#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iw2 s ASN 21 N 0.00 6.66 0.09 3.54 4.22 -1.26 -4.93 114.94 123.25 3iw2 s ASN 21 Ca 0.00 -1.93 0.04 0.00 -2.14 0.00 0.00 52.86 48.83 3iw2 s ASN 21 Cb 0.00 -2.55 -0.03 0.00 1.28 0.00 0.00 41.25 39.95 3iw2 s ASN 21 CO 0.00 -1.31 -0.12 -0.76 -2.04 0.00 0.00 177.10 172.88 3iw2 s LEU 22 N 4.30 2.35 0.77 3.54 1.43 -1.26 -5.02 118.68 124.78 3iw2 s LEU 22 Ca 0.47 -0.72 -0.14 0.00 -1.03 0.00 0.00 54.13 52.72 3iw2 s LEU 22 Cb 0.01 -0.39 0.06 0.00 0.03 0.00 0.00 46.19 45.90 3iw2 s LEU 22 CO -0.03 -0.18 1.20 -2.84 0.23 0.00 0.00 176.35 174.72 3iw2 s PRO 23 N -2.29 1.92 0.20 1.29 0.02 -1.26 -4.92 135.00 129.96 3iw2 s PRO 23 Ca 0.02 1.71 -0.32 0.00 0.02 0.00 0.00 61.00 62.43 3iw2 s PRO 23 Cb -0.06 -1.81 -0.11 0.00 0.02 0.00 0.00 34.50 32.53 3iw2 s PRO 23 CO 0.01 -2.00 1.66 -1.25 -0.33 0.00 0.00 177.00 175.10 3iw2 s PRO 24 N -4.08 4.15 -0.72 5.54 0.04 -1.26 -2.52 135.00 136.16 3iw2 s PRO 24 Ca 0.73 2.53 0.00 0.00 0.04 0.00 0.00 61.00 64.30 3iw2 s PRO 24 Cb -0.28 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.17 3iw2 s PRO 24 CO 0.48 -0.69 0.00 0.41 0.04 0.00 0.00 177.00 177.24 3iw2 n GLY 25 N 3.72 0.88 3.75 0.56 0.00 -1.26 -4.99 105.19 107.85 3iw2 n GLY 25 Ca 0.14 -0.53 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 3iw2 n GLY 25 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3iw2 s PHE 26 N -2.17 3.08 -0.19 1.61 5.36 -1.05 -4.99 117.98 119.63 3iw2 s PHE 26 Ca 0.00 1.14 0.00 0.00 -0.96 0.00 0.00 56.93 57.11 3iw2 s PHE 26 Cb 0.00 -3.75 0.05 0.00 -0.34 0.00 0.00 43.02 38.98 3iw2 s PHE 26 CO 0.00 -2.35 -0.06 0.34 -1.46 0.00 0.00 175.22 171.69 3iw2 s ASP 27 N 0.22 3.27 0.02 6.13 -1.08 -1.26 -4.81 116.67 119.16 3iw2 s ASP 27 Ca 0.57 -0.87 0.07 0.00 -0.52 0.00 0.00 52.55 51.80 3iw2 s ASP 27 Cb -0.40 -1.06 0.31 0.00 -1.46 0.00 0.00 42.92 40.31 3iw2 s ASP 27 CO 0.44 -0.19 1.22 0.49 0.52 0.00 0.00 175.17 177.65 3iw2 n PHE 28 N 4.78 0.06 -0.45 -5.34 3.72 -1.26 -1.16 117.46 117.81 3iw2 n PHE 28 Ca -0.13 0.03 0.09 0.00 -0.05 0.00 0.00 57.45 57.40 3iw2 n PHE 28 Cb 0.46 -0.55 0.29 0.00 -0.94 0.00 0.00 39.48 38.75 3iw2 n PHE 28 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3iw2 n THR 29 N -1.56 1.36 -2.35 4.37 -2.24 -1.26 -5.00 114.28 107.60 3iw2 n THR 29 Ca 0.01 -1.12 -0.43 0.00 -2.27 0.00 0.00 64.05 60.24 3iw2 n THR 29 Cb 0.07 0.33 -0.02 0.00 -2.10 0.00 0.00 70.33 68.61 3iw2 n THR 29 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3iw2 s ASP 30 N -1.04 6.51 0.53 3.42 2.15 -0.31 -4.30 116.67 123.64 3iw2 s ASP 30 Ca 0.43 1.15 0.27 0.00 0.43 0.00 0.00 52.55 54.82 3iw2 s ASP 30 Cb 0.25 -2.54 1.42 0.00 -0.30 0.00 0.00 42.92 41.75 3iw2 s ASP 30 CO 0.25 -1.22 1.98 -0.65 -0.17 0.00 0.00 175.17 175.35 3iw2 h PRO 31 N 9.99 0.00 -0.38 4.34 0.11 -1.90 -1.07 132.00 143.08 3iw2 h PRO 31 Ca -0.28 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.91 3iw2 h PRO 31 Cb 1.11 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3iw2 h PRO 31 CO 1.05 0.00 0.26 0.00 -0.21 0.00 0.00 178.00 179.10 3iw2 h ALA 32 N 1.70 2.13 -0.04 -0.75 0.00 -1.91 -1.46 119.26 118.94 3iw2 h ALA 32 Ca 0.28 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 3iw2 h ALA 32 Cb 1.14 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3iw2 h ALA 32 CO -0.00 -0.22 -0.10 0.82 0.00 0.00 0.00 179.25 179.75 3iw2 h ILE 33 N 0.17 1.44 0.00 0.00 2.04 -1.52 -3.33 117.51 116.32 3iw2 h ILE 33 Ca 0.17 -1.46 -0.00 0.00 1.00 0.00 0.00 64.86 64.57 3iw2 h ILE 33 Cb 0.47 2.31 -0.00 0.00 -0.74 0.00 0.00 36.82 38.85 3iw2 h ILE 33 CO -0.03 0.40 -0.02 1.88 0.00 0.00 0.00 178.15 180.39 3iw2 h TYR 34 N -0.39 0.00 -0.02 1.37 0.05 -1.50 0.12 116.97 116.60 3iw2 h TYR 34 Ca -0.00 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.79 3iw2 h TYR 34 Cb 0.70 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.44 3iw2 h TYR 34 CO 0.12 0.02 0.02 0.00 -1.05 0.00 0.00 178.16 177.27 3iw2 h ALA 35 N 1.98 1.92 0.00 3.88 0.00 -1.38 -3.33 119.26 122.34 3iw2 h ALA 35 Ca -0.00 -0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 3iw2 h ALA 35 Cb 0.71 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 3iw2 h ALA 35 CO 0.00 -0.03 -1.93 -1.91 0.00 0.00 0.00 179.25 175.39 3iw2 n GLU 36 N -4.38 0.38 -3.56 0.00 2.13 -0.65 -4.32 120.64 110.23 3iw2 n GLU 36 Ca -0.02 0.12 -0.08 0.00 0.66 0.00 0.00 57.16 57.83 3iw2 n GLU 36 Cb 0.11 -1.24 -0.02 0.00 0.27 0.00 0.00 31.44 30.56 3iw2 n GLU 36 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 3iw2 s ARG 37 N -2.32 1.15 -0.02 5.31 1.70 0.32 -4.95 118.95 120.14 3iw2 s ARG 37 Ca -0.22 -0.50 -0.24 0.00 -0.47 0.00 0.00 55.73 54.29 3iw2 s ARG 37 Cb 0.07 0.48 -0.04 0.00 -0.57 0.00 0.00 34.95 34.89 3iw2 s ARG 37 CO 0.34 -0.51 0.75 -0.51 -1.08 0.00 0.00 175.30 174.29 3iw2 s LEU 38 N -2.70 4.37 -1.51 -1.89 1.43 -1.26 -3.52 118.68 113.59 3iw2 s LEU 38 Ca 0.06 1.32 -0.12 0.00 -1.03 0.00 0.00 54.13 54.36 3iw2 s LEU 38 Cb -0.02 -3.18 -0.00 0.00 0.03 0.00 0.00 46.19 43.03 3iw2 s LEU 38 CO -0.06 -0.08 2.51 -0.81 0.23 0.00 0.00 176.35 178.13 3iw2 n PRO 39 N 3.45 3.29 -0.19 1.29 -0.04 -1.26 -4.70 135.00 136.85 3iw2 n PRO 39 Ca -0.01 -2.52 -0.10 0.00 -0.04 0.00 0.00 63.50 60.83 3iw2 n PRO 39 Cb 0.51 -3.05 0.01 0.00 -0.04 0.00 0.00 33.50 30.93 3iw2 n PRO 39 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3iw2 h VAL 40 N 3.54 1.26 -0.13 0.52 2.07 -1.97 -1.60 116.25 119.94 3iw2 h VAL 40 Ca 0.69 -1.10 -0.14 0.00 0.82 0.00 0.00 66.70 66.97 3iw2 h VAL 40 Cb 0.48 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3iw2 h VAL 40 CO 1.82 0.39 -0.52 0.00 0.02 0.00 0.00 177.57 179.28 3iw2 h ALA 41 N 0.95 0.87 -0.20 1.67 0.00 -1.99 -1.90 119.26 118.66 3iw2 h ALA 41 Ca 0.15 -0.49 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 3iw2 h ALA 41 Cb 0.52 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3iw2 h ALA 41 CO 0.03 0.67 -0.18 0.93 0.00 0.00 0.00 179.25 180.70 3iw2 h GLU 42 N 0.29 0.48 -0.81 0.00 3.07 -1.87 -1.19 114.58 114.54 3iw2 h GLU 42 Ca 0.01 -0.24 0.09 0.00 -0.50 0.00 0.00 59.36 58.72 3iw2 h GLU 42 Cb 1.01 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.85 3iw2 h GLU 42 CO 0.09 0.81 0.46 0.74 -1.40 0.00 0.00 179.01 179.71 3iw2 h PHE 43 N 0.15 0.83 -0.41 4.33 0.04 -1.22 -2.14 116.94 118.53 3iw2 h PHE 43 Ca 0.03 0.03 -0.10 0.00 2.80 0.00 0.00 57.97 60.73 3iw2 h PHE 43 Cb 0.72 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.60 3iw2 h PHE 43 CO 0.08 0.34 -0.17 0.00 -0.60 0.00 0.00 178.31 177.96 3iw2 h ALA 44 N 1.45 0.95 -0.29 2.45 0.00 -1.16 -1.00 119.26 121.66 3iw2 h ALA 44 Ca 0.39 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3iw2 h ALA 44 Cb 0.35 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3iw2 h ALA 44 CO -0.25 0.61 0.18 1.49 0.00 0.00 0.00 179.25 181.29 3iw2 h GLU 45 N 0.68 0.38 -0.31 0.00 4.57 -0.72 -2.01 114.58 117.17 3iw2 h GLU 45 Ca 0.11 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.25 3iw2 h GLU 45 Cb 0.66 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.15 3iw2 h GLU 45 CO 0.05 0.28 0.18 -0.07 -1.18 0.00 0.00 179.01 178.27 3iw2 h LEU 46 N 0.37 0.39 -1.44 1.64 3.38 -1.06 0.19 115.31 118.78 3iw2 h LEU 46 Ca 0.10 -0.07 0.12 0.00 0.09 0.00 0.00 57.88 58.12 3iw2 h LEU 46 Cb -0.01 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 3iw2 h LEU 46 CO -0.02 0.35 0.51 0.03 0.09 0.00 0.00 178.44 179.40 3iw2 h ARG 47 N 0.39 0.57 0.05 1.13 3.08 -0.92 0.18 114.38 118.87 3iw2 h ARG 47 Ca 0.11 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.05 3iw2 h ARG 47 Cb 0.04 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 29.97 3iw2 h ARG 47 CO -0.02 0.38 -0.34 1.03 -1.07 0.00 0.00 179.97 179.95 3iw2 h SER 48 N 0.59 0.16 0.00 7.04 0.87 -1.01 -3.40 113.55 117.80 3iw2 h SER 48 Ca 0.37 -0.97 -0.18 0.00 -1.23 0.00 0.00 61.79 59.79 3iw2 h SER 48 Cb 0.63 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.50 3iw2 h SER 48 CO -0.14 1.16 -2.09 0.00 -0.53 0.00 0.00 176.83 175.23 3iw2 n ALA 49 N -2.66 2.09 -2.72 6.23 0.00 0.63 -4.83 120.51 119.25 3iw2 n ALA 49 Ca -0.12 -0.87 -0.07 0.00 0.00 0.00 0.00 53.44 52.38 3iw2 n ALA 49 Cb 0.61 -0.39 0.06 0.00 0.00 0.00 0.00 19.45 19.73 3iw2 n ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3iw2 n ALA 50 N -2.45 -2.13 0.26 0.00 0.00 0.41 -4.74 120.51 111.87 3iw2 n ALA 50 Ca -0.18 -1.03 0.17 0.00 0.00 0.00 0.00 53.44 52.41 3iw2 n ALA 50 Cb 0.83 -1.95 0.91 0.00 0.00 0.00 0.00 19.45 19.24 3iw2 n ALA 50 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3iw2 h PRO 51 N 3.80 0.00 -4.67 0.00 0.13 -1.21 -3.32 132.00 126.73 3iw2 h PRO 51 Ca -0.16 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.33 3iw2 h PRO 51 Cb 1.09 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.85 3iw2 h PRO 51 CO 0.15 0.00 -0.81 0.42 -0.23 0.00 0.00 178.00 177.53 3iw2 s ILE 52 N -4.52 1.79 -0.03 -3.56 1.01 -1.26 -2.65 121.20 111.98 3iw2 s ILE 52 Ca -0.05 -1.16 0.02 0.00 0.00 0.00 0.00 60.65 59.46 3iw2 s ILE 52 Cb 0.14 -1.86 0.01 0.00 0.01 0.00 0.00 42.46 40.76 3iw2 s ILE 52 CO 0.50 0.14 -0.05 0.86 0.00 0.00 0.00 174.94 176.39 3iw2 s TRP 53 N 1.32 0.70 -0.30 3.97 -0.00 -1.04 -4.96 118.94 118.63 3iw2 s TRP 53 Ca -0.03 -0.17 -0.29 0.00 -0.00 0.00 0.00 56.10 55.62 3iw2 s TRP 53 Cb -0.17 -0.56 -0.01 0.00 -0.00 0.00 0.00 33.47 32.73 3iw2 s TRP 53 CO -0.08 -0.12 1.53 -0.46 -0.00 0.00 0.00 176.95 177.83 3iw2 s TRP 54 N 0.48 2.24 -0.89 5.86 -0.11 -1.26 -0.42 118.94 124.84 3iw2 s TRP 54 Ca -0.06 0.65 -0.18 0.00 1.22 0.00 0.00 56.10 57.73 3iw2 s TRP 54 Cb -0.10 -4.08 0.14 0.00 -1.50 0.00 0.00 33.47 27.93 3iw2 s TRP 54 CO 0.00 -2.46 1.06 1.21 -4.62 0.00 0.00 176.95 172.14 3iw2 s ASN 55 N 4.20 6.59 0.48 5.86 3.04 0.52 -4.94 114.94 130.69 3iw2 s ASN 55 Ca 0.67 -2.02 -0.24 0.00 0.04 0.00 0.00 52.86 51.31 3iw2 s ASN 55 