#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iwo n PRO 5 N 0.00 1.43 -0.33 0.00 -0.02 -1.26 -4.78 135.00 130.04 3iwo n PRO 5 Ca 0.00 0.50 0.15 0.00 -2.02 0.00 0.00 63.50 62.14 3iwo n PRO 5 Cb 0.00 -1.96 0.37 0.00 -0.02 0.00 0.00 33.50 31.89 3iwo n PRO 5 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3iwo h GLN 6 N 2.74 0.65 -0.06 -0.52 -0.00 -2.05 -1.42 115.11 114.45 3iwo h GLN 6 Ca -0.42 -0.04 -0.04 0.00 -0.00 0.00 0.00 58.65 58.15 3iwo h GLN 6 Cb 1.33 -0.15 -0.01 0.00 0.00 0.00 0.00 27.48 28.66 3iwo h GLN 6 CO 0.66 0.43 -0.17 -0.56 0.00 0.00 0.00 178.83 179.19 3iwo h GLN 7 N 0.67 0.09 -0.02 1.69 -0.00 -1.99 0.28 115.11 115.82 3iwo h GLN 7 Ca 0.57 -0.02 -0.07 0.00 -0.00 0.00 0.00 58.65 59.13 3iwo h GLN 7 Cb 1.02 -0.01 0.00 0.00 -0.00 0.00 0.00 27.48 28.49 3iwo h GLN 7 CO -0.35 0.26 -0.27 0.82 -0.00 0.00 0.00 178.83 179.29 3iwo h ILE 8 N 0.09 1.51 -0.64 1.86 2.04 -1.63 -2.85 117.51 117.87 3iwo h ILE 8 Ca 0.02 -1.87 0.04 0.00 1.00 0.00 0.00 64.86 64.05 3iwo h ILE 8 Cb 0.35 2.63 -0.05 0.00 -0.74 0.00 0.00 36.82 39.02 3iwo h ILE 8 CO 0.02 0.52 0.38 0.78 0.00 0.00 0.00 178.15 179.85 3iwo h ASN 9 N -0.40 0.59 0.21 1.72 2.35 -1.15 -1.54 115.58 117.36 3iwo h ASN 9 Ca -0.03 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 3iwo h ASN 9 Cb 0.99 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.25 3iwo h ASN 9 CO 0.05 0.40 -0.10 -0.78 -1.65 0.00 0.00 177.43 175.36 3iwo h ASP 10 N 0.73 -0.24 -0.02 5.81 3.58 -1.02 -1.52 116.42 123.73 3iwo h ASP 10 Ca 0.27 -0.03 -0.13 0.00 0.42 0.00 0.00 57.03 57.56 3iwo h ASP 10 Cb 0.08 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 3iwo h ASP 10 CO -0.13 -0.13 -0.40 -0.29 -2.88 0.00 0.00 179.24 175.41 3iwo h ILE 11 N -0.33 1.30 -0.04 2.25 6.09 -1.32 -1.31 117.51 124.15 3iwo h ILE 11 Ca -0.03 -1.55 -0.01 0.00 -1.37 0.00 0.00 64.86 61.90 3iwo h ILE 11 Cb 0.26 1.55 -0.00 0.00 0.47 0.00 0.00 36.82 39.10 3iwo h ILE 11 CO 0.05 0.49 -0.00 0.58 -3.07 0.00 0.00 178.15 176.19 3iwo h VAL 12 N 0.44 1.25 -0.51 2.19 2.07 -1.26 -1.96 116.25 118.48 3iwo h VAL 12 Ca 0.04 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 3iwo h VAL 12 Cb 0.88 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 3iwo h VAL 12 CO 0.08 0.21 0.07 -0.74 0.02 0.00 0.00 177.57 177.20 3iwo h HIS 13 N -0.22 0.84 0.00 1.57 -0.00 -1.21 0.14 115.15 116.27 3iwo h HIS 13 Ca 0.01 -0.10 -0.02 0.00 -0.00 0.00 0.00 60.37 60.26 3iwo h HIS 13 Cb 0.33 -0.24 -0.00 0.00 -0.00 0.00 0.00 27.41 27.50 3iwo h HIS 13 CO 0.03 0.74 -0.11 0.00 -0.00 0.00 0.00 177.93 178.59 3iwo h ARG 14 N 0.76 0.00 0.00 5.26 3.08 -1.22 -3.22 114.38 119.05 3iwo h ARG 14 Ca 0.16 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.97 3iwo h ARG 14 Cb 0.37 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.38 3iwo h ARG 14 CO 0.01 0.11 -1.76 2.41 -1.07 0.00 0.00 179.97 179.67 3iwo n THR 15 N -3.22 1.43 0.10 2.04 -1.04 -0.74 -4.56 114.28 108.30 3iwo n THR 15 Ca 0.01 -0.13 -0.23 0.00 -2.04 0.00 0.00 64.05 61.66 3iwo n THR 15 Cb 0.41 -2.04 -0.15 0.00 -1.82 0.00 0.00 70.33 66.74 3iwo n THR 15 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3iwo h ILE 16 N -0.91 1.35 -0.35 12.58 1.08 -0.92 -2.85 117.51 127.49 3iwo h ILE 16 Ca -0.36 -2.57 0.03 0.00 -0.39 0.00 0.00 64.86 61.56 3iwo h ILE 16 Cb 1.28 3.00 -0.03 0.00 -3.07 0.00 0.00 36.82 37.99 3iwo h ILE 16 CO -0.22 0.76 0.16 0.74 -0.69 0.00 0.00 178.15 178.90 3iwo h THR 17 N 0.02 0.95 -0.17 -0.27 2.02 -1.63 -0.48 112.91 113.35 3iwo h THR 17 Ca -0.20 -0.11 -0.10 0.00 0.77 0.00 0.00 66.41 66.76 3iwo h THR 17 Cb 1.94 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.93 3iwo h THR 17 CO 0.23 0.06 -0.33 -0.65 0.37 0.00 0.00 175.52 175.20 3iwo h PRO 18 N 0.33 0.34 -0.54 6.66 0.11 -1.74 -2.73 132.00 134.44 3iwo h PRO 18 Ca 0.15 -0.14 0.08 0.00 0.11 0.00 0.00 66.00 66.20 3iwo h PRO 18 Cb 0.09 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 31.12 3iwo h PRO 18 CO -0.12 0.64 0.18 1.25 -0.21 0.00 0.00 178.00 179.73 3iwo h LEU 19 N 0.30 0.15 -0.46 2.35 5.85 -1.12 -0.65 115.31 121.72 3iwo h LEU 19 Ca 0.04 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3iwo h LEU 19 Cb 0.73 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 3iwo h LEU 19 CO 0.06 0.10 0.30 0.40 -0.34 0.00 0.00 178.44 178.96 3iwo h ILE 20 N 0.34 1.13 -0.37 4.05 2.04 -0.89 -0.55 117.51 123.27 3iwo h ILE 20 Ca 0.27 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.88 3iwo h ILE 20 Cb 0.32 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 3iwo h ILE 20 CO -0.29 0.13 0.24 -0.33 0.00 0.00 0.00 178.15 177.89 3iwo h GLU 21 N 0.62 0.49 -0.77 2.37 4.39 -1.17 0.16 114.58 120.67 3iwo h GLU 21 Ca 0.17 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.81 3iwo h GLU 21 Cb -0.05 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.46 3iwo h GLU 21 CO -0.03 0.33 0.40 1.96 -1.16 0.00 0.00 179.01 180.51 3iwo h GLN 22 N 0.49 1.08 -0.03 2.33 4.20 -0.77 -3.05 115.11 119.36 3iwo h GLN 22 Ca 0.13 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3iwo h GLN 22 Cb -0.04 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.53 3iwo h GLN 22 CO -0.03 0.80 -0.15 1.04 -0.67 0.00 0.00 178.83 179.83 3iwo n GLN 23 N -4.34 1.96 -3.76 1.46 1.13 -0.24 -4.98 117.38 108.59 3iwo n GLN 23 Ca 0.08 -1.62 -0.23 0.00 -1.94 0.00 0.00 57.00 53.29 3iwo n GLN 23 Cb 0.11 -1.46 0.02 0.00 0.11 0.00 0.00 30.24 29.02 3iwo n GLN 23 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3iwo n LYS 24 N 0.91 -4.24 -2.78 -1.09 5.02 -0.02 -4.93 118.16 111.02 3iwo n LYS 24 Ca 0.12 0.55 -0.42 0.00 -2.02 0.00 0.00 58.31 56.55 3iwo n LYS 24 Cb 0.55 -4.95 -0.03 0.00 -0.02 0.00 0.00 35.03 30.58 3iwo n LYS 24 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3iwo s ILE 25 N -3.74 4.85 0.25 -0.18 1.01 -0.81 -4.96 121.20 117.63 3iwo s ILE 25 Ca 0.03 1.87 0.07 0.00 0.00 0.00 0.00 60.65 62.62 3iwo s ILE 25 Cb -0.01 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.19 3iwo s ILE 25 CO 0.83 0.06 1.59 -0.65 0.00 0.00 0.00 174.94 176.77 3iwo h PRO 26 N 7.09 0.14 -2.26 2.79 0.11 -1.89 -3.46 132.00 134.51 3iwo h PRO 26 Ca -0.33 -0.10 -0.07 0.00 0.11 0.00 0.00 66.00 65.62 3iwo h PRO 26 Cb 1.16 0.01 -0.20 0.00 0.11 0.00 0.00 31.00 32.08 3iwo h PRO 26 CO 0.83 0.70 0.04 0.20 -0.21 0.00 0.00 178.00 179.56 3iwo s GLY 27 N -4.38 -0.47 -0.15 -0.55 0.00 -1.24 -0.75 107.32 99.77 3iwo s GLY 27 Ca -0.03 1.35 -0.20 0.00 0.00 0.00 0.00 44.72 45.84 3iwo s GLY 27 CO 0.78 1.07 0.53 -0.29 0.00 0.00 0.00 173.10 175.19 3iwo s MET 28 N -0.56 0.70 0.00 2.90 1.75 -0.57 -2.46 119.30 121.06 3iwo s MET 28 Ca -0.07 0.53 0.04 0.00 -1.25 0.00 0.00 55.69 54.95 3iwo s MET 28 Cb -0.03 0.34 -0.01 0.00 2.84 0.00 0.00 34.83 37.97 3iwo s MET 28 CO 0.05 -0.13 -0.13 0.00 -0.65 0.00 0.00 175.02 174.16 3iwo s ALA 29 N -0.19 1.05 -0.01 4.11 0.00 -0.12 -1.29 121.76 125.31 3iwo s ALA 29 Ca -0.04 -0.60 0.03 0.00 0.00 0.00 0.00 51.96 51.35 3iwo s ALA 29 Cb -0.03 -0.24 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 3iwo s ALA 29 CO 0.03 0.24 -0.09 0.08 0.00 0.00 0.00 175.76 176.02 3iwo s VAL 30 N -0.43 0.72 -0.07 0.00 1.01 0.03 -0.99 120.40 120.67 3iwo s VAL 30 Ca 0.04 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.70 3iwo s VAL 30 Cb -0.05 -0.62 -0.01 0.00 0.00 0.00 0.00 36.38 35.69 3iwo s VAL 30 CO -0.00 0.21 -0.20 0.00 0.00 0.00 0.00 175.10 175.11 3iwo s ALA 31 N -0.06 2.35 -0.15 5.51 0.00 -0.52 -0.85 121.76 128.04 3iwo s ALA 31 Ca 0.01 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.97 3iwo s ALA 31 Cb -0.05 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 3iwo s ALA 31 CO -0.00 0.40 -0.14 0.08 0.00 0.00 0.00 175.76 176.10 3iwo s VAL 32 N -0.14 2.80 -0.26 0.00 1.01 0.14 -0.71 120.40 123.24 3iwo s VAL 32 Ca -0.03 -0.73 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 3iwo s VAL 32 Cb -0.14 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 34.01 3iwo s VAL 32 CO 0.04 0.52 0.23 -0.63 0.00 0.00 0.00 175.10 175.25 3iwo s ILE 33 N 0.66 5.30 -0.07 2.22 1.09 0.12 -1.04 121.20 129.48 3iwo s ILE 33 Ca -0.07 0.27 -0.00 0.00 -1.10 0.00 0.00 60.65 59.75 3iwo s ILE 33 Cb -0.16 -3.56 0.03 0.00 -1.06 0.00 0.00 42.46 37.71 3iwo s ILE 33 CO 0.02 0.26 -0.02 -0.47 -0.10 0.00 0.00 174.94 174.63 3iwo s TYR 34 N 1.57 0.79 -1.63 3.97 5.04 0.15 -1.21 117.35 126.03 3iwo s TYR 34 Ca 0.09 -0.25 -0.17 0.00 -2.44 0.00 0.00 57.07 54.30 3iwo s TYR 34 Cb -0.15 -0.80 0.14 0.00 0.35 0.00 0.00 41.96 41.51 3iwo s TYR 34 CO 0.09 -0.30 0.78 1.04 -1.34 0.00 0.00 175.55 175.82 3iwo n GLN 35 N 4.70 -3.44 -0.75 4.97 6.02 -1.09 -1.53 117.38 126.26 3iwo n GLN 35 Ca -0.15 0.40 0.00 0.00 -0.01 0.00 0.00 57.00 57.25 3iwo n GLN 35 Cb 0.50 -5.16 0.00 0.00 1.02 0.00 0.00 30.24 26.61 3iwo n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3iwo n GLY 36 N -1.39 1.30 3.65 1.08 0.00 -0.60 -5.03 105.19 104.21 3iwo n GLY 36 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 3iwo n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iwo s LYS 37 N -0.08 2.87 0.12 1.61 1.02 -0.58 -5.00 119.74 119.69 3iwo s LYS 37 Ca 0.00 -0.49 -0.16 0.00 0.02 0.00 0.00 55.97 55.34 3iwo s LYS 37 Cb 0.00 -2.71 -0.07 0.00 -0.52 0.00 0.00 37.83 34.54 3iwo s LYS 37 CO 0.00 0.68 0.55 -1.25 -0.92 0.00 0.00 175.35 174.41 3iwo s PRO 38 N -0.98 4.05 0.01 -1.68 0.04 -1.26 -0.67 135.00 134.50 3iwo s PRO 38 Ca 0.14 0.57 0.04 0.00 0.04 0.00 0.00 61.00 61.78 3iwo s PRO 38 Cb -0.11 -3.04 -0.01 0.00 0.04 0.00 0.00 34.50 31.37 3iwo s PRO 38 CO 0.03 0.54 -0.12 0.71 0.04 0.00 0.00 177.00 178.21 3iwo s TYR 39 N -1.33 1.03 0.07 0.56 1.51 -0.21 -4.98 117.35 114.00 3iwo s TYR 39 Ca 0.34 -0.26 0.10 0.00 -1.01 0.00 0.00 57.07 56.24 3iwo s TYR 39 Cb -0.16 -0.64 -0.03 0.00 -0.11 0.00 0.00 41.96 41.02 3iwo s TYR 39 CO 0.19 -0.00 -0.27 0.71 -1.11 0.00 0.00 175.55 175.07 3iwo s TYR 40 N -0.52 2.31 -0.03 2.71 2.02 -1.26 -0.68 117.35 121.89 3iwo s TYR 40 Ca 0.02 -0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 56.30 3iwo s TYR 40 Cb -0.06 -1.35 0.02 0.00 -0.40 0.00 0.00 41.96 40.17 3iwo s TYR 40 CO 0.00 0.19 0.08 -0.06 -1.57 0.00 0.00 175.55 174.19 3iwo s PHE 41 N -0.88 -0.08 0.03 2.71 0.40 -0.03 -5.00 117.98 115.12 3iwo s PHE 41 Ca 0.12 0.24 0.01 0.00 -0.60 0.00 0.00 56.93 56.71 3iwo s PHE 41 Cb -0.10 -0.04 -0.02 0.00 0.51 0.00 0.00 43.02 43.37 3iwo s PHE 41 CO 0.03 -0.07 -0.05 0.95 0.70 0.00 0.00 175.22 176.78 3iwo s THR 42 N 0.45 0.28 -0.03 0.64 -4.23 -1.26 -0.79 115.64 110.70 3iwo s THR 42 Ca -0.03 -0.87 -0.07 0.00 -1.18 0.00 0.00 61.69 59.54 3iwo s THR 42 Cb -0.05 -0.38 0.01 0.00 1.34 0.00 0.00 72.50 73.42 3iwo s THR 42 CO -0.02 -0.39 0.15 0.26 -0.54 0.00 0.00 174.62 174.09 3iwo s TRP 43 N -1.25 -0.06 0.00 3.99 0.51 -0.42 -5.01 118.94 116.70 3iwo s TRP 43 Ca -0.12 0.13 0.00 0.00 -2.12 0.00 0.00 56.10 54.00 3iwo s TRP 43 Cb -0.09 0.00 0.00 0.00 -0.81 0.00 0.00 33.47 32.57 3iwo s TRP 43 CO -0.00 -0.19 0.00 0.41 -0.51 0.00 0.00 176.95 176.65 3iwo n GLY 44 N 2.17 0.31 3.37 0.98 0.00 -1.26 -1.52 105.19 109.24 3iwo n GLY 44 Ca -0.18 -0.87 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 3iwo n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3iwo s TYR 45 N 0.00 2.59 0.20 1.61 4.12 0.07 -1.67 117.35 124.27 3iwo s TYR 45 Ca 0.00 -0.45 0.05 0.00 0.02 0.00 0.00 57.07 56.70 3iwo s TYR 45 Cb 0.00 -1.64 0.13 0.00 -1.52 0.00 0.00 41.96 38.93 3iwo s TYR 45 CO 0.00 -0.03 1.47 0.00 0.02 0.00 0.00 175.55 177.01 3iwo h ALA 46 N 5.80 0.70 -3.10 3.71 0.00 -0.64 -3.30 119.26 122.43 3iwo h ALA 46 Ca -0.38 -0.65 -0.47 0.00 0.00 0.00 0.00 54.91 53.40 3iwo h ALA 46 Cb 1.16 -0.09 -0.41 0.00 0.00 0.00 0.00 17.79 18.46 3iwo h ALA 46 CO 0.50 0.86 -0.75 0.34 0.00 0.00 0.00 179.25 180.19 3iwo s ASP 47 N -6.88 2.49 0.04 0.00 -1.08 -1.12 -1.29 116.67 108.83 3iwo s ASP 47 Ca -0.02 -0.67 -0.21 0.00 -0.52 0.00 0.00 52.55 51.13 3iwo s ASP 47 Cb 0.11 -0.33 -0.14 0.00 -1.46 0.00 0.00 42.92 41.10 3iwo s ASP 47 CO 0.80 -0.34 1.36 0.40 0.52 0.00 0.00 175.17 177.91 3iwo h ILE 48 N 6.44 1.34 -0.62 4.11 2.04 -1.87 0.19 117.51 129.15 3iwo h ILE 48 Ca -0.15 -1.22 0.01 0.00 1.00 0.00 0.00 64.86 64.49 3iwo h ILE 48 Cb 1.14 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 39.03 3iwo h ILE 48 CO 0.30 0.36 0.41 0.00 0.00 0.00 0.00 178.15 179.21 3iwo h ALA 49 N 0.63 0.79 -0.00 1.87 0.00 -1.98 -2.00 119.26 118.56 3iwo h ALA 49 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3iwo