0.00 30.24 31.61 2oq4 n GLN 115 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 2oq4 n LEU 116 N -1.98 0.05 -0.08 1.69 0.00 0.45 -3.18 117.00 113.96 2oq4 n LEU 116 Ca -0.06 0.06 0.01 0.00 0.00 0.00 0.00 56.01 56.02 2oq4 n LEU 116 Cb 0.44 0.00 0.02 0.00 0.00 0.00 0.00 43.42 43.88 2oq4 n LEU 116 CO 0.13 0.00 0.14 0.35 0.00 0.00 0.00 177.39 178.01 2oq4 n THR 117 N -0.06 -0.10 1.34 1.96 -2.24 -1.25 0.11 114.28 114.04 2oq4 n THR 117 Ca 0.00 0.50 0.14 0.00 -2.27 0.00 0.00 64.05 62.41 2oq4 n THR 117 Cb 0.00 -0.68 0.71 0.00 -2.10 0.00 0.00 70.33 68.26 2oq4 n THR 117 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2oq4 n THR 118 N -4.34 0.10 -1.63 4.28 -2.24 -1.26 -3.99 114.28 105.20 2oq4 n THR 118 Ca 0.03 0.02 -0.53 0.00 -2.27 0.00 0.00 64.05 61.31 2oq4 n THR 118 Cb 0.10 -0.57 -0.06 0.00 -2.10 0.00 0.00 70.33 67.70 2oq4 n THR 118 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2oq4 n HIS 119 N -1.26 1.72 -0.31 4.78 -0.00 0.31 -4.69 115.22 115.75 2oq4 n HIS 119 Ca 0.14 0.57 0.16 0.00 -0.00 0.00 0.00 57.72 58.59 2oq4 n HIS 119 Cb 0.21 -2.39 0.35 0.00 -0.00 0.00 0.00 29.99 28.17 2oq4 n HIS 119 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2oq4 h PRO 120 N 5.40 0.33 0.05 1.57 0.13 -1.90 0.20 132.00 137.78 2oq4 h PRO 120 Ca -0.47 -0.02 -0.28 0.00 -0.87 0.00 0.00 66.00 64.36 2oq4 h PRO 120 Cb 1.32 -0.07 0.02 0.00 0.13 0.00 0.00 31.00 32.40 2oq4 h PRO 120 CO 0.83 0.22 -1.13 0.35 -0.23 0.00 0.00 178.00 178.04 2oq4 h PHE 121 N 0.34 1.03 0.00 1.56 3.57 -1.97 -3.01 116.94 118.46 2oq4 h PHE 121 Ca 0.61 -0.59 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 2oq4 h PHE 121 Cb 1.25 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.88 2oq4 h PHE 121 CO -0.13 1.43 -0.40 -0.07 -2.23 0.00 0.00 178.31 176.91 2oq4 h LEU 122 N 0.35 0.00 0.00 0.59 3.38 -1.61 -2.95 115.31 115.06 2oq4 h LEU 122 Ca -0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 2oq4 h LEU 122 Cb 1.79 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.54 2oq4 h LEU 122 CO 0.22 0.40 -0.54 -0.61 0.09 0.00 0.00 178.44 178.00 2oq4 h GLN 123 N 0.00 0.00 0.00 1.13 -0.00 -0.73 -3.36 115.11 112.14 2oq4 h GLN 123 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2oq4 h GLN 123 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.27 2oq4 h GLN 123 CO 0.05 0.03 -1.01 -2.13 0.00 0.00 0.00 178.83 175.77 2oq4 n ARG 124 N -2.90 0.43 -3.26 1.69 0.63 -1.13 -4.94 116.66 107.18 2oq4 n ARG 124 Ca 0.02 0.04 -0.38 0.00 -0.92 0.00 0.00 57.85 56.61 2oq4 n ARG 124 Cb 0.56 -1.69 -0.06 0.00 0.45 0.00 0.00 32.46 31.72 2oq4 n ARG 124 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2oq4 s VAL 125 N -3.28 5.09 0.00 5.15 -7.23 -1.14 -4.11 120.40 114.89 2oq4 s VAL 125 Ca 0.02 1.09 0.00 0.00 -1.81 0.00 0.00 61.98 61.28 2oq4 s VAL 125 Cb 0.12 -3.87 0.00 0.00 0.56 0.00 0.00 36.38 33.19 2oq4 s VAL 125 CO 0.79 0.35 0.00 0.61 -0.31 0.00 0.00 175.10 176.54 2oq4 n GLY 126 N 2.96 -2.31 3.49 2.32 0.00 0.22 -4.89 105.19 106.97 2oq4 n GLY 126 Ca -0.06 -1.46 -0.44 0.00 0.00 0.00 0.00 46.02 44.06 2oq4 n GLY 126 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2oq4 n PRO 127 N -1.34 0.71 -2.94 1.61 -0.02 -1.26 -3.79 135.00 127.98 2oq4 n PRO 127 Ca 0.00 0.25 -0.42 0.00 -2.02 0.00 0.00 63.50 61.31 2oq4 n PRO 127 Cb 0.00 -1.52 -0.05 0.00 -0.02 0.00 0.00 33.50 31.91 2oq4 n PRO 127 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2oq4 s ASP 128 N -0.83 6.64 0.60 2.55 -1.08 -1.26 0.73 116.67 124.01 2oq4 s ASP 128 Ca 0.62 0.59 0.29 0.00 -0.52 0.00 0.00 52.55 53.53 2oq4 s ASP 128 Cb -0.70 -2.41 1.56 0.00 -1.46 0.00 0.00 42.92 39.91 2oq4 s ASP 128 CO 0.58 -0.65 1.96 -0.37 0.52 0.00 0.00 175.17 177.20 2oq4 h VAL 129 N 5.64 0.33 -0.38 1.11 -1.51 -1.61 -0.39 116.25 119.45 2oq4 h VAL 129 Ca -0.24 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.23 2oq4 h VAL 129 Cb 1.09 0.68 0.00 0.00 -2.13 0.00 0.00 31.29 30.94 2oq4 h VAL 129 CO 0.89 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 177.41 2oq4 n LEU 130 N -3.59 2.09 -4.60 4.19 4.77 -1.26 -4.84 117.00 113.76 2oq4 n LEU 130 Ca 0.05 -1.05 -0.42 0.00 -0.03 0.00 0.00 56.01 54.56 2oq4 n LEU 130 Cb 0.53 -0.27 -0.05 0.00 -2.33 0.00 0.00 43.42 41.29 2oq4 n LEU 130 CO 0.25 0.51 0.53 -0.62 -1.33 0.00 0.00 177.39 176.73 2oq4 s ASP 131 N -0.98 6.57 0.51 -1.43 -1.08 -0.16 -4.92 116.67 115.18 2oq4 s ASP 131 Ca 0.26 0.47 0.32 0.00 -0.52 0.00 0.00 52.55 53.08 2oq4 s ASP 131 Cb 0.14 -2.38 1.45 0.00 -1.46 0.00 0.00 42.92 40.66 2oq4 s ASP 131 CO 0.17 -0.62 1.81 -0.65 0.52 0.00 0.00 175.17 176.40 2oq4 h PRO 132 N 8.28 0.08 -0.10 4.34 0.11 -1.89 0.60 132.00 