Cb -0.20 -2.38 -0.07 0.00 -1.54 0.00 0.00 41.25 37.06 3iw2 s ASN 55 CO 0.30 -1.04 1.37 -0.83 -3.04 0.00 0.00 177.10 173.86 3iw2 s GLY 56 N 3.48 2.90 -0.06 1.21 0.00 -1.26 -1.97 107.32 111.62 3iw2 s GLY 56 Ca 0.30 1.35 0.02 0.00 0.00 0.00 0.00 44.72 46.39 3iw2 s GLY 56 CO -0.08 1.92 -0.10 1.20 0.00 0.00 0.00 173.10 176.05 3iw2 s GLN 57 N -2.58 1.43 0.77 2.90 -0.21 -0.37 -4.84 119.66 116.75 3iw2 s GLN 57 Ca 0.64 -0.32 -0.11 0.00 0.02 0.00 0.00 55.36 55.59 3iw2 s GLN 57 Cb -0.41 -1.22 0.05 0.00 1.00 0.00 0.00 33.01 32.43 3iw2 s GLN 57 CO 0.51 -0.00 1.08 -0.51 -2.12 0.00 0.00 175.29 174.25 3iw2 s ASP 58 N 0.72 4.68 0.39 5.90 1.01 -1.26 -4.35 116.67 123.76 3iw2 s ASP 58 Ca -0.14 1.50 -0.27 0.00 0.71 0.00 0.00 52.55 54.35 3iw2 s ASP 58 Cb -0.15 -2.27 -0.11 0.00 1.01 0.00 0.00 42.92 41.40 3iw2 s ASP 58 CO 0.03 -1.88 1.47 -2.65 0.21 0.00 0.00 175.17 172.35 3iw2 n PRO 59 N -3.39 2.58 -0.98 8.23 -0.02 -1.26 -2.19 135.00 137.97 3iw2 n PRO 59 Ca 0.07 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 3iw2 n PRO 59 Cb 0.55 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 3iw2 n PRO 59 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iw2 n GLY 60 N 0.48 0.40 0.32 -1.23 0.00 -1.26 -4.88 105.19 99.02 3iw2 n GLY 60 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.07 3iw2 n GLY 60 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3iw2 n LYS 61 N -1.79 0.51 -0.54 1.61 5.02 -0.93 -4.82 118.16 117.21 3iw2 n LYS 61 Ca 0.00 -1.50 0.10 0.00 -2.02 0.00 0.00 58.31 54.89 3iw2 n LYS 61 Cb 0.13 -0.84 0.34 0.00 -0.02 0.00 0.00 35.03 34.64 3iw2 n LYS 61 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3iw2 n GLY 62 N -0.48 2.74 2.73 0.72 0.00 -1.25 -4.71 105.19 104.93 3iw2 n GLY 62 Ca 0.05 -0.83 -0.19 0.00 0.00 0.00 0.00 46.02 45.05 3iw2 n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iw2 n GLY 63 N 1.18 -0.36 0.00 -0.02 0.00 -1.26 -2.20 105.19 102.54 3iw2 n GLY 63 Ca 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3iw2 n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iw2 n GLY 64 N -1.33 0.77 3.61 -0.02 0.00 -1.25 -0.63 105.19 106.35 3iw2 n GLY 64 Ca -0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 3iw2 n GLY 64 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3iw2 s PHE 65 N -2.06 3.00 -0.11 1.61 0.08 -0.93 -4.90 117.98 114.67 3iw2 s PHE 65 Ca 0.00 0.07 0.19 0.00 0.12 0.00 0.00 56.93 57.32 3iw2 s PHE 65 Cb 0.00 -1.73 0.43 0.00 -0.57 0.00 0.00 43.02 41.15 3iw2 s PHE 65 CO 0.00 0.37 1.19 0.72 -0.10 0.00 0.00 175.22 177.40 3iw2 n HIS 66 N 2.18 0.22 0.46 0.36 8.25 -1.26 -3.97 115.22 121.47 3iw2 n HIS 66 Ca -0.18 -1.07 0.08 0.00 -0.26 0.00 0.00 57.72 56.30 3iw2 n HIS 66 Cb 0.53 -0.20 0.11 0.00 1.12 0.00 0.00 29.99 31.55 3iw2 n HIS 66 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 3iw2 n ASP 67 N -0.23 2.66 0.00 0.41 5.75 -1.26 -4.96 116.55 118.92 3iw2 n ASP 67 Ca 0.13 -1.78 0.00 0.00 -0.01 0.00 0.00 54.79 53.13 3iw2 n ASP 67 Cb 0.95 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.95 3iw2 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3iw2 n GLY 68 N 0.98 0.64 0.00 6.12 0.00 -1.26 -4.93 105.19 106.74 3iw2 n GLY 68 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3iw2 n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iw2 n GLY 69 N -2.01 0.99 3.39 -0.02 0.00 -1.26 -1.23 105.19 105.04 3iw2 n GLY 69 Ca 0.00 -1.91 -0.12 0.00 0.00 0.00 0.00 46.02 43.99 3iw2 n GLY 69 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3iw2 s PHE 70 N -2.20 -0.41 -0.22 1.61 -0.12 -0.83 -4.54 117.98 111.27 3iw2 s PHE 70 Ca 0.00 0.29 -0.27 0.00 -0.05 0.00 0.00 56.93 56.90 3iw2 s PHE 70 Cb 0.00 0.40 -0.00 0.00 -0.63 0.00 0.00 43.02 42.79 3iw2 s PHE 70 CO 0.00 -0.73 0.93 -1.58 -0.05 0.00 0.00 175.22 173.79 3iw2 s TRP 71 N -3.22 3.35 -0.26 3.49 0.52 -0.22 -0.36 118.94 122.24 3iw2 s TRP 71 Ca -0.01 1.32 -0.27 0.00 0.02 0.00 0.00 56.10 57.16 3iw2 s TRP 71 Cb -0.00 -3.15 0.01 0.00 -1.15 0.00 0.00 33.47 29.18 3iw2 s TRP 71 CO -0.08 -0.40 0.94 0.00 0.02 0.00 0.00 176.95 177.43 3iw2 s ALA 72 N 2.86 3.62 -0.30 0.98 0.00 0.44 -0.41 121.76 128.96 3iw2 s ALA 72 Ca 0.40 -0.06 -0.09 0.00 0.00 0.00 0.00 51.96 52.21 3iw2 s ALA 72 Cb -0.15 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 3iw2 s ALA 72 CO 0.08 -1.12 0.13 0.42 0.00 0.00 0.00 175.76 175.28 3iw2 s ILE 73 N 3.14 4.57 -0.15 0.00 -1.09 0.35 -2.49 121.20 125.52 3iw2 s ILE 73 Ca 0.40 -0.34 0.06 0.00 -2.23 0.00 0.00 60.65 58.54 3iw2 s ILE 73 Cb -0.14 -3.28 -0.08 0.00 -1.58 0.00 0.00 42.46 37.38 3iw2 s ILE 73 CO 0.09 0.14 0.19 0.35 -1.23 0.00 0.00 174.94 174.48 3iw2 n THR 74 N 4.97 0.00 -3.96 2.92 -2.24 -1.08 -1.67 114.28 113.22 3iw2 n THR 74 Ca -0.14 -0.26 -0.36 0.00 -2.27 0.00 0.00 64.05 61.01 3iw2 n THR 74 Cb 0.50 0.70 -0.06 0.00 -2.10 0.00 0.00 70.33 69.37 3iw2 n THR 74 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3iw2 s LYS 75 N -1.95 3.37 0.13 -0.78 -0.14 -1.26 -2.78 119.74 116.32 3iw2 s LYS 75 Ca 0.00 -0.18 -0.23 0.00 -1.36 0.00 0.00 55.97 54.20 3iw2 s LYS 75 Cb 0.04 -3.12 -0.04 0.00 -1.68 0.00 0.00 37.83 33.03 3iw2 s LYS 75 CO 0.24 0.76 1.66 1.25 -0.76 0.00 0.00 175.35 178.51 3iw2 h LEU 76 N 4.95 -0.50 -1.49 3.17 5.85 -1.90 -1.61 115.31 123.77 3iw2 h LEU 76 Ca -0.54 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.25 3iw2 h LEU 76 Cb 1.22 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.46 3iw2 h LEU 76 CO 0.58 -0.22 0.19 0.78 -0.34 0.00 0.00 178.44 179.44 3iw2 h ASN 77 N -0.23 0.48 -0.46 1.25 2.35 -1.96 -1.18 115.58 115.83 3iw2 h ASN 77 Ca 0.08 -0.03 -0.11 0.00 -0.55 0.00 0.00 56.30 55.68 3iw2 h ASN 77 Cb 0.34 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 3iw2 h ASN 77 CO -0.22 0.40 -0.15 0.44 -1.65 0.00 0.00 177.43 176.26 3iw2 h ASP 78 N 0.54 0.93 -0.69 5.81 3.32 -1.88 -0.65 116.42 123.80 3iw2 h ASP 78 Ca 0.14 -0.38 0.07 0.00 0.02 0.00 0.00 57.03 56.88 3iw2 h ASP 78 Cb 0.05 -0.25 -0.06 0.00 0.22 0.00 0.00 39.33 39.29 3iw2 h ASP 78 CO -0.02 1.09 0.38 0.58 -1.72 0.00 0.00 179.24 179.55 3iw2 h VAL 79 N 0.75 0.94 -0.43 -1.35 2.07 -0.96 -1.03 116.25 116.25 3iw2 h VAL 79 Ca 0.11 -0.23 -0.06 0.00 0.82 0.00 0.00 66.70 67.34 3iw2 h VAL 79 Cb 0.70 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 3iw2 h VAL 79 CO 0.05 0.12 0.05 0.11 0.02 0.00 0.00 177.57 177.93 3iw2 h LYS 80 N 0.68 0.73 -0.07 1.57 1.57 -1.03 -1.78 116.57 118.24 3iw2 h LYS 80 Ca 0.32 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3iw2 h LYS 80 Cb 0.23 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 3iw2 h LYS 80 CO -0.20 0.77 0.04 1.49 -0.57 0.00 0.00 179.45 180.98 3iw2 h GLU 81 N 0.58 0.09 -0.66 3.15 4.81 -0.80 -0.75 114.58 121.00 3iw2 h GLU 81 Ca 0.13 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.43 3iw2 h GLU 81 Cb 0.41 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.70 3iw2 h GLU 81 CO 0.01 0.10 0.31 0.82 -0.73 0.00 0.00 179.01 179.52 3iw2 h ILE 82 N 0.06 0.85 -0.10 2.32 2.04 -1.07 -1.95 117.51 119.66 3iw2 h ILE 82 Ca 0.02 -0.19 -0.12 0.00 1.00 0.00 0.00 64.86 65.57 3iw2 h ILE 82 Cb 0.03 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.35 3iw2 h ILE 82 CO -0.00 0.10 -0.48 0.28 0.00 0.00 0.00 178.15 178.04 3iw2 h SER 83 N 0.55 0.27 -0.40 1.72 0.02 -0.83 -2.81 113.55 112.07 3iw2 h SER 83 Ca 0.32 -0.13 -0.15 0.00 -0.84 0.00 0.00 61.79 60.99 3iw2 h SER 83 Cb 0.32 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 3iw2 h SER 83 CO -0.26 0.71 -0.34 0.03 -1.14 0.00 0.00 176.83 175.83 3iw2 h ARG 84 N 0.20 0.94 -2.56 3.45 3.08 -0.77 -3.37 114.38 115.35 3iw2 h ARG 84 Ca 0.01 -0.48 -0.74 0.00 0.07 0.00 0.00 59.98 58.85 3iw2 h ARG 84 Cb 0.93 0.01 -0.14 0.00 0.08 0.00 0.00 29.97 30.85 3iw2 h ARG 84 CO 0.08 1.13 2.22 0.72 -1.07 0.00 0.00 179.97 183.05 3iw2 n HIS 85 N -4.09 2.57 1.10 3.04 8.25 -0.77 -4.67 115.22 120.66 3iw2 n HIS 85 Ca -0.02 -2.76 0.11 0.00 -0.26 0.00 0.00 57.72 54.78 3iw2 n HIS 85 Cb 0.52 -1.76 0.56 0.00 1.12 0.00 0.00 29.99 30.44 3iw2 n HIS 85 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3iw2 n SER 86 N 1.53 0.00 0.21 0.41 3.41 -1.25 -0.74 113.62 117.19 3iw2 n SER 86 Ca 0.61 -0.18 0.09 0.00 -0.26 0.00 0.00 58.87 59.14 3iw2 n SER 86 Cb 0.26 -0.22 0.34 0.00 -0.26 0.00 0.00 64.21 64.34 3iw2 n SER 86 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 3iw2 h ASP 87 N 0.00 0.00 0.00 4.04 2.03 -1.93 -3.33 116.42 117.23 3iw2 h ASP 87 Ca 0.00 0.00 -0.38 0.00 -0.73 0.00 0.00 57.03 55.92 3iw2 h ASP 87 Cb 0.15 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.59 3iw2 h ASP 87 CO 0.00 0.22 -2.34 0.52 -1.03 0.00 0.00 179.24 176.62 3iw2 n VAL 88 N -3.27 1.32 -3.34 4.15 0.31 -0.75 -4.88 118.33 111.87 3iw2 n VAL 88 Ca 0.01 -0.41 -0.44 0.00 -0.01 0.00 0.00 64.34 63.49 3iw2 n VAL 88 Cb 0.50 -1.62 -0.07 0.00 -0.91 0.00 0.00 33.84 31.74 3iw2 n VAL 88 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3iw2 s PHE 89 N -2.45 3.21 0.10 3.52 0.08 0.08 -0.47 117.98 122.05 3iw2 s PHE 89 Ca -0.33 -0.90 -0.18 0.00 0.12 0.00 0.00 56.93 55.64 3iw2 s PHE 89 Cb 0.11 -3.30 -0.07 0.00 -0.57 0.00 0.00 43.02 39.19 3iw2 s PHE 89 CO 0.47 -0.86 0.57 0.45 -0.10 0.00 0.00 175.22 175.74 3iw2 s SER 90 N 2.73 7.00 -0.14 1.36 0.15 0.35 -4.34 113.70 120.82 3iw2 s SER 90 Ca 0.06 1.22 0.10 0.00 0.70 0.00 0.00 55.95 58.02 3iw2 s SER 90 Cb -0.24 -2.34 -0.23 0.00 -1.71 0.00 0.00 66.02 61.49 3iw2 s SER 90 CO 0.07 0.22 0.30 -1.20 1.20 0.00 0.00 173.24 173.83 3iw2 n SER 91 N 1.43 0.96 -0.17 5.45 7.64 -1.26 -1.05 113.62 126.61 3iw2 n SER 91 Ca -0.09 0.17 -0.04 0.00 1.01 0.00 0.00 58.87 59.93 3iw2 n SER 91 Cb 0.51 0.09 0.06 0.00 -1.01 0.00 0.00 64.21 63.86 3iw2 n SER 91 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 3iw2 h TYR 92 N 0.01 0.45 -0.63 1.43 3.20 -1.76 -1.17 116.97 118.51 3iw2 h TYR 92 Ca -0.43 