h ALA 49 Cb 0.61 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3iwo h ALA 49 CO 0.03 0.20 -0.05 1.63 0.00 0.00 0.00 179.25 181.06 3iwo n LYS 50 N -4.67 0.28 -4.02 0.00 5.02 -1.20 -4.94 118.16 108.63 3iwo n LYS 50 Ca 0.05 -0.04 -0.30 0.00 -2.02 0.00 0.00 58.31 56.00 3iwo n LYS 50 Cb 0.03 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.53 3iwo n LYS 50 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3iwo n LYS 51 N -1.33 -3.95 -3.01 1.97 5.02 -0.05 -4.95 118.16 111.86 3iwo n LYS 51 Ca 0.11 0.46 -0.41 0.00 -2.02 0.00 0.00 58.31 56.45 3iwo n LYS 51 Cb 0.29 -5.02 -0.05 0.00 -0.02 0.00 0.00 35.03 30.22 3iwo n LYS 51 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 3iwo s GLN 52 N -6.65 4.17 0.64 1.97 2.00 -0.59 -4.98 119.66 116.22 3iwo s GLN 52 Ca 0.42 0.75 -0.13 0.00 -2.00 0.00 0.00 55.36 54.40 3iwo s GLN 52 Cb -0.22 -3.63 -0.02 0.00 0.80 0.00 0.00 33.01 29.94 3iwo s GLN 52 CO 0.88 -0.41 1.05 -1.25 -0.50 0.00 0.00 175.29 175.07 3iwo s PRO 53 N 2.47 3.18 0.15 1.67 0.05 -1.26 -0.06 135.00 141.19 3iwo s PRO 53 Ca 0.31 1.07 -0.31 0.00 0.05 0.00 0.00 61.00 62.12 3iwo s PRO 53 Cb -0.16 -2.02 -0.09 0.00 0.05 0.00 0.00 34.50 32.28 3iwo s PRO 53 CO 0.09 -0.91 1.47 0.08 0.05 0.00 0.00 177.00 177.78 3iwo s VAL 54 N -2.74 2.94 0.46 -0.36 1.01 -0.67 -4.18 120.40 116.86 3iwo s VAL 54 Ca 0.61 0.68 0.03 0.00 0.00 0.00 0.00 61.98 63.30 3iwo s VAL 54 Cb -0.15 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 3iwo s VAL 54 CO 0.45 0.06 0.10 0.42 0.00 0.00 0.00 175.10 176.13 3iwo s THR 55 N 1.03 0.66 -1.07 3.92 -4.23 -1.26 -4.78 115.64 109.92 3iwo s THR 55 Ca 0.67 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 59.26 3iwo s THR 55 Cb -0.40 -2.20 0.08 0.00 1.34 0.00 0.00 72.50 71.31 3iwo s THR 55 CO 0.32 0.00 1.24 0.00 -0.54 0.00 0.00 174.62 175.64 3iwo n GLN 56 N -1.07 0.02 0.00 3.99 0.00 -1.26 -2.26 117.38 116.80 3iwo n GLN 56 Ca -0.11 0.34 0.12 0.00 0.00 0.00 0.00 57.00 57.34 3iwo n GLN 56 Cb 0.65 -1.50 0.09 0.00 0.00 0.00 0.00 30.24 29.48 3iwo n GLN 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 3iwo n GLN 57 N -1.47 1.44 -2.51 2.61 1.13 -1.26 -4.12 117.38 113.20 3iwo n GLN 57 Ca 0.02 -1.15 -0.42 0.00 -1.94 0.00 0.00 57.00 53.51 3iwo n GLN 57 Cb 0.09 -1.48 -0.03 0.00 0.11 0.00 0.00 30.24 28.94 3iwo n GLN 57 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3iwo s THR 58 N -2.35 4.30 -0.04 5.09 2.01 -0.96 -4.86 115.64 118.84 3iwo s THR 58 Ca 0.22 1.65 -0.20 0.00 0.31 0.00 0.00 61.69 63.67 3iwo s THR 58 Cb 0.19 -4.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.59 3iwo s THR 58 CO 0.50 0.10 0.56 -0.76 -0.69 0.00 0.00 174.62 174.32 3iwo s LEU 59 N 1.27 4.38 0.13 4.42 1.02 0.21 -4.09 118.68 126.02 3iwo s LEU 59 Ca 0.56 1.06 0.09 0.00 0.02 0.00 0.00 54.13 55.86 3iwo s LEU 59 Cb -0.26 -2.85 -0.04 0.00 0.02 0.00 0.00 46.19 43.06 3iwo s LEU 59 CO 0.27 0.08 -0.17 -0.36 0.02 0.00 0.00 176.35 176.19 3iwo s PHE 60 N 0.01 2.54 -0.02 0.29 0.40 0.01 -1.49 117.98 119.72 3iwo s PHE 60 Ca 0.30 -0.26 -0.30 0.00 -0.60 0.00 0.00 56.93 56.06 3iwo s PHE 60 Cb -0.17 -1.33 -0.04 0.00 0.51 0.00 0.00 43.02 41.99 3iwo s PHE 60 CO 0.15 0.41 1.16 -1.21 0.70 0.00 0.00 175.22 176.43 3iwo s GLU 61 N -2.26 4.41 0.26 0.44 2.02 -1.26 -1.56 118.70 120.74 3iwo s GLU 61 Ca 0.19 1.65 0.23 0.00 0.02 0.00 0.00 54.97 57.06 3iwo s GLU 61 Cb -0.10 -3.48 0.17 0.00 0.10 0.00 0.00 34.13 30.82 3iwo s GLU 61 CO 0.11 -0.33 1.27 -0.07 0.02 0.00 0.00 175.26 176.25 3iwo h LEU 62 N 7.59 0.00 0.00 1.80 3.38 -1.41 -3.44 115.31 123.23 3iwo h LEU 62 Ca -0.37 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.57 3iwo h LEU 62 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3iwo h LEU 62 CO 0.84 0.02 0.00 0.61 0.09 0.00 0.00 178.44 180.00 3iwo n GLY 63 N 1.19 3.19 0.01 0.83 0.00 -1.25 -2.50 105.19 106.66 3iwo n GLY 63 Ca 0.02 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 45.87 3iwo n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3iwo n SER 64 N 2.67 0.04 0.24 1.61 7.64 -1.25 -0.90 113.62 123.67 3iwo n SER 64 Ca 0.00 0.51 0.17 0.00 1.01 0.00 0.00 58.87 60.56 3iwo n SER 64 Cb 0.00 -0.52 0.88 0.00 -1.01 0.00 0.00 64.21 63.56 3iwo n SER 64 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3iwo h VAL 65 N 0.00 0.40 -0.44 0.44 2.07 -1.54 -1.29 116.25 115.90 3iwo h VAL 65 Ca 0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 3iwo h VAL 65 Cb 0.20 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3iwo h VAL 65 CO 0.00 0.00 0.31 0.28 0.02 0.00 0.00 177.57 178.18 3iwo h SER 66 N 0.00 0.06 -0.17 0.57 0.02 -1.21 -0.88 113.55 111.94 3iwo h SER 66 Ca 0.06 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.06 3iwo h SER 66 Cb 0.39 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 3iwo h SER 66 CO -0.00 0.04 0.17 0.11 -1.14 0.00 0.00 176.83 176.01 3iwo h LYS 67 N 0.07 0.00 -0.29 3.45 1.57 -1.38 -1.05 116.57 118.94 3iwo h LYS 67 Ca 0.21 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.86 3iwo h LYS 67 Cb 0.74 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 3iwo h LYS 67 CO -0.02 0.00 -0.35 1.79 -0.57 0.00 0.00 179.45 180.31 3iwo h THR 68 N 0.00 1.29 -0.43 -0.16 1.35 -1.33 0.54 112.91 114.16 3iwo h THR 68 Ca 0.08 -1.49 -0.14 0.00 -0.55 0.00 0.00 66.41 64.31 3iwo h THR 68 Cb 0.43 1.44 -0.01 0.00 -1.73 0.00 0.00 68.15 68.28 3iwo h THR 68 CO -0.00 0.48 -0.28 -0.26 -0.25 0.00 0.00 175.52 175.21 3iwo h PHE 69 N 0.54 1.10 -0.57 4.73 0.04 -1.36 -1.49 116.94 119.92 3iwo h PHE 69 Ca 0.06 -0.29 -0.02 0.00 2.80 0.00 0.00 57.97 60.52 3iwo h PHE 69 Cb 0.85 -0.25 -0.03 0.00 2.20 0.00 0.00 35.95 38.73 3iwo h PHE 69 CO 0.04 1.11 0.29 1.15 -0.60 0.00 0.00 178.31 180.30 3iwo h THR 70 N 0.77 1.20 -0.45 -1.55 2.02 -1.15 0.33 112.91 114.08 3iwo h THR 70 Ca 0.09 -0.54 -0.00 0.00 0.77 0.00 0.00 66.41 66.72 3iwo h THR 70 Cb 0.86 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 3iwo h THR 70 CO 0.08 0.22 0.27 1.23 0.37 0.00 0.00 175.52 177.69 3iwo h GLY 71 N 0.77 0.66 1.14 2.16 0.00 -0.80 -1.04 103.07 105.97 3iwo h GLY 71 Ca 0.20 -0.28 -0.15 0.00 0.00 0.00 0.00 47.33 47.10 3iwo h GLY 71 CO -0.03 0.27 -0.30 -2.08 0.00 0.00 0.00 176.54 174.41 3iwo h VAL 72 N 0.60 1.27 -0.93 4.60 2.07 -1.11 -0.28 116.25 122.47 3iwo h VAL 72 Ca 0.16 -1.47 0.01 0.00 0.82 0.00 0.00 66.70 66.22 3iwo h VAL 72 Cb 0.01 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 3iwo h VAL 72 CO -0.03 0.50 0.62 0.25 0.02 0.00 0.00 177.57 178.93 3iwo h LEU 73 N 0.81 1.07 -0.60 2.57 5.85 -0.77 0.12 115.31 124.36 3iwo h LEU 73 Ca 0.09 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 3iwo h LEU 73 Cb 0.89 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 3iwo h LEU 73 CO 0.08 0.77 0.19 1.23 -0.34 0.00 0.00 178.44 180.38 3iwo h GLY 74 N 1.26 0.99 1.04 3.75 0.00 -0.96 -1.66 103.07 107.48 3iwo h GLY 74 Ca 0.34 -0.58 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 3iwo h GLY 74 CO -0.07 0.54 0.34 -1.33 0.00 0.00 0.00 176.54 176.02 3iwo h GLY 75 N 0.84 1.23 1.01 4.60 0.00 -0.42 -1.35 103.07 108.99 3iwo h GLY 75 Ca 0.19 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3iwo h GLY 75 CO -0.01 0.61 0.56 -1.80 0.00 0.00 0.00 176.54 175.91 3iwo h ASP 76 N 1.12 1.05 -0.51 0.19 3.58 -0.58 -1.29 116.42 119.97 3iwo h ASP 76 Ca 0.26 -0.05 -0.08 0.00 0.42 0.00 0.00 57.03 57.58 3iwo h ASP 76 Cb 0.18 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.94 3iwo h ASP 76 CO -0.03 0.78 0.01 0.00 -2.88 0.00 0.00 179.24 177.13 3iwo h ALA 77 N 1.31 0.98 -0.42 -0.78 0.00 -0.66 -0.68 119.26 119.01 3iwo h ALA 77 Ca 0.32 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3iwo h ALA 77 Cb -0.09 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3iwo h ALA 77 CO -0.07 0.62 0.23 0.82 0.00 0.00 0.00 179.25 180.86 3iwo h ILE 78 N 0.87 1.15 -0.14 0.00 2.04 -1.00 -1.14 117.51 119.29 3iwo h ILE 78 Ca 0.16 -0.39 -0.06 0.00 1.00 0.00 0.00 64.86 65.57 3iwo h ILE 78 Cb 0.49 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 3iwo h ILE 78 CO 0.02 0.16 -0.20 0.00 0.00 0.00 0.00 178.15 178.13 3iwo h ALA 79 N 1.09 1.40 0.00 1.87 0.00 -0.93 -0.98 119.26 121.71 3iwo h ALA 79 Ca 0.15 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3iwo h ALA 79 Cb 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3iwo h ALA 79 CO -0.02 0.42 0.00 0.54 0.00 0.00 0.00 179.25 180.18 3iwo n ARG 80 N -4.21 0.23 -1.37 0.00 1.74 -0.29 -4.90 116.66 107.86 3iwo n ARG 80 Ca -0.01 0.13 -0.13 0.00 -0.77 0.00 0.00 57.85 57.07 3iwo n ARG 80 Cb 0.32 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.21 3iwo n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3iwo n GLY 81 N 0.16 1.34 0.10 -0.13 0.00 -0.37 -4.92 105.19 101.37 3iwo n GLY 81 Ca 0.08 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.53 3iwo n GLY 81 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3iwo h GLU 82 N 0.00 0.16 -4.55 1.61 5.08 -1.41 -3.48 114.58 111.99 3iwo h GLU 82 Ca -0.26 -0.27 -0.21 0.00 -1.00 0.00 0.00 59.36 57.62 3iwo h GLU 82 Cb 0.83 0.10 -0.15 0.00 0.50 0.00 0.00 28.75 30.03 3iwo h GLU 82 CO 0.38 1.01 -0.68 0.96 -1.00 0.00 0.00 179.01 179.68 3iwo s ILE 83 N -2.64 0.51 -0.03 3.13 -4.36 -1.18 -4.83 121.20 111.81 3iwo s ILE 83 Ca -0.06 -1.91 0.05 0.00 -0.26 0.00 0.00 60.65 58.48 3iwo s ILE 83 Cb 0.08 -1.77 -0.01 0.00 1.25 0.00 0.00 42.46 42.01 3iwo s ILE 83 CO 0.84 -0.78 -0.18 -0.54 0.24 0.00 0.00 174.94 174.52 3iwo s LYS 84 N -3.89 1.68 0.54 0.37 1.02 -1.26 -4.21 119.74 113.98 3iwo s LYS 84 Ca 0.14 -0.66 0.32 0.00 0.02 0.00 0.00 55.97 55.80 3iwo s LYS 84 Cb 0.06 -1.54 1.51 0.00 -0.52 0.00 0.00 37.83 37.34 3iwo s LYS 84 CO -0.04 0.34 2.05 -0.07 -0.92 0.00 0.00 175.35 176.71 3iwo h LEU 85 N 5.93 0.00 0.00 3.17 3.38 -1.98 -1.87 115.31 123.93 3iwo h LEU 85 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3iwo h LEU 85 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3iwo h LEU 85 CO 0.48 0.07 0.00 -1.54 0.09 0.00 0.00 178.44 177.54 3iwo n SER 86 N -3.31 0.00 -4.78 -0.43 3.41 -1.26 -0.88 113.62 106.38 3iwo n SER 86 Ca -0.01 0.43 -0.37 0.00 -0.26 0.00 0.00 58.87 58.66 3iwo n SER 86 Cb 0.26 -0.47 -0.05 0.00 -0.26 0.00 0.00 64.21 63.69 3iwo n SER 86 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3iwo s ASP 87 N -2.95 6.98 0.46 4.04 1.01 -0.71 -4.85 116.67 120.67 3iwo s ASP 87 Ca 0.13 1.98 -0.25 0.00 0.71 0.00 0.00 52.55 55.13 3iwo s ASP 87 Cb 0.16 -2.58 -0.08 0.00 1.01 0.00 0.00 42.92 41.43 3iwo s ASP 87 CO 0.44 -0.33 1.38 -2.65 0.21 0.00 0.00 175.17 174.22 3iwo n PRO 88 N 0.20 2.08 -0.33 8.23 -0.02 -1.26 -1.42 135.00 142.49 3iwo n PRO 88 Ca 0.04 0.75 0.08 0.00 -2.02 0.00 0.00 63.50 62.34 3iwo n PRO 88 Cb 0.50 -2.56 0.25 0.00 -0.02 0.00 0.00 33.50 31.66 3iwo n PRO 88 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3iwo h THR 89 N 2.10 0.79 0.00 3.45 2.02 -1.61 -2.37 112.91 117.30 3iwo h THR 89 Ca -0.50 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 66.40 3iwo h THR 89 Cb 1.28 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3iwo h THR 89 CO 0.60 0.14 -0.09 0.74 0.37 0.00 0.00 175.52 177.28 3iwo h THR 90 N 0.77 0.58 -0.91 3.16 2.02 -1.83 -1.74 112.91 114.96 3iwo h THR 90 Ca 0.49 -0.39 0.11 0.00 0.77 0.00 0.00 66.41 67.39 3iwo h THR 90 Cb 0.64 1.25 -0.07 0.00 -1.74 0.00 0.00 68.15 68.23 3iwo h THR 90 CO -0.33 0.09 0.59 0.50 0.37 0.00 0.00 175.52 176.73 3iwo h LYS 91 N 0.00 0.86 0.00 6.66 3.64 -1.80 -2.60 116.57 123.32 3iwo h LYS 91 Ca -0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3iwo h LYS 91 Cb 0.24 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3iwo h LYS 91 CO 0.01 0.57 -1.10 0.66 -2.27 0.00 0.00 179.45 177.31 3iwo n TYR 92 N -4.55 0.05 -3.55 1.91 4.02 -0.71 -4.57 117.16 109.78 3iwo n TYR 92 Ca 0.16 0.02 -0.28 0.00 -0.01 0.00 0.00 57.90 57.79 3iwo n TYR 92 Cb 0.33 -0.19 -0.11 0.00 -0.02 0.00 0.00 39.34 39.36 3iwo n TYR 92 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 3iwo s TRP 93 N -3.12 1.71 0.54 -0.72 -0.11 -0.89 -4.99 118.94 111.37 3iwo s TRP 93 Ca 0.05 -2.51 0.21 0.00 1.22 0.00 0.00 56.10 55.07 3iwo s TRP 93 Cb 0.16 -1.42 1.43 0.00 -1.50 0.00 0.00 33.47 32.13 3iwo s TRP 93 CO 0.84 -0.76 2.15 -1.35 -4.62 0.00 0.00 176.95 173.21 3iwo h PRO 94 N 5.82 0.00 0.00 5.86 0.11 -1.72 -0.51 132.00 141.55 3iwo h PRO 94 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3iwo h PRO 94 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 3iwo h PRO 94 CO 0.45 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.63 3iwo n GLU 95 N -4.33 0.10 -2.72 1.05 4.71 -1.26 -4.39 120.64 113.79 3iwo n GLU 95 Ca -0.01 0.31 -0.43 0.00 -0.01 0.00 0.00 57.16 57.02 3iwo n GLU 95 Cb 0.17 -1.67 0.00 0.00 -1.01 0.00 0.00 31.44 28.93 3iwo n GLU 95 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 3iwo n LEU 96 N -1.85 5.40 -0.06 -4.62 7.94 -0.20 -4.72 117.00 118.88 3iwo n LEU 96 Ca 0.03 -4.33 0.08 0.00 -1.11 0.00 0.00 56.01 50.68 3iwo n LEU 96 Cb 0.22 -1.64 -0.08 0.00 0.53 0.00 0.00 43.42 42.45 3iwo n LEU 96 CO 0.18 0.68 0.01 0.35 -1.11 0.00 0.00 177.39 177.49 3iwo n THR 97 N 4.93 0.00 -1.70 1.96 -2.24 -1.26 -4.68 114.28 111.30 3iwo n THR 97 Ca 0.41 -0.14 -0.40 0.00 -2.27 0.00 0.00 64.05 61.65 3iwo n THR 97 Cb 0.43 1.03 0.02 0.00 -2.10 0.00 0.00 70.33 69.71 3iwo n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3iwo n ALA 98 N -1.19 1.17 0.27 6.98 0.00 -1.26 -4.88 120.51 121.59 3iwo n ALA 98 Ca 0.04 0.20 0.12 0.00 0.00 0.00 0.00 53.44 53.80 3iwo n ALA 98 Cb 0.28 -2.26 0.74 0.00 0.00 0.00 0.00 19.45 18.21 3iwo n ALA 98 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3iwo h LYS 99 N 1.73 0.00 0.00 0.00 2.10 -1.94 -2.38 116.57 116.08 3iwo h LYS 99 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 3iwo h LYS 99 Cb 1.