143.42 2oq4 h PRO 132 Ca -0.25 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.77 2oq4 h PRO 132 Cb 1.10 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2oq4 h PRO 132 CO 0.87 0.05 -0.31 -0.91 -0.21 0.00 0.00 178.00 177.50 2oq4 h ASN 133 N 0.08 0.18 -2.77 -2.05 -0.26 -1.95 -3.41 115.58 105.41 2oq4 h ASN 133 Ca 0.55 -0.06 -0.56 0.00 -0.56 0.00 0.00 56.30 55.67 2oq4 h ASN 133 Cb 2.02 -0.05 -0.03 0.00 -1.06 0.00 0.00 38.32 39.21 2oq4 h ASN 133 CO -0.07 0.49 1.08 -0.22 -1.06 0.00 0.00 177.43 177.65 2oq4 s LEU 134 N -8.41 4.02 0.28 1.61 2.96 0.21 -4.98 118.68 114.37 2oq4 s LEU 134 Ca -0.04 1.74 0.08 0.00 -0.22 0.00 0.00 54.13 55.69 2oq4 s LEU 134 Cb 0.14 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.26 2oq4 s LEU 134 CO 0.75 -1.12 0.10 0.42 -1.32 0.00 0.00 176.35 175.18 2oq4 s THR 135 N 4.71 3.64 0.15 3.68 -4.23 -1.26 -4.89 115.64 117.43 2oq4 s THR 135 Ca 0.69 -1.69 -0.18 0.00 -1.18 0.00 0.00 61.69 59.34 2oq4 s THR 135 Cb -0.26 -3.05 0.02 0.00 1.34 0.00 0.00 72.50 70.55 2oq4 s THR 135 CO 0.27 -0.31 1.71 -0.65 -0.54 0.00 0.00 174.62 175.10 2oq4 h PRO 136 N 1.66 0.11 -0.72 3.99 0.11 -1.94 -1.65 132.00 133.56 2oq4 h PRO 136 Ca -0.45 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.75 2oq4 h PRO 136 Cb 1.25 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.29 2oq4 h PRO 136 CO 0.61 0.07 0.47 0.93 -0.21 0.00 0.00 178.00 179.87 2oq4 h GLU 137 N 0.11 0.57 -0.05 1.05 3.07 -1.96 -1.28 114.58 116.09 2oq4 h GLU 137 Ca 0.15 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 58.96 2oq4 h GLU 137 Cb 0.19 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 27.97 2oq4 h GLU 137 CO -0.23 0.37 -0.02 0.28 -1.40 0.00 0.00 179.01 178.01 2oq4 h VAL 138 N 0.58 1.32 0.00 3.13 2.07 -1.73 -3.01 116.25 118.62 2oq4 h VAL 138 Ca 0.33 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 2oq4 h VAL 138 Cb 0.51 1.90 -0.00 0.00 -1.52 0.00 0.00 31.29 32.18 2oq4 h VAL 138 CO -0.11 0.27 -0.14 0.58 0.02 0.00 0.00 177.57 178.19 2oq4 h VAL 139 N -0.29 0.96 0.00 2.57 2.07 -0.95 -1.21 116.25 119.41 2oq4 h VAL 139 Ca 0.01 -0.49 -0.04 0.00 0.82 0.00 0.00 66.70 67.00 2oq4 h VAL 139 Cb 0.45 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 2oq4 h VAL 139 CO 0.01 0.13 -0.18 0.50 0.02 0.00 0.00 177.57 178.05 2oq4 h LYS 140 N 0.00 0.00 0.00 1.57 3.64 -1.17 0.46 116.57 121.08 2oq4 h LYS 140 Ca -0.00 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.19 2oq4 h LYS 140 Cb 0.26 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 2oq4 h LYS 140 CO 0.02 0.18 -1.46 1.49 -2.27 0.00 0.00 179.45 177.41 2oq4 h GLU 141 N 0.00 0.00 -0.14 1.90 4.57 -1.11 -2.91 114.58 116.88 2oq4 h GLU 141 Ca -0.00 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 58.02 2oq4 h GLU 141 Cb 0.77 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.36 2oq4 h GLU 141 CO 0.02 0.34 -0.54 -0.09 -1.18 0.00 0.00 179.01 177.56 2oq4 h ARG 142 N 0.00 0.62 -0.50 1.92 2.43 -1.14 1.42 114.38 119.12 2oq4 h ARG 142 Ca -0.19 -0.48 -0.00 0.00 -0.81 0.00 0.00 59.98 58.51 2oq4 h ARG 142 Cb 1.67 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 31.29 2oq4 h ARG 142 CO 0.05 1.10 0.30 -0.07 -1.51 0.00 0.00 179.97 179.84 2oq4 h LEU 143 N 0.27 0.60 -0.10 3.80 3.38 -1.03 -2.13 115.31 120.10 2oq4 h LEU 143 Ca -0.03 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2oq4 h LEU 143 Cb 1.17 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 2oq4 h LEU 143 CO 0.11 0.48 -0.17 -0.07 0.09 0.00 0.00 178.44 178.89 2oq4 h LEU 144 N 0.67 0.00 -9.19 1.67 3.38 -1.45 -2.63 115.31 107.76 2oq4 h LEU 144 Ca 0.18 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.52 2oq4 h LEU 144 Cb -0.01 0.00 0.13 0.00 0.09 0.00 0.00 40.66 40.87 2oq4 h LEU 144 CO -0.03 0.17 -0.40 -1.54 0.09 0.00 0.00 178.44 176.72 2oq4 n SER 145 N -3.15 -0.79 0.23 -0.43 3.41 0.48 -4.38 113.62 108.99 2oq4 n SER 145 Ca 0.03 1.04 0.12 0.00 -0.26 0.00 0.00 58.87 59.81 2oq4 n SER 145 Cb 0.58 -1.06 0.65 0.00 -0.26 0.00 0.00 64.21 64.13 2oq4 n SER 145 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2oq4 h PRO 146 N 1.08 0.00 0.00 4.33 0.11 -1.86 0.12 132.00 135.79 2oq4 h PRO 146 Ca -0.35 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 2oq4 h PRO 146 Cb 1.41 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.51 2oq4 h PRO 146 CO 0.55 0.00 -0.77 -0.09 -0.21 0.00 0.00 178.00 177.48 2oq4 h ARG 147 N 0.00 0.00 0.00 1.05 2.43 -1.87 -3.40 114.38 112.60 2oq4 h ARG 147 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2oq4 h ARG 147 Cb 0.