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.44 3iw2 h TYR 92 Cb 2.08 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 40.19 3iw2 h TYR 92 CO 0.02 0.20 0.32 0.93 -1.64 0.00 0.00 178.16 178.00 3iw2 h GLU 93 N 0.48 0.89 0.00 1.82 4.39 -1.87 -3.21 114.58 117.08 3iw2 h GLU 93 Ca 0.23 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.82 3iw2 h GLU 93 Cb 0.17 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3iw2 h GLU 93 CO -0.18 0.69 -0.14 0.09 -1.16 0.00 0.00 179.01 178.32 3iw2 n ASN 94 N -4.52 0.92 -0.84 1.42 3.02 -1.26 -5.04 115.26 108.95 3iw2 n ASN 94 Ca 0.04 -1.91 0.11 0.00 -0.03 0.00 0.00 54.58 52.79 3iw2 n ASN 94 Cb 0.11 -0.14 -0.03 0.00 -0.61 0.00 0.00 39.78 39.10 3iw2 n ASN 94 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3iw2 n GLY 95 N -0.40 -1.84 0.00 7.41 0.00 -0.44 -4.67 105.19 105.26 3iw2 n GLY 95 Ca 0.03 -1.30 0.10 0.00 0.00 0.00 0.00 46.02 44.85 3iw2 n GLY 95 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3iw2 n VAL 96 N -3.07 0.00 -2.42 1.61 0.24 -1.25 -4.61 118.33 108.82 3iw2 n VAL 96 Ca -0.00 -0.23 -0.43 0.00 -2.04 0.00 0.00 64.34 61.64 3iw2 n VAL 96 Cb 0.38 0.56 -0.02 0.00 -1.47 0.00 0.00 33.84 33.29 3iw2 n VAL 96 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3iw2 s ILE 97 N -3.16 4.25 -2.35 1.34 1.01 -1.26 -0.24 121.20 120.79 3iw2 s ILE 97 Ca 0.01 1.54 0.25 0.00 0.00 0.00 0.00 60.65 62.44 3iw2 s ILE 97 Cb 0.14 -3.99 0.53 0.00 0.01 0.00 0.00 42.46 39.15 3iw2 s ILE 97 CO 0.85 -0.10 1.68 -0.81 0.00 0.00 0.00 174.94 176.56 3iw2 n PRO 98 N 6.23 1.63 -3.67 2.79 -0.04 -1.26 -4.87 135.00 135.80 3iw2 n PRO 98 Ca 0.13 -0.93 -0.09 0.00 -0.04 0.00 0.00 63.50 62.56 3iw2 n PRO 98 Cb 0.45 -1.44 -0.09 0.00 -0.04 0.00 0.00 33.50 32.39 3iw2 n PRO 98 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 3iw2 s ARG 99 N -1.91 0.54 0.35 0.54 6.06 -1.26 -4.88 118.95 118.40 3iw2 s ARG 99 Ca 0.36 0.95 0.05 0.00 -2.50 0.00 0.00 55.73 54.59 3iw2 s ARG 99 Cb 0.19 0.08 -0.02 0.00 0.06 0.00 0.00 34.95 35.26 3iw2 s ARG 99 CO 0.30 -0.15 0.18 1.19 -2.50 0.00 0.00 175.30 174.32 3iw2 n PHE 100 N 4.11 -0.17 -1.69 5.12 3.72 0.20 -4.80 117.46 123.94 3iw2 n PHE 100 Ca -0.21 -2.48 -0.43 0.00 -0.05 0.00 0.00 57.45 54.29 3iw2 n PHE 100 Cb 0.57 0.09 -0.01 0.00 -0.94 0.00 0.00 39.48 39.19 3iw2 n PHE 100 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3iw2 n LYS 101 N -0.76 2.09 0.29 -1.08 5.02 -1.26 -4.37 118.16 118.09 3iw2 n LYS 101 Ca -0.01 0.73 0.14 0.00 -2.02 0.00 0.00 58.31 57.15 3iw2 n LYS 101 Cb 0.56 -2.31 0.87 0.00 -0.02 0.00 0.00 35.03 34.13 3iw2 n LYS 101 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 3iw2 h ASN 102 N 2.63 0.00 -0.27 4.39 2.35 -1.90 -1.34 115.58 121.44 3iw2 h ASN 102 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 3iw2 h ASN 102 Cb 1.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.65 3iw2 h ASN 102 CO 0.63 0.02 0.00 -0.90 -1.65 0.00 0.00 177.43 175.53 3iw2 n ASP 103 N -3.89 2.53 -4.70 5.81 5.75 -1.26 -4.06 116.55 116.73 3iw2 n ASP 103 Ca -0.03 -1.86 -0.43 0.00 -0.01 0.00 0.00 54.79 52.47 3iw2 n ASP 103 Cb 0.10 -0.17 -0.01 0.00 -1.03 0.00 0.00 41.12 40.01 3iw2 n ASP 103 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3iw2 n ILE 104 N 0.89 1.69 -2.59 2.12 3.06 -0.50 -4.96 119.36 119.06 3iw2 n ILE 104 Ca 0.17 -0.42 -0.37 0.00 -2.50 0.00 0.00 62.75 59.63 3iw2 n ILE 104 Cb 0.46 -1.58 -0.05 0.00 0.54 0.00 0.00 39.64 39.02 3iw2 n ILE 104 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3iw2 s ALA 105 N -0.78 3.16 0.24 1.51 0.00 -1.26 -4.84 121.76 119.79 3iw2 s ALA 105 Ca 0.59 0.69 -0.06 0.00 0.00 0.00 0.00 51.96 53.18 3iw2 s ALA 105 Cb -0.58 -3.26 0.25 0.00 0.00 0.00 0.00 23.12 19.53 3iw2 s ALA 105 CO 0.58 -0.11 1.84 -0.09 0.00 0.00 0.00 175.76 177.98 3iw2 h ARG 106 N 2.85 1.15 -0.97 0.00 9.65 -1.93 -0.28 114.38 124.85 3iw2 h ARG 106 Ca -0.48 -0.17 0.23 0.00 -1.10 0.00 0.00 59.98 58.46 3iw2 h ARG 106 Cb 1.21 -0.21 -0.08 0.00 -1.39 0.00 0.00 29.97 29.50 3iw2 h ARG 106 CO 0.64 0.89 0.63 0.93 2.80 0.00 0.00 179.97 185.85 3iw2 h GLU 107 N 1.14 0.40 0.00 0.20 3.07 -1.98 0.57 114.58 117.97 3iw2 h GLU 107 Ca 0.27 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 59.08 3iw2 h GLU 107 Cb 0.12 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 27.94 3iw2 h GLU 107 CO -0.03 0.26 -0.14 -0.44 -1.40 0.00 0.00 179.01 177.26 3iw2 h ASP 108 N 0.41 0.00 0.03 1.42 5.19 -1.43 -1.96 116.42 120.07 3iw2 h ASP 108 Ca 0.52 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.93 3iw2 h ASP 108 Cb 1.31 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.82 3iw2 h ASP 108 CO -0.22 0.14 -0.02 0.40 -3.12 0.00 0.00 179.24 176.42 3iw2 h ILE 109 N 0.00 0.90 -0.67 0.35 2.04 -0.95 -3.39 117.51 115.79 3iw2 h ILE 109 Ca -0.00 -1.58 0.09 0.00 1.00 0.00 0.00 64.86 64.37 3iw2 h ILE 109 Cb 1.00 1.67 -0.04 0.00 -0.74 0.00 0.00 36.82 38.71 3iw2 h ILE 109 CO 0.02 0.29 0.45 -0.33 0.00 0.00 0.00 178.15 178.58 3iw2 h GLU 110 N -0.98 0.54 0.00 2.37 5.08 -1.03 0.14 114.58 120.69 3iw2 h GLU 110 Ca -0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3iw2 h GLU 110 Cb 0.51 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.64 3iw2 h GLU 110 CO 0.01 0.35 0.00 -0.24 -1.00 0.00 0.00 179.01 178.13 3iw2 h VAL 111 N 0.55 0.00 0.00 3.13 3.04 -1.54 -1.05 116.25 120.39 3iw2 h VAL 111 Ca 0.31 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.91 3iw2 h VAL 111 Cb 0.47 1.04 0.00 0.00 -2.01 0.00 0.00 31.29 30.79 3iw2 h VAL 111 CO -0.10 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.46 3iw2 n GLN 112 N -3.00 0.50 0.00 4.17 6.02 0.04 -2.41 117.38 122.70 3iw2 n GLN 112 Ca -0.02 0.04 0.06 0.00 -0.01 0.00 0.00 57.00 57.07 3iw2 n GLN 112 Cb 0.11 -1.50 0.28 0.00 1.02 0.00 0.00 30.24 30.15 3iw2 n GLN 112 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3iw2 n ARG 113 N -1.18 0.04 0.00 -1.09 1.74 -0.40 -2.87 116.66 112.90 3iw2 n ARG 113 Ca 0.14 0.26 0.14 0.00 -0.77 0.00 0.00 57.85 57.62 3iw2 n ARG 113 Cb 0.15 -1.50 0.52 0.00 -1.02 0.00 0.00 32.46 30.61 3iw2 n ARG 113 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3iw2 n PHE 114 N -1.45 0.00 -3.79 -1.55 3.72 -1.01 -4.51 117.46 108.87 3iw2 n PHE 114 Ca 0.04 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.10 3iw2 n PHE 114 Cb 0.13 -0.25 -0.05 0.00 -0.94 0.00 0.00 39.48 38.38 3iw2 n PHE 114 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 3iw2 s VAL 115 N -2.68 5.32 0.30 -4.37 -7.23 -1.14 -4.87 120.40 105.73 3iw2 s VAL 115 Ca 0.22 0.08 0.05 0.00 -1.81 0.00 0.00 61.98 60.52 3iw2 s VAL 115 Cb 0.19 -3.57 0.29 0.00 0.56 0.00 0.00 36.38 33.86 3iw2 s VAL 115 CO 0.54 0.33 1.78 -0.03 -0.31 0.00 0.00 175.10 177.41 3iw2 h MET 116 N 3.84 0.77 -1.16 4.82 4.05 -1.89 -1.16 114.93 124.20 3iw2 h MET 116 Ca -0.49 -0.05 0.33 0.00 -0.28 0.00 0.00 59.70 59.21 3iw2 h MET 116 Cb 1.19 -0.17 -0.10 0.00 -0.80 0.00 0.00 31.60 31.72 3iw2 h MET 116 CO 0.67 0.51 0.75 1.25 0.23 0.00 0.00 176.91 180.33 3iw2 h LEU 117 N 0.79 0.34 -3.40 3.39 5.85 -1.95 -2.48 115.31 117.86 3iw2 h LEU 117 Ca 0.56 0.10 -0.18 0.00 0.84 0.00 0.00 57.88 59.20 3iw2 h LEU 117 Cb 0.82 0.05 -0.11 0.00 0.37 0.00 0.00 40.66 41.80 3iw2 h LEU 117 CO -0.36 -0.02 -0.00 0.59 -0.34 0.00 0.00 178.44 178.31 3iw2 n ASN 118 N -4.61 2.81 -4.71 1.25 3.02 -0.44 -4.80 115.26 107.77 3iw2 n ASN 118 Ca 0.30 -3.64 -0.25 0.00 -0.03 0.00 0.00 54.58 50.96 3iw2 n ASN 118 Cb 1.11 -0.64 -0.07 0.00 -0.61 0.00 0.00 39.78 39.57 3iw2 n ASN 118 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3iw2 s MET 119 N -3.19 2.56 0.40 3.52 -1.94 -0.94 -3.25 119.30 116.46 3iw2 s MET 119 Ca 0.45 -1.13 0.08 0.00 -1.71 0.00 0.00 55.69 53.38 3iw2 s MET 119 Cb 0.40 -2.40 -0.06 0.00 2.01 0.00 0.00 34.83 34.78 3iw2 s MET 119 CO 0.02 0.43 0.08 -0.51 -0.01 0.00 0.00 175.02 175.03 3iw2 s ASP 120 N -3.32 4.17 0.44 3.03 1.01 -1.26 -4.42 116.67 116.32 3iw2 s ASP 120 Ca 0.30 -1.17 -0.25 0.00 0.71 0.00 0.00 52.55 52.14 3iw2 s ASP 120 Cb -0.08 -0.46 -0.08 0.00 1.01 0.00 0.00 42.92 43.31 3iw2 s ASP 120 CO 0.21 -0.45 1.33 0.00 0.21 0.00 0.00 175.17 176.48 3iw2 s ALA 121 N -2.62 3.18 -1.31 5.23 0.00 -1.26 -1.48 121.76 123.49 3iw2 s ALA 121 Ca 0.38 1.29 0.27 0.00 0.00 0.00 0.00 51.96 53.89 3iw2 s ALA 121 Cb 0.05 -3.52 0.90 0.00 0.00 0.00 0.00 23.12 20.55 3iw2 s ALA 121 CO 0.20 -0.98 1.67 -0.35 0.00 0.00 0.00 175.76 176.30 3iw2 n PRO 122 N -0.15 0.34 -0.10 0.00 -0.04 -1.26 -4.83 135.00 128.96 3iw2 n PRO 122 Ca 0.05 -0.15 -0.13 0.00 -0.04 0.00 0.00 63.50 63.23 3iw2 n PRO 122 Cb 0.44 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.36 3iw2 n PRO 122 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3iw2 h HIS 123 N 0.37 0.85 -0.17 0.54 3.86 -1.88 -2.86 115.15 115.86 3iw2 h HIS 123 Ca 0.00 -0.25 0.04 0.00 -1.16 0.00 0.00 60.37 59.00 3iw2 h HIS 123 Cb 0.46 -0.18 -0.04 0.00 1.06 0.00 0.00 27.41 28.70 3iw2 h HIS 123 CO 0.00 0.99 -0.09 1.25 0.86 0.00 0.00 177.93 180.94 3iw2 h HIS 124 N 0.47 -0.22 -0.52 2.45 -0.00 -1.55 -2.70 115.15 113.08 3iw2 h HIS 124 Ca 0.05 0.02 0.10 0.00 -0.00 0.00 0.00 60.37 60.54 3iw2 h HIS 124 Cb 0.84 0.13 -0.08 0.00 -0.00 0.00 0.00 27.41 28.29 3iw2 h HIS 124 CO 0.07 -0.15 0.05 1.15 -0.00 0.00 0.00 177.93 179.05 3iw2 h THR 125 N -0.08 0.64 -0.38 6.26 2.02 -1.78 0.40 112.91 119.99 3iw2 h THR 125 Ca 0.10 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 3iw2 h THR 125 Cb 0.23 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 3iw2 h THR 125 CO -0.23 0.03 0.13 -0.09 0.37 0.00 0.00 175.52 175.73 3iw2 h ARG 126 N 0.17 0.58 -0.14 6.66 2.43 -1.52 -0.86 114.38 121.70 3iw2 h ARG 126 Ca 0.26 -0.12 -0.21 0.00 -0.81 0.00 0.00 59.98 59.10 3iw2 h ARG 126 Cb 0.39 -0.09 0.01 0.00 -0.42 0.00 0.00 29.97 29.86 3iw2 h ARG 126 CO -0.39 0.58 -0.76 -0.07 -1.51 0.00 0.00 179.97 177.82 