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.64 3iwo h LYS 99 CO 0.58 0.08 0.00 -0.56 -2.00 0.00 0.00 179.45 177.55 3iwo h GLN 100 N 0.00 0.00 0.00 0.07 -0.00 -1.93 -2.71 115.11 110.54 3iwo h GLN 100 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3iwo h GLN 100 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.68 3iwo h GLN 100 CO 0.01 0.00 -0.14 0.91 -0.00 0.00 0.00 178.83 179.61 3iwo n TRP 101 N -2.49 0.48 -0.25 0.06 7.02 -0.90 -4.58 117.44 116.78 3iwo n TRP 101 Ca 0.01 0.14 -0.10 0.00 -1.02 0.00 0.00 57.50 56.53 3iwo n TRP 101 Cb 0.21 -0.69 -0.06 0.00 -2.42 0.00 0.00 31.31 28.36 3iwo n TRP 101 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 3iwo h ASN 102 N 0.00 -1.73 -0.44 -0.99 4.21 -1.66 -1.84 115.58 113.13 3iwo h ASN 102 Ca 0.00 0.27 0.00 0.00 1.21 0.00 0.00 56.30 57.78 3iwo h ASN 102 Cb 0.64 0.77 0.00 0.00 -1.12 0.00 0.00 38.32 38.61 3iwo h ASN 102 CO 0.00 -0.33 0.00 0.61 -1.29 0.00 0.00 177.43 176.42 3iwo n GLY 103 N -1.37 2.47 3.55 2.83 0.00 -1.26 -4.86 105.19 106.54 3iwo n GLY 103 Ca 0.01 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 3iwo n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iwo s ILE 104 N -2.17 5.14 0.45 -0.61 1.01 -0.69 -4.87 121.20 119.45 3iwo s ILE 104 Ca 0.40 0.11 0.08 0.00 0.00 0.00 0.00 60.65 61.23 3iwo s ILE 104 Cb 0.29 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.91 3iwo s ILE 104 CO 0.13 -0.12 0.45 0.42 0.00 0.00 0.00 174.94 175.83 3iwo s THR 105 N 2.09 2.53 0.40 2.92 -4.23 -1.26 -1.70 115.64 116.39 3iwo s THR 105 Ca 0.13 -1.28 0.08 0.00 -1.18 0.00 0.00 61.69 59.44 3iwo s THR 105 Cb -0.16 -2.81 0.28 0.00 1.34 0.00 0.00 72.50 71.15 3iwo s THR 105 CO 0.12 0.00 2.02 -0.07 -0.54 0.00 0.00 174.62 176.15 3iwo h LEU 106 N 0.85 0.51 -0.38 4.79 3.38 -1.18 -1.99 115.31 121.29 3iwo h LEU 106 Ca -0.39 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 57.63 3iwo h LEU 106 Cb 1.28 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.86 3iwo h LEU 106 CO 0.54 0.35 0.06 0.25 0.09 0.00 0.00 178.44 179.73 3iwo h LEU 107 N 0.59 -0.03 -0.60 1.67 5.85 -1.28 -1.24 115.31 120.26 3iwo h LEU 107 Ca 0.22 0.07 0.02 0.00 0.84 0.00 0.00 57.88 59.02 3iwo h LEU 107 Cb 0.12 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 3iwo h LEU 107 CO -0.06 0.02 0.39 0.45 -0.34 0.00 0.00 178.44 178.90 3iwo h HIS 108 N 0.18 0.73 -0.21 1.25 3.86 -1.65 -1.94 115.15 117.36 3iwo h HIS 108 Ca 0.18 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.42 3iwo h HIS 108 Cb 0.22 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.43 3iwo h HIS 108 CO -0.21 0.44 0.10 -0.07 0.86 0.00 0.00 177.93 179.05 3iwo h LEU 109 N 0.78 0.15 -1.59 2.43 3.38 -1.23 0.80 115.31 120.03 3iwo h LEU 109 Ca 0.23 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 3iwo h LEU 109 Cb -0.04 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3iwo h LEU 109 CO -0.07 0.12 -0.22 0.00 0.09 0.00 0.00 178.44 178.36 3iwo h ALA 110 N 1.11 1.53 -0.14 1.53 0.00 -0.91 -2.57 119.26 119.81 3iwo h ALA 110 Ca 0.09 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3iwo h ALA 110 Cb 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3iwo h ALA 110 CO -0.06 0.27 0.00 0.25 0.00 0.00 0.00 179.25 179.71 3iwo n THR 111 N -4.12 1.28 -2.04 0.00 -2.24 -0.76 -4.44 114.28 101.96 3iwo n THR 111 Ca -0.02 -1.29 -0.13 0.00 -2.27 0.00 0.00 64.05 60.35 3iwo n THR 111 Cb 0.29 0.31 -0.02 0.00 -2.10 0.00 0.00 70.33 68.81 3iwo n THR 111 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3iwo n TYR 112 N -0.32 -0.46 -0.95 4.78 4.01 -0.68 -4.81 117.16 118.72 3iwo n TYR 112 Ca 0.08 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.91 3iwo n TYR 112 Cb 0.44 -2.69 0.18 0.00 -0.31 0.00 0.00 39.34 36.95 3iwo n TYR 112 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3iwo n THR 113 N -3.69 1.96 0.30 -0.72 -2.24 0.19 -1.23 114.28 108.84 3iwo n THR 113 Ca -0.15 -2.00 0.19 0.00 -2.27 0.00 0.00 64.05 59.82 3iwo n THR 113 Cb 0.57 -0.18 0.85 0.00 -2.10 0.00 0.00 70.33 69.47 3iwo n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3iwo h ALA 114 N 0.77 1.00 0.00 6.98 0.00 -1.80 0.27 119.26 126.48 3iwo h ALA 114 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3iwo h ALA 114 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3iwo h ALA 114 CO 0.09 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.75 3iwo n GLY 115 N -0.40 1.41 0.00 0.00 0.00 -1.26 -4.02 105.19 100.92 3iwo n GLY 115 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3iwo n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iwo n GLY 116 N -0.04 1.92 3.69 -0.02 0.00 -1.26 -0.48 105.19 108.99 3iwo n GLY 116 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3iwo n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3iwo n LEU 117 N 0.00 3.77 -4.82 0.99 4.77 -1.26 -4.71 117.00 115.74 3iwo n LEU 117 Ca 0.00 1.12 -0.32 0.00 -0.03 0.00 0.00 56.01 56.78 3iwo n LEU 117 Cb 0.00 -1.48 -0.00 0.00 -2.33 0.00 0.00 43.42 39.61 3iwo n LEU 117 CO 0.00 -0.70 0.70 -2.16 -1.33 0.00 0.00 177.39 173.91 3iwo s PRO 118 N -2.11 3.54 0.24 3.23 0.04 -1.26 -4.76 135.00 133.91 3iwo s PRO 118 Ca 0.60 1.09 -0.09 0.00 0.04 0.00 0.00 61.00 62.65 3iwo s PRO 118 Cb -0.53 -2.07 0.39 0.00 0.04 0.00 0.00 34.50 32.33 3iwo s PRO 118 CO 0.59 -0.62 1.64 1.25 0.04 0.00 0.00 177.00 179.89 3iwo h LEU 119 N 0.54 -0.38 -8.70 -3.56 5.85 -1.92 -3.20 115.31 103.94 3iwo h LEU 119 Ca -0.47 0.19 -0.64 0.00 0.84 0.00 0.00 57.88 57.81 3iwo h LEU 119 Cb 1.21 0.35 -0.25 0.00 0.37 0.00 0.00 40.66 42.33 3iwo h LEU 119 CO 0.59 -0.18 -0.86 -1.10 -0.34 0.00 0.00 178.44 176.55 3iwo s GLN 120 N -6.14 1.50 0.20 1.25 -1.52 -1.26 -0.52 119.66 113.17 3iwo s GLN 120 Ca -0.14 -1.10 -0.31 0.00 -1.95 0.00 0.00 55.36 51.86 3iwo s GLN 120 Cb 0.21 -1.73 -0.10 0.00 -0.22 0.00 0.00 33.01 31.18 3iwo s GLN 120 CO 0.75 0.43 1.45 0.08 -0.25 0.00 0.00 175.29 177.75 3iwo s VAL 121 N -0.90 2.81 0.41 1.09 1.01 -1.26 -4.83 120.40 118.73 3iwo s VAL 121 Ca 0.10 0.64 -0.24 0.00 0.00 0.00 0.00 61.98 62.47 3iwo s VAL 121 Cb -0.10 -3.41 -0.11 0.00 0.00 0.00 0.00 36.38 32.77 3iwo s VAL 121 CO 0.03 0.08 0.93 -2.65 0.00 0.00 0.00 175.10 173.49 3iwo n PRO 122 N 3.03 1.21 -0.31 2.72 -0.02 -1.26 -4.85 135.00 135.52 3iwo n PRO 122 Ca 0.09 0.43 0.16 0.00 -2.02 0.00 0.00 63.50 62.17 3iwo n PRO 122 Cb 0.40 -1.93 0.35 0.00 -0.02 0.00 0.00 33.50 32.30 3iwo n PRO 122 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3iwo h ASP 123 N 1.44 0.08 0.82 2.55 3.32 -2.03 -2.05 116.42 120.56 3iwo h ASP 123 Ca -0.43 0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.83 3iwo h ASP 123 Cb 1.35 0.26 0.00 0.00 0.22 0.00 0.00 39.33 41.16 3iwo h ASP 123 CO 0.56 -0.19 -0.12 -0.62 -1.72 0.00 0.00 179.24 177.16 3iwo n GLU 124 N -5.22 0.07 -2.35 3.56 4.71 -1.26 -4.66 120.64 115.48 3iwo n GLU 124 Ca 0.25 -0.01 -0.42 0.00 -0.01 0.00 0.00 57.16 56.96 3iwo n GLU 124 Cb 0.79 -1.50 -0.02 0.00 -1.01 0.00 0.00 31.44 29.69 3iwo n GLU 124 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 3iwo s VAL 125 N -2.94 3.83 -0.01 2.62 1.01 -0.77 -4.80 120.40 119.33 3iwo s VAL 125 Ca 0.15 0.78 -0.01 0.00 0.00 0.00 0.00 61.98 62.89 3iwo s VAL 125 Cb 0.19 -4.29 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 3iwo s VAL 125 CO 0.56 -0.94 -0.03 0.29 0.00 0.00 0.00 175.10 174.97 3iwo n LYS 126 N 8.38 0.06 -2.44 2.72 5.02 -1.26 -4.35 118.16 126.29 3iwo n LYS 126 Ca 0.15 0.02 -0.24 0.00 -2.02 0.00 0.00 58.31 56.22 3iwo n LYS 126 Cb 0.49 -0.59 0.05 0.00 -0.02 0.00 0.00 35.03 34.95 3iwo n LYS 126 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3iwo s SER 127 N -5.38 5.22 0.25 4.39 1.04 -1.26 -4.75 113.70 113.21 3iwo s SER 127 Ca -0.04 0.37 -0.03 0.00 0.48 0.00 0.00 55.95 56.73 3iwo s SER 127 Cb 0.01 -1.22 0.47 0.00 0.10 0.00 0.00 66.02 65.38 3iwo s SER 127 CO 0.05 -1.26 1.78 0.28 0.98 0.00 0.00 173.24 175.06 3iwo h SER 128 N -0.22 0.57 -0.32 7.02 0.02 -1.99 -0.97 113.55 117.66 3iwo h SER 128 Ca -0.44 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.56 3iwo h SER 128 Cb 1.29 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.79 3iwo h SER 128 CO 0.58 0.28 0.12 0.28 -1.14 0.00 0.00 176.83 176.95 3iwo h SER 129 N 0.68 0.44 -0.69 3.07 0.02 -1.99 -1.30 113.55 113.78 3iwo h SER 129 Ca 0.43 -0.17 0.10 0.00 -0.84 0.00 0.00 61.79 61.31 3iwo h SER 129 Cb 0.53 -0.12 -0.08 0.00 0.14 0.00 0.00 62.40 62.88 3iwo h SER 129 CO -0.31 0.49 0.31 0.44 -1.14 0.00 0.00 176.83 176.61 3iwo h ASP 130 N 0.37 0.36 -0.14 3.07 3.32 -1.86 -1.69 116.42 119.85 3iwo h ASP 130 Ca 0.11 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 3iwo h ASP 130 Cb 0.19 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 3iwo h ASP 130 CO -0.01 0.19 0.01 0.25 -1.72 0.00 0.00 179.24 177.97 3iwo h LEU 131 N 0.51 0.23 -0.45 1.55 5.85 -0.93 -0.63 115.31 121.44 3iwo h LEU 131 Ca 0.35 -0.28 0.08 0.00 0.84 0.00 0.00 57.88 58.86 3iwo h LEU 131 Cb 0.42 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.32 3iwo h LEU 131 CO -0.30 0.45 0.04 0.25 -0.34 0.00 0.00 178.44 178.54 3iwo h LEU 132 N -0.01 -0.10 -0.55 2.25 5.85 -1.02 -1.93 115.31 119.80 3iwo h LEU 132 Ca 0.04 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 3iwo h LEU 132 Cb 0.33 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 3iwo h LEU 132 CO 0.00 -0.02 0.11 0.03 -0.34 0.00 0.00 178.44 178.23 3iwo h ARG 133 N 0.16 0.90 0.08 1.25 3.08 -1.10 -0.12 114.38 118.64 3iwo h ARG 133 Ca 0.22 -0.23 0.02 0.00 0.07 0.00 0.00 59.98 60.07 3iwo h ARG 133 Cb 0.31 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 3iwo h ARG 133 CO -0.34 0.86 -0.28 0.35 -1.07 0.00 0.00 179.97 179.49 3iwo h PHE 134 N 0.80 -0.76 -0.22 3.04 3.57 -0.74 -0.14 116.94 122.50 3iwo h PHE 134 Ca 0.17 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.57 3iwo h PHE 134 Cb 0.38 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 3iwo h PHE 134 CO 0.03 -0.38 -0.37 1.88 -2.23 0.00 0.00 178.31 177.23 3iwo h TYR 135 N -0.47 0.56 -0.16 0.41 0.05 -1.25 -2.17 116.97 113.93 3iwo h TYR 135 Ca 0.04 -0.15 -0.03 0.00 0.05 0.00 0.00 58.73 58.64 3iwo h TYR 135 Cb 0.52 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.12 3iwo h TYR 135 CO -0.27 0.79 -0.04 1.96 -1.05 0.00 0.00 178.16 179.54 3iwo h GLN 136 N 0.40 0.24 0.00 4.88 1.08 -0.76 -3.05 115.11 117.90 3iwo h GLN 136 Ca 0.04 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3iwo h GLN 136 Cb 0.84 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.22 3iwo h GLN 136 CO 0.07 0.30 -0.70 0.09 -0.95 0.00 0.00 178.83 177.65 3iwo n ASN 137 N -4.35 0.61 -4.74 1.46 5.03 -0.09 -4.84 115.26 108.34 3iwo n ASN 137 Ca -0.00 -0.13 -0.41 0.00 0.87 0.00 0.00 54.58 54.90 3iwo n ASN 137 Cb 0.20 0.39 -0.03 0.00 -1.02 0.00 0.00 39.78 39.32 3iwo n ASN 137 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 3iwo s TRP 138 N -3.11 3.27 -0.13 3.10 -0.00 -0.83 -5.02 118.94 116.22 3iwo s TRP 138 Ca 0.07 1.26 0.03 0.00 -0.00 0.00 0.00 56.10 57.46 3iwo s TRP 138 Cb 0.15 -3.58 0.01 0.00 -0.00 0.00 0.00 33.47 30.05 3iwo s TRP 138 CO 0.74 -1.79 -0.22 -0.65 -0.00 0.00 