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2oq4 h ARG 147 CO 0.00 0.07 0.00 1.19 -1.51 0.00 0.00 179.97 179.72 2oq4 n PHE 148 N -2.84 0.00 -0.23 2.20 3.72 -0.51 -4.83 117.46 114.96 2oq4 n PHE 148 Ca -0.00 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.34 2oq4 n PHE 148 Cb 0.59 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.17 2oq4 n PHE 148 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 2oq4 h ARG 149 N 0.00 0.88 -0.26 -1.08 0.11 -0.63 -2.94 114.38 110.46 2oq4 h ARG 149 Ca 0.00 -0.09 0.00 0.00 0.10 0.00 0.00 59.98 59.99 2oq4 h ARG 149 Cb 0.25 -0.18 0.00 0.00 1.11 0.00 0.00 29.97 31.15 2oq4 h ARG 149 CO 0.00 0.64 0.00 -1.71 0.10 0.00 0.00 179.97 179.00 2oq4 n ASN 150 N -4.57 1.82 -4.70 0.08 5.15 -1.26 -2.24 115.26 109.53 2oq4 n ASN 150 Ca 0.05 -1.84 -0.42 0.00 -0.60 0.00 0.00 54.58 51.77 2oq4 n ASN 150 Cb 0.06 -0.17 -0.03 0.00 -0.53 0.00 0.00 39.78 39.11 2oq4 n ASN 150 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2oq4 s ARG 151 N -1.66 4.49 0.19 1.20 1.81 -1.11 -4.93 118.95 118.94 2oq4 s ARG 151 Ca 0.29 1.33 -0.31 0.00 -1.72 0.00 0.00 55.73 55.32 2oq4 s ARG 151 Cb 0.15 -3.49 -0.10 0.00 -0.45 0.00 0.00 34.95 31.07 2oq4 s ARG 151 CO 0.22 -0.13 1.47 -0.65 -0.68 0.00 0.00 175.30 175.54 2oq4 s GLN 152 N 1.33 4.26 0.00 3.54 -0.21 -1.26 -4.03 119.66 123.29 2oq4 s GLN 152 Ca 0.48 2.27 0.00 0.00 0.02 0.00 0.00 55.36 58.14 2oq4 s GLN 152 Cb -0.20 -3.15 0.00 0.00 1.00 0.00 0.00 33.01 30.66 2oq4 s GLN 152 CO 0.23 -0.49 0.71 1.19 -2.12 0.00 0.00 175.29 174.81 2oq4 n PHE 153 N 3.23 0.00 0.31 0.91 3.72 -0.22 -2.28 117.46 123.13 2oq4 n PHE 153 Ca 0.10 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.35 2oq4 n PHE 153 Cb 0.40 -0.25 -0.08 0.00 -0.94 0.00 0.00 39.48 38.62 2oq4 n PHE 153 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2oq4 h ALA 154 N 1.58 -1.16 0.04 4.37 0.00 -1.73 -3.25 119.26 119.11 2oq4 h ALA 154 Ca 0.00 -0.18 -0.30 0.00 0.00 0.00 0.00 54.91 54.42 2oq4 h ALA 154 Cb 0.13 0.53 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 2oq4 h ALA 154 CO 0.00 -1.14 -1.70 0.78 0.00 0.00 0.00 179.25 177.18 2oq4 h GLY 155 N -0.90 0.10 -0.41 0.00 0.00 -1.79 -3.39 103.07 96.67 2oq4 h GLY 155 Ca -0.07 -0.26 0.14 0.00 0.00 0.00 0.00 47.33 47.13 2oq4 h GLY 155 CO 0.05 0.23 -0.19 -2.00 0.00 0.00 0.00 176.54 174.63 2oq4 h LEU 156 N 0.02 -0.70 -2.84 3.11 5.85 -1.65 0.29 115.31 119.39 2oq4 h LEU 156 Ca -0.29 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2oq4 h LEU 156 Cb 2.00 0.45 0.00 0.00 0.37 0.00 0.00 40.66 43.48 2oq4 h LEU 156 CO 0.09 -0.24 0.00 -0.07 -0.34 0.00 0.00 178.44 177.89 2oq4 h LEU 157 N -0.01 0.00 0.00 2.25 3.38 -1.76 -0.08 115.31 119.09 2oq4 h LEU 157 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2oq4 h LEU 157 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2oq4 h LEU 157 CO -0.72 0.00 -1.04 0.18 0.09 0.00 0.00 178.44 176.95 2oq4 n LEU 158 N -3.01 0.76 -4.70 1.67 4.77 0.83 -4.48 117.00 112.85 2oq4 n LEU 158 Ca -0.03 -0.42 -0.42 0.00 -0.03 0.00 0.00 56.01 55.11 2oq4 n LEU 158 Cb 0.07 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 2oq4 n LEU 158 CO 0.19 0.19 0.72 -0.62 -1.33 0.00 0.00 177.39 176.54 2oq4 s ASP 159 N -3.01 7.27 0.00 -1.43 -1.08 -0.04 -4.94 116.67 113.44 2oq4 s ASP 159 Ca 0.05 1.55 0.27 0.00 -0.52 0.00 0.00 52.55 53.90 2oq4 s ASP 159 Cb 0.14 -2.55 0.86 0.00 -1.46 0.00 0.00 42.92 39.91 2oq4 s ASP 159 CO 0.78 -0.36 1.65 0.00 0.52 0.00 0.00 175.17 177.77 2oq4 n GLN 160 N 4.54 0.17 0.18 4.34 1.13 -1.26 -3.13 117.38 123.34 2oq4 n GLN 160 Ca 0.07 -0.07 0.05 0.00 -1.94 0.00 0.00 57.00 55.11 2oq4 n GLN 160 Cb 0.50 -1.50 0.26 0.00 0.11 0.00 0.00 30.24 29.61 2oq4 n GLN 160 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2oq4 h ALA 161 N 3.15 0.90 0.00 -1.58 0.00 -1.91 0.64 119.26 120.46 2oq4 h ALA 161 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2oq4 h ALA 161 Cb 0.48 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2oq4 h ALA 161 CO 0.00 0.52 -0.26 0.35 0.00 0.00 0.00 179.25 179.85 2oq4 h PHE 162 N 0.00 0.00 -3.07 0.00 3.57 -1.85 -2.77 116.94 112.82 2oq4 h PHE 162 Ca -0.00 0.00 -0.43 0.00 3.53 0.00 0.00 57.97 61.06 2oq4 h PHE 162 Cb 1.02 0.00 -0.40 0.00 2.79 0.00 0.00 35.95 39.36 2oq4 h PHE 162 CO 0.00 0.00 -0.74 -0.51 -2.23 0.00 0.00 178.31 174.83 2oq4 s LEU 163 N -6.82 0.27 0.01 0.59 1.43 -1.18 -3.98 118.68 109.00 2oq4 s LEU 163 Ca -0.08 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.28 2oq4 s LEU 163 Cb 0.01 -0.18 -0.05 0.00 0.03 0.00 0.00 46.19 46.01 2oq4 s LEU 163 CO 0.11 -0.33 1.22 0.00 0.23 0.00 0.00 176.35 177.59 2oq4 s ALA 164 N 2.16 3.45 0.00 4.21 0.00 0.22 -3.86 121.76 127.94 2oq4 s ALA 164 Ca 0.03 