3iw2 h LEU 127 N 0.47 0.85 -0.74 3.80 3.38 -1.05 -2.49 115.31 119.53 3iw2 h LEU 127 Ca 0.12 -0.55 -0.04 0.00 0.09 0.00 0.00 57.88 57.50 3iw2 h LEU 127 Cb 0.24 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3iw2 h LEU 127 CO -0.01 1.34 0.32 -0.09 0.09 0.00 0.00 178.44 180.10 3iw2 h ARG 128 N 0.49 1.08 -0.51 1.13 9.65 -0.22 -1.09 114.38 124.92 3iw2 h ARG 128 Ca -0.05 -0.18 0.02 0.00 -1.10 0.00 0.00 59.98 58.67 3iw2 h ARG 128 Cb 1.38 -0.18 -0.03 0.00 -1.39 0.00 0.00 29.97 29.74 3iw2 h ARG 128 CO 0.15 0.87 0.31 -0.22 2.80 0.00 0.00 179.97 183.88 3iw2 h LYS 129 N 1.05 0.61 -0.17 0.20 3.64 -1.08 -1.53 116.57 119.29 3iw2 h LYS 129 Ca 0.25 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.57 3iw2 h LYS 129 Cb 0.17 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3iw2 h LYS 129 CO -0.03 0.40 0.01 0.82 -2.27 0.00 0.00 179.45 178.39 3iw2 h ILE 130 N 0.63 1.24 0.00 2.00 2.04 -1.19 -3.23 117.51 119.00 3iw2 h ILE 130 Ca 0.20 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3iw2 h ILE 130 Cb -0.01 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 3iw2 h ILE 130 CO -0.07 0.24 0.00 0.40 0.00 0.00 0.00 178.15 178.71 3iw2 h ILE 131 N 0.05 0.00 0.00 -0.67 2.04 -1.06 -1.98 117.51 115.89 3iw2 h ILE 131 Ca 0.05 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.49 3iw2 h ILE 131 Cb 0.35 1.29 -0.00 0.00 -0.74 0.00 0.00 36.82 37.72 3iw2 h ILE 131 CO 0.01 0.00 -0.01 0.28 0.00 0.00 0.00 178.15 178.43 3iw2 h SER 132 N 0.00 0.00 -0.94 1.72 0.02 -1.29 -1.75 113.55 111.31 3iw2 h SER 132 Ca 0.00 0.00 0.14 0.00 -0.84 0.00 0.00 61.79 61.09 3iw2 h SER 132 Cb 0.51 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.98 3iw2 h SER 132 CO 0.00 0.01 0.60 0.03 -1.14 0.00 0.00 176.83 176.32 3iw2 h ARG 133 N 0.00 0.77 0.00 3.45 3.08 -1.53 -1.70 114.38 118.45 3iw2 h ARG 133 Ca -0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.00 3iw2 h ARG 133 Cb 0.03 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.90 3iw2 h ARG 133 CO 0.00 0.51 0.00 0.78 -1.07 0.00 0.00 179.97 180.19 3iw2 h GLY 134 N 0.79 0.00 0.00 0.04 0.00 -1.55 -3.33 103.07 99.03 3iw2 h GLY 134 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.81 3iw2 h GLY 134 CO -0.24 0.00 0.00 0.69 0.00 0.00 0.00 176.54 176.99 3iw2 n PHE 135 N -2.42 0.00 -1.61 5.60 3.72 -0.66 -4.61 117.46 117.48 3iw2 n PHE 135 Ca 0.04 -0.32 -0.38 0.00 -0.05 0.00 0.00 57.45 56.74 3iw2 n PHE 135 Cb 0.36 -0.03 0.05 0.00 -0.94 0.00 0.00 39.48 38.91 3iw2 n PHE 135 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3iw2 n THR 136 N -0.32 3.43 0.20 4.37 -2.24 -1.08 -4.74 114.28 113.90 3iw2 n THR 136 Ca 0.00 -0.50 0.10 0.00 -2.27 0.00 0.00 64.05 61.38 3iw2 n THR 136 Cb 0.28 -1.13 0.64 0.00 -2.10 0.00 0.00 70.33 68.02 3iw2 n THR 136 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3iw2 h PRO 137 N 0.64 0.02 -0.18 -0.78 0.11 -1.96 0.14 132.00 129.99 3iw2 h PRO 137 Ca -0.48 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 3iw2 h PRO 137 Cb 1.36 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.46 3iw2 h PRO 137 CO 0.51 0.01 0.02 0.00 -0.21 0.00 0.00 178.00 178.33 3iw2 h ARG 138 N 0.02 0.31 -0.67 1.05 -0.00 -1.98 0.12 114.38 113.23 3iw2 h ARG 138 Ca 0.05 -0.09 -0.04 0.00 -0.50 0.00 0.00 59.98 59.41 3iw2 h ARG 138 Cb 0.19 -0.03 -0.03 0.00 0.00 0.00 0.00 29.97 30.10 3iw2 h ARG 138 CO -0.00 0.49 0.28 0.00 0.00 0.00 0.00 179.97 180.74 3iw2 h ALA 139 N 0.80 1.23 0.16 0.04 0.00 -1.10 -2.32 119.26 118.07 3iw2 h ALA 139 Ca 0.05 -0.17 -0.31 0.00 0.00 0.00 0.00 54.91 54.49 3iw2 h ALA 139 Cb 0.34 -0.27 0.03 0.00 0.00 0.00 0.00 17.79 17.89 3iw2 h ALA 139 CO 0.01 0.57 -1.32 0.28 0.00 0.00 0.00 179.25 178.79 3iw2 h VAL 140 N 0.96 1.30 -0.79 0.00 2.07 -1.28 -3.18 116.25 115.33 3iw2 h VAL 140 Ca 0.23 -2.57 0.16 0.00 0.82 0.00 0.00 66.70 65.33 3iw2 h VAL 140 Cb 0.17 2.82 -0.05 0.00 -1.52 0.00 0.00 31.29 32.70 3iw2 h VAL 140 CO -0.02 0.78 0.53 1.23 0.02 0.00 0.00 177.57 180.10 3iw2 h GLY 141 N 0.35 0.77 2.00 2.17 0.00 -0.52 -1.09 103.07 106.75 3iw2 h GLY 141 Ca -0.21 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.93 3iw2 h GLY 141 CO 0.25 0.05 0.00 3.21 0.00 0.00 0.00 176.54 180.05 3iw2 h ARG 142 N 0.43 0.00 0.00 4.80 3.08 -1.40 -2.44 114.38 118.85 3iw2 h ARG 142 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.44 3iw2 h ARG 142 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.95 3iw2 h ARG 142 CO -0.13 0.00 -0.43 1.28 -1.07 0.00 0.00 179.97 179.62 3iw2 n LEU 143 N -2.64 0.70 -0.08 3.04 4.77 -0.41 -4.46 117.00 117.91 3iw2 n LEU 143 Ca 0.01 0.32 -0.07 0.00 -0.03 0.00 0.00 56.01 56.24 3iw2 n LEU 143 Cb 0.23 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 3iw2 n LEU 143 CO 0.22 -0.08 0.71 -0.74 -1.33 0.00 0.00 177.39 176.17 3iw2 h HIS 144 N 0.00 -0.56 -0.31 -1.77 2.76 -1.48 -2.18 115.15 111.60 3iw2 h HIS 144 Ca 0.00 0.04 -0.09 0.00 -2.20 0.00 0.00 60.37 58.12 3iw2 h HIS 144 Cb 0.72 0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.97 3iw2 h HIS 144 CO 0.00 -0.29 -0.15 -0.44 -1.30 0.00 0.00 177.93 175.75 3iw2 h ASP 145 N -0.18 0.67 -0.46 3.26 3.32 -1.81 -0.00 116.42 121.22 3iw2 h ASP 145 Ca 0.16 -0.41 -0.08 0.00 0.02 0.00 0.00 57.03 56.73 3iw2 h ASP 145 Cb 0.44 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 3iw2 h ASP 145 CO -0.43 0.93 0.01 1.05 -1.72 0.00 0.00 179.24 179.08 3iw2 h GLU 146 N 0.41 0.87 -0.18 3.56 4.11 -1.81 -1.60 114.58 119.94 3iw2 h GLU 146 Ca 0.07 -0.24 -0.15 0.00 0.07 0.00 0.00 59.36 59.10 3iw2 h GLU 146 Cb 0.68 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 3iw2 h GLU 146 CO 0.05 0.87 -0.53 -0.07 0.07 0.00 0.00 179.01 179.39 3iw2 h LEU 147 N 0.81 0.57 -0.51 3.06 3.38 -1.19 -0.62 115.31 120.80 3iw2 h LEU 147 Ca 0.15 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.85 3iw2 h LEU 147 Cb 0.47 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3iw2 h LEU 147 CO 0.02 0.99 0.31 -0.61 0.09 0.00 0.00 178.44 179.25 3iw2 h GLN 148 N 0.40 0.61 -0.46 1.13 4.15 -0.63 0.38 115.11 120.69 3iw2 h GLN 148 Ca 0.01 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.36 3iw2 h GLN 148 Cb 1.06 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.60 3iw2 h GLN 148 CO 0.10 0.40 0.15 1.49 -1.93 0.00 0.00 178.83 179.04 3iw2 h GLU 149 N 0.62 0.71 -0.38 1.69 4.81 -1.17 -1.74 114.58 119.12 3iw2 h GLU 149 Ca 0.20 -0.15 -0.05 0.00 -0.13 0.00 0.00 59.36 59.24 3iw2 h GLU 149 Cb 0.00 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 3iw2 h GLU 149 CO -0.08 0.68 0.06 0.00 -0.73 0.00 0.00 179.01 178.93 3iw2 h ARG 150 N 0.60 0.63 -0.27 1.92 3.08 -0.81 -2.62 114.38 116.91 3iw2 h ARG 150 Ca 0.15 -0.17 0.01 0.00 0.07 0.00 0.00 59.98 60.03 3iw2 h ARG 150 Cb 0.26 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 3iw2 h ARG 150 CO -0.01 0.69 0.17 0.00 -1.07 0.00 0.00 179.97 179.75 3iw2 h ALA 151 N 0.91 0.34 -0.68 0.04 0.00 -0.12 -1.12 119.26 118.62 3iw2 h ALA 151 Ca 0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3iw2 h ALA 151 Cb 0.37 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3iw2 h ALA 151 CO 0.01 -0.21 0.40 1.96 0.00 0.00 0.00 179.25 181.41 3iw2 h GLN 152 N 0.34 0.93 -0.05 0.00 1.08 -1.31 -1.59 115.11 114.51 3iw2 h GLN 152 Ca 0.10 -0.09 -0.17 0.00 -1.45 0.00 0.00 58.65 57.04 3iw2 h GLN 152 Cb -0.02 -0.19 0.01 0.00 -0.05 0.00 0.00 27.48 27.22 3iw2 h GLN 152 CO -0.03 0.66 -0.63 -0.22 -0.95 0.00 0.00 178.83 177.66 3iw2 h LYS 153 N 0.94 0.52 -0.37 1.46 3.64 -1.26 -0.23 116.57 121.27 3iw2 h LYS 153 Ca 0.25 -0.49 0.08 0.00 -1.27 0.00 0.00 60.65 59.21 3iw2 h LYS 153 Cb -0.02 0.12 -0.09 0.00 -0.41 0.00 0.00 32.23 31.84 3iw2 h LYS 153 CO -0.04 1.12 -0.29 0.82 -2.27 0.00 0.00 179.45 178.79 3iw2 h ILE 154 N 0.10 0.28 -0.36 2.00 2.04 -1.16 0.11 117.51 120.52 3iw2 h ILE 154 Ca -0.06 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 3iw2 h ILE 154 Cb 1.30 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 3iw2 h ILE 154 CO 0.13 0.00 0.17 0.00 0.00 0.00 0.00 178.15 178.45 3iw2 h ALA 155 N 0.83 0.47 -0.75 1.87 0.00 -1.28 -1.23 119.26 119.17 3iw2 h ALA 155 Ca 0.17 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 55.06 3iw2 h ALA 155 Cb 0.51 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 3iw2 h ALA 155 CO -0.51 0.03 0.42 0.00 0.00 0.00 0.00 179.25 179.19 3iw2 h ALA 156 N 1.03 1.03 -0.09 0.00 0.00 -0.78 -0.67 119.26 119.78 3iw2 h ALA 156 Ca 0.12 0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 3iw2 h ALA 156 Cb 0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3iw2 h ALA 156 CO -0.02 0.06 -0.68 0.93 0.00 0.00 0.00 179.25 179.55 3iw2 h GLU 157 N 0.73 0.37 -0.34 0.00 5.08 -0.47 -1.98 114.58 117.97 3iw2 h GLU 157 Ca 0.35 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 58.34 3iw2 h GLU 157 Cb 0.29 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 3iw2 h GLU 157 CO -0.22 0.92 -0.14 0.00 -1.00 0.00 0.00 179.01 178.57 3iw2 h ALA 158 N 1.01 0.47 -0.48 3.43 0.00 -0.92 -2.57 119.26 120.19 3iw2 h ALA 158 Ca -0.02 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.60 3iw2 h ALA 158 Cb 1.23 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 3iw2 h ALA 158 CO 0.11 0.36 0.24 0.00 0.00 0.00 0.00 179.25 179.97 3iw2 h ALA 159 N 0.79 0.60 -0.90 0.00 0.00 -0.96 -2.37 119.26 116.42 3iw2 h ALA 159 Ca 0.08 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.08 3iw2 h ALA 159 Cb 0.66 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 3iw2 h ALA 159 CO 0.04 -0.10 0.59 0.00 0.00 0.00 0.00 179.25 179.78 3iw2 h ALA 160 N 1.25 1.54 0.00 0.00 0.00 -1.31 -1.93 119.26 118.80 3iw2 h ALA 160 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3iw2 h ALA 160 Cb 0.10 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3iw2 h ALA 160 CO -0.14 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.43 3iw2 n ALA 161 