0.00 176.95 175.03 3iwo s GLN 139 N -0.25 3.03 0.51 5.86 -1.52 -1.26 -4.97 119.66 121.07 3iwo s GLN 139 Ca 0.56 -0.86 -0.22 0.00 -1.95 0.00 0.00 55.36 52.89 3iwo s GLN 139 Cb -0.36 -2.41 -0.06 0.00 -0.22 0.00 0.00 33.01 29.97 3iwo s GLN 139 CO 0.39 0.04 1.25 -1.25 -0.25 0.00 0.00 175.29 175.47 3iwo s PRO 140 N 0.69 3.39 0.20 2.91 0.04 -1.26 -4.95 135.00 136.01 3iwo s PRO 140 Ca -0.10 1.98 0.11 0.00 0.04 0.00 0.00 61.00 63.03 3iwo s PRO 140 Cb -0.16 -2.28 -0.03 0.00 0.04 0.00 0.00 34.50 32.07 3iwo s PRO 140 CO 0.01 -0.91 1.38 0.00 0.04 0.00 0.00 177.00 177.52 3iwo h ALA 141 N 1.64 0.54 -2.59 8.56 0.00 -1.06 -3.48 119.26 122.87 3iwo h ALA 141 Ca -0.50 -0.69 -0.10 0.00 0.00 0.00 0.00 54.91 53.62 3iwo h ALA 141 Cb 1.28 -0.12 -0.13 0.00 0.00 0.00 0.00 17.79 18.81 3iwo h ALA 141 CO 0.58 0.95 -0.34 -1.58 0.00 0.00 0.00 179.25 178.86 3iwo s TRP 142 N -2.90 0.31 0.72 0.00 0.51 -1.06 -5.02 118.94 111.50 3iwo s TRP 142 Ca 0.02 -0.70 -0.14 0.00 -2.12 0.00 0.00 56.10 53.16 3iwo s TRP 142 Cb 0.09 -0.06 0.03 0.00 -0.81 0.00 0.00 33.47 32.72 3iwo s TRP 142 CO 0.78 -0.65 1.14 0.00 -0.51 0.00 0.00 176.95 177.72 3iwo s ALA 143 N -3.93 2.23 0.51 0.98 0.00 -1.26 -4.45 121.76 115.84 3iwo s ALA 143 Ca 0.13 0.63 -0.23 0.00 0.00 0.00 0.00 51.96 52.49 3iwo s ALA 143 Cb 0.04 -3.38 -0.06 0.00 0.00 0.00 0.00 23.12 19.72 3iwo s ALA 143 CO -0.04 -1.69 1.32 -2.14 0.00 0.00 0.00 175.76 173.20 3iwo s PRO 144 N -4.19 3.40 -0.67 0.00 0.02 -1.26 -3.35 135.00 128.94 3iwo s PRO 144 Ca 0.69 2.14 0.00 0.00 0.02 0.00 0.00 61.00 63.84 3iwo s PRO 144 Cb -0.23 -2.37 0.00 0.00 0.02 0.00 0.00 34.50 31.92 3iwo s PRO 144 CO 0.46 -0.95 0.00 0.41 -0.33 0.00 0.00 177.00 176.59 3iwo n GLY 145 N 0.64 0.63 0.01 0.52 0.00 0.08 -4.91 105.19 102.16 3iwo n GLY 145 Ca 0.09 -0.70 -0.01 0.00 0.00 0.00 0.00 46.02 45.40 3iwo n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3iwo n THR 146 N -3.21 0.13 -4.00 2.61 -2.24 -1.21 -4.86 114.28 101.50 3iwo n THR 146 Ca -0.07 -0.07 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 3iwo n THR 146 Cb 0.34 -0.86 -0.14 0.00 -2.10 0.00 0.00 70.33 67.57 3iwo n THR 146 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3iwo s GLN 147 N -2.05 0.23 -0.25 -0.78 -1.52 -1.26 -2.02 119.66 112.01 3iwo s GLN 147 Ca -0.01 -0.20 -0.09 0.00 -1.95 0.00 0.00 55.36 53.11 3iwo s GLN 147 Cb 0.01 -0.16 -0.04 0.00 -0.22 0.00 0.00 33.01 32.60 3iwo s GLN 147 CO 0.07 0.04 0.13 0.50 -0.25 0.00 0.00 175.29 175.78 3iwo s ARG 148 N -0.33 3.88 -0.28 2.91 3.52 0.26 -4.30 118.95 124.61 3iwo s ARG 148 Ca -0.02 -0.37 -0.00 0.00 -0.13 0.00 0.00 55.73 55.21 3iwo s ARG 148 Cb -0.03 -3.46 0.08 0.00 -1.56 0.00 0.00 34.95 29.99 3iwo s ARG 148 CO -0.00 -0.07 0.04 -1.17 -0.81 0.00 0.00 175.30 173.29 3iwo s LEU 149 N 1.38 2.46 -0.09 -0.88 2.96 -0.37 -1.98 118.68 122.16 3iwo s LEU 149 Ca 0.06 -1.45 -0.39 0.00 -0.22 0.00 0.00 54.13 52.13 3iwo s LEU 149 Cb -0.15 -0.99 -0.17 0.00 0.50 0.00 0.00 46.19 45.38 3iwo s LEU 149 CO 0.06 -0.35 1.42 0.00 -1.32 0.00 0.00 176.35 176.16 3iwo n TYR 150 N 4.76 1.52 -3.65 5.38 4.19 -1.26 -4.79 117.16 123.30 3iwo n TYR 150 Ca -0.05 0.75 -0.05 0.00 3.31 0.00 0.00 57.90 61.86 3iwo n TYR 150 Cb 0.43 -2.31 -0.07 0.00 0.49 0.00 0.00 39.34 37.89 3iwo n TYR 150 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 3iwo s ALA 151 N 1.48 -1.72 0.33 2.98 0.00 -1.26 -4.34 121.76 119.23 3iwo s ALA 151 Ca 0.92 2.10 0.05 0.00 0.00 0.00 0.00 51.96 55.03 3iwo s ALA 151 Cb -1.11 -1.52 0.58 0.00 0.00 0.00 0.00 23.12 21.08 3iwo s ALA 151 CO 0.58 -0.70 1.84 -0.91 0.00 0.00 0.00 175.76 176.57 3iwo h ASN 152 N 7.72 0.44 0.65 0.00 2.35 -0.94 -2.62 115.58 123.18 3iwo h ASN 152 Ca -0.22 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 3iwo h ASN 152 Cb 1.14 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.39 3iwo h ASN 152 CO 0.14 0.58 0.00 -1.54 -1.65 0.00 0.00 177.43 174.95 3iwo n SER 153 N -4.24 0.46 -0.05 5.81 3.41 -1.21 -0.95 113.62 116.85 3iwo n SER 153 Ca 0.01 0.62 -0.05 0.00 -0.26 0.00 0.00 58.87 59.19 3iwo n SER 153 Cb 0.29 -0.71 -0.02 0.00 -0.26 0.00 0.00 64.21 63.51 3iwo n SER 153 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3iwo n SER 154 N -2.01 1.26 0.17 4.04 2.88 -1.01 -3.71 113.62 115.25 3iwo n SER 154 Ca 0.02 0.37 0.02 0.00 -1.33 0.00 0.00 58.87 57.95 3iwo n SER 154 Cb 0.21 -0.71 0.29 0.00 -0.75 0.00 0.00 64.21 63.25 3iwo n SER 154 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 3iwo h ILE 155 N -0.68 1.28 -0.41 2.46 2.10 -1.26 -1.76 117.51 119.24 3iwo h ILE 155 Ca 0.00 -1.65 0.04 0.00 1.08 0.00 0.00 64.86 64.33 3iwo h ILE 155 Cb 0.50 1.90 -0.04 0.00 -1.09 0.00 0.00 36.82 38.10 3iwo h ILE 155 CO 0.00 0.46 0.19 1.23 -1.08 0.00 0.00 178.15 178.95 3iwo h GLY 156 N 1.54 0.55 1.02 8.18 0.00 -1.27 -0.45 103.07 112.65 3iwo h GLY 156 Ca -0.00 -0.13 -0.10 0.00 0.00 0.00 0.00 47.33 47.10 3iwo h GLY 156 CO 0.06 0.08 -0.10 -2.00 0.00 0.00 0.00 176.54 174.58 3iwo h LEU 157 N 0.38 0.88 -0.54 3.11 5.85 -1.57 -2.39 115.31 121.03 3iwo h LEU 157 Ca 0.18 -0.36 0.11 0.00 0.84 0.00 0.00 57.88 58.65 3iwo h LEU 157 Cb 0.11 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 40.80 3iwo h LEU 157 CO -0.14 1.03 -0.05 0.15 -0.34 0.00 0.00 178.44 179.09 3iwo h PHE 158 N 0.71 -0.13 -0.44 1.25 3.57 -0.95 -1.17 116.94 119.78 3iwo h PHE 158 Ca 0.12 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 3iwo h PHE 158 Cb 0.64 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.50 3iwo h PHE 158 CO 0.05 -0.17 0.20 0.78 -2.23 0.00 0.00 178.31 176.94 3iwo h GLY 159 N 0.07 0.68 1.38 2.40 0.00 -0.82 0.14 103.07 106.92 3iwo h GLY 159 Ca 0.27 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 47.20 3iwo h GLY 159 CO -0.49 0.33 0.11 0.00 0.00 0.00 0.00 176.54 176.48 3iwo h ALA 160 N 1.05 1.23 0.07 3.60 0.00 -1.14 -3.00 119.26 121.07 3iwo h ALA 160 Ca 0.15 -0.20 -0.26 0.00 0.00 0.00 0.00 54.91 54.59 3iwo h ALA 160 Cb 0.13 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.73 3iwo h ALA 160 CO -0.02 0.53 -1.11 -0.07 0.00 0.00 0.00 179.25 178.58 3iwo h LEU 161 N 0.75 0.64 -1.82 0.00 3.38 -0.92 -3.33 115.31 114.01 3iwo h LEU 161 Ca 0.17 -0.57 0.09 0.00 0.09 0.00 0.00 57.88 57.66 3iwo h LEU 161 Cb 0.30 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3iwo h LEU 161 CO 0.00 1.39 0.32 0.00 0.09 0.00 0.00 178.44 180.24 3iwo h ALA 162 N 0.55 2.16 -0.01 1.53 0.00 -0.59 -1.85 119.26 121.05 3iwo h ALA 162 Ca -0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3iwo h ALA 162 Cb 1.78 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.54 3iwo h ALA 162 CO 0.20 -0.27 -0.21 1.33 0.00 0.00 0.00 179.25 180.30 3iwo n VAL 163 N -4.45 0.00 -0.13 0.00 0.24 -1.21 -4.52 118.33 108.25 3iwo n VAL 163 Ca 0.07 -0.12 -0.09 0.00 -2.04 0.00 0.00 64.34 62.16 3iwo n VAL 163 Cb 0.38 0.30 -0.01 0.00 -1.47 0.00 0.00 33.84 33.05 3iwo n VAL 163 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 3iwo h LYS 164 N 1.14 0.56 -0.47 7.34 1.79 -1.48 -2.37 116.57 123.07 3iwo h LYS 164 Ca 0.00 -0.07 0.07 0.00 -2.18 0.00 0.00 60.65 58.47 3iwo h LYS 164 Cb 0.48 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 31.00 3iwo h LYS 164 CO 0.00 0.47 0.32 -1.35 -1.08 0.00 0.00 179.45 177.81 3iwo h PRO 165 N 0.50 0.32 0.00 3.15 0.11 -1.79 -0.45 132.00 133.83 3iwo h PRO 165 Ca 0.14 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 3iwo h PRO 165 Cb 0.09 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.13 3iwo h PRO 165 CO -0.02 0.21 -0.01 0.66 -0.21 0.00 0.00 178.00 178.63 3iwo h SER 166 N 0.32 0.00 0.00 -2.05 4.64 -1.73 -3.46 113.55 111.28 3iwo h SER 166 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3iwo h SER 166 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3iwo h SER 166 CO -0.05 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.53 3iwo n GLY 167 N -0.43 0.22 3.86 -0.77 0.00 -0.18 -5.00 105.19 102.89 3iwo n GLY 167 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 3iwo n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iwo s LEU 168 N 0.00 3.87 0.85 0.99 1.43 -1.26 -5.08 118.68 119.49 3iwo s LEU 168 Ca 0.00 1.22 -0.11 0.00 -1.03 0.00 0.00 54.13 54.21 3iwo s LEU 168 Cb 0.00 -4.08 0.11 0.00 0.03 0.00 0.00 46.19 42.24 3iwo s LEU 168 CO 0.00 -0.37 1.14 -0.94 0.23 0.00 0.00 176.35 176.41 3iwo s SER 169 N -2.93 3.50 0.17 2.29 1.04 -1.26 -4.75 113.70 111.77 3iwo s SER 169 Ca 0.53 2.14 -0.14 0.00 0.48 0.00 0.00 55.95 58.95 3iwo s SER 169 Cb -0.10 -2.56 0.12 0.00 0.10 0.00 0.00 66.02 63.58 3iwo s SER 169 CO 0.28 -2.72 1.74 0.15 0.98 0.00 0.00 173.24 173.67 3iwo h PHE 170 N -1.43 0.25 -0.33 5.02 3.57 -1.93 -0.63 116.94 121.46 3iwo h PHE 170 Ca -0.44 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.08 3iwo h PHE 170 Cb 1.26 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.94 3iwo h PHE 170 CO 0.51 0.08 0.19 1.49 -2.23 0.00 0.00 178.31 178.36 3iwo h GLU 171 N 0.30 0.45 -0.44 1.11 4.81 -1.99 -0.38 114.58 118.44 3iwo h GLU 171 Ca 0.21 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.29 3iwo h GLU 171 Cb 0.21 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 3iwo h GLU 171 CO -0.22 0.35 -0.12 1.96 -0.73 0.00 0.00 179.01 180.25 3iwo h GLN 172 N 0.41 0.79 0.02 1.92 1.08 -1.85 0.20 115.11 117.68 3iwo h GLN 172 Ca 0.12 -0.27 -0.00 0.00 -1.45 0.00 0.00 58.65 57.05 3iwo h GLN 172 Cb 0.03 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.40 3iwo h GLN 172 CO -0.02 0.88 -0.01 0.00 -0.95 0.00 0.00 178.83 178.73 3iwo h ALA 173 N 1.15 -0.02 -0.44 3.87 0.00 -0.91 -1.41 119.26 121.50 3iwo h ALA 173 Ca 0.12 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.02 3iwo h ALA 173 Cb 0.61 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 3iwo h ALA 173 CO 0.04 -0.47 0.22 1.98 0.00 0.00 0.00 179.25 181.02 3iwo h MET 174 N -0.11 0.42 -0.17 0.00 1.85 -0.73 -0.08 114.93 116.11 3iwo h MET 174 Ca -0.00 -0.03 -0.02 0.00 -0.61 0.00 0.00 59.70 59.04 3iwo h MET 174 Cb 0.10 -0.10 -0.01 0.00 0.43 0.00 0.00 31.60 32.03 3iwo h MET 174 CO 0.00 0.28 0.01 0.37 -0.40 0.00 0.00 176.91 177.18 3iwo h GLN 175 N 0.43 0.29 0.00 0.39 4.15 -0.86 -0.99 115.11 118.52 3iwo h GLN 175 Ca 0.19 -0.09 -0.12 0.00 0.77 0.00 0.00 58.65 59.40 3iwo h GLN 175 Cb 0.10 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.74 3iwo h GLN 175 CO -0.13 0.49 -0.73 1.79 -1.93 0.00 0.00 178.83 178.31 3iwo h THR 176 N 0.05 0.84 0.00 2.39 1.35 -1.17 -0.74 112.91 115.63 3iwo h THR 176 Ca 0.05 -2.25 0.00 0.00 -0.55 0.00 0.00 66.41 63.66 3iwo h THR 176 Cb 0.35 2.37 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 3iwo h THR 176 CO 0.01 0.48 -1.92 0.54 -0.25 0.00 0.00 175.52 174.37 3iwo n ARG 177 N -3.16 0.61 0.07 4.72 1.74 -0.05 -4.44 116.66 116.15 3iwo n ARG 177 Ca -0.01 -0.18 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 3iwo n ARG 177 Cb 0.77 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 3iwo n ARG 177 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3iwo n VAL 178 N -2.20 0.82 0.12 1.55 0.31 -0.47 -4.72 118.33 113.74 3iwo n VAL 178 Ca -0.04 0.27 -0.13 0.00 -0.01 0.00 0.00 64.34 64.43 3iwo n VAL 178 Cb 0.53 -1.29 -0.07 0.00 -0.91 0.00 0.00 33.84 32.09 3iwo n VAL 178 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 3iwo h PHE 179 N 0.00 -0.20 -0.14 3.52 0.04 -1.31 -3.06 116.94 115.80 3iwo h PHE 179 Ca 0.00 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 3iwo h PHE 179 Cb 0.07 0.07 -0.00 0.00 2.20 0.00 0.00 35.95 38.28 3iwo h PHE 179 CO 0.00 -0.12 -0.11 1.96 -0.60 0.00 0.00 178.31 179.44 3iwo h GLN 180 N -0.22 0.32 0.00 1.51 4.20 -1.38 0.62 115.11 120.16 3iwo h GLN 180 Ca -0.02 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.53 3iwo h GLN 180 Cb 0.17 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 3iwo h GLN 180 CO 0.04 0.69 -0.00 -1.35 -0.67 0.00 0.00 178.83 177.53 3iwo h PRO 181 N -0.05 0.00 -0.25 1.46 0.11 -1.78 -0.37 132.00 131.13 3iwo h PRO 181 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 3iwo h PRO 181 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 3iwo h PRO 181 CO 0.03 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.10 3iwo n LEU 182 N -4.32 2.16 -3.28 2.35 4.77 -1.11 -4.94 117.00 112.63 3iwo n LEU 182 Ca -0.03 -0.94 -0.23 0.00 -0.03 0.00 0.00 56.01 54.78 3iwo n LEU 182 Cb 0.09 -0.16 0.06 0.00 -2.33 0.00 0.00 43.42 41.08 3iwo n LEU 182 CO 0.32 0.47 0.12 0.29 -1.33 0.00 0.00 177.39 177.26 3iwo n LYS 183 N 