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.76 2oq4 s ALA 164 Cb -0.15 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.48 2oq4 s ALA 164 CO -0.08 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.48 2oq4 n GLY 165 N 3.32 2.28 3.68 0.00 0.00 -1.26 -1.53 105.19 111.68 2oq4 n GLY 165 Ca 0.10 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 2oq4 n GLY 165 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oq4 s LEU 166 N 0.00 4.34 0.00 0.99 1.43 -1.25 -2.10 118.68 122.09 2oq4 s LEU 166 Ca 0.00 2.33 0.00 0.00 -1.03 0.00 0.00 54.13 55.43 2oq4 s LEU 166 Cb 0.00 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.67 2oq4 s LEU 166 CO 0.00 -0.87 0.00 0.61 0.23 0.00 0.00 176.35 176.32 2oq4 n GLY 167 N 3.99 3.81 0.22 -3.19 0.00 -1.26 -4.66 105.19 104.10 2oq4 n GLY 167 Ca 0.16 -2.15 0.14 0.00 0.00 0.00 0.00 46.02 44.18 2oq4 n GLY 167 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2oq4 h ASN 168 N 0.00 0.00 0.73 1.61 -1.24 -1.95 -1.18 115.58 113.55 2oq4 h ASN 168 Ca 0.00 0.00 -0.26 0.00 0.71 0.00 0.00 56.30 56.75 2oq4 h ASN 168 Cb 0.00 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.03 2oq4 h ASN 168 CO 0.00 0.00 -1.29 0.10 -1.29 0.00 0.00 177.43 174.95 2oq4 h TYR 169 N 0.00 0.16 -0.01 0.67 -0.00 -1.95 -3.30 116.97 112.54 2oq4 h TYR 169 Ca 0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 58.73 58.47 2oq4 h TYR 169 Cb 0.67 -0.01 0.01 0.00 0.00 0.00 0.00 36.73 37.41 2oq4 h TYR 169 CO 0.00 1.12 -0.55 -0.07 -0.00 0.00 0.00 178.16 178.66 2oq4 h LEU 170 N 0.02 0.50 0.00 0.10 3.38 -1.95 -3.05 115.31 114.32 2oq4 h LEU 170 Ca -0.13 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.09 2oq4 h LEU 170 Cb 1.90 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.50 2oq4 h LEU 170 CO 0.14 1.18 0.00 -1.14 0.09 0.00 0.00 178.44 178.71 2oq4 n ARG 171 N -4.26 0.00 0.29 1.13 0.63 -0.45 -0.89 116.66 113.11 2oq4 n ARG 171 Ca -0.10 0.42 0.19 0.00 -0.92 0.00 0.00 57.85 57.44 2oq4 n ARG 171 Cb 0.64 -0.80 0.84 0.00 0.45 0.00 0.00 32.46 33.59 2oq4 n ARG 171 CO 0.00 0.00 0.00 -0.39 -2.51 0.00 0.00 177.63 174.73 2oq4 h VAL 172 N 0.00 0.00 -0.02 5.15 -1.51 -1.73 -2.28 116.25 115.86 2oq4 h VAL 172 Ca 0.00 -0.36 -0.17 0.00 -1.23 0.00 0.00 66.70 64.94 2oq4 h VAL 172 Cb 0.00 1.36 -0.02 0.00 -2.13 0.00 0.00 31.29 30.50 2oq4 h VAL 172 CO 0.00 0.00 -0.75 -0.33 -1.23 0.00 0.00 177.57 175.26 2oq4 h GLU 173 N 0.00 0.14 -0.38 5.19 4.39 -1.29 -2.83 114.58 119.80 2oq4 h GLU 173 Ca 0.00 -0.13 -0.09 0.00 0.34 0.00 0.00 59.36 59.49 2oq4 h GLU 173 Cb 0.36 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 2oq4 h GLU 173 CO 0.00 0.82 -0.10 0.82 -1.16 0.00 0.00 179.01 179.39 2oq4 h ILE 174 N 0.09 1.28 -0.69 3.13 5.03 -0.43 -2.85 117.51 123.06 2oq4 h ILE 174 Ca -0.02 -1.19 -0.04 0.00 -0.12 0.00 0.00 64.86 63.49 2oq4 h ILE 174 Cb 1.32 1.26 -0.03 0.00 -3.03 0.00 0.00 36.82 36.34 2oq4 h ILE 174 CO 0.11 0.40 0.27 -0.07 -0.68 0.00 0.00 178.15 178.18 2oq4 h LEU 175 N 0.55 0.96 -1.37 1.44 3.38 -1.46 -2.55 115.31 116.25 2oq4 h LEU 175 Ca 0.10 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 2oq4 h LEU 175 Cb 0.63 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2oq4 h LEU 175 CO 0.04 0.87 -0.31 -0.25 0.09 0.00 0.00 178.44 178.89 2oq4 h TRP 176 N 0.98 0.00 0.00 1.13 7.01 -1.50 0.23 115.95 123.81 2oq4 h TRP 176 Ca 0.23 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.23 2oq4 h TRP 176 Cb 0.22 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.28 2oq4 h TRP 176 CO 0.02 0.31 0.00 0.37 -2.79 0.00 0.00 178.44 176.34 2oq4 h GLN 177 N 0.00 0.00 0.00 2.65 5.75 -1.22 -3.14 115.11 119.15 2oq4 h GLN 177 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2oq4 h GLN 177 Cb 0.60 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.15 2oq4 h GLN 177 CO 0.04 0.00 -0.06 1.33 -2.65 0.00 0.00 178.83 177.49 2oq4 n VAL 178 N -2.42 1.25 -1.58 2.39 0.24 -0.96 -5.00 118.33 112.26 2oq4 n VAL 178 Ca 0.04 -1.45 -0.20 0.00 -2.04 0.00 0.00 64.34 60.70 2oq4 n VAL 178 Cb 0.40 0.16 -0.09 0.00 -1.47 0.00 0.00 33.84 32.84 2oq4 n VAL 178 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oq4 n GLY 179 N -0.88 1.91 3.81 7.63 0.00 -0.09 -4.96 105.19 112.60 2oq4 n GLY 179 Ca 0.08 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 2oq4 n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oq4 s LEU 180 N -4.52 3.91 0.00 0.99 1.43 0.63 0.21 118.68 121.32 2oq4 s LEU 180 Ca 0.00 0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 2oq4 s LEU 180 Cb 0.00 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.66 2oq4 s LEU 180 CO 0.00 0.15 0.00 0.35 0.23 0.00 0.00 176.35 177.08 