N -2.40 1.96 0.00 0.00 0.00 -0.92 -4.93 120.51 114.23 3iw2 n ALA 161 Ca 0.14 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.61 3iw2 n ALA 161 Cb 0.22 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.25 3iw2 n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iw2 n GLY 162 N 0.64 1.87 3.61 0.00 0.00 -0.73 -4.82 105.19 105.76 3iw2 n GLY 162 Ca 0.04 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 3iw2 n GLY 162 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iw2 s SER 163 N 0.00 -0.26 0.00 1.61 1.04 -1.26 -1.20 113.70 113.62 3iw2 s SER 163 Ca 0.00 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.89 3iw2 s SER 163 Cb 0.00 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.74 3iw2 s SER 163 CO 0.00 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 173.70 3iw2 n GLY 164 N -0.38 -0.28 3.56 7.32 0.00 -0.43 -4.96 105.19 110.02 3iw2 n GLY 164 Ca -0.08 -1.50 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 3iw2 n GLY 164 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3iw2 s ASP 165 N -4.00 6.08 0.44 1.61 -1.08 -1.26 -0.50 116.67 117.96 3iw2 s ASP 165 Ca 0.00 0.00 0.12 0.00 -0.52 0.00 0.00 52.55 52.15 3iw2 s ASP 165 Cb 0.00 -2.55 0.98 0.00 -1.46 0.00 0.00 42.92 39.89 3iw2 s ASP 165 CO 0.00 -1.81 2.02 0.15 0.52 0.00 0.00 175.17 176.06 3iw2 h PHE 166 N 10.96 0.17 -0.06 -5.34 3.57 -0.75 0.34 116.94 125.84 3iw2 h PHE 166 Ca -0.27 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.22 3iw2 h PHE 166 Cb 1.08 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.76 3iw2 h PHE 166 CO 1.07 0.22 0.02 0.28 -2.23 0.00 0.00 178.31 177.67 3iw2 h VAL 167 N 0.17 1.14 -0.08 1.41 2.07 -1.89 0.17 116.25 119.25 3iw2 h VAL 167 Ca 0.04 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 3iw2 h VAL 167 Cb 0.18 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 3iw2 h VAL 167 CO 0.01 0.11 -0.11 -0.08 0.02 0.00 0.00 177.57 177.52 3iw2 h GLU 168 N -0.07 0.21 0.00 1.57 4.81 -1.75 0.88 114.58 120.23 3iw2 h GLU 168 Ca 0.02 -0.13 -0.05 0.00 -0.13 0.00 0.00 59.36 59.07 3iw2 h GLU 168 Cb 0.16 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3iw2 h GLU 168 CO -0.00 0.69 -0.47 1.96 -0.73 0.00 0.00 179.01 180.46 3iw2 h GLN 169 N -0.25 0.00 0.00 1.92 4.20 -0.30 -3.38 115.11 117.30 3iw2 h GLN 169 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3iw2 h GLN 169 Cb 0.67 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.45 3iw2 h GLN 169 CO 0.03 0.19 -0.65 0.28 -0.67 0.00 0.00 178.83 178.00 3iw2 n VAL 170 N -3.05 0.00 -0.01 -0.54 0.31 0.51 -4.75 118.33 110.80 3iw2 n VAL 170 Ca 0.01 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.24 3iw2 n VAL 170 Cb 0.63 -0.46 -0.14 0.00 -0.91 0.00 0.00 33.84 32.96 3iw2 n VAL 170 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3iw2 h SER 171 N 0.00 0.05 -0.00 4.52 0.02 -0.75 -3.42 113.55 113.98 3iw2 h SER 171 Ca 0.00 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 3iw2 h SER 171 Cb 0.65 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.18 3iw2 h SER 171 CO 0.00 1.10 -0.03 0.00 -1.14 0.00 0.00 176.83 176.76 3iw2 h GLU 173 N -0.68 0.58 -0.57 0.00 4.81 -1.80 -3.30 114.58 113.62 3iw2 h GLU 173 Ca -0.00 -0.40 -0.07 0.00 -0.13 0.00 0.00 59.36 58.76 3iw2 h GLU 173 Cb 0.74 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.16 3iw2 h GLU 173 CO 0.01 1.02 0.09 1.25 -0.73 0.00 0.00 179.01 180.65 3iw2 h LEU 174 N 0.43 0.90 -1.37 1.64 5.85 -1.84 0.10 115.31 121.03 3iw2 h LEU 174 Ca -0.01 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.45 3iw2 h LEU 174 Cb 1.19 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 3iw2 h LEU 174 CO 0.12 0.93 0.38 -0.65 -0.34 0.00 0.00 178.44 178.88 3iw2 h PRO 175 N 0.83 0.81 -0.36 5.25 0.11 -1.79 0.70 132.00 137.54 3iw2 h PRO 175 Ca 0.17 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.17 3iw2 h PRO 175 Cb 0.41 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 3iw2 h PRO 175 CO 0.01 0.55 0.02 -0.07 -0.21 0.00 0.00 178.00 178.30 3iw2 h LEU 176 N 0.83 0.62 -1.32 2.35 3.38 -1.49 -2.25 115.31 117.42 3iw2 h LEU 176 Ca 0.22 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 3iw2 h LEU 176 Cb -0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3iw2 h LEU 176 CO -0.04 0.76 -0.22 1.56 0.09 0.00 0.00 178.44 180.58 3iw2 h GLN 177 N 0.45 0.18 -0.60 1.13 1.08 -0.39 0.37 115.11 117.34 3iw2 h GLN 177 Ca 0.11 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 57.16 3iw2 h GLN 177 Cb 0.44 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.82 3iw2 h GLN 177 CO 0.02 0.40 0.01 0.00 -0.95 0.00 0.00 178.83 178.30 3iw2 h ALA 178 N 1.61 0.80 -0.23 3.87 0.00 -0.76 -0.45 119.26 124.11 3iw2 h ALA 178 Ca 0.03 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 3iw2 h ALA 178 Cb 0.49 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3iw2 h ALA 178 CO 0.03 0.64 -0.16 0.82 0.00 0.00 0.00 179.25 180.58 3iw2 h ILE 179 N 0.94 1.31 -0.93 0.00 2.04 -0.74 -2.43 117.51 117.71 3iw2 h ILE 179 Ca 0.17 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 3iw2 h ILE 179 Cb 0.55 1.66 -0.04 0.00 -0.74 0.00 0.00 36.82 38.24 3iw2 h ILE 179 CO 0.03 0.40 0.54 0.00 0.00 0.00 0.00 178.15 179.11 3iw2 h ALA 180 N 0.69 1.18 -0.09 1.87 0.00 -0.86 -2.67 119.26 119.38 3iw2 h ALA 180 Ca 0.04 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 3iw2 h ALA 180 Cb 0.69 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3iw2 h ALA 180 CO 0.04 0.66 -0.38 0.78 0.00 0.00 0.00 179.25 180.36 3iw2 h GLY 181 N 1.29 0.46 0.43 0.00 0.00 -1.05 -0.55 103.07 103.64 3iw2 h GLY 181 Ca 0.33 -0.63 0.17 0.00 0.00 0.00 0.00 47.33 47.20 3iw2 h GLY 181 CO -0.06 0.56 0.58 -2.00 0.00 0.00 0.00 176.54 175.62 3iw2 h LEU 182 N -0.03 0.57 -0.54 3.11 5.85 -1.44 -2.68 115.31 120.15 3iw2 h LEU 182 Ca -0.02 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3iw2 h LEU 182 Cb 1.02 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.98 3iw2 h LEU 182 CO 0.08 0.26 -0.36 0.18 -0.34 0.00 0.00 178.44 178.26 3iw2 n LEU 183 N -4.56 1.19 -3.19 2.25 4.77 -1.01 -4.36 117.00 112.09 3iw2 n LEU 183 Ca 0.18 -0.35 -0.23 0.00 -0.03 0.00 0.00 56.01 55.58 3iw2 n LEU 183 Cb 0.56 -0.10 0.05 0.00 -2.33 0.00 0.00 43.42 41.60 3iw2 n LEU 183 CO 0.29 0.23 0.08 0.61 -1.33 0.00 0.00 177.39 177.27 3iw2 n GLY 184 N 1.38 -0.52 3.70 -0.72 0.00 -0.68 -4.57 105.19 103.77 3iw2 n GLY 184 Ca 0.11 0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 3iw2 n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iw2 s VAL 185 N -3.23 2.93 0.54 1.61 1.01 -0.30 -4.94 120.40 118.02 3iw2 s VAL 185 Ca 0.40 0.46 -0.20 0.00 0.00 0.00 0.00 61.98 62.63 3iw2 s VAL 185 Cb -0.18 -3.29 -0.07 0.00 0.00 0.00 0.00 36.38 32.84 3iw2 s VAL 185 CO 0.49 0.01 0.90 -2.65 0.00 0.00 0.00 175.10 173.85 3iw2 n PRO 186 N 5.27 0.97 -0.17 2.72 -0.02 -1.26 -4.84 135.00 137.68 3iw2 n PRO 186 Ca 0.16 0.37 0.05 0.00 -2.02 0.00 0.00 63.50 62.05 3iw2 n PRO 186 Cb 0.40 -2.05 0.34 0.00 -0.02 0.00 0.00 33.50 32.16 3iw2 n PRO 186 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3iw2 h GLN 187 N 0.76 0.76 0.00 -0.52 7.50 -1.99 -0.77 115.11 120.86 3iw2 h GLN 187 Ca -0.47 -0.05 -0.02 0.00 0.50 0.00 0.00 58.65 58.62 3iw2 h GLN 187 Cb 1.36 -0.17 -0.00 0.00 0.05 0.00 0.00 27.48 28.72 3iw2 h GLN 187 CO 0.52 0.50 -0.08 0.93 -1.50 0.00 0.00 178.83 179.21 3iw2 h GLU 188 N 0.79 0.00 -0.01 1.46 3.07 -2.03 -2.62 114.58 115.25 3iw2 h GLU 188 Ca 0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 3iw2 h GLU 188 Cb 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 3iw2 h GLU 188 CO -0.08 0.08 -0.67 -0.25 -1.40 0.00 0.00 179.01 176.69 3iw2 n ASP 189 N -3.29 1.19 0.02 1.42 8.00 -0.31 -4.55 116.55 119.02 3iw2 n ASP 189 Ca -0.01 -0.99 -0.06 0.00 0.71 0.00 0.00 54.79 54.44 3iw2 n ASP 189 Cb 0.28 0.60 0.13 0.00 -0.02 0.00 0.00 41.12 42.11 3iw2 n ASP 189 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3iw2 h ARG 190 N 0.83 0.49 -0.61 -1.24 3.08 -1.26 -2.47 114.38 113.19 3iw2 h ARG 190 Ca 0.00 -0.25 0.03 0.00 0.07 0.00 0.00 59.98 59.83 3iw2 h ARG 190 Cb 0.57 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 3iw2 h ARG 190 CO 0.00 0.82 0.37 0.78 -1.07 0.00 0.00 179.97 180.87 3iw2 h GLY 191 N 1.10 0.88 1.74 0.04 0.00 -1.80 -0.27 103.07 104.75 3iw2 h GLY 191 Ca 0.03 -0.28 -0.21 0.00 0.00 0.00 0.00 47.33 46.88 3iw2 h GLY 191 CO 0.08 0.23 -0.91 0.07 0.00 0.00 0.00 176.54 176.00 3iw2 h LYS 192 N 0.73 0.23 -0.30 4.80 2.10 -1.83 -2.10 116.57 120.20 3iw2 h LYS 192 Ca 0.25 -0.26 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3iw2 h LYS 192 Cb 0.03 0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 31.43 3iw2 h LYS 192 CO -0.11 1.00 0.19 1.25 -2.00 0.00 0.00 179.45 179.78 3iw2 h LEU 193 N 0.12 0.35 -0.66 7.07 5.85 -1.12 -1.03 115.31 125.90 3iw2 h LEU 193 Ca -0.05 -0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.55 3iw2 h LEU 193 Cb 1.55 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.47 3iw2 h LEU 193 CO 0.14 0.28 0.10 -0.26 -0.34 0.00 0.00 178.44 178.36 3iw2 h PHE 194 N 0.39 1.17 -0.13 1.25 0.04 -1.00 0.04 116.94 118.70 3iw2 h PHE 194 Ca 0.11 -0.17 0.03 0.00 2.80 0.00 0.00 57.97 60.74 3iw2 h PHE 194 Cb -0.01 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 37.79 3iw2 h PHE 194 CO -0.05 0.99 -0.05 1.25 -0.60 0.00 0.00 178.31 179.85 3iw2 h HIS 195 N 1.02 -0.12 0.44 -0.55 2.76 -1.02 -1.33 115.15 116.34 3iw2 h HIS 195 Ca 0.20 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.36 3iw2 h HIS 195 Cb 0.45 0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.49 3iw2 h HIS 195 CO 0.03 -0.08 -0.22 -1.49 -1.30 0.00 0.00 177.93 174.87 3iw2 h TRP 196 N -0.03 -0.58 -0.98 5.26 6.55 -1.05 -3.00 115.95 122.11 3iw2 h TRP 196 Ca 0.07 -0.01 0.24 0.00 0.95 0.00 0.00 58.89 60.13 3iw2 h TRP 196 Cb 0.14 0.19 -0.08 