0.65 -6.37 -2.85 3.23 5.02 -0.15 -4.92 118.16 112.77 3iwo n LYS 183 Ca 0.17 0.87 -0.44 0.00 -2.02 0.00 0.00 58.31 56.89 3iwo n LYS 183 Cb 0.40 -5.81 -0.01 0.00 -0.02 0.00 0.00 35.03 29.59 3iwo n LYS 183 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3iwo s LEU 184 N -6.95 4.74 0.00 -0.35 1.43 0.16 -4.80 118.68 112.90 3iwo s LEU 184 Ca 0.44 -2.59 0.28 0.00 -1.03 0.00 0.00 54.13 51.23 3iwo s LEU 184 Cb -0.19 -2.44 1.11 0.00 0.03 0.00 0.00 46.19 44.69 3iwo s LEU 184 CO 0.54 -0.94 1.78 0.59 0.23 0.00 0.00 176.35 178.55 3iwo n ASN 185 N 6.53 1.29 -2.58 2.29 3.02 -1.26 -3.62 115.26 120.93 3iwo n ASN 185 Ca 0.36 -1.37 -0.09 0.00 -0.03 0.00 0.00 54.58 53.44 3iwo n ASN 185 Cb 0.45 0.01 0.04 0.00 -0.61 0.00 0.00 39.78 39.67 3iwo n ASN 185 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3iwo n HIS 186 N -0.04 1.76 -4.76 3.10 8.25 -1.26 -5.05 115.22 117.23 3iwo n HIS 186 Ca 0.19 -2.28 -0.26 0.00 -0.26 0.00 0.00 57.72 55.10 3iwo n HIS 186 Cb 0.33 -0.27 -0.17 0.00 1.12 0.00 0.00 29.99 31.01 3iwo n HIS 186 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3iwo s THR 187 N -4.03 1.38 -0.00 1.59 2.01 -1.24 -3.75 115.64 111.59 3iwo s THR 187 Ca 0.34 -0.62 -0.11 0.00 0.31 0.00 0.00 61.69 61.61 3iwo s THR 187 Cb 0.36 -1.23 0.01 0.00 0.01 0.00 0.00 72.50 71.65 3iwo s THR 187 CO -0.02 0.41 0.23 0.26 -0.69 0.00 0.00 174.62 174.81 3iwo s TRP 188 N 0.55 -0.07 -0.13 4.92 0.52 -0.47 -5.01 118.94 119.25 3iwo s TRP 188 Ca -0.15 0.07 -0.15 0.00 0.02 0.00 0.00 56.10 55.88 3iwo s TRP 188 Cb -0.16 0.03 -0.25 0.00 -1.15 0.00 0.00 33.47 31.93 3iwo s TRP 188 CO 0.05 -0.34 0.43 0.82 0.02 0.00 0.00 176.95 177.93 3iwo h ILE 189 N 4.05 0.91 -3.63 2.03 2.04 -1.86 0.88 117.51 121.93 3iwo h ILE 189 Ca -0.30 -2.33 -0.68 0.00 1.00 0.00 0.00 64.86 62.55 3iwo h ILE 189 Cb 1.18 2.55 -0.32 0.00 -0.74 0.00 0.00 36.82 39.50 3iwo h ILE 189 CO 0.40 0.66 -0.72 0.20 0.00 0.00 0.00 178.15 178.69 3iwo s ASN 190 N -6.98 4.62 -0.02 1.72 0.01 -1.26 -4.79 114.94 108.23 3iwo s ASN 190 Ca -0.23 -1.05 -0.30 0.00 -0.71 0.00 0.00 52.86 50.58 3iwo s ASN 190 Cb 0.05 -1.70 -0.05 0.00 0.41 0.00 0.00 41.25 39.96 3iwo s ASN 190 CO 0.72 -0.19 1.43 -0.69 -1.51 0.00 0.00 177.10 176.87 3iwo s VAL 191 N 1.30 3.72 0.69 1.60 1.01 -1.26 -5.01 120.40 122.45 3iwo s VAL 191 Ca -0.02 1.06 -0.10 0.00 0.00 0.00 0.00 61.98 62.91 3iwo s VAL 191 Cb -0.18 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.54 3iwo s VAL 191 CO -0.03 -0.03 1.06 -2.16 0.00 0.00 0.00 175.10 173.95 3iwo s PRO 192 N 2.76 2.78 0.38 2.72 0.04 -1.26 -4.87 135.00 137.54 3iwo s PRO 192 Ca 0.65 0.31 0.08 0.00 0.04 0.00 0.00 61.00 62.09 3iwo s PRO 192 Cb -0.31 -2.07 0.82 0.00 0.04 0.00 0.00 34.50 32.98 3iwo s PRO 192 CO 0.26 -1.02 1.94 -1.35 0.04 0.00 0.00 177.00 176.87 3iwo h PRO 193 N -0.59 0.65 -0.07 0.56 0.11 -2.01 -1.14 132.00 129.50 3iwo h PRO 193 Ca -0.45 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.64 3iwo h PRO 193 Cb 1.26 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 3iwo h PRO 193 CO 0.63 0.43 0.07 0.00 -0.21 0.00 0.00 178.00 178.92 3iwo h ALA 194 N 1.62 1.77 -0.01 -0.75 0.00 -2.03 -2.48 119.26 117.38 3iwo h ALA 194 Ca 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3iwo h ALA 194 Cb 0.45 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3iwo h ALA 194 CO -0.12 -0.11 -0.58 0.39 0.00 0.00 0.00 179.25 178.83 3iwo n GLU 195 N -4.05 0.84 -0.29 0.00 -0.58 -0.45 -4.53 120.64 111.59 3iwo n GLU 195 Ca -0.01 -0.67 0.11 0.00 -0.42 0.00 0.00 57.16 56.17 3iwo n GLU 195 Cb 0.17 -1.49 0.35 0.00 -0.57 0.00 0.00 31.44 29.91 3iwo n GLU 195 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3iwo h GLU 196 N 1.64 0.73 0.00 3.49 5.08 -1.28 -0.33 114.58 123.91 3iwo h GLU 196 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3iwo h GLU 196 Cb 0.66 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.75 3iwo h GLU 196 CO 0.00 0.48 0.00 1.57 -1.00 0.00 0.00 179.01 180.06 3iwo h LYS 197 N 0.75 0.00 -0.01 2.33 2.10 -1.79 -2.50 116.57 117.44 3iwo h LYS 197 Ca 0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.11 3iwo h LYS 197 Cb 0.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 3iwo h LYS 197 CO -0.22 0.00 -0.42 0.09 -2.00 0.00 0.00 179.45 176.90 3iwo n ASN 198 N -3.07 1.76 -4.54 7.07 3.02 -0.16 -4.90 115.26 114.44 3iwo n ASN 198 Ca -0.00 -1.35 -0.43 0.00 -0.03 0.00 0.00 54.58 52.77 3iwo n ASN 198 Cb 0.24 0.39 -0.04 0.00 -0.61 0.00 0.00 39.78 39.76 3iwo n ASN 198 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3iwo s TYR 199 N -2.48 2.76 0.62 3.10 5.04 -0.94 -0.62 117.35 124.82 3iwo s TYR 199 Ca 0.20 0.17 -0.19 0.00 -2.44 0.00 0.00 57.07 54.81 3iwo s TYR 199 Cb 0.18 -4.18 -0.02 0.00 0.35 0.00 0.00 41.96 38.29 3iwo s TYR 199 CO 0.56 -1.38 1.24 0.00 -1.34 0.00 0.00 175.55 174.63 3iwo n ALA 200 N 7.69 1.03 -1.77 3.97 0.00 -0.55 -4.94 120.51 125.93 3iwo n ALA 200 Ca 0.04 0.02 -0.38 0.00 0.00 0.00 0.00 53.44 53.13 3iwo n ALA 200 Cb 0.48 -2.29 -0.06 0.00 0.00 0.00 0.00 19.45 17.58 3iwo n ALA 200 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3iwo s TRP 201 N -1.39 3.73 0.50 0.00 0.52 -0.41 -4.92 118.94 116.97 3iwo s TRP 201 Ca 0.80 1.80 -0.09 0.00 0.02 0.00 0.00 56.10 58.63 3iwo s TRP 201 Cb -0.39 -2.98 -0.05 0.00 -1.15 0.00 0.00 33.47 28.90 3iwo s TRP 201 CO 0.43 0.16 0.86 0.20 0.02 0.00 0.00 176.95 178.62 3iwo s GLY 202 N -1.44 1.73 -0.15 0.98 0.00 -0.32 -4.83 107.32 103.28 3iwo s GLY 202 Ca 0.48 -0.24 0.00 0.00 0.00 0.00 0.00 44.72 44.96 3iwo s GLY 202 CO 0.27 -0.03 -0.10 -0.19 0.00 0.00 0.00 173.10 173.06 3iwo s TYR 203 N -2.72 1.95 -0.12 1.90 2.02 -0.66 -0.19 117.35 119.53 3iwo s TYR 203 Ca 0.52 -1.15 0.01 0.00 -0.37 0.00 0.00 57.07 56.08 3iwo s TYR 203 Cb -0.10 -1.45 0.02 0.00 -0.40 0.00 0.00 41.96 40.02 3iwo s TYR 203 CO 0.41 -0.63 -0.13 0.50 -1.57 0.00 0.00 175.55 174.13 3iwo s ARG 204 N 1.56 2.06 -1.59 -0.62 3.52 -0.68 -4.42 118.95 118.78 3iwo s ARG 204 Ca 0.03 -0.48 -0.08 0.00 -0.13 0.00 0.00 55.73 55.07 3iwo s ARG 204 Cb -0.14 -1.88 0.07 0.00 -1.56 0.00 0.00 34.95 31.45 3iwo s ARG 204 CO -0.09 -0.17 0.40 0.39 -0.81 0.00 0.00 175.30 175.02 3iwo n GLU 205 N 4.56 -2.20 -0.44 5.12 1.02 -1.26 -0.92 120.64 126.53 3iwo n GLU 205 Ca -0.17 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 3iwo n GLU 205 Cb 0.51 -4.40 0.00 0.00 -0.02 0.00 0.00 31.44 27.52 3iwo n GLU 205 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3iwo n GLY 206 N -1.90 1.32 3.80 0.62 0.00 -1.26 -5.00 105.19 102.77 3iwo n GLY 206 Ca -0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 3iwo n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iwo s LYS 207 N -0.17 3.99 -0.06 1.61 1.02 -0.10 -5.04 119.74 120.99 3iwo s LYS 207 Ca 0.00 0.24 -0.30 0.00 0.02 0.00 0.00 55.97 55.93 3iwo s LYS 207 Cb 0.00 -3.30 -0.03 0.00 -0.52 0.00 0.00 37.83 33.98 3iwo s LYS 207 CO 0.00 0.52 1.20 0.00 -0.92 0.00 0.00 175.35 176.14 3iwo s ALA 208 N -0.44 3.50 0.02 5.17 0.00 -1.26 -1.69 121.76 127.06 3iwo s ALA 208 Ca 0.20 0.61 0.01 0.00 0.00 0.00 0.00 51.96 52.78 3iwo s ALA 208 Cb -0.15 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.44 3iwo s ALA 208 CO 0.09 -0.77 -0.04 0.14 0.00 0.00 0.00 175.76 175.18 3iwo s VAL 209 N 2.23 0.23 0.15 0.00 -7.23 0.73 -4.93 120.40 111.58 3iwo s VAL 209 Ca 0.56 -0.81 0.11 0.00 -1.81 0.00 0.00 61.98 60.02 3iwo s VAL 209 Cb -0.24 -0.33 -0.04 0.00 0.56 0.00 0.00 36.38 36.32 3iwo s VAL 209 CO 0.22 -0.37 -0.24 -1.00 -0.31 0.00 0.00 175.10 173.39 3iwo s HIS 210 N -1.19 2.36 0.48 2.82 3.76 -1.26 -1.17 115.29 121.09 3iwo s HIS 210 Ca -0.11 -0.35 -0.24 0.00 -0.15 0.00 0.00 55.06 54.21 3iwo s HIS 210 Cb -0.08 -1.24 -0.07 0.00 1.11 0.00 0.00 32.58 32.29 3iwo s HIS 210 CO -0.00 0.40 1.39 1.55 -0.85 0.00 0.00 174.74 177.22 3iwo n VAL 211 N 0.69 3.12 -3.94 -0.90 3.14 -1.26 -5.00 118.33 114.17 3iwo n VAL 211 Ca -0.16 -0.50 -0.32 0.00 -2.96 0.00 0.00 64.34 60.40 3iwo n VAL 211 Cb 0.54 -1.76 -0.14 0.00 -1.06 0.00 0.00 33.84 31.42 3iwo n VAL 211 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 3iwo s SER 212 N -0.62 4.80 0.32 6.55 0.01 -1.26 -5.10 113.70 118.40 3iwo s SER 212 Ca 0.65 -2.35 -0.28 0.00 1.31 0.00 0.00 55.95 55.27 3iwo s SER 212 Cb -0.44 -1.68 -0.09 0.00 0.21 0.00 0.00 66.02 64.01 3iwo s SER 212 CO 0.55 -0.38 1.11 -2.16 0.41 0.00 0.00 173.24 172.77 3iwo s PRO 213 N 0.64 4.44 0.00 12.44 0.04 -1.26 -5.04 135.00 146.27 3iwo s PRO 213 Ca 0.12 1.77 0.00 0.00 0.04 0.00 0.00 61.00 62.93 3iwo s PRO 213 Cb -0.21 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.35 3iwo s PRO 213 CO -0.05 0.04 0.00 0.41 0.04 0.00 0.00 177.00 177.44 3iwo n GLY 214 N 0.92 3.91 3.71 0.56 0.00 -1.26 -4.97 105.19 108.06 3iwo n GLY 214 Ca 0.01 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.53 3iwo n GLY 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iwo n ALA 215 N -3.00 2.22 -0.99 4.61 0.00 -1.26 -2.05 120.51 120.04 3iwo n ALA 215 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.84 3iwo n ALA 215 Cb 0.00 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.01 3iwo n ALA 215 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3iwo n LEU 216 N 2.98 0.83 0.13 0.00 4.77 -1.26 -4.86 117.00 119.59 3iwo n LEU 216 Ca 0.13 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.09 3iwo n LEU 216 Cb 0.34 -2.14 0.17 0.00 -2.33 0.00 0.00 43.42 39.46 3iwo n LEU 216 CO 0.64 -0.82 0.50 0.44 -1.33 0.00 0.00 177.39 176.82 3iwo h ASP 217 N 0.00 0.03 -0.42 -1.43 3.32 -1.79 -1.99 116.42 114.14 3iwo h ASP 217 Ca 0.00 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.05 3iwo h ASP 217 Cb 0.81 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 3iwo h ASP 217 CO 0.00 0.63 0.25 0.00 -1.72 0.00 0.00 179.24 178.40 3iwo h ALA 218 N 1.37 0.53 -0.28 3.45 0.00 -1.89 0.14 119.26 122.58 3iwo h ALA 218 Ca -0.01 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 3iwo h ALA 218 Cb 1.08 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3iwo h ALA 218 CO 0.08 -0.07 -0.37 0.93 0.00 0.00 0.00 179.25 179.82 3iwo h GLU 219 N 0.51 0.63 0.00 0.00 3.07 -1.86 -2.08 114.58 114.86 3iwo h GLU 219 Ca 0.16 -0.31 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 3iwo h GLU 219 Cb -0.00 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3iwo h GLU 219 CO -0.07 0.91 -1.19 0.00 -1.40 0.00 0.00 179.01 177.25 3iwo n ALA 220 N -2.51 2.81 -1.69 3.43 0.00 -0.76 -4.63 120.51 117.16 3iwo n ALA 220 Ca -0.01 -0.33 -0.03 0.00 0.00 0.00 0.00 53.44 53.06 3iwo n ALA 220 Cb 0.51 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 3iwo n ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iwo n GLY 221 N 1.25 0.05 0.86 0.00 0.00 0.39 -4.11 105.19 103.64 3iwo n GLY 221 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3iwo n GLY 221 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iwo n GLY 222 N 0.00 0.83 3.74 -0.02 0.00 -0.68 -3.89 105.19 105.17 3iwo n GLY 222 Ca -0.11 -0.64 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 3iwo n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iwo s VAL 223 N -1.95 4.53 -0.05 1.61 1.01 -1.26 -4.33 120.40 119.95 3iwo s VAL 223 Ca 0.31 1.84 0.05 0.00 0.00 0.00 0.00 61.98 64.19 3iwo s VAL 223 Cb 0.20 -4.21 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 3iwo s VAL 223 CO 0.31 0.39 -0.20 -0.54 0.00 0.00 0.00 175.10 175.05 3iwo s LYS 224 N -0.32 2.49 0.19 2.72 3.01 0.30 -1.09 119.74 127.04 3iwo s LYS 224 Ca 0.41 -0.82 -0.16 0.00 -1.01 0.00 0.00 55.97 54.39 3iwo s LYS 224 Cb -0.22 -2.25 0.02 0.00 -1.01 0.00 0.00 37.83 34.37 3iwo s LYS 224 CO 0.27 0.50 0.49 0.45 0.51 0.00 0.00 175.35 177.56 3iwo s SER 225 N -0.44 -0.22 0.40 2.83 0.15 -0.60 -1.37 113.70 114.45 3iwo s SER 225 Ca 0.05 -0.52 0.05 0.00 0.70 0.00 0.00 55.95 56.23 3iwo s SER 225 Cb -0.12 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 3iwo s SER 225 CO 0.01 -1.02 0.56 0.42 1.20 0.00 0.00 173.24 174.41 3iwo s THR 226 N -3.88 3.70 0.40 6.45 -4.23 -1.25 -0.81 115.64 116.02 3iwo s THR 226 Ca 0.10 -0.86 0.11 0.00 -1.18 0.00 0.00 61.69 59.85 3iwo s THR 226 Cb -0.00 -3.30 0.16 0.00 1.34 0.00 0.00 72.50 70.69 3iwo s THR 226 CO -0.03 -0.14 1.92 -0.29 -0.54 0.00 0.00 174.62 175.54 3iwo h ILE 227 N 0.66 1.17 -0.01 2.99 6.09 -1.74 -1.34 117.51 125.34 3iwo h ILE 227 Ca -0.44 -0.79 -0.00 0.00 -1.37 0.00 0.00 64.86 62.26 3iwo h ILE 227 Cb 1.26 1.28 -0.00 0.00 0.47 0.00 0.00 36.82 39.83 3iwo h ILE 227 CO 0.52 