2oq4 n THR 181 N 0.26 0.00 -0.10 5.49 -2.24 -0.59 -4.22 114.28 112.88 2oq4 n THR 181 Ca -0.08 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.50 2oq4 n THR 181 Cb 0.52 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.65 2oq4 n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oq4 n GLY 182 N 5.00 -0.80 2.77 3.38 0.00 -1.26 -4.65 105.19 109.63 2oq4 n GLY 182 Ca 0.00 0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2oq4 n GLY 182 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2oq4 n ASN 183 N -4.43 4.62 -3.83 1.61 0.23 -1.26 -2.24 115.26 109.96 2oq4 n ASN 183 Ca -0.32 -2.96 -0.20 0.00 -0.53 0.00 0.00 54.58 50.57 2oq4 n ASN 183 Cb 0.65 -1.57 -0.17 0.00 -2.08 0.00 0.00 39.78 36.62 2oq4 n ASN 183 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 2oq4 s HIS 184 N 1.82 0.58 0.00 -2.53 3.76 -1.26 -4.97 115.29 112.70 2oq4 s HIS 184 Ca 0.44 -0.12 -0.11 0.00 -0.15 0.00 0.00 55.06 55.12 2oq4 s HIS 184 Cb 0.12 -0.62 -0.05 0.00 1.11 0.00 0.00 32.58 33.14 2oq4 s HIS 184 CO -0.05 -0.21 0.33 0.15 -0.85 0.00 0.00 174.74 174.12 2oq4 s LYS 185 N 1.25 3.73 0.00 1.40 1.02 -1.26 -1.06 119.74 124.82 2oq4 s LYS 185 Ca -0.06 0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.10 2oq4 s LYS 185 Cb -0.13 -3.13 0.00 0.00 -0.52 0.00 0.00 37.83 34.04 2oq4 s LYS 185 CO -0.02 0.67 0.19 0.00 -0.92 0.00 0.00 175.35 175.27 2oq4 n ALA 186 N 1.48 1.62 -0.05 5.17 0.00 -0.95 -2.11 120.51 125.67 2oq4 n ALA 186 Ca -0.13 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.26 2oq4 n ALA 186 Cb 0.53 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.91 2oq4 n ALA 186 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2oq4 n LYS 187 N -0.28 2.13 -0.67 0.00 2.85 -1.13 -4.55 118.16 116.50 2oq4 n LYS 187 Ca 0.00 0.01 -0.13 0.00 -1.05 0.00 0.00 58.31 57.14 2oq4 n LYS 187 Cb 0.01 -1.23 0.10 0.00 -0.65 0.00 0.00 35.03 33.26 2oq4 n LYS 187 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2oq4 n ASP 188 N -2.42 3.42 -4.51 -5.58 8.00 -0.90 -4.93 116.55 109.63 2oq4 n ASP 188 Ca -0.16 -2.88 -0.24 0.00 0.71 0.00 0.00 54.79 52.22 2oq4 n ASP 188 Cb 0.78 -0.69 -0.09 0.00 -0.02 0.00 0.00 41.12 41.10 2oq4 n ASP 188 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2oq4 s LEU 189 N -1.81 2.72 0.75 0.64 0.05 -1.26 -4.98 118.68 114.78 2oq4 s LEU 189 Ca 0.31 -0.93 -0.11 0.00 0.05 0.00 0.00 54.13 53.45 2oq4 s LEU 189 Cb 0.26 -1.25 0.04 0.00 -2.05 0.00 0.00 46.19 43.19 2oq4 s LEU 189 CO 0.06 0.04 1.10 0.54 -0.55 0.00 0.00 176.35 177.54 2oq4 s ASN 190 N -3.48 5.03 0.40 1.48 2.20 -1.26 -4.87 114.94 114.44 2oq4 s ASN 190 Ca 0.30 1.20 0.08 0.00 -0.94 0.00 0.00 52.86 53.50 2oq4 s ASN 190 Cb -0.06 -1.97 0.84 0.00 -2.00 0.00 0.00 41.25 38.06 2oq4 s ASN 190 CO 0.16 -1.62 2.01 0.00 -2.94 0.00 0.00 177.10 174.72 2oq4 h ALA 191 N -0.84 1.64 -0.11 3.54 0.00 -2.00 -1.66 119.26 119.83 2oq4 h ALA 191 Ca -0.46 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 2oq4 h ALA 191 Cb 1.26 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 2oq4 h ALA 191 CO 0.62 0.29 -0.00 0.00 0.00 0.00 0.00 179.25 180.16 2oq4 h ALA 192 N 1.71 0.14 0.09 0.00 0.00 -1.99 -1.06 119.26 118.14 2oq4 h ALA 192 Ca 0.12 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2oq4 h ALA 192 Cb 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2oq4 h ALA 192 CO -0.01 -0.17 -0.04 1.96 0.00 0.00 0.00 179.25 180.99 2oq4 h GLN 193 N -0.09 -0.11 -0.94 0.00 4.20 -1.89 -1.37 115.11 114.91 2oq4 h GLN 193 Ca 0.03 0.01 0.18 0.00 0.06 0.00 0.00 58.65 58.92 2oq4 h GLN 193 Cb 0.36 0.03 -0.10 0.00 0.30 0.00 0.00 27.48 28.06 2oq4 h GLN 193 CO 0.01 -0.05 0.53 1.25 -0.67 0.00 0.00 178.83 179.89 2oq4 h LEU 194 N -0.14 0.66 -0.16 1.46 5.85 -1.25 0.70 115.31 122.42 2oq4 h LEU 194 Ca -0.01 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2oq4 h LEU 194 Cb 0.11 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2oq4 h LEU 194 CO 0.02 0.23 0.06 -0.78 -0.34 0.00 0.00 178.44 177.63 2oq4 h ASP 195 N 0.68 0.23 -0.42 1.25 -0.00 -0.68 -0.20 116.42 117.28 2oq4 h ASP 195 Ca 0.54 -0.17 -0.03 0.00 -0.00 0.00 0.00 57.03 57.36 2oq4 h ASP 195 Cb 0.82 -0.06 -0.02 0.00 -0.00 0.00 0.00 39.33 40.08 2oq4 h ASP 195 CO -0.39 0.34 0.15 0.00 -0.00 0.00 0.00 179.24 179.34 2oq4 h ALA 196 N 0.90 0.55 0.54 -0.78 0.00 0.23 -1.41 119.26 119.29 2oq4 h ALA 196 Ca 0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2oq4 h ALA 196 Cb 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2oq4 h ALA 196 CO -0.00 0.17 -0.41 1.25 0.00 0.00 0.00 179.25 180.26 2oq4 h LEU 197 N 0.53 -1.06 -0.64 0.00 6.46 0.42 0.44 115.31 121.47 2oq4 h LEU 197 Ca 