0.00 -0.86 0.00 0.00 29.16 28.55 3iw2 h TRP 196 CO -0.19 -0.36 0.64 0.77 -1.05 0.00 0.00 178.44 178.26 3iw2 h SER 197 N -0.61 0.44 1.02 -3.49 0.02 -0.89 -0.92 113.55 109.12 3iw2 h SER 197 Ca -0.06 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3iw2 h SER 197 Cb 0.47 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.00 3iw2 h SER 197 CO 0.09 0.13 -0.13 0.59 -1.14 0.00 0.00 176.83 176.37 3iw2 n ASN 198 N -4.57 0.32 -1.14 3.07 3.02 -0.51 -2.97 115.26 112.48 3iw2 n ASN 198 Ca 0.22 0.37 0.12 0.00 -0.03 0.00 0.00 54.58 55.26 3iw2 n ASN 198 Cb 0.79 -0.39 0.21 0.00 -0.61 0.00 0.00 39.78 39.77 3iw2 n ASN 198 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3iw2 n GLU 199 N -1.72 2.49 -0.03 3.52 1.02 -0.36 -4.74 120.64 120.81 3iw2 n GLU 199 Ca 0.06 -2.27 -0.02 0.00 -0.02 0.00 0.00 57.16 54.91 3iw2 n GLU 199 Cb 0.37 -1.51 -0.14 0.00 -0.02 0.00 0.00 31.44 30.14 3iw2 n GLU 199 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 3iw2 n MET 200 N 1.48 0.66 -3.07 3.49 1.56 -1.13 -2.75 117.12 117.36 3iw2 n MET 200 Ca 0.19 0.03 -0.43 0.00 -0.27 0.00 0.00 57.70 57.21 3iw2 n MET 200 Cb 0.60 -1.62 -0.06 0.00 2.15 0.00 0.00 33.22 34.30 3iw2 n MET 200 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 3iw2 s THR 201 N -2.88 4.75 0.51 1.12 -4.23 -1.26 -4.89 115.64 108.77 3iw2 s THR 201 Ca -0.07 -0.16 -0.23 0.00 -1.18 0.00 0.00 61.69 60.05 3iw2 s THR 201 Cb 0.09 -4.33 -0.06 0.00 1.34 0.00 0.00 72.50 69.54 3iw2 s THR 201 CO 0.84 -0.82 1.39 0.61 -0.54 0.00 0.00 174.62 176.11 3iw2 n GLY 202 N 5.12 0.87 3.66 3.99 0.00 -1.26 -5.03 105.19 112.54 3iw2 n GLY 202 Ca -0.03 0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 3iw2 n GLY 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iw2 s ASN 203 N -0.75 -0.17 -0.30 1.61 2.20 -1.26 -5.03 114.94 111.24 3iw2 s ASN 203 Ca 0.68 -0.76 0.08 0.00 -0.94 0.00 0.00 52.86 51.92 3iw2 s ASN 203 Cb -0.43 0.63 0.52 0.00 -2.00 0.00 0.00 41.25 39.97 3iw2 s ASN 203 CO 0.52 -1.19 1.49 -1.84 -2.94 0.00 0.00 177.10 173.14 3iw2 n GLU 204 N -0.40 1.86 -2.50 3.55 0.28 -1.13 -4.97 120.64 117.33 3iw2 n GLU 204 Ca -0.04 -3.19 -0.41 0.00 -0.16 0.00 0.00 57.16 53.36 3iw2 n GLU 204 Cb 0.61 -1.84 -0.04 0.00 1.43 0.00 0.00 31.44 31.60 3iw2 n GLU 204 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 3iw2 s ASP 205 N -2.47 7.24 0.57 -1.84 -1.08 -1.22 -4.93 116.67 112.94 3iw2 s ASP 205 Ca 0.45 2.08 0.31 0.00 -0.52 0.00 0.00 52.55 54.88 3iw2 s ASP 205 Cb 0.41 -2.60 1.73 0.00 -1.46 0.00 0.00 42.92 41.00 3iw2 s ASP 205 CO 0.00 -0.25 2.18 1.55 0.52 0.00 0.00 175.17 179.16 3iw2 h PRO 206 N 5.30 0.00 0.00 4.34 0.13 -1.95 -1.53 132.00 138.28 3iw2 h PRO 206 Ca -0.44 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.68 3iw2 h PRO 206 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 3iw2 h PRO 206 CO 0.73 0.05 -0.07 1.49 -0.23 0.00 0.00 178.00 179.98 3iw2 h GLU 207 N 0.00 0.00 -0.13 0.86 4.81 -2.02 -3.10 114.58 115.00 3iw2 h GLU 207 Ca -0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 3iw2 h GLU 207 Cb 0.18 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3iw2 h GLU 207 CO 0.01 0.07 -0.06 0.66 -0.73 0.00 0.00 179.01 178.95 3iw2 n TYR 208 N -3.30 0.45 0.28 0.92 4.01 -0.59 -4.78 117.16 114.16 3iw2 n TYR 208 Ca -0.01 -1.08 0.16 0.00 -0.16 0.00 0.00 57.90 56.81 3iw2 n TYR 208 Cb 0.25 -0.26 0.80 0.00 -0.31 0.00 0.00 39.34 39.83 3iw2 n TYR 208 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3iw2 h ALA 209 N 0.83 1.12 -0.57 -0.72 0.00 -1.46 -2.24 119.26 116.22 3iw2 h ALA 209 Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3iw2 h ALA 209 Cb 1.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3iw2 h ALA 209 CO 0.12 0.08 0.00 -2.39 0.00 0.00 0.00 179.25 177.07 3iw2 n HIS 210 N -3.34 0.85 -4.24 0.00 1.44 -1.26 -4.93 115.22 103.73 3iw2 n HIS 210 Ca -0.01 -0.40 -0.35 0.00 -2.01 0.00 0.00 57.72 54.95 3iw2 n HIS 210 Cb 0.24 -0.03 -0.08 0.00 0.12 0.00 0.00 29.99 30.23 3iw2 n HIS 210 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3iw2 s ILE 211 N -1.32 4.56 -0.29 0.61 1.01 -0.84 -5.07 121.20 119.85 3iw2 s ILE 211 Ca 0.39 -0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.83 3iw2 s ILE 211 Cb 0.21 -2.97 0.08 0.00 0.01 0.00 0.00 42.46 39.80 3iw2 s ILE 211 CO 0.25 0.55 0.01 -0.62 0.00 0.00 0.00 174.94 175.13 3iw2 s ASP 212 N -1.10 4.30 0.00 3.58 3.68 -1.26 -4.97 116.67 120.90 3iw2 s ASP 212 Ca 0.16 -1.67 0.00 0.00 2.13 0.00 0.00 52.55 53.17 3iw2 s ASP 212 Cb -0.12 -1.32 0.00 0.00 -1.45 0.00 0.00 42.92 40.03 3iw2 s ASP 212 CO 0.05 -0.32 0.00 -2.65 0.13 0.00 0.00 175.17 172.38 3iw2 n PRO 213 N 4.52 0.00 0.09 4.34 -0.02 -1.11 -2.94 135.00 139.88 3iw2 n PRO 213 Ca -0.04 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.31 3iw2 n PRO 213 Cb 0.43 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.82 3iw2 n PRO 213 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3iw2 h LYS 214 N 0.00 -0.21 -0.26 -0.52 1.57 -1.93 -0.83 116.57 114.38 3iw2 h LYS 214 Ca 0.00 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3iw2 h LYS 214 Cb 0.00 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3iw2 h LYS 214 CO 0.00 0.11 0.14 0.00 -0.57 0.00 0.00 179.45 179.13 3iw2 h ALA 215 N 0.21 0.33 -0.69 3.86 0.00 -1.97 -1.65 119.26 119.36 3iw2 h ALA 215 Ca -0.02 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 3iw2 h ALA 215 Cb 0.42 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 3iw2 h ALA 215 CO 0.04 -0.13 0.19 0.77 0.00 0.00 0.00 179.25 180.12 3iw2 h SER 216 N 0.30 1.01 -0.25 0.00 0.02 -1.55 -0.84 113.55 112.24 3iw2 h SER 216 Ca 0.09 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 3iw2 h SER 216 Cb 0.08 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 3iw2 h SER 216 CO -0.01 0.96 0.14 0.28 -1.14 0.00 0.00 176.83 177.05 3iw2 h SER 217 N 1.03 0.31 -0.67 3.07 0.02 -0.96 -0.41 113.55 115.93 3iw2 h SER 217 Ca 0.22 -0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3iw2 h SER 217 Cb 0.33 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 3iw2 h SER 217 CO -0.00 0.30 0.41 0.00 -1.14 0.00 0.00 176.83 176.40 3iw2 h ALA 218 N 1.02 0.86 -0.18 3.77 0.00 -0.87 -0.63 119.26 123.23 3iw2 h ALA 218 Ca 0.09 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 3iw2 h ALA 218 Cb 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3iw2 h ALA 218 CO -0.01 0.33 -0.51 0.93 0.00 0.00 0.00 179.25 179.98 3iw2 h GLU 219 N 0.92 0.50 -0.05 0.00 5.08 -0.97 -0.67 114.58 119.38 3iw2 h GLU 219 Ca 0.24 -0.30 -0.22 0.00 -1.00 0.00 0.00 59.36 58.09 3iw2 h GLU 219 Cb -0.04 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3iw2 h GLU 219 CO -0.05 0.90 -0.86 1.25 -1.00 0.00 0.00 179.01 179.25 3iw2 h LEU 220 N 0.39 0.63 -0.70 1.33 5.85 -0.86 -2.11 115.31 119.83 3iw2 h LEU 220 Ca 0.01 -0.46 -0.12 0.00 0.84 0.00 0.00 57.88 58.16 3iw2 h LEU 220 Cb 1.03 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 3iw2 h LEU 220 CO 0.09 1.24 -0.28 -0.29 -0.34 0.00 0.00 178.44 178.86 3iw2 h ILE 221 N 0.32 1.28 0.17 4.05 2.10 -0.98 0.74 117.51 125.19 3iw2 h ILE 221 Ca -0.06 -1.40 0.01 0.00 1.08 0.00 0.00 64.86 64.49 3iw2 h ILE 221 Cb 1.47 1.32 -0.02 0.00 -1.09 0.00 0.00 36.82 38.50 3iw2 h ILE 221 CO 0.15 0.46 -0.22 1.23 -1.08 0.00 0.00 178.15 178.69 3iw2 h GLY 222 N 0.98 -0.45 0.41 8.18 0.00 -1.08 -0.10 103.07 111.01 3iw2 h GLY 222 Ca 0.08 0.26 0.07 0.00 0.00 0.00 0.00 47.33 47.73 3iw2 h GLY 222 CO 0.06 -0.20 0.02 -1.82 0.00 0.00 0.00 176.54 174.59 3iw2 h TYR 223 N -0.45 0.01 -0.73 5.60 3.20 -1.19 -1.99 116.97 121.42 3iw2 h TYR 223 Ca 0.01 0.03 0.11 0.00 3.14 0.00 0.00 58.73 62.01 3iw2 h TYR 223 Cb 0.44 0.06 -0.08 0.00 1.54 0.00 0.00 36.73 38.69 3iw2 h TYR 223 CO -0.18 -0.06 0.35 0.00 -1.64 0.00 0.00 178.16 176.63 3iw2 h ALA 224 N 1.33 1.01 0.02 1.82 0.00 -0.63 0.73 119.26 123.55 3iw2 h ALA 224 Ca 0.19 0.07 -0.20 0.00 0.00 0.00 0.00 54.91 54.96 3iw2 h ALA 224 Cb 0.26 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3iw2 h ALA 224 CO -0.30 -0.08 -0.93 0.52 0.00 0.00 0.00 179.25 178.46 3iw2 h MET 225 N 0.57 0.15 -0.80 0.00 2.86 -0.86 -1.18 114.93 115.68 3iw2 h MET 225 Ca 0.37 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 3iw2 h MET 225 Cb 0.44 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.12 3iw2 h MET 225 CO -0.30 0.97 0.51 0.87 1.06 0.00 0.00 176.91 180.02 3iw2 h LYS 226 N 0.08 1.06 0.26 1.72 6.56 -1.16 -1.24 116.57 123.85 3iw2 h LYS 226 Ca -0.05 -0.08 -0.01 0.00 -1.06 0.00 0.00 60.65 59.46 3iw2 h LYS 226 Cb 1.59 -0.23 0.00 0.00 -0.57 0.00 0.00 32.23 33.02 3iw2 h LYS 226 CO 0.14 0.72 -0.13 1.98 -2.06 0.00 0.00 179.45 180.10 3iw2 h MET 227 N 1.08 -0.34 -0.69 3.15 -1.53 -0.69 -0.23 114.93 115.67 3iw2 h MET 227 Ca 0.29 0.02 0.10 0.00 -3.44 0.00 0.00 59.70 56.67 3iw2 h MET 227 Cb -0.10 0.08 -0.05 0.00 -0.55 0.00 0.00 31.60 30.99 3iw2 h MET 227 CO -0.06 -0.14 0.46 0.00 0.14 0.00 0.00 176.91 177.31 3iw2 h ALA 228 N 0.21 1.91 0.07 0.39 0.00 -1.24 -2.21 119.26 118.39 3iw2 h ALA 228 Ca -0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3iw2 h ALA 228 Cb 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3iw2 h ALA 228 CO 0.06 -0.06 -0.03 1.05 0.00 0.00 0.00 179.25 180.26 3iw2 h GLU 229 N 0.55 -0.09 -0.09 0.00 4.11 -0.36 -2.82 114.58 115.88 3iw2 h GLU 229 Ca 0.32 0.01 0.02 0.00 0.07 0.00 0.00 59.36 59.78 3iw2 h GLU 229 Cb 0.52 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 3iw2 h GLU 229 CO -0.11 0.11 0.16 1.05 0.07 0.00 0.00 179.01 180.29 3iw2 h GLU 230 N -0.27 0.00 0.00 1.06 4.11 -0.77 -3.51 114.58 115.19 3iw2 h GLU 230 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 3iw2 h GLU 230 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3iw2 h GLU 230 CO 0.02 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.73 3iw2 n LYS 231 N -3.44 3.82 0.00 1.06 