0.24 -0.00 -0.33 -3.07 0.00 0.00 178.15 175.50 3iwo h GLU 228 N 0.16 0.02 -0.98 2.19 5.08 -1.94 -1.63 114.58 117.47 3iwo h GLU 228 Ca 0.03 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3iwo h GLU 228 Cb 0.39 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 3iwo h GLU 228 CO 0.02 0.44 0.65 -0.44 -1.00 0.00 0.00 179.01 178.69 3iwo h ASP 229 N -0.41 1.10 -0.28 1.42 5.19 -1.85 -1.84 116.42 119.76 3iwo h ASP 229 Ca 0.00 -0.02 -0.08 0.00 -0.62 0.00 0.00 57.03 56.31 3iwo h ASP 229 Cb 0.44 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.66 3iwo h ASP 229 CO 0.00 0.78 -0.10 0.24 -3.12 0.00 0.00 179.24 177.04 3iwo h MET 230 N 1.30 0.68 -0.74 3.56 2.86 -1.22 0.10 114.93 121.46 3iwo h MET 230 Ca 0.37 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 3iwo h MET 230 Cb -0.10 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.46 3iwo h MET 230 CO -0.09 0.77 0.43 0.00 1.06 0.00 0.00 176.91 179.07 3iwo h ALA 231 N 1.27 0.95 -0.51 6.32 0.00 -0.97 0.09 119.26 126.41 3iwo h ALA 231 Ca 0.11 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3iwo h ALA 231 Cb 0.54 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3iwo h ALA 231 CO 0.03 0.44 0.01 -0.09 0.00 0.00 0.00 179.25 179.64 3iwo h ARG 232 N 1.02 0.85 -0.55 0.00 2.43 -0.92 -0.33 114.38 116.89 3iwo h ARG 232 Ca 0.26 -0.23 0.03 0.00 -0.81 0.00 0.00 59.98 59.23 3iwo h ARG 232 Cb 0.00 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.42 3iwo h ARG 232 CO -0.05 0.85 0.32 2.35 -1.51 0.00 0.00 179.97 181.93 3iwo h TRP 233 N 0.80 0.59 -0.43 2.20 -0.00 -0.19 -0.73 115.95 118.18 3iwo h TRP 233 Ca 0.15 0.02 -0.02 0.00 -0.00 0.00 0.00 58.89 59.04 3iwo h TRP 233 Cb 0.46 -0.19 -0.02 0.00 -0.00 0.00 0.00 29.16 29.42 3iwo h TRP 233 CO 0.03 0.32 0.18 0.28 -0.00 0.00 0.00 178.44 179.24 3iwo h VAL 234 N 0.62 1.20 -0.97 2.65 2.07 -0.62 -2.11 116.25 119.09 3iwo h VAL 234 Ca 0.23 -0.61 0.09 0.00 0.82 0.00 0.00 66.70 67.23 3iwo h VAL 234 Cb 0.06 0.79 -0.08 0.00 -1.52 0.00 0.00 31.29 30.55 3iwo h VAL 234 CO -0.12 0.22 0.61 1.56 0.02 0.00 0.00 177.57 179.87 3iwo h GLN 235 N 0.56 1.00 -0.24 1.57 4.20 -0.78 0.19 115.11 121.62 3iwo h GLN 235 Ca 0.14 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.65 3iwo h GLN 235 Cb 0.18 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 3iwo h GLN 235 CO -0.01 0.66 -0.45 0.77 -0.67 0.00 0.00 178.83 179.13 3iwo h SER 236 N 1.03 0.65 1.32 1.46 0.02 -0.96 -2.25 113.55 114.82 3iwo h SER 236 Ca 0.45 -0.31 -0.12 0.00 -0.84 0.00 0.00 61.79 60.98 3iwo h SER 236 Cb 0.34 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 3iwo h SER 236 CO -0.22 1.01 -0.71 0.78 -1.14 0.00 0.00 176.83 176.55 3iwo h ASN 237 N 0.49 0.00 -0.53 3.07 2.35 -0.95 -2.94 115.58 117.06 3iwo h ASN 237 Ca 0.03 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.68 3iwo h ASN 237 Cb 0.98 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.33 3iwo h ASN 237 CO 0.09 0.51 -0.07 -0.07 -1.65 0.00 0.00 177.43 176.24 3iwo h LEU 238 N 0.00 0.98 -5.96 1.61 3.38 -0.51 -3.39 115.31 111.41 3iwo h LEU 238 Ca -0.04 -0.34 -0.56 0.00 0.09 0.00 0.00 57.88 57.03 3iwo h LEU 238 Cb 1.42 -0.27 -0.41 0.00 0.09 0.00 0.00 40.66 41.50 3iwo h LEU 238 CO 0.06 1.08 -0.90 0.29 0.09 0.00 0.00 178.44 179.07 3iwo n LYS 239 N -4.21 1.68 0.29 1.13 5.02 -0.86 -4.78 118.16 116.43 3iwo n LYS 239 Ca 0.01 -3.93 0.19 0.00 -2.02 0.00 0.00 58.31 52.56 3iwo n LYS 239 Cb 0.37 -1.77 0.86 0.00 -0.02 0.00 0.00 35.03 34.48 3iwo n LYS 239 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3iwo h PRO 240 N 3.74 0.00 0.00 1.97 0.13 -1.73 -2.24 132.00 133.88 3iwo h PRO 240 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3iwo h PRO 240 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3iwo h PRO 240 CO 0.64 0.00 0.00 -0.07 -0.23 0.00 0.00 178.00 178.34 3iwo h LEU 241 N 0.00 0.00 0.00 1.56 3.38 -1.89 -2.27 115.31 116.10 3iwo h LEU 241 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3iwo h LEU 241 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3iwo h LEU 241 CO 0.00 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.00 3iwo n ASP 242 N -2.67 0.00 -4.71 -0.43 9.92 -0.84 -4.80 116.55 113.02 3iwo n ASP 242 Ca 0.02 0.10 -0.40 0.00 -0.53 0.00 0.00 54.79 53.98 3iwo n ASP 242 Cb 0.30 -0.35 -0.05 0.00 -0.64 0.00 0.00 41.12 40.39 3iwo n ASP 242 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3iwo s ILE 243 N -2.69 5.02 0.12 0.53 1.01 -0.85 -4.99 121.20 119.35 3iwo s ILE 243 Ca 0.20 1.48 -0.10 0.00 0.00 0.00 0.00 60.65 62.23 3iwo s ILE 243 Cb 0.16 -4.06 -0.16 0.00 0.01 0.00 0.00 42.46 38.41 3iwo s ILE 243 CO 0.39 0.22 1.31 0.78 0.00 0.00 0.00 174.94 177.64 3iwo h ASN 244 N 6.84 0.82 -2.96 3.58 2.35 -1.88 -3.43 115.58 120.90 3iwo h ASN 244 Ca -0.40 -0.57 -0.57 0.00 -0.55 0.00 0.00 56.30 54.22 3iwo h ASN 244 Cb 1.19 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 39.28 3iwo h ASN 244 CO 0.76 1.35 1.14 -1.61 -1.65 0.00 0.00 177.43 177.43 3iwo s GLU 245 N -3.62 3.58 0.20 0.81 8.01 -1.26 -4.89 118.70 121.53 3iwo s GLU 245 Ca -0.09 1.29 -0.11 0.00 0.01 0.00 0.00 54.97 56.07 3iwo s GLU 245 Cb 0.09 -4.07 0.13 0.00 -4.31 0.00 0.00 34.13 25.97 3iwo s GLU 245 CO 0.89 -1.55 1.85 0.87 0.01 0.00 0.00 175.26 177.32 3iwo h LYS 246 N 11.26 0.95 -0.18 1.61 1.57 -2.00 -1.01 116.57 128.76 3iwo h LYS 246 Ca -0.31 -0.08 -0.11 0.00 -1.87 0.00 0.00 60.65 58.28 3iwo h LYS 246 Cb 1.14 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 3iwo h LYS 246 CO 1.04 0.66 -0.37 1.79 -0.57 0.00 0.00 179.45 182.01 3iwo h THR 247 N 0.95 1.29 -0.15 -0.16 1.35 -1.92 -2.07 112.91 112.21 3iwo h THR 247 Ca 0.25 -1.47 -0.22 0.00 -0.55 0.00 0.00 66.41 64.43 3iwo h THR 247 Cb -0.05 1.56 0.01 0.00 -1.73 0.00 0.00 68.15 67.94 3iwo h THR 247 CO -0.05 0.45 -0.75 0.25 -0.25 0.00 0.00 175.52 175.17 3iwo h LEU 248 N 0.34 0.91 -0.39 3.87 5.85 -1.76 0.17 115.31 124.29 3iwo h LEU 248 Ca 0.04 -0.63 0.08 0.00 0.84 0.00 0.00 57.88 58.21 3iwo h LEU 248 Cb 0.80 -0.27 -0.08 0.00 0.37 0.00 0.00 40.66 41.48 3iwo h LEU 248 CO 0.06 1.40 -0.16 -0.61 -0.34 0.00 0.00 178.44 178.79 3iwo h GLN 249 N 0.49 -0.08 -0.44 1.25 4.15 -1.08 -0.65 115.11 118.75 3iwo h GLN 249 Ca -0.05 0.01 -0.10 0.00 0.77 0.00 0.00 58.65 59.27 3iwo h GLN 249 Cb 1.38 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 29.08 3iwo h GLN 249 CO 0.16 -0.05 -0.11 1.96 -1.93 0.00 0.00 178.83 178.85 3iwo h GLN 250 N -0.08 0.86 -0.61 1.69 4.20 -1.24 -2.67 115.11 117.26 3iwo h GLN 250 Ca 0.19 -0.33 0.08 0.00 0.06 0.00 0.00 58.65 58.65 3iwo h GLN 250 Cb 0.38 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.05 3iwo h GLN 250 CO -0.45 0.97 0.27 0.78 -0.67 0.00 0.00 178.83 179.72 3iwo h GLY 251 N 0.69 0.86 1.00 3.46 0.00 -0.33 0.32 103.07 109.08 3iwo h GLY 251 Ca 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 3iwo h GLY 251 CO 0.04 0.04 0.34 -2.22 0.00 0.00 0.00 176.54 174.74 3iwo h ILE 252 N 0.48 1.22 -0.67 2.60 2.04 -1.03 -1.94 117.51 120.20 3iwo h ILE 252 Ca 0.29 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 3iwo h ILE 252 Cb 0.31 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 3iwo h ILE 252 CO -0.26 0.25 0.30 1.56 0.00 0.00 0.00 178.15 180.00 3iwo h GLN 253 N 0.91 0.98 -0.16 2.37 4.20 -1.08 -2.75 115.11 119.57 3iwo h GLN 253 Ca 0.23 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.72 3iwo h GLN 253 Cb 0.08 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 3iwo h GLN 253 CO -0.03 0.79 -0.19 -0.07 -0.67 0.00 0.00 178.83 178.66 3iwo h LEU 254 N 0.94 0.27 -0.99 1.46 3.38 -0.76 -2.46 115.31 117.15 3iwo h LEU 254 Ca 0.23 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 3iwo h LEU 254 Cb 0.15 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3iwo h LEU 254 CO -0.03 0.48 -0.36 0.00 0.09 0.00 0.00 178.44 178.62 3iwo h ALA 255 N 1.55 1.02 -0.25 1.53 0.00 -1.07 -2.68 119.26 119.37 3iwo h ALA 255 Ca 0.05 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3iwo h ALA 255 Cb 0.49 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3iwo h ALA 255 CO 0.03 0.46 0.00 1.04 0.00 0.00 0.00 179.25 180.78 3iwo n GLN 256 N -3.56 2.12 -2.08 0.00 6.02 -1.02 -0.87 117.38 117.99 3iwo n GLN 256 Ca -0.00 -1.69 -0.36 0.00 -0.01 0.00 0.00 57.00 54.94 3iwo n GLN 256 Cb 0.49 -1.46 0.02 0.00 1.02 0.00 0.00 30.24 30.32 3iwo n GLN 256 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 3iwo s SER 257 N -1.59 5.41 -0.43 1.08 0.01 -0.96 -3.93 113.70 113.30 3iwo s SER 257 Ca 0.35 2.35 -0.17 0.00 1.31 0.00 0.00 55.95 59.79 3iwo s SER 257 Cb 0.20 -2.60 0.03 0.00 0.21 0.00 0.00 66.02 63.86 3iwo s SER 257 CO 0.29 -1.44 0.43 -0.13 0.41 0.00 0.00 173.24 172.80 3iwo s ARG 258 N -3.24 3.07 -0.15 12.44 0.52 0.69 -4.05 118.95 128.23 3iwo s ARG 258 Ca 0.75 -0.83 0.07 0.00 -0.52 0.00 0.00 55.73 55.20 3iwo s ARG 258 Cb -0.29 -3.98 -0.23 0.00 0.52 0.00 0.00 34.95 30.96 3iwo s ARG 258 CO 0.32 -0.87 0.24 0.66 0.02 0.00 0.00 175.30 175.68 3iwo n TYR 259 N 5.55 0.59 -3.96 -0.53 4.01 -0.72 -1.96 117.16 120.14 3iwo n TYR 259 Ca -0.08 0.17 -0.09 0.00 -0.16 0.00 0.00 57.90 57.73 3iwo n TYR 259 Cb 0.47 -1.09 -0.11 0.00 -0.31 0.00 0.00 39.34 38.30 3iwo n TYR 259 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 3iwo s TRP 260 N -2.54 0.22 -0.05 -0.72 0.52 -1.24 -2.02 118.94 113.10 3iwo s TRP 260 Ca -0.17 -0.46 0.06 0.00 0.02 0.00 0.00 56.10 55.55 3iwo s TRP 260 Cb 0.07 -0.16 -0.01 0.00 -1.15 0.00 0.00 33.47 32.22 3iwo s TRP 260 CO 0.76 -0.21 -0.23 -1.14 0.02 0.00 0.00 176.95 176.15 3iwo s GLN 261 N -1.49 2.32 -0.16 4.98 0.74 -0.32 -1.41 119.66 124.33 3iwo s GLN 261 Ca -0.15 -0.84 -0.02 0.00 0.05 0.00 0.00 55.36 54.40 3iwo s GLN 261 Cb -0.09 -2.00 0.05 0.00 1.10 0.00 0.00 33.01 32.06 3iwo s GLN 261 CO -0.01 0.37 -0.00 -0.08 -0.55 0.00 0.00 175.29 175.02 3iwo s THR 262 N -0.17 0.72 0.00 -0.34 -1.32 -0.44 -0.71 115.64 113.39 3iwo s THR 262 Ca -0.02 -0.46 0.00 0.00 -1.21 0.00 0.00 61.69 60.00 3iwo s THR 262 Cb -0.13 -1.04 0.00 0.00 -1.51 0.00 0.00 72.50 69.83 3iwo s THR 262 CO 0.03 0.01 0.00 0.61 -2.21 0.00 0.00 174.62 173.06 3iwo n GLY 263 N 5.00 3.17 1.18 6.08 0.00 -1.26 -1.54 105.19 117.82 3iwo n GLY 263 Ca -0.10 -0.16 0.09 0.00 0.00 0.00 0.00 46.02 45.85 3iwo n GLY 263 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3iwo n ASP 264 N 6.40 3.43 -4.63 1.61 5.75 -1.26 -4.96 116.55 122.89 3iwo n ASP 264 Ca 0.00 -2.08 -0.32 0.00 -0.01 0.00 0.00 54.79 52.38 3iwo n ASP 264 Cb 0.00 -0.43 -0.10 0.00 -1.03 0.00 0.00 41.12 39.56 3iwo n ASP 264 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 3iwo s MET 265 N -1.32 2.56 -0.05 0.11 1.75 -0.59 -4.44 119.30 117.33 3iwo s MET 265 Ca 0.41 -0.75 0.05 0.00 -1.25 0.00 0.00 55.69 54.15 3iwo s MET 265 Cb 0.23 -2.52 -0.01 0.00 2.84 0.00 0.00 34.83 35.36 3iwo s MET 265 CO 0.26 0.59 -0.21 0.71 -0.65 0.00 0.00 175.02 175.72 3iwo s TYR 266 N -1.09 2.06 -0.24 4.11 2.02 0.13 -1.32 117.35 123.01 3iwo s TYR 266 Ca 0.20 -0.60 -0.17 0.00 -0.37 0.00 0.00 57.07 56.13 3iwo s TYR 266 Cb -0.11 -1.37 -0.03 0.00 -0.40 0.00 0.00 41.96 40.05 3iwo s TYR 266 CO 0.11 -0.18 0.48 -1.14 -1.57 0.00 0.00 175.55 173.24 3iwo s GLN 267 N -0.08 4.10 0.00 -0.62 2.00 -0.50 -1.06 119.66 123.49 3iwo s GLN 267 Ca -0.03 0.28 0.00 0.00 -2.00 0.00 0.00 55.36 53.61 3iwo s GLN 267 Cb -0.12 -3.62 0.00 0.00 0.80 0.00 0.00 33.01 30.07 3iwo s GLN 267 CO 0.03 -0.26 0.00 0.41 -0.50 0.00 0.00 175.29 174.97 3iwo n GLY 268 N 4.28 1.61 3.38 2.59 0.00 -0.06 -1.75 105.19 115.24 3iwo n GLY 268 Ca -0.05 -1.92 -0.45 0.00 0.00 0.00 0.00 46.02 43.60 3iwo n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iwo s LEU 269 N 0.00 5.41 0.00 0.99 1.43 -0.05 -4.62 118.68 121.84 3iwo s LEU 269 Ca 0.00 -1.36 0.00 0.00 -1.03 0.00 0.00 54.13 51.74 3iwo s LEU 269 Cb 0.00 -2.31 0.00 0.00 0.03 0.00 0.00 46.19 43.91 3iwo s LEU 269 CO 0.00 -1.01 0.00 0.61 0.23 0.00 0.00 176.35 176.18 3iwo n GLY 270 N 5.25 2.00 3.75 -3.19 0.00 -1.26 -4.29 105.19 107.45 3iwo n GLY 270 Ca -0.10 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 3iwo n GLY 270 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3iwo s TRP 271 N 0.00 2.29 0.09 1.61 0.52 -1.26 -4.68 118.94 117.50 3iwo s TRP 271 Ca 0.00 1.35 0.07 0.00 0.02 0.00 0.00 56.10 57.54 3iwo s TRP 271 Cb 0.00 -3.84 -0.04 0.00 -1.15 0.00 0.00 33.47 28.44 3iwo s TRP 271 CO 0.00 -2.97 -0.14 -1.21 0.02 0.00 0.00 176.95 172.65 3iwo s GLU 272 N -2.84 2.03 0.03 4.98 2.02 -1.01 -0.89 118.70 123.02 3iwo s GLU 272 Ca 0.70 -1.05 0.01 0.00 0.02 0.00 0.00 54.97 54.66 3iwo s GLU 272 Cb -0.41 -2.23 -0.02 0.00 0.10 0.00 0.00 34.13 31.57 3iwo s GLU 272 CO 0.50 0.51 -0.05 -1.64 0.02 0.00 0.00 175.26 174.60 3iwo s MET 273 N -1.95 0.40 0.05 1.61 -1.94 -0.23 -0.97 119.30 116.27 3iwo s MET 273 Ca 0.18 -0.58 0.02 0.00 -1.71 0.00 0.00 55.69 53.60 3iwo s MET 273 Cb -0.11 -0.15 -0.03 0.00 2.01 0.00 0.00 34.83 36.56 3iwo s MET 273 CO 0.10 0.02 -0.07 -0.51 -0.01 0.00 0.00 175.02 174.55 3iwo s LEU 274 N -1.25 2.31 0.40 -0.03 1.02 -0.39 0.21 118.68 120.94 3iwo s LEU 274 Ca -0.10 -0.64 -0.27 0.00 0.02 0.00 0.00 54.13 53.14 3iwo s LEU 274 Cb -0.08 -0.11 -0.10 0.00 0.02 0.00 0.00 46.19 45.92 3iwo s LEU 274 CO -0.00 -0.27 1.42 -1.81 0.02 0.00 0.00 176.35 175.71 3iwo s ASP 275 N -1.87 6.25 -0.14 2.29 1.01 -1.26 -0.39 116.67 122.55 3iwo s ASP 275 Ca -0.06 2.92 -0.07 0.00 0.71 0.00 0.00 52.55 56.05 3iwo s ASP 275 Cb -0.07 -2.66 -0.04 0.00 1.01 0.00 0.00 42.92 41.16 3iwo s ASP 275 CO -0.01 -0.92 0.09 0.86 0.21 0.00 0.00 175.17 175.40 3iwo s TRP 276 N -1.16 3.40 0.46 4.23 -0.11 -0.16 -3.38 118.94 122.22 3iwo s TRP 276 Ca 0.55 0.32 -0.23 0.00 1.22 0.00 0.00 56.10 57.96 3iwo s TRP 276 Cb -0.44 -1.98 -0.07 0.00 -1.50 0.00 0.00 33.47 29.48 3iwo s TRP 276 CO 0.58 0.47 1.18 -1.25 -4.62 0.00 0.00 176.95 173.30 3iwo s PRO 277 N -0.41 3.73 0.21 5.86 0.04 -1.26 -4.79 135.00 138.38 3iwo s PRO 277 Ca 0.10 1.80 0.04 0.00 0.04 0.00 0.00 61.00 62.99 3iwo s PRO 277 Cb -0.12 -2.41 -0.03 0.00 0.04 0.00 0.00 34.50 31.98 3iwo s PRO 277 CO 0.02 -0.58 0.34 0.14 0.04 0.00 0.00 177.00 176.95 3iwo s VAL 278 N -1.53 5.28 -0.42 -0.36 -7.23 -1.22 -5.07 120.40 109.86 3iwo s VAL 278 Ca 0.64 -0.85 -0.26 0.00 -1.81 0.00 0.00 61.98 59.70 3iwo s VAL 278 Cb -0.29 -3.81 0.02 0.00 0.56 0.00 0.00 36.38 32.85 3iwo s VAL 278 CO 0.36 -0.24 0.92 0.21 -0.31 0.00 0.00 175.10 176.04 3iwo s ASN 279 N -3.69 6.58 0.31 4.85 3.84 -1.26 -4.95 114.94 120.62 3iwo s ASN 279 Ca 0.34 0.33 -0.01 0.00 0.21 0.00 0.00 52.86 53.74 3iwo s ASN 279 Cb -0.10 -2.46 0.48 0.00 -0.55 0.00 0.00 41.25 38.62 3iwo s ASN 279 CO 0.29 -0.96 1.97 1.55 -2.79 0.00 0.00 177.10 177.16 3iwo h PRO 280 N 8.80 1.02 -0.24 0.43 0.13 -2.00 -1.07 132.00 139.07 3iwo h PRO 280 Ca -0.24 -0.07 -0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3iwo h PRO 280 Cb 1.08 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 3iwo h PRO 280 CO 1.00 0.69 0.15 -0.44 -0.23 0.00 0.00 178.00 179.17 3iwo h ASP 281 N 1.05 0.28 -0.03 1.44 3.32 -1.98 0.50 116.42 121.00 3iwo h ASP 281 Ca 0.28 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 3iwo h ASP 281 Cb -0.10 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 3iwo h ASP 281 CO -0.06 0.22 0.01 -1.28 -1.72 0.00 0.00 179.24 176.41 3iwo h SER 282 N 0.33 0.04 -0.02 6.45 0.87 -1.61 0.07 113.55 119.68 3iwo h SER 282 Ca 0.09 -0.15 -0.17 0.00 -1.23 0.00 0.00 61.79 60.33 3iwo h SER 282 Cb -0.01 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 3iwo h SER 282 CO -0.02 0.18 -0.59 0.16 -0.53 0.00 0.00 176.83 176.04 3iwo h ILE 283 N -0.10 1.31 0.48 2.23 3.07 -1.31 0.75 117.51 123.95 3iwo h ILE 283 Ca 0.01 -1.83 -0.02 0.00 1.55 0.00 0.00 64.86 64.56 3iwo h ILE 283 Cb 0.15 1.80 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 3iwo h ILE 283 CO -0.00 0.57 -0.23 0.40 -1.05 0.00 0.00 178.15 177.84 3iwo h ILE 284 N 0.47 0.41 -0.54 0.16 2.04 -0.86 -2.32 117.51 116.86 3iwo h ILE 284 Ca 0.00 -0.44 -0.09 0.00 1.00 0.00 0.00 64.86 65.33 3iwo h ILE 284 Cb 1.15 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 3iwo h ILE 284 CO 0.11 0.06 -0.02 0.78 0.00 0.00 0.00 178.15 179.08 3iwo h ASN 285 N -0.95 0.92 -0.06 1.72 2.35 -1.09 -2.84 115.58 115.64 3iwo h ASN 285 Ca -0.07 -0.25 0.02 0.00 -0.55 0.00 0.00 56.30 55.45 3iwo h ASN 285 Cb 0.59 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.71 3iwo h ASN 285 CO 0.11 0.99 0.11 1.23 -1.65 0.00 0.00 177.43 178.22 3iwo h GLY 286 N 0.99 0.00 1.30 2.83 0.00 -0.85 -2.59 103.07 104.75 3iwo h GLY 286 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 3iwo h GLY 286 CO 0.03 0.00 -0.39 -1.14 0.00 0.00 0.00 176.54 175.04 3iwo n SER 287 N -3.42 0.44 -4.72 0.19 3.41 -0.88 -3.40 113.62 105.24 3iwo n SER 287 Ca -0.01 0.03 -0.42 0.00 -0.26 0.00 0.00 58.87 58.20 3iwo n SER 287 Cb 0.20 0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 3iwo n SER 287 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3iwo s ASP 288 N -3.30 6.50 0.62 4.04 2.15 -0.98 -4.60 116.67 121.11 3iwo s ASP 288 Ca 0.11 2.74 0.27 0.00 0.43 0.00 0.00 52.55 56.09 3iwo s ASP 288 Cb 0.17 -2.60 1.37 0.00 -0.30 0.00 0.00 42.92 41.55 3iwo s ASP 288 CO 0.66 -0.88 1.78 0.78 -0.17 0.00 0.00 175.17 177.35 3iwo h ASN 289 N 6.53 0.00 0.30 -0.34 2.35 -1.89 -0.06 115.58 122.47 3iwo h ASN 289 Ca -0.43 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.27 3iwo h ASN 289 Cb 1.20 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.57 3iwo h ASN 289 CO 0.91 0.00 -0.25 0.07 -1.65 0.00 0.00 177.43 176.52 3iwo h LYS 290 N 0.00 0.00 0.01 0.81 2.10 -1.93 -1.55 116.57 116.01 3iwo h LYS 290 Ca 0.16 0.00 -0.41 0.00 -2.00 0.00 0.00 60.65 58.40 3iwo h LYS 290 Cb 1.24 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.51 3iwo h LYS 290 CO -0.00 0.25 -2.33 -0.89 -2.00 0.00 0.00 179.45 174.48 3iwo n ILE 291 N -4.11 1.54 0.25 0.07 5.41 -0.18 -4.19 119.36 118.14 3iwo n ILE 291 Ca -0.02 -0.40 0.07 0.00 1.00 0.00 0.00 62.75 63.40 3iwo n ILE 291 Cb 0.31 -1.78 0.60 0.00 -0.71 0.00 0.00 39.64 38.06 3iwo n ILE 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3iwo h ALA 292 N -0.61 1.87 -0.21 -1.39 0.00 -1.18 -2.11 119.26 115.63 3iwo h ALA 292 Ca -0.61 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.24 3iwo h ALA 292 Cb 1.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.45 3iwo h ALA 292 CO -0.28 0.08 0.00 1.28 0.00 0.00 0.00 179.25 180.33 3iwo n LEU 293 N -4.43 3.20 -4.85 0.00 4.77 -0.58 -4.59 117.00 110.53 3iwo n LEU 293 Ca -0.03 -1.26 -0.33 0.00 -0.03 0.00 0.00 56.01 54.36 3iwo n LEU 293 Cb 0.14 -0.13 -0.06 0.00 -2.33 0.00 0.00 43.42 41.05 3iwo n LEU 293 CO 0.35 0.62 0.37 0.00 -1.33 0.00 0.00 177.39 177.40 3iwo s ALA 294 N -1.69 3.40 0.29 -1.18 0.00 -0.80 -4.69 121.76 117.09 3iwo s ALA 294 Ca 0.33 -0.01 -0.30 0.00 0.00 0.00 0.00 51.96 51.99 3iwo s ALA 294 Cb 0.21 -2.70 -0.11 0.00 0.00 0.00 0.00 23.12 20.52 3iwo s ALA 294 CO 0.30 0.37 1.47 0.00 0.00 0.00 0.00 175.76 177.90 3iwo s ALA 295 N -1.85 3.63 -0.00 0.00 0.00 -1.26 -4.68 121.76 117.60 3iwo s ALA 295 Ca 0.50 1.42 0.01 0.00 0.00 0.00 0.00 51.96 53.89 3iwo s ALA 295 Cb -0.12 -3.58 -0.00 0.00 0.00 0.00 0.00 23.12 19.42 3iwo s ALA 295 CO 0.19 -0.84 -0.03 1.03 0.00 0.00 0.00 175.76 176.11 3iwo s ARG 296 N -0.86 0.25 0.40 0.00 0.52 -0.84 -4.97 118.95 113.46 3iwo s ARG 296 Ca 0.58 -0.12 -0.25 0.00 -0.52 0.00 0.00 55.73 55.42 3iwo s ARG 296 Cb -0.44 -0.24 -0.08 0.00 0.52 0.00 0.00 34.95 34.71 3iwo s ARG 296 CO 0.49 0.06 1.13 -1.25 0.02 0.00 0.00 175.30 175.75 3iwo s PRO 297 N -0.11 4.07 0.02 3.54 0.04 -1.26 -0.57 135.00 140.73 3iwo s PRO 297 Ca 0.01 1.72 0.07 0.00 0.04 0.00 0.00 61.00 62.84 3iwo s PRO 297 Cb -0.01 -2.61 -0.03 0.00 0.04 0.00 0.00 34.50 31.88 3iwo s PRO 297 CO -0.00 -0.27 -0.19 0.14 0.04 0.00 0.00 177.00 176.71 3iwo s VAL 298 N -1.50 2.70 -0.23 -0.36 -7.23 -0.86 -4.56 120.40 108.36 3iwo s VAL 298 Ca 0.58 -1.13 -0.10 0.00 -1.81 0.00 0.00 61.98 59.52 3iwo s VAL 298 Cb -0.28 -2.10 -0.05 0.00 0.56 0.00 0.00 36.38 34.51 3iwo s VAL 298 CO 0.34 0.40 0.14 -0.54 -0.31 0.00 0.00 175.10 175.13 3iwo s LYS 299 N -1.25 4.01 0.24 4.82 1.02 0.11 -4.83 119.74 123.86 3iwo s LYS 299 Ca 0.13 -0.31 -0.30 0.00 0.02 0.00 0.00 55.97 55.52 3iwo s LYS 299 Cb -0.10 -3.48 -0.10 0.00 -0.52 0.00 0.00 37.83 33.63 3iwo s LYS 299 CO 0.04 0.05 1.44 0.00 -0.92 0.00 0.00 175.35 175.96 3iwo s ALA 300 N 1.05 3.63 -0.46 5.17 0.00 -1.26 -1.17 121.76 128.71 3iwo s ALA 300 Ca 0.07 1.32 -0.14 0.00 0.00 0.00 0.00 51.96 53.21 3iwo s ALA 300 Cb -0.14 -3.56 0.08 0.00 0.00 0.00 0.00 23.12 19.50 3iwo s ALA 300 CO 0.04 -0.74 0.37 0.42 0.00 0.00 0.00 175.76 175.85 3iwo s ILE 301 N 0.04 4.97 -0.36 0.00 1.01 -0.86 -4.91 121.20 121.10 3iwo s ILE 301 Ca 0.60 -1.18 0.01 0.00 0.00 0.00 0.00 60.65 60.07 3iwo s ILE 301 Cb -0.42 -4.00 0.10 0.00 0.01 0.00 0.00 42.46 38.15 3iwo s ILE 301 CO 0.43 -0.58 0.10 -0.89 0.00 0.00 0.00 174.94 173.99 3iwo s THR 302 N 1.58 2.76 0.72 2.92 2.01 -1.26 -1.86 115.64 122.51 3iwo s THR 302 Ca 0.04 -2.08 -0.07 0.00 0.31 0.00 0.00 61.69 59.89 3iwo s THR 302 Cb -0.24 -2.90 0.08 0.00 0.01 0.00 0.00 72.50 69.45 3iwo s THR 302 CO 0.05 -0.55 1.03 -2.16 -0.69 0.00 0.00 174.62 172.31 3iwo s PRO 303 N 1.05 2.02 0.42 4.92 0.04 -1.26 -5.09 135.00 137.09 3iwo s PRO 303 Ca 0.07 -0.37 -0.27 0.00 0.04 0.00 0.00 61.00 60.48 3iwo s PRO 303 Cb -0.21 -2.17 -0.10 0.00 0.04 0.00 0.00 34.50 32.07 3iwo s PRO 303 CO -0.06 -1.34 1.47 -2.14 0.04 0.00 0.00 177.00 174.97 3iwo s PRO 304 N -5.28 3.89 0.03 0.56 0.02 -0.78 -4.95 135.00 128.49 3iwo s PRO 304 Ca 0.62 2.53 -0.30 0.00 0.02 0.00 0.00 61.00 63.86 3iwo s PRO 304 Cb -0.10 -2.81 -0.04 0.00 0.02 0.00 0.00 34.50 31.57 3iwo s PRO 304 CO 0.45 -0.70 1.11 0.99 -0.33 0.00 0.00 177.00 178.53 3iwo s THR 305 N -1.16 4.38 0.77 0.99 2.01 -0.83 -4.79 115.64 117.01 3iwo s THR 305 Ca 0.57 1.71 -0.13 0.00 0.31 0.00 0.00 61.69 64.15 3iwo s THR 305 Cb -0.46 -4.09 0.06 0.00 0.01 0.00 0.00 72.50 68.02 3iwo s THR 305 CO 0.61 0.13 1.15 -2.84 -0.69 0.00 0.00 174.62 172.97 3iwo s PRO 306 N 1.10 2.01 -0.44 4.92 0.02 -1.26 -0.22 135.00 141.12 3iwo s PRO 306 Ca 0.56 1.50 -0.46 0.00 0.02 0.00 0.00 61.00 62.62 3iwo s PRO 306 Cb -0.26 -1.84 -0.20 0.00 0.02 0.00 0.00 34.50 32.22 3iwo s PRO 306 CO 0.28 -1.88 1.57 0.00 -0.33 0.00 0.00 177.00 176.64 3iwo n ALA 307 N -3.23 -1.45 -2.62 -1.55 0.00 -1.25 -4.75 120.51 105.66 3iwo n ALA 307 Ca 0.11 0.50 -0.40 0.00 0.00 0.00 0.00 53.44 53.65 3iwo n ALA 307 Cb 0.52 -1.93 -0.08 0.00 0.00 0.00 0.00 19.45 17.96 3iwo n ALA 307 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3iwo s VAL 308 N 2.80 5.07 0.28 0.00 1.01 -1.26 -4.96 120.40 123.33 3iwo s VAL 308 Ca 1.03 0.87 -0.01 0.00 0.00 0.00 0.00 61.98 63.87 3iwo s VAL 308 Cb -1.45 -3.83 0.16 0.00 0.00 0.00 0.00 36.38 31.26 3iwo s VAL 308 CO 0.79 0.08 1.83 0.03 0.00 0.00 0.00 175.10 177.83 3iwo h ARG 309 N 8.03 0.85 -3.44 2.72 3.08 -1.97 -3.20 114.38 120.45 3iwo h ARG 309 Ca -0.29 -0.17 -0.69 0.00 0.07 0.00 0.00 59.98 58.90 3iwo h ARG 309 Cb 1.14 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 31.04 3iwo h ARG 309 CO 0.72 0.75 3.40 0.00 -1.07 0.00 0.00 179.97 183.76 3iwo n ALA 310 N -2.46 6.56 -2.70 0.04 0.00 -1.26 -1.07 120.51 119.62 3iwo n ALA 310 Ca 0.04 -3.75 -0.18 0.00 0.00 0.00 0.00 53.44 49.55 3iwo n ALA 310 Cb 0.22 -3.40 -0.13 0.00 0.00 0.00 0.00 19.45 16.14 3iwo n ALA 310 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3iwo s SER 311 N 2.47 1.51 -0.35 0.00 0.01 -1.21 -0.98 113.70 115.14 3iwo s SER 311 Ca 0.58 -0.51 -0.23 0.00 1.31 0.00 0.00 55.95 57.10 3iwo s SER 311 Cb 0.16 -0.07 0.01 0.00 0.21 0.00 0.00 66.02 66.33 3iwo s SER 311 CO -0.07 -0.03 0.79 0.86 0.41 0.00 0.00 173.24 175.20 3iwo s TRP 312 N -1.03 3.13 -0.11 2.43 -0.11 0.47 -4.02 118.94 119.70 3iwo s TRP 312 Ca -0.01 0.62 0.01 0.00 1.22 0.00 0.00 56.10 57.93 3iwo s TRP 312 Cb -0.09 -3.39 -0.02 0.00 -1.50 0.00 0.00 33.47 28.48 3iwo s TRP 312 CO 0.01 -0.71 -0.13 0.08 -4.62 0.00 0.00 176.95 171.58 3iwo s VAL 313 N 3.10 3.04 0.23 5.86 1.01 -0.21 -1.27 120.40 132.17 3iwo s VAL 313 Ca 0.32 -0.68 -0.21 0.00 0.00 0.00 0.00 61.98 61.41 3iwo s VAL 313 Cb -0.13 -2.26 0.03 0.00 0.00 0.00 0.00 36.38 34.02 3iwo s VAL 313 CO 0.16 0.54 0.65 -1.38 0.00 0.00 0.00 175.10 175.07 3iwo s HIS 314 N 0.12 -0.26 -0.28 5.22 -0.00 -0.15 -0.75 115.29 119.19 3iwo s HIS 314 Ca -0.06 -0.11 -0.15 0.00 -0.00 0.00 0.00 55.06 54.73 3iwo s HIS 314 Cb -0.15 0.61 0.10 0.00 -0.00 0.00 0.00 32.58 33.14 3iwo s HIS 314 CO 0.05 -1.08 0.76 0.21 -0.00 0.00 0.00 174.74 174.67 3iwo s LYS 315 N -3.87 0.61 0.37 -0.38 2.47 -0.34 -2.39 119.74 116.21 3iwo s LYS 315 Ca 0.08 1.11 -0.10 0.00 -1.56 0.00 0.00 55.97 55.51 3iwo s LYS 315 Cb -0.04 0.20 -0.06 0.00 -1.46 0.00 0.00 37.83 36.47 3iwo s LYS 315 CO 0.00 -0.14 0.72 0.95 0.16 0.00 0.00 175.35 177.05 3iwo s THR 316 N 1.72 4.82 -0.14 3.43 -4.23 -1.26 -2.03 115.64 117.95 3iwo s THR 316 Ca -0.09 0.54 -0.22 0.00 -1.18 0.00 0.00 61.69 60.75 3iwo s THR 316 Cb -0.05 -3.72 0.05 0.00 1.34 0.00 0.00 72.50 70.12 3iwo s THR 316 CO -0.19 -0.45 0.55 -0.83 -0.54 0.00 0.00 174.62 173.16 3iwo s GLY 317 N -3.07 -0.42 0.03 3.99 0.00 -0.59 -3.56 107.32 103.70 3iwo s GLY 317 Ca 0.50 1.31 -0.09 0.00 0.00 0.00 0.00 44.72 46.44 3iwo s GLY 317 CO 0.30 1.06 0.18 0.00 0.00 0.00 0.00 173.10 174.63 3iwo s ALA 318 N -0.35 -0.35 0.13 3.20 0.00 -1.26 0.32 121.76 123.46 3iwo s ALA 318 Ca -0.05 -0.23 0.01 0.00 0.00 0.00 0.00 51.96 51.68 3iwo s ALA 318 Cb -0.03 0.22 -0.00 0.00 0.00 0.00 0.00 23.12 23.31 3iwo s ALA 318 CO 0.04 -0.31 0.03 0.25 0.00 0.00 0.00 175.76 175.76 3iwo n THR 319 N 0.91 0.00 -0.21 0.00 -2.24 -0.68 -3.96 114.28 108.10 3iwo n THR 319 Ca -0.20 -0.71 0.04 0.00 -2.27 0.00 0.00 64.05 60.91 3iwo n THR 319 Cb 0.58 0.21 0.30 0.00 -2.10 0.00 0.00 70.33 69.32 3iwo n THR 319 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3iwo h GLY 320 N 0.44 1.05 -0.81 3.38 0.00 -1.97 -3.15 103.07 102.00 3iwo h GLY 320 Ca -0.11 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3iwo h GLY 320 CO 0.17 0.29 0.00 0.61 0.00 0.00 0.00 176.54 177.62 3iwo n GLY 321 N -1.43 1.20 3.05 4.60 0.00 -1.26 -4.47 105.19 106.88 3iwo n GLY 321 Ca 0.10 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 3iwo n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3iwo s PHE 322 N -0.85 0.53 -0.03 1.61 0.40 -1.19 -2.20 117.98 116.25 3iwo s PHE 322 Ca 0.14 -0.62 0.00 0.00 -0.60 0.00 0.00 56.93 55.85 3iwo s PHE 322 Cb 0.08 -0.34 0.03 0.00 0.51 0.00 0.00 43.02 43.30 3iwo s PHE 322 CO 0.11 -0.16 0.01 0.20 0.70 0.00 0.00 175.22 176.08 3iwo s GLY 323 N -1.86 0.20 0.11 4.36 0.00 -0.52 -1.69 107.32 107.93 3iwo s GLY 323 Ca -0.08 0.20 0.05 0.00 0.00 0.00 0.00 44.72 44.89 3iwo s GLY 323 CO -0.02 0.66 -0.12 -0.56 0.00 0.00 0.00 173.10 173.07 3iwo s SER 324 N 1.09 1.71 -0.11 1.64 0.01 0.15 -1.41 113.70 116.78 3iwo s SER 324 Ca -0.09 -0.81 -0.17 0.00 1.31 0.00 0.00 55.95 56.19 3iwo s SER 324 Cb -0.13 -0.03 0.04 0.00 0.21 0.00 0.00 66.02 66.11 3iwo s SER 324 CO -0.02 -0.21 0.43 -0.47 0.41 0.00 0.00 173.24 173.38 3iwo s TYR 325 N -2.32 -0.42 -0.02 2.43 5.04 -0.23 -1.54 117.35 120.29 3iwo s TYR 325 Ca 0.07 0.92 0.01 0.00 -2.44 0.00 0.00 57.07 55.63 3iwo s TYR 325 Cb -0.04 0.17 0.01 0.00 0.35 0.00 0.00 41.96 42.46 3iwo s TYR 325 CO 0.01 -0.32 -0.03 0.08 -1.34 0.00 0.00 175.55 173.95 3iwo s VAL 326 N -0.38 0.31 -0.03 3.14 1.01 -0.86 -0.65 120.40 122.94 3iwo s VAL 326 Ca -0.05 -0.06 -0.08 0.00 0.00 0.00 0.00 61.98 61.79 3iwo s VAL 326 Cb -0.03 -0.34 0.01 0.00 0.00 0.00 0.00 36.38 36.02 3iwo s VAL 326 CO 0.03 0.14 0.18 0.00 0.00 0.00 0.00 175.10 175.44 3iwo s ALA 327 N 0.55 -0.43 0.12 5.51 0.00 -0.87 -1.20 121.76 125.43 3iwo s ALA 327 Ca -0.06 0.20 -0.20 0.00 0.00 0.00 0.00 51.96 51.91 3iwo s ALA 327 Cb -0.09 -0.08 0.05 0.00 0.00 0.00 0.00 23.12 23.00 3iwo s ALA 327 CO -0.01 -0.16 0.49 -0.59 0.00 0.00 0.00 175.76 175.49 3iwo s PHE 328 N -0.73 -0.36 -0.30 0.00 -0.71 0.07 -0.39 117.98 115.55 3iwo s PHE 328 Ca -0.08 0.17 0.00 0.00 -1.04 0.00 0.00 56.93 55.97 3iwo s PHE 328 Cb -0.05 0.37 0.09 0.00 -1.21 0.00 0.00 43.02 42.23 3iwo s PHE 328 CO 0.01 -0.73 0.07 0.42 -1.34 0.00 0.00 175.22 173.65 3iwo s ILE 329 N -3.46 1.18 0.24 -4.49 1.01 0.31 -1.05 121.20 114.94 3iwo s ILE 329 Ca 0.00 -1.50 -0.05 0.00 0.00 0.00 0.00 60.65 59.10 3iwo s ILE 329 Cb 0.00 -1.83 0.20 0.00 0.01 0.00 0.00 42.46 40.84 3iwo s ILE 329 CO -0.10 -0.57 1.78 -0.65 0.00 0.00 0.00 174.94 175.40 3iwo h PRO 330 N 8.00 0.62 0.00 2.79 0.11 -1.69 -1.72 132.00 140.11 3iwo h PRO 330 Ca -0.12 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.93 3iwo h PRO 330 Cb 1.03 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 3iwo h PRO 330 CO 0.47 0.41 -0.07 1.05 -0.21 0.00 0.00 178.00 179.64 3iwo h GLU 331 N 0.64 0.00 -0.02 1.05 4.11 -1.42 -2.21 114.58 116.74 3iwo h GLU 331 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.81 3iwo h GLU 331 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3iwo h GLU 331 CO -0.28 0.07 -0.28 1.63 0.07 0.00 0.00 179.01 180.22 3iwo n LYS 332 N -3.36 1.44 -3.83 1.06 4.76 -0.68 -4.97 118.16 112.57 3iwo n LYS 332 Ca -0.01 -1.12 -0.27 0.00 -2.87 0.00 0.00 58.31 54.04 3iwo n LYS 332 Cb 0.24 -1.48 0.03 0.00 -1.84 0.00 0.00 35.03 31.99 3iwo n LYS 332 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3iwo n GLU 333 N 0.20 -5.59 -4.47 1.97 1.02 -0.83 -4.52 120.64 108.42 3iwo n GLU 333 Ca 0.12 0.62 -0.21 0.00 -0.02 0.00 0.00 57.16 57.68 3iwo n GLU 333 Cb 0.47 -5.45 -0.15 0.00 -0.02 0.00 0.00 31.44 26.29 3iwo n GLU 333 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3iwo s LEU 334 N -7.13 1.90 0.17 -4.62 2.96 -1.18 -1.56 118.68 109.22 3iwo s LEU 334 Ca 0.49 -0.21 -0.25 0.00 -0.22 0.00 0.00 54.13 53.95 3iwo s LEU 334 Cb -0.24 -0.59 0.06 0.00 0.50 0.00 0.00 46.19 45.92 3iwo s LEU 334 CO 0.82 0.10 0.94 -0.83 -1.32 0.00 0.00 176.35 176.06 3iwo s GLY 335 N -0.03 -0.22 -0.04 7.98 0.00 -0.35 -0.53 107.32 114.14 3iwo s GLY 335 Ca 0.00 0.08 -0.09 0.00 0.00 0.00 0.00 44.72 44.72 3iwo s GLY 335 CO 0.00 -0.01 0.20 -1.50 0.00 0.00 0.00 173.10 171.79 3iwo s ILE 336 N -3.35 0.04 -0.06 0.90 2.07 0.47 0.16 121.20 121.44 3iwo s ILE 336 Ca 0.12 -0.36 0.03 0.00 -1.41 0.00 0.00 60.65 59.03 3iwo s ILE 336 Cb -0.02 -0.41 0.00 0.00 0.13 0.00 0.00 42.46 42.17 3iwo s ILE 336 CO 0.03 -0.20 -0.16 -0.69 -1.91 0.00 0.00 174.94 172.01 3iwo s VAL 337 N -0.74 1.37 -0.18 4.00 1.01 0.12 -2.04 120.40 123.94 3iwo s VAL 337 Ca -0.08 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.25 3iwo s VAL 337 Cb -0.05 -1.21 0.04 0.00 0.00 0.00 0.00 36.38 35.16 3iwo s VAL 337 CO 0.01 0.40 -0.11 -0.04 0.00 0.00 0.00 175.10 175.37 3iwo s MET 338 N 0.31 2.07 -0.13 2.72 -1.94 0.18 -1.45 119.30 121.07 3iwo s MET 338 Ca -0.10 -0.76 0.03 0.00 -1.71 0.00 0.00 55.69 53.15 3iwo s MET 338 Cb -0.14 -2.32 0.00 0.00 2.01 0.00 0.00 34.83 34.38 3iwo s MET 338 CO 0.04 -0.38 -0.21 -0.51 -0.01 0.00 0.00 175.02 173.95 3iwo s LEU 339 N 1.43 2.21 0.03 -0.03 1.43 -0.16 -1.07 118.68 122.51 3iwo s LEU 339 Ca 0.00 -0.54 0.03 0.00 -1.03 0.00 0.00 54.13 52.59 3iwo s LEU 339 Cb -0.15 -1.46 -0.02 0.00 0.03 0.00 0.00 46.19 44.59 3iwo s LEU 339 CO -0.09 0.12 -0.09 0.00 0.23 0.00 0.00 176.35 176.52 3iwo s ALA 340 N 0.59 0.69 -0.58 4.21 0.00 -0.50 -0.94 121.76 125.23 3iwo s ALA 340 Ca -0.12 -0.62 -0.02 0.00 0.00 0.00 0.00 51.96 51.20 3iwo s ALA 340 Cb -0.16 -0.06 0.38 0.00 0.00 0.00 0.00 23.12 23.27 3iwo s ALA 340 CO 0.03 0.08 2.04 0.27 0.00 0.00 0.00 175.76 178.19 3iwo n ASN 341 N 2.02 7.38 -3.81 0.00 6.94 -1.03 -1.43 115.26 125.33 3iwo n ASN 341 Ca -0.19 -3.60 -0.12 0.00 -0.02 0.00 0.00 54.58 50.65 3iwo n ASN 341 Cb 0.56 -1.01 -0.12 0.00 -2.36 0.00 0.00 39.78 36.85 3iwo n ASN 341 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 3iwo s LYS 342 N -3.29 0.26 -0.67 -3.83 2.20 -0.93 -1.65 119.74 111.82 3iwo s LYS 342 Ca 0.56 0.19 -0.27 0.00 -0.36 0.00 0.00 55.97 56.09 3iwo s LYS 342 Cb 0.44 0.12 0.03 0.00 -1.51 0.00 0.00 37.83 36.91 3iwo s LYS 342 CO -0.02 -0.04 1.21 1.21 -0.36 0.00 0.00 175.35 177.35 3iwo s ASN 343 N -0.07 6.27 0.32 1.43 2.47 -1.25 -2.22 114.94 121.88 3iwo s ASN 343 Ca -0.02 -0.29 0.09 0.00 0.42 0.00 0.00 52.86 53.07 3iwo s ASN 343 Cb -0.02 -2.54 -0.05 0.00 -1.45 0.00 0.00 41.25 37.19 3iwo s ASN 343 CO 0.00 -1.66 0.01 -0.72 -3.72 0.00 0.00 177.10 171.01 3iwo s TYR 344 N 5.27 2.59 0.29 0.43 -0.85 -1.26 -4.95 117.35 118.87 3iwo s TYR 344 Ca 0.37 -0.37 -0.30 0.00 -0.52 0.00 0.00 57.07 56.25 3iwo s TYR 344 Cb -0.09 -1.40 -0.12 0.00 0.38 0.00 0.00 41.96 40.74 3iwo s TYR 344 CO 0.18 0.51 1.54 -2.30 -1.52 0.00 0.00 175.55 173.97 3iwo n PRO 345 N -0.94 2.55 -0.25 -3.49 -0.02 -1.26 -4.90 135.00 126.68 3iwo n PRO 345 Ca -0.05 0.90 0.06 0.00 -2.02 0.00 0.00 63.50 62.39 3iwo n PRO 345 Cb 0.61 -2.65 0.17 0.00 -0.02 0.00 0.00 33.50 31.61 3iwo n PRO 345 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3iwo h ASN 346 N 4.50 -0.25 0.32 2.55 2.35 -1.98 -2.39 115.58 120.68 3iwo h ASN 346 Ca -0.47 0.18 -0.06 0.00 -0.55 0.00 0.00 56.30 55.41 3iwo h ASN 346 Cb 1.24 0.31 -0.01 0.00 0.05 0.00 0.00 38.32 39.91 3iwo h ASN 346 CO 0.77 -0.15 -0.28 -0.65 -1.65 0.00 0.00 177.43 175.47 3iwo h PRO 347 N 0.14 0.00 -0.46 0.81 0.11 -1.81 -0.94 132.00 129.85 3iwo h PRO 347 Ca 0.42 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.48 3iwo h PRO 347 Cb 0.74 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.83 3iwo h PRO 347 CO -0.63 0.28 0.09 0.00 -0.21 0.00 0.00 178.00 177.54 3iwo h ALA 348 N 1.72 1.31 -0.17 -0.75 0.00 -1.79 -0.55 119.26 119.03 3iwo h ALA 348 Ca -0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 3iwo h ALA 348 Cb 0.52 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3iwo h ALA 348 CO 0.04 0.48 -0.04 0.00 0.00 0.00 0.00 179.25 179.73 3iwo h ARG 349 N 0.67 0.33 -0.57 0.00 3.08 -1.12 -2.61 114.38 114.15 3iwo h ARG 349 Ca 0.15 -0.13 -0.11 0.00 0.07 0.00 0.00 59.98 59.97 3iwo h ARG 349 Cb 0.28 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 3iwo h ARG 349 CO -0.00 0.60 -0.06 0.28 -1.07 0.00 0.00 179.97 179.72 3iwo h VAL 350 N 0.03 1.27 -0.18 2.04 2.07 -1.15 -1.50 116.25 118.84 3iwo h VAL 350 Ca 0.04 -1.22 0.02 0.00 0.82 0.00 0.00 66.70 66.37 3iwo h VAL 350 Cb 0.48 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 3iwo h VAL 350 CO 0.02 0.44 0.03 -0.78 0.02 0.00 0.00 177.57 177.29 3iwo h ASP 351 N 0.94 -0.01 -0.37 0.57 1.82 -1.13 0.12 116.42 118.35 3iwo h ASP 351 Ca 0.15 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.82 3iwo h ASP 351 Cb 0.63 0.04 -0.02 0.00 0.68 0.00 0.00 39.33 40.66 3iwo h ASP 351 CO 0.04 0.02 0.21 0.00 -1.61 0.00 0.00 179.24 177.91 3iwo h ALA 352 N 1.13 0.48 -0.47 -0.78 0.00 -1.33 -1.42 119.26 116.87 3iwo h ALA 352 Ca 0.08 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3iwo h ALA 352 Cb 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3iwo h ALA 352 CO -0.11 -0.01 0.29 0.00 0.00 0.00 0.00 179.25 179.42 3iwo h ALA 353 N 1.08 0.60 -0.31 0.00 0.00 -0.88 -2.39 119.26 117.35 3iwo h ALA 353 Ca 0.13 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3iwo h ALA 353 Cb 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3iwo h ALA 353 CO -0.02 0.07 0.18 2.35 0.00 0.00 0.00 179.25 181.83 3iwo h TRP 354 N 0.63 0.34 -0.77 0.00 2.91 -0.63 -1.12 115.95 117.31 3iwo h TRP 354 Ca 0.17 0.01 0.11 0.00 1.13 0.00 0.00 58.89 60.32 3iwo h TRP 354 Cb -0.03 -0.11 -0.08 0.00 -0.51 0.00 0.00 29.16 28.43 3iwo h TRP 354 CO -0.03 0.20 0.38 1.96 -1.03 0.00 0.00 178.44 179.92 3iwo h GLN 355 N 0.37 0.59 0.12 2.65 1.08 -0.99 0.42 115.11 119.36 3iwo h GLN 355 Ca 0.12 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.28 3iwo h GLN 355 Cb -0.00 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.30 3iwo h GLN 355 CO -0.06 0.39 -0.06 0.82 -0.95 0.00 0.00 178.83 178.98 3iwo h ILE 356 N 0.61 0.99 -0.33 2.54 2.04 -1.16 -2.59 117.51 119.62 3iwo h ILE 356 Ca 0.40 -1.24 -0.08 0.00 1.00 0.00 0.00 64.86 64.93 3iwo h ILE 356 Cb 0.48 1.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 3iwo h ILE 356 CO -0.31 0.26 -0.13 -0.07 0.00 0.00 0.00 178.15 177.90 3iwo h LEU 357 N -0.82 0.57 -0.89 1.44 3.38 -1.15 -2.31 115.31 115.53 3iwo h LEU 357 Ca -0.02 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 3iwo h LEU 357 Cb 0.55 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3iwo h LEU 357 CO 0.03 0.73 -0.15 -1.13 0.09 0.00 0.00 178.44 178.01 3iwo h ASN 358 N 0.53 0.65 -0.29 -0.43 -1.24 -0.99 -0.55 115.58 113.25 3iwo h ASN 358 Ca 0.09 -0.20 -0.06 0.00 0.71 0.00 0.00 56.30 56.84 3iwo h ASN 358 Cb 0.54 -0.17 -0.02 0.00 0.73 0.00 0.00 38.32 39.40 3iwo h ASN 358 CO 0.03 0.81 -0.03 0.00 -1.29 0.00 0.00 177.43 176.96 3iwo h ALA 359 N 1.25 1.22 0.00 1.57 0.00 -1.20 -3.27 119.26 118.83 3iwo h ALA 359 Ca 0.10 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3iwo h ALA 359 Cb 0.59 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3iwo h ALA 359 CO 0.04 0.51 -0.98 1.28 0.00 0.00 0.00 179.25 180.10 3iwo n LEU 360 N -4.23 0.64 0.00 0.00 4.77 -0.89 -5.11 117.00 112.17 3iwo n LEU 360 Ca 0.02 -0.09 0.11 0.00 -0.03 0.00 0.00 56.01 56.03 3iwo n LEU 360 Cb 0.29 -0.10 0.67 0.00 -2.33 0.00 0.00 43.42 41.95 3iwo n LEU 360 CO 0.40 0.08 0.86 1.67 -1.33 0.00 0.00 177.39 179.08