0.14 0.07 0.13 0.00 -0.12 0.00 0.00 57.88 58.10 2oq4 h LEU 197 Cb 0.22 0.33 -0.10 0.00 -0.73 0.00 0.00 40.66 40.38 2oq4 h LEU 197 CO -0.01 -0.60 0.08 0.00 -0.62 0.00 0.00 178.44 177.30 2oq4 h ALA 198 N -0.63 0.72 -0.02 1.25 0.00 -0.97 0.42 119.26 120.02 2oq4 h ALA 198 Ca -0.06 0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2oq4 h ALA 198 Cb 0.78 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2oq4 h ALA 198 CO 0.02 -0.36 -0.30 0.45 0.00 0.00 0.00 179.25 179.06 2oq4 h HIS 199 N 0.19 0.04 -0.05 0.00 3.86 -0.84 -3.01 115.15 115.35 2oq4 h HIS 199 Ca 0.34 -0.01 -0.12 0.00 -1.16 0.00 0.00 60.37 59.42 2oq4 h HIS 199 Cb 0.55 -0.01 0.01 0.00 1.06 0.00 0.00 27.41 29.02 2oq4 h HIS 199 CO -0.31 0.33 -0.45 0.00 0.86 0.00 0.00 177.93 178.37 2oq4 h ALA 200 N 1.67 0.12 0.00 2.45 0.00 0.27 0.18 119.26 123.95 2oq4 h ALA 200 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2oq4 h ALA 200 Cb 0.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2oq4 h ALA 200 CO 0.04 0.28 0.03 1.28 0.00 0.00 0.00 179.25 180.88 2oq4 n LEU 201 N -4.32 0.00 0.00 0.00 4.77 0.12 -2.76 117.00 114.81 2oq4 n LEU 201 Ca -0.09 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 2oq4 n LEU 201 Cb 0.58 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2oq4 n LEU 201 CO 0.44 -0.40 -0.44 0.18 -1.33 0.00 0.00 177.39 175.84 2oq4 n LEU 202 N -1.40 1.62 0.00 2.23 4.77 -1.18 -4.78 117.00 118.26 2oq4 n LEU 202 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 2oq4 n LEU 202 Cb 0.03 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.02 2oq4 n LEU 202 CO 0.00 0.27 0.66 -0.33 -1.33 0.00 0.00 177.39 176.66 2oq4 h GLU 203 N 0.00 -0.02 0.04 3.23 5.08 -0.44 -3.00 114.58 119.47 2oq4 h GLU 203 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2oq4 h GLU 203 Cb 0.89 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 2oq4 h GLU 203 CO 0.00 0.39 -0.08 0.82 -1.00 0.00 0.00 179.01 179.15 2oq4 h ILE 204 N -0.44 0.82 -0.41 3.13 2.04 -1.75 0.32 117.51 121.23 2oq4 h ILE 204 Ca -0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.94 2oq4 h ILE 204 Cb 0.42 0.82 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 2oq4 h ILE 204 CO 0.00 0.00 -0.12 -0.65 0.00 0.00 0.00 178.15 177.38 2oq4 h PRO 205 N -0.15 -0.03 -0.16 2.37 0.11 -1.79 0.72 132.00 133.06 2oq4 h PRO 205 Ca 0.02 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.09 2oq4 h PRO 205 Cb 0.17 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 2oq4 h PRO 205 CO -0.05 -0.02 -0.06 0.00 -0.21 0.00 0.00 178.00 177.66 2oq4 h ARG 206 N -0.03 0.24 0.11 1.05 3.08 -1.35 0.69 114.38 118.18 2oq4 h ARG 206 Ca 0.20 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 2oq4 h ARG 206 Cb 0.33 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.34 2oq4 h ARG 206 CO -0.43 0.33 -0.05 0.35 -1.07 0.00 0.00 179.97 179.09 2oq4 h PHE 207 N 0.24 -0.14 -0.84 3.04 3.57 0.13 -1.25 116.94 121.68 2oq4 h PHE 207 Ca 0.05 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.60 2oq4 h PHE 207 Cb 0.27 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.01 2oq4 h PHE 207 CO 0.00 0.31 0.55 0.66 -2.23 0.00 0.00 178.31 177.60 2oq4 h SER 208 N -0.66 0.87 0.32 0.41 4.64 0.89 0.19 113.55 120.20 2oq4 h SER 208 Ca -0.02 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 2oq4 h SER 208 Cb 0.51 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 2oq4 h SER 208 CO 0.03 0.58 -0.12 0.22 -0.87 0.00 0.00 176.83 176.67 2oq4 h TYR 209 N 1.00 0.00 -0.00 4.77 3.20 0.52 -2.88 116.97 123.57 2oq4 h TYR 209 Ca 0.34 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.21 2oq4 h TYR 209 Cb 0.10 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.37 2oq4 h TYR 209 CO -0.00 0.12 -0.69 0.00 -1.64 0.00 0.00 178.16 175.95 2oq4 n ALA 210 N -2.31 3.99 0.00 1.82 0.00 -0.08 -4.83 120.51 119.10 2oq4 n ALA 210 Ca -0.02 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.91 2oq4 n ALA 210 Cb 0.23 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 19.05 2oq4 n ALA 210 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2oq4 n THR 211 N -1.04 0.00 -0.41 0.00 -2.24 -0.41 -5.07 114.28 105.11 2oq4 n THR 211 Ca 0.04 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.53 2oq4 n THR 211 Cb 0.30 -0.06 -0.08 0.00 -2.10 0.00 0.00 70.33 68.39 2oq4 n THR 211 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2oq4 n ARG 212 N -0.54 0.00 0.00 -0.78 0.63 -1.09 -4.75 116.66 110.12 2oq4 n ARG 212 Ca 0.00 -0.77 0.00 0.00 -0.92 0.00 0.00 57.85 56.16 2oq4 n ARG 212 Cb 0.03 -2.22 0.00 0.00 0.45 0.00 0.00 32.46 30.72 2oq4 n ARG 212 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2oq4 