4.01 -0.86 -5.10 118.16 117.65 3iw2 n LYS 231 Ca -0.01 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.79 3iw2 n LYS 231 Cb 0.25 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.77 3iw2 n LYS 231 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 3iw2 n ILE 239 N 0.00 0.00 -0.34 -0.18 2.08 -1.26 -4.95 119.36 114.70 3iw2 n ILE 239 Ca 0.00 0.00 0.11 0.00 0.56 0.00 0.00 62.75 63.42 3iw2 n ILE 239 Cb 0.00 0.00 0.23 0.00 -0.75 0.00 0.00 39.64 39.12 3iw2 n ILE 239 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 3iw2 h VAL 240 N 0.00 0.03 0.06 1.39 2.07 -1.82 0.61 116.25 118.58 3iw2 h VAL 240 Ca 0.00 -0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 3iw2 h VAL 240 Cb 0.00 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 29.75 3iw2 h VAL 240 CO 0.00 0.00 -0.28 0.00 0.02 0.00 0.00 177.57 177.31 3iw2 h THR 241 N 0.01 0.38 -0.99 2.57 1.03 -1.97 -1.35 112.91 112.59 3iw2 h THR 241 Ca 0.55 0.00 0.23 0.00 -0.01 0.00 0.00 66.41 67.17 3iw2 h THR 241 Cb 1.02 0.38 -0.09 0.00 -1.07 0.00 0.00 68.15 68.39 3iw2 h THR 241 CO -0.95 0.00 0.63 1.56 -0.01 0.00 0.00 175.52 176.75 3iw2 h GLN 242 N -0.46 0.48 0.23 0.00 4.20 -1.30 0.33 115.11 118.59 3iw2 h GLN 242 Ca 0.05 -0.03 -0.33 0.00 0.06 0.00 0.00 58.65 58.40 3iw2 h GLN 242 Cb 0.52 -0.11 0.03 0.00 0.30 0.00 0.00 27.48 28.22 3iw2 h GLN 242 CO -0.20 0.32 -1.48 -0.07 -0.67 0.00 0.00 178.83 176.72 3iw2 h LEU 243 N 0.50 0.76 0.00 1.46 3.38 -0.69 -3.32 115.31 117.40 3iw2 h LEU 243 Ca 0.56 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3iw2 h LEU 243 Cb 1.25 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.75 3iw2 h LEU 243 CO -0.29 1.67 -0.86 2.30 0.09 0.00 0.00 178.44 181.36 3iw2 n ILE 244 N -3.67 0.07 -2.71 1.22 -5.35 -0.54 -1.79 119.36 106.59 3iw2 n ILE 244 Ca -0.17 -0.10 -0.41 0.00 -0.27 0.00 0.00 62.75 61.80 3iw2 n ILE 244 Cb 1.09 0.43 -0.04 0.00 -1.74 0.00 0.00 39.64 39.38 3iw2 n ILE 244 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 3iw2 s GLN 245 N -3.08 4.65 0.30 6.28 -0.21 0.11 -4.76 119.66 122.95 3iw2 s GLN 245 Ca 0.07 1.47 -0.29 0.00 0.02 0.00 0.00 55.36 56.62 3iw2 s GLN 245 Cb 0.16 -3.39 -0.11 0.00 1.00 0.00 0.00 33.01 30.67 3iw2 s GLN 245 CO 0.79 0.13 1.45 0.00 -2.12 0.00 0.00 175.29 175.54 3iw2 s ALA 246 N 0.24 3.61 -0.18 6.09 0.00 -1.26 -4.62 121.76 125.65 3iw2 s ALA 246 Ca 0.48 1.41 -0.05 0.00 0.00 0.00 0.00 51.96 53.80 3iw2 s ALA 246 Cb -0.23 -3.57 -0.09 0.00 0.00 0.00 0.00 23.12 19.23 3iw2 s ALA 246 CO 0.30 -0.83 -0.20 -0.40 0.00 0.00 0.00 175.76 174.63 3iw2 n ASP 247 N 1.59 1.81 -1.44 0.00 5.75 -1.26 -4.98 116.55 118.02 3iw2 n ASP 247 Ca 0.04 0.10 -0.02 0.00 -0.01 0.00 0.00 54.79 54.90 3iw2 n ASP 247 Cb 0.40 -0.43 0.25 0.00 -1.03 0.00 0.00 41.12 40.31 3iw2 n ASP 247 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3iw2 n GLY 250 N 2.19 4.20 3.68 6.12 0.00 -1.26 -5.13 105.19 114.98 3iw2 n GLY 250 Ca -0.33 -1.09 -0.46 0.00 0.00 0.00 0.00 46.02 44.15 3iw2 n GLY 250 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3iw2 n GLU 251 N -0.62 2.29 -3.74 1.61 -0.58 -1.26 -5.00 120.64 113.34 3iw2 n GLU 251 Ca 0.34 0.83 -0.10 0.00 -0.42 0.00 0.00 57.16 57.81 3iw2 n GLU 251 Cb 1.16 -2.63 -0.05 0.00 -0.57 0.00 0.00 31.44 29.35 3iw2 n GLU 251 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 3iw2 s LYS 252 N 1.63 1.16 0.24 3.49 -2.85 -1.26 -4.41 119.74 117.74 3iw2 s LYS 252 Ca 0.81 -0.86 -0.30 0.00 -1.00 0.00 0.00 55.97 54.63 3iw2 s LYS 252 Cb -0.64 0.46 -0.09 0.00 -2.06 0.00 0.00 37.83 35.50 3iw2 s LYS 252 CO 0.39 -0.46 1.07 -0.51 0.10 0.00 0.00 175.35 175.94 3iw2 s LEU 253 N -2.86 4.56 0.85 2.77 1.43 -0.74 -5.04 118.68 119.65 3iw2 s LEU 253 Ca 0.07 2.16 -0.11 0.00 -1.03 0.00 0.00 54.13 55.22 3iw2 s LEU 253 Cb 0.01 -3.62 0.10 0.00 0.03 0.00 0.00 46.19 42.72 3iw2 s LEU 253 CO -0.07 -0.10 1.09 -0.94 0.23 0.00 0.00 176.35 176.56 3iw2 s SER 254 N -0.73 3.82 0.33 2.29 1.04 -1.26 -4.65 113.70 114.54 3iw2 s SER 254 Ca 0.45 1.66 0.01 0.00 0.48 0.00 0.00 55.95 58.54 3iw2 s SER 254 Cb -0.30 -2.33 0.56 0.00 0.10 0.00 0.00 66.02 64.04 3iw2 s SER 254 CO 0.38 -2.44 1.99 0.44 0.98 0.00 0.00 173.24 174.59 3iw2 h ASP 255 N -1.41 0.81 -0.39 7.02 5.19 -1.97 0.12 116.42 125.79 3iw2 h ASP 255 Ca -0.47 -0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 55.90 3iw2 h ASP 255 Cb 1.26 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 40.55 3iw2 h ASP 255 CO 0.53 0.59 0.17 0.44 -3.12 0.00 0.00 179.24 177.85 3iw2 h ASP 256 N 0.95 0.52 -0.39 6.45 5.19 -1.97 -1.49 116.42 125.68 3iw2 h ASP 256 Ca 0.26 -0.15 -0.00 0.00 -0.62 0.00 0.00 57.03 56.51 3iw2 h ASP 256 Cb -0.10 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.26 3iw2 h ASP 256 CO -0.05 0.53 0.23 -0.33 -3.12 0.00 0.00 179.24 176.50 3iw2 h GLU 257 N 0.48 0.53 -0.57 3.56 5.08 -1.68 0.52 114.58 122.51 3iw2 h GLU 257 Ca 0.13 -0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.52 3iw2 h GLU 257 Cb 0.16 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.24 3iw2 h GLU 257 CO -0.01 0.41 0.23 0.35 -1.00 0.00 0.00 179.01 178.99 3iw2 h PHE 258 N 0.51 0.41 -0.28 4.33 3.57 -0.63 0.24 116.94 125.10 3iw2 h PHE 258 Ca 0.14 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.71 3iw2 h PHE 258 Cb 0.01 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 3iw2 h PHE 258 CO -0.03 0.14 0.01 0.78 -2.23 0.00 0.00 178.31 176.98 3iw2 h GLY 259 N 0.44 0.28 1.16 2.40 0.00 -0.85 -0.46 103.07 106.03 3iw2 h GLY 259 Ca 0.28 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.63 3iw2 h GLY 259 CO -0.25 -0.05 0.55 0.74 0.00 0.00 0.00 176.54 177.53 3iw2 h PHE 260 N 0.10 1.08 0.32 5.60 0.04 -0.38 -1.83 116.94 121.87 3iw2 h PHE 260 Ca 0.13 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.92 3iw2 h PHE 260 Cb 0.17 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 37.93 3iw2 h PHE 260 CO -0.20 0.69 -0.30 0.35 -0.60 0.00 0.00 178.31 178.25 3iw2 h PHE 261 N 1.16 -0.80 -0.58 -0.55 3.57 0.00 -1.61 116.94 118.13 3iw2 h PHE 261 Ca 0.31 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.84 3iw2 h PHE 261 Cb -0.11 0.31 -0.04 0.00 2.79 0.00 0.00 35.95 38.90 3iw2 h PHE 261 CO 0.00 -0.44 0.35 0.28 -2.23 0.00 0.00 178.31 176.28 3iw2 h VAL 262 N -0.65 1.06 -0.84 1.41 2.07 -0.75 -1.71 116.25 116.83 3iw2 h VAL 262 Ca -0.02 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.27 3iw2 h VAL 262 Cb 0.58 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 3iw2 h VAL 262 CO -0.05 0.13 0.54 0.58 0.02 0.00 0.00 177.57 178.79 3iw2 h VAL 263 N 0.69 1.22 -0.41 2.57 2.07 -1.29 -1.59 116.25 119.51 3iw2 h VAL 263 Ca 0.24 -0.44 0.05 0.00 0.82 0.00 0.00 66.70 67.37 3iw2 h VAL 263 Cb 0.04 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 29.77 3iw2 h VAL 263 CO -0.11 0.22 0.14 -0.03 0.02 0.00 0.00 177.57 177.82 3iw2 h MET 264 N 1.15 0.29 -0.49 1.57 -1.53 -0.86 -2.96 114.93 112.10 3iw2 h MET 264 Ca 0.31 -0.02 -0.11 0.00 -3.44 0.00 0.00 59.70 56.43 3iw2 h MET 264 Cb -0.10 -0.07 -0.02 0.00 -0.55 0.00 0.00 31.60 30.87 3iw2 h MET 264 CO -0.06 0.19 -0.14 -0.07 0.14 0.00 0.00 176.91 176.97 3iw2 h LEU 265 N 0.30 0.95 -1.80 3.39 3.38 -0.65 0.30 115.31 121.17 3iw2 h LEU 265 Ca 0.19 -0.32 0.20 0.00 0.09 0.00 0.00 57.88 58.04 3iw2 h LEU 265 Cb 0.18 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 3iw2 h LEU 265 CO -0.20 1.09 0.55 0.00 0.09 0.00 0.00 178.44 179.96 3iw2 h ALA 266 N 0.99 2.48 0.03 1.53 0.00 -1.15 -1.06 119.26 122.08 3iw2 h ALA 266 Ca 0.13 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.73 3iw2 h ALA 266 Cb 0.69 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 3iw2 h ALA 266 CO 0.05 -0.71 -1.61 0.28 0.00 0.00 0.00 179.25 177.26 3iw2 n VAL 267 N -4.39 1.60 -0.32 0.00 0.31 -1.02 -4.23 118.33 110.27 3iw2 n VAL 267 Ca 0.16 -0.24 -0.03 0.00 -0.01 0.00 0.00 64.34 64.22 3iw2 n VAL 267 Cb 0.74 -1.93 0.11 0.00 -0.91 0.00 0.00 33.84 31.85 3iw2 n VAL 267 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3iw2 h ALA 268 N -0.38 1.20 -0.24 3.52 0.00 -0.23 -3.26 119.26 119.87 3iw2 h ALA 268 Ca -0.41 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3iw2 h ALA 268 Cb 1.54 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3iw2 h ALA 268 CO -0.15 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.16 3iw2 n GLY 269 N -1.16 2.91 0.00 0.00 0.00 -0.42 -4.60 105.19 101.92 3iw2 n GLY 269 Ca 0.09 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3iw2 n GLY 269 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3iw2 n ASN 270 N 0.15 0.00 0.00 1.61 5.15 -1.23 -4.39 115.26 116.55 3iw2 n ASN 270 Ca 0.08 0.00 0.08 0.00 -0.60 0.00 0.00 54.58 54.15 3iw2 n ASN 270 Cb 0.39 0.00 0.36 0.00 -0.53 0.00 0.00 39.78 40.01 3iw2 n ASN 270 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3iw2 n GLU 271 N -0.02 0.04 0.27 1.20 1.02 -1.26 -1.97 120.64 119.91 3iw2 n GLU 271 Ca 0.00 0.20 -0.11 0.00 -0.02 0.00 0.00 57.16 57.23 3iw2 n GLU 271 Cb 0.00 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.87 3iw2 n GLU 271 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3iw2 h THR 272 N 0.00 0.00 -0.06 2.62 1.35 -1.81 -2.58 112.91 112.43 3iw2 h THR 272 Ca 0.00 -0.45 -0.15 0.00 -0.55 0.00 0.00 66.41 65.26 3iw2 h THR 272 Cb 0.27 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.67 3iw2 h THR 272 CO 0.00 0.00 -0.62 0.74 -0.25 0.00 0.00 175.52 175.39 3iw2 h THR 273 N -1.19 1.39 -0.46 6.82 2.02 -1.71 -2.58 112.91 117.21 3iw2 h THR 273 Ca -0.08 -2.01 0.09 0.00 0.77 0.00 0.00 66.41 65.18 3iw2 h THR 273 Cb 0.56 2.03 -0.08 0.00 -1.74 0.00 0.00 68.15 68.93 3iw2 h THR 273 CO 0.12 0.59 -0.02 -0.09 0.37 0.00 0.00 175.52 176.50 3iw2 h ARG 274 N 0.17 0.09 0.00 6.66 2.43 -1.48 -2.20 114.38 120.04 3iw2 h ARG 274 Ca -0.01 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 3iw2 h ARG 274 Cb 1.12 