n ALA 223 N 7.42 0.00 -3.65 5.13 0.00 -1.26 -5.02 120.51 123.14 2oq4 n ALA 223 Ca 0.31 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.49 2oq4 n ALA 223 Cb 0.29 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.58 2oq4 n ALA 223 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2oq4 s LEU 224 N 0.00 1.50 0.24 0.00 1.98 -1.26 -5.11 118.68 116.02 2oq4 s LEU 224 Ca 0.00 -0.32 -0.31 0.00 -2.89 0.00 0.00 54.13 50.61 2oq4 s LEU 224 Cb 0.00 -0.87 -0.14 0.00 0.66 0.00 0.00 46.19 45.84 2oq4 s LEU 224 CO 0.00 -0.02 1.27 0.33 -1.89 0.00 0.00 176.35 176.03 2oq4 n PHE 225 N 4.27 1.79 -3.82 5.38 7.35 -1.26 -5.00 117.46 126.17 2oq4 n PHE 225 Ca -0.19 0.56 -0.12 0.00 -0.76 0.00 0.00 57.45 56.93 2oq4 n PHE 225 Cb 0.51 -2.37 -0.11 0.00 0.35 0.00 0.00 39.48 37.85 2oq4 n PHE 225 CO 0.00 0.00 0.00 -0.98 -0.76 0.00 0.00 176.76 175.02 2oq4 s ARG 226 N -0.70 0.30 0.17 -4.13 1.70 -1.26 -4.73 118.95 110.30 2oq4 s ARG 226 Ca 0.67 0.12 -0.30 0.00 -0.47 0.00 0.00 55.73 55.75 2oq4 s ARG 226 Cb -0.71 0.14 -0.08 0.00 -0.57 0.00 0.00 34.95 33.73 2oq4 s ARG 226 CO 0.53 -0.05 1.11 -0.06 -1.08 0.00 0.00 175.30 175.74 2oq4 s PHE 227 N -0.25 3.58 -0.14 5.89 0.08 -1.26 -4.94 117.98 120.95 2oq4 s PHE 227 Ca -0.03 1.59 0.11 0.00 0.12 0.00 0.00 56.93 58.71 2oq4 s PHE 227 Cb -0.03 -3.28 -0.23 0.00 -0.57 0.00 0.00 43.02 38.90 2oq4 s PHE 227 CO 0.01 -0.64 0.29 1.63 -0.10 0.00 0.00 175.22 176.41 2oq4 n LYS 228 N 2.42 0.67 0.00 0.44 4.76 -1.26 -4.73 118.16 120.46 2oq4 n LYS 228 Ca 0.03 0.16 0.00 0.00 -2.87 0.00 0.00 58.31 55.63 2oq4 n LYS 228 Cb 0.46 -1.65 0.00 0.00 -1.84 0.00 0.00 35.03 32.01 2oq4 n LYS 228 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2oq4 n VAL 229 N -3.01 0.00 -1.48 -0.18 0.24 -1.26 -4.73 118.33 107.91 2oq4 n VAL 229 Ca -0.28 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.59 2oq4 n VAL 229 Cb 1.09 -0.19 -0.09 0.00 -1.47 0.00 0.00 33.84 33.18 2oq4 n VAL 229 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 2oq4 n PHE 230 N -0.96 1.11 -2.24 6.34 7.35 -1.26 0.18 117.46 127.98 2oq4 n PHE 230 Ca 0.00 0.30 -0.21 0.00 -0.76 0.00 0.00 57.45 56.79 2oq4 n PHE 230 Cb 0.14 -2.49 -0.03 0.00 0.35 0.00 0.00 39.48 37.45 2oq4 n PHE 230 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 2oq4 n HIS 231 N 11.76 -0.79 -1.27 -5.13 8.25 -1.26 -4.84 115.22 121.93 2oq4 n HIS 231 Ca 0.51 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.99 2oq4 n HIS 231 Cb 0.23 -3.89 0.21 0.00 1.12 0.00 0.00 29.99 27.66 2oq4 n HIS 231 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2oq4 n ARG 232 N -2.89 2.06 -2.14 -0.41 1.74 0.13 -5.03 116.66 110.12 2oq4 n ARG 232 Ca -0.24 -3.00 -0.36 0.00 -0.77 0.00 0.00 57.85 53.48 2oq4 n ARG 232 Cb 0.69 -1.76 0.01 0.00 -1.02 0.00 0.00 32.46 30.38 2oq4 n ARG 232 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2oq4 s ASP 233 N -2.47 5.56 0.00 0.55 -4.77 -1.25 -1.99 116.67 112.30 2oq4 s ASP 233 Ca 0.41 2.31 0.00 0.00 -3.30 0.00 0.00 52.55 51.97 2oq4 s ASP 233 Cb 0.36 -2.59 0.00 0.00 -1.09 0.00 0.00 42.92 39.60 2oq4 s ASP 233 CO 0.02 -1.33 0.00 0.61 0.70 0.00 0.00 175.17 175.17 2oq4 n GLY 234 N 0.36 3.07 3.93 2.12 0.00 0.13 -4.91 105.19 109.88 2oq4 n GLY 234 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 2oq4 n GLY 234 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oq4 s GLU 235 N -0.32 2.56 0.37 1.61 0.41 -0.84 -4.73 118.70 117.76 2oq4 s GLU 235 Ca 0.00 -0.19 -0.18 0.00 -0.41 0.00 0.00 54.97 54.18 2oq4 s GLU 235 Cb 0.00 -2.25 -0.10 0.00 -1.78 0.00 0.00 34.13 30.00 2oq4 s GLU 235 CO 0.00 -0.94 0.85 -1.25 -0.49 0.00 0.00 175.26 173.43 2oq4 s PRO 236 N -5.08 4.14 0.04 0.39 0.04 -1.26 -0.48 135.00 132.78 2oq4 s PRO 236 Ca 0.57 0.91 -0.30 0.00 0.04 0.00 0.00 61.00 62.22 2oq4 s PRO 236 Cb -0.11 -2.33 -0.05 0.00 0.04 0.00 0.00 34.50 32.05 2oq4 s PRO 236 CO 0.44 0.07 1.23 0.00 0.04 0.00 0.00 177.00 178.79 2oq4 n GLU 238 N 4.33 0.08 -0.03 0.00 1.02 -1.26 -1.21 120.64 123.57 2oq4 n GLU 238 Ca 0.10 0.25 -0.04 0.00 -0.02 0.00 0.00 57.16 57.45 2oq4 n GLU 238 Cb 0.46 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.36 2oq4 n GLU 238 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2oq4 n ARG 239 N -1.32 0.23 -0.03 3.49 0.63 -1.26 -4.81 116.66 113.59 2oq4 n ARG 239 Ca 0.03 0.09 0.08 0.00 -0.92 0.00 0.00 57.85 57.13 2oq4 n ARG 239 Cb 0.06 -0.85 0.09 0.00 0.45 0.00 0.00 32.46 32.20 2oq4 n ARG 239 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2oq4 n GLY 241 N 0.94 0.84 3.80 0.00 0.00 -0.35 -4.92 105.19 105.50 2oq4 n GLY 241 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2oq4 n GLY 241 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2oq4 s SER 242 N -2.70 6.52 -0.11 1.61 0.01 -1.26 -3.75 113.70 114.03 2oq4 s SER 242 Ca 0.00 1.90 -0.29 0.00 1.31 0.00 0.00 55.95 58.86 2oq4 s SER 242 Cb 0.00 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.63 2oq4 s SER 242 CO 0.00 -0.65 1.49 -0.63 0.41 0.00 0.00 173.24 173.85 2oq4 s ILE 243 N -1.97 3.88 0.52 1.44 -1.09 -1.26 0.15 121.20 122.88 2oq4 s ILE 243 Ca 0.65 1.07 -0.21 0.00 -2.23 0.00 0.00 60.65 59.92 2oq4 s ILE 243 Cb -0.16 -3.69 -0.06 0.00 -1.58 0.00 0.00 42.46 36.97 2oq4 s ILE 243 CO 0.20 -0.10 1.21 -0.63 -1.23 0.00 0.00 174.94 174.38 2oq4 s ILE 244 N 3.83 2.81 0.25 2.92 1.01 0.37 -4.78 121.20 127.60 2oq4 s ILE 244 Ca 0.65 0.57 0.00 0.00 0.00 0.00 0.00 60.65 61.87 2oq4 s ILE 244 Cb -0.28 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 38.92 2oq4 s ILE 244 CO 0.23 -0.05 0.03 -0.62 0.00 0.00 0.00 174.94 174.53 2oq4 n GLU 245 N -0.95 1.36 -3.79 2.79 1.02 -1.00 0.18 120.64 120.25 2oq4 n GLU 245 Ca 0.10 -1.78 -0.09 0.00 -0.02 0.00 0.00 57.16 55.37 2oq4 n GLU 245 Cb 0.48 0.44 -0.04 0.00 -0.02 0.00 0.00 31.44 32.30 2oq4 n GLU 245 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2oq4 s LYS 246 N -2.92 1.43 0.00 3.49 2.20 -1.26 -3.53 119.74 119.15 2oq4 s LYS 246 Ca 0.02 -0.93 0.00 0.00 -0.36 0.00 0.00 55.97 54.70 2oq4 s LYS 246 Cb -0.00 0.52 0.00 0.00 -1.51 0.00 0.00 37.83 36.84 2oq4 s LYS 246 CO 0.01 -0.61 0.00 -2.37 -0.36 0.00 0.00 175.35 172.03 2oq4 n THR 247 N -0.35 0.00 -4.94 3.43 5.66 -1.26 -4.90 114.28 111.91 2oq4 n THR 247 Ca -0.08 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.59 2oq4 n THR 247 Cb 0.62 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.26 2oq4 n THR 247 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2oq4 s THR 248 N -2.74 2.91 -0.10 1.09 2.01 -1.26 -2.08 115.64 115.46 2oq4 s THR 248 Ca 0.00 -0.78 -0.03 0.00 0.31 0.00 0.00 61.69 61.19 2oq4 s THR 248 Cb 0.00 -2.13 0.05 0.00 0.01 0.00 0.00 72.50 70.43 2oq4 s THR 248 CO 0.00 0.58 0.14 -0.22 -0.69 0.00 0.00 174.62 174.43 2oq4 s LEU 249 N -0.60 0.02 -0.92 4.42 1.98 -1.16 -4.83 118.68 117.59 2oq4 s LEU 249 Ca 0.09 0.06 -0.00 0.00 -2.89 0.00 0.00 54.13 51.39 2oq4 s LEU 249 Cb -0.11 0.13 0.00 0.00 0.66 0.00 0.00 46.19 46.87 2oq4 s LEU 249 CO 0.01 -0.27 0.77 -1.20 -1.89 0.00 0.00 176.35 173.77 2oq4 n SER 250 N 5.31 -2.06 -4.11 3.68 7.64 -1.26 -3.38 113.62 119.45 2oq4 n SER 250 Ca -0.05 -0.48 -0.29 0.00 1.01 0.00 0.00 58.87 59.07 2oq4 n SER 250 Cb 0.50 -4.06 -0.08 0.00 -1.01 0.00 0.00 64.21 59.56 2oq4 n SER 250 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2oq4 n SER 251 N -2.63 0.49 -3.64 6.43 3.41 -1.26 -4.93 113.62 111.48 2oq4 n SER 251 Ca -0.22 -1.14 -0.15 0.00 -0.26 0.00 0.00 58.87 57.11 2oq4 n SER 251 Cb 0.63 -1.41 -0.08 0.00 -0.26 0.00 0.00 64.21 63.10 2oq4 n SER 251 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2oq4 s ARG 252 N -6.92 0.79 0.55 4.33 6.06 -1.22 -5.14 118.95 117.40 2oq4 s ARG 252 Ca 0.04 0.65 -0.20 0.00 -2.50 0.00 0.00 55.73 53.72 2oq4 s ARG 252 Cb -0.02 0.38 -0.07 0.00 0.06 0.00 0.00 34.95 35.30 2oq4 s ARG 252 CO 0.88 -0.14 0.83 -2.30 -2.50 0.00 0.00 175.30 172.07 2oq4 n PRO 253 N 2.25 0.86 0.00 5.12 -0.02 -1.26 -3.01 135.00 138.94 2oq4 n PRO 253 Ca -0.15 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 2oq4 n PRO 253 Cb 0.56 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 2oq4 n PRO 253 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2oq4 n PHE 254 N -1.45 0.00 0.00 6.00 7.35 -0.88 -4.84 117.46 123.63 2oq4 n PHE 254 Ca 0.12 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.81 2oq4 n PHE 254 Cb 0.46 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.29 2oq4 n PHE 254 CO 0.00 0.00 0.00 0.98 -0.76 0.00 0.00 176.76 176.98 2oq4 n TYR 255 N -0.76 0.00 -3.17 -5.13 9.36 -1.26 -4.73 117.16 111.48 2oq4 n TYR 255 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2oq4 n TYR 255 Cb 0.00 -0.82 0.00 0.00 -0.63 0.00 0.00 39.34 37.89 2oq4 n TYR 255 CO 0.00 0.00 0.00 -2.67 0.22 0.00 0.00 176.86 174.41 2oq4 n TRP 256 N 0.59 0.00 0.00 2.98 4.27 -1.23 -4.91 117.44 119.14 2oq4 n TRP 256 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 2oq4 n TRP 256 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 2oq4 n TRP 256 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2oq4 s GLN 261 N -0.22 1.47 0.00 0.00 2.00 -1.26 -4.42 119.66 117.23 2oq4 s GLN 261 Ca 0.00 -0.27 0.00 0.00 -2.00 0.00 0.00 55.36 53.09 2oq4 s GLN 261 Cb 0.00 -1.44 0.00 0.00 0.80 0.00 0.00 33.01 32.37 2oq4 s GLN 261 CO 0.00 -0.16 0.00 0.72 -0.50 0.00 0.00 175.29 175.35