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.65 3iw2 h ARG 274 CO 0.09 0.06 -0.21 -0.91 -1.51 0.00 0.00 179.97 177.49 3iw2 h ASN 275 N 0.09 0.00 -0.84 -3.80 2.35 -1.27 0.85 115.58 112.97 3iw2 h ASN 275 Ca 0.23 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.95 3iw2 h ASN 275 Cb 0.34 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.67 3iw2 h ASN 275 CO -0.39 0.21 0.43 0.77 -1.65 0.00 0.00 177.43 176.80 3iw2 h SER 276 N 0.00 1.07 0.05 5.81 4.64 -1.04 -0.92 113.55 123.16 3iw2 h SER 276 Ca -0.00 -0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.20 3iw2 h SER 276 Cb 0.92 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 3iw2 h SER 276 CO 0.03 0.88 -0.03 0.40 -0.87 0.00 0.00 176.83 177.24 3iw2 h ILE 277 N 1.18 1.29 -0.04 0.95 2.04 -0.78 -0.33 117.51 121.82 3iw2 h ILE 277 Ca 0.29 -1.36 0.03 0.00 1.00 0.00 0.00 64.86 64.82 3iw2 h ILE 277 Cb 0.07 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 38.27 3iw2 h ILE 277 CO -0.04 0.33 -0.14 0.74 0.00 0.00 0.00 178.15 179.04 3iw2 h THR 278 N -0.70 0.65 0.00 -0.27 2.02 -0.87 -1.75 112.91 111.99 3iw2 h THR 278 Ca -0.01 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.09 3iw2 h THR 278 Cb 0.59 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 3iw2 h THR 278 CO 0.01 0.00 -0.39 1.56 0.37 0.00 0.00 175.52 177.08 3iw2 h GLN 279 N -0.21 0.00 -0.52 6.66 4.20 -1.25 -0.66 115.11 123.33 3iw2 h GLN 279 Ca 0.06 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 3iw2 h GLN 279 Cb 0.29 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 3iw2 h GLN 279 CO -0.16 0.39 0.19 0.78 -0.67 0.00 0.00 178.83 179.36 3iw2 h GLY 280 N 2.96 0.84 1.60 3.46 0.00 -0.92 -0.04 103.07 110.97 3iw2 h GLY 280 Ca -0.00 -0.47 -0.15 0.00 0.00 0.00 0.00 47.33 46.71 3iw2 h GLY 280 CO 0.05 0.44 -0.55 1.98 0.00 0.00 0.00 176.54 178.46 3iw2 h MET 281 N 0.70 0.42 -0.75 4.80 1.85 -1.11 -1.04 114.93 119.80 3iw2 h MET 281 Ca 0.17 -0.27 0.00 0.00 -0.61 0.00 0.00 59.70 59.00 3iw2 h MET 281 Cb 0.22 0.03 -0.04 0.00 0.43 0.00 0.00 31.60 32.24 3iw2 h MET 281 CO -0.01 0.86 0.48 0.52 -0.40 0.00 0.00 176.91 178.36 3iw2 h MET 282 N 0.33 1.00 -0.88 0.39 2.07 -1.01 -1.04 114.93 115.78 3iw2 h MET 282 Ca 0.01 -0.07 0.00 0.00 -2.07 0.00 0.00 59.70 57.57 3iw2 h MET 282 Cb 1.07 -0.22 -0.04 0.00 -1.87 0.00 0.00 31.60 30.53 3iw2 h MET 282 CO 0.10 0.68 0.55 0.00 1.07 0.00 0.00 176.91 179.31 3iw2 h ALA 283 N 1.26 1.12 -0.55 6.32 0.00 -0.27 -2.14 119.26 124.99 3iw2 h ALA 283 Ca 0.27 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 3iw2 h ALA 283 Cb -0.09 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.32 3iw2 h ALA 283 CO -0.06 0.55 0.08 0.74 0.00 0.00 0.00 179.25 180.56 3iw2 h PHE 284 N 1.20 0.93 -0.12 0.00 0.04 -0.77 -0.89 116.94 117.33 3iw2 h PHE 284 Ca 0.32 -0.11 -0.09 0.00 2.80 0.00 0.00 57.97 60.89 3iw2 h PHE 284 Cb -0.09 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 37.78 3iw2 h PHE 284 CO -0.00 0.81 -0.32 0.00 -0.60 0.00 0.00 178.31 178.20 3iw2 h ALA 285 N 1.24 1.24 0.00 2.45 0.00 -0.90 -2.76 119.26 120.53 3iw2 h ALA 285 Ca 0.17 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 3iw2 h ALA 285 Cb 0.39 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3iw2 h ALA 285 CO 0.01 0.51 -0.65 1.49 0.00 0.00 0.00 179.25 180.61 3iw2 h GLU 286 N 0.21 0.00 -2.31 0.00 4.57 -1.18 -3.40 114.58 112.47 3iw2 h GLU 286 Ca 0.03 0.00 -0.59 0.00 -1.18 0.00 0.00 59.36 57.61 3iw2 h GLU 286 Cb 0.67 0.00 -0.41 0.00 -0.16 0.00 0.00 28.75 28.85 3iw2 h GLU 286 CO 0.05 0.09 -0.74 0.72 -1.18 0.00 0.00 179.01 177.95 3iw2 n HIS 287 N -2.91 2.29 0.25 0.92 8.25 -0.36 -4.97 115.22 118.70 3iw2 n HIS 287 Ca 0.01 -3.98 0.07 0.00 -0.26 0.00 0.00 57.72 53.56 3iw2 n HIS 287 Cb 0.60 -0.46 0.61 0.00 1.12 0.00 0.00 29.99 31.86 3iw2 n HIS 287 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3iw2 h PRO 288 N 4.45 0.00 -0.22 -0.41 0.13 -1.76 -0.23 132.00 133.96 3iw2 h PRO 288 Ca 0.17 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.25 3iw2 h PRO 288 Cb 0.75 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 3iw2 h PRO 288 CO 0.69 0.04 -0.08 -0.44 -0.23 0.00 0.00 178.00 177.98 3iw2 h ASP 289 N 0.00 0.32 -0.29 1.44 3.32 -1.93 -1.46 116.42 117.82 3iw2 h ASP 289 Ca -0.00 -0.06 -0.17 0.00 0.02 0.00 0.00 57.03 56.82 3iw2 h ASP 289 Cb 0.07 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 3iw2 h ASP 289 CO 0.01 0.44 -0.47 1.56 -1.72 0.00 0.00 179.24 179.06 3iw2 h GLN 290 N 0.33 0.82 -0.19 3.56 1.08 -1.38 -2.13 115.11 117.20 3iw2 h GLN 290 Ca 0.07 -0.50 0.01 0.00 -1.45 0.00 0.00 58.65 56.77 3iw2 h GLN 290 Cb 0.35 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.82 3iw2 h GLN 290 CO 0.02 1.14 0.10 2.35 -0.95 0.00 0.00 178.83 181.48 3iw2 h TRP 291 N 0.59 0.19 -0.42 2.96 -0.00 -1.22 0.12 115.95 118.16 3iw2 h TRP 291 Ca 0.02 0.01 0.06 0.00 -0.00 0.00 0.00 58.89 58.98 3iw2 h TRP 291 Cb 1.07 -0.06 -0.05 0.00 -0.00 0.00 0.00 29.16 30.12 3iw2 h TRP 291 CO 0.08 0.11 0.13 0.93 -0.00 0.00 0.00 178.44 179.69 3iw2 h GLU 292 N 0.21 0.28 -0.43 2.65 4.39 -1.23 -0.68 114.58 119.77 3iw2 h GLU 292 Ca 0.07 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.76 3iw2 h GLU 292 Cb 0.00 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 3iw2 h GLU 292 CO -0.04 0.18 0.27 1.25 -1.16 0.00 0.00 179.01 179.51 3iw2 h LEU 293 N 0.29 0.51 -0.53 1.33 5.85 -1.21 -2.94 115.31 118.59 3iw2 h LEU 293 Ca 0.20 -0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.91 3iw2 h LEU 293 Cb 0.21 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 3iw2 h LEU 293 CO -0.22 0.39 0.31 0.22 -0.34 0.00 0.00 178.44 178.81 3iw2 h TYR 294 N 0.57 0.58 -0.18 1.25 3.20 -0.10 -2.02 116.97 120.28 3iw2 h TYR 294 Ca 0.16 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 3iw2 h TYR 294 Cb -0.03 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.04 3iw2 h TYR 294 CO -0.04 0.33 0.06 0.87 -1.64 0.00 0.00 178.16 177.74 3iw2 h LYS 295 N 0.62 0.24 0.22 1.82 1.57 -1.02 0.50 116.57 120.53 3iw2 h LYS 295 Ca 0.22 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 3iw2 h LYS 295 Cb 0.04 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3iw2 h LYS 295 CO -0.10 0.22 -0.11 0.87 -0.57 0.00 0.00 179.45 179.76 3iw2 h LYS 296 N 0.25 -0.29 -0.00 3.15 1.57 -1.30 -3.42 116.57 116.53 3iw2 h LYS 296 Ca 0.06 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3iw2 h LYS 296 Cb 0.08 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3iw2 h LYS 296 CO -0.01 0.06 -0.04 1.33 -0.57 0.00 0.00 179.45 180.22 3iw2 n VAL 297 N -4.98 0.00 -4.15 0.50 0.24 -0.80 -5.04 118.33 104.11 3iw2 n VAL 297 Ca -0.07 -0.48 -0.42 0.00 -2.04 0.00 0.00 64.34 61.33 3iw2 n VAL 297 Cb 0.24 1.06 -0.02 0.00 -1.47 0.00 0.00 33.84 33.65 3iw2 n VAL 297 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3iw2 n ARG 298 N -0.13 -0.42 -1.27 7.34 5.12 0.17 -4.79 116.66 122.69 3iw2 n ARG 298 Ca 0.02 0.05 -0.30 0.00 -1.93 0.00 0.00 57.85 55.69 3iw2 n ARG 298 Cb 0.08 -2.70 0.11 0.00 -1.16 0.00 0.00 32.46 28.79 3iw2 n ARG 298 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3iw2 s PRO 299 N -7.41 1.89 0.52 5.56 0.04 -1.26 -4.88 135.00 129.46 3iw2 s PRO 299 Ca 0.34 0.99 0.29 0.00 0.04 0.00 0.00 61.00 62.66 3iw2 s PRO 299 Cb -0.19 -1.87 1.41 0.00 0.04 0.00 0.00 34.50 33.89 3iw2 s PRO 299 CO 0.96 -1.85 2.03 1.49 0.04 0.00 0.00 177.00 179.67 3iw2 h GLU 300 N -1.27 0.00 0.00 4.56 4.22 -1.88 -2.50 114.58 117.70 3iw2 h GLU 300 Ca -0.46 0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.98 3iw2 h GLU 300 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3iw2 h GLU 300 CO 0.53 0.11 -0.39 0.25 -2.18 0.00 0.00 179.01 177.34 3iw2 n THR 301 N -3.44 0.13 -0.11 0.32 -2.24 -1.26 -4.38 114.28 103.30 3iw2 n THR 301 Ca -0.01 -0.09 -0.11 0.00 -2.27 0.00 0.00 64.05 61.57 3iw2 n THR 301 Cb 0.28 -0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.42 3iw2 n THR 301 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3iw2 h ALA 302 N 2.84 0.43 -0.99 6.98 0.00 -1.05 -3.03 119.26 124.44 3iw2 h ALA 302 Ca 0.00 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.72 3iw2 h ALA 302 Cb 0.58 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 3iw2 h ALA 302 CO 0.00 0.15 0.65 0.00 0.00 0.00 0.00 179.25 180.05 3iw2 h ALA 303 N 0.87 1.28 0.00 0.00 0.00 -1.80 0.93 119.26 120.54 3iw2 h ALA 303 Ca 0.09 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 3iw2 h ALA 303 Cb 0.39 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3iw2 h ALA 303 CO 0.01 0.60 -0.80 -0.44 0.00 0.00 0.00 179.25 178.62 3iw2 h ASP 304 N 1.30 0.00 -0.29 0.00 3.32 -1.83 -0.96 116.42 117.97 3iw2 h ASP 304 Ca 0.38 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.30 3iw2 h ASP 304 Cb -0.09 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3iw2 h ASP 304 CO -0.10 0.80 -0.26 -0.08 -1.72 0.00 0.00 179.24 177.88 3iw2 h GLU 305 N 0.00 0.78 0.06 3.56 4.57 -1.28 -0.97 114.58 121.31 3iw2 h GLU 305 Ca -0.01 -0.34 0.00 0.00 -1.18 0.00 0.00 59.36 57.84 3iw2 h GLU 305 Cb 1.53 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 30.09 3iw2 h GLU 305 CO 0.10 0.96 -0.05 0.82 -1.18 0.00 0.00 179.01 179.66 3iw2 h ILE 306 N 0.67 0.89 -0.39 2.32 2.04 -0.58 -0.84 117.51 121.62 3iw2 h ILE 306 Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 3iw2 h ILE 306 Cb 0.78 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 3iw2 h ILE 306 CO 0.06 0.00 0.24 0.58 0.00 0.00 0.00 178.15 179.04 3iw2 h VAL 307 N -0.12 1.12 -0.36 1.67 2.07 -1.12 0.30 116.25 119.81 3iw2 h VAL 307 Ca 0.00 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.28 3iw2 h VAL 307 Cb 0.11 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 3iw2 h VAL 307 CO -0.01 0.11 0.24 -0.09 0.02 0.00 0.00 177.57 177.84 3iw2 h ARG 308 N 0.52 0.47 -0.42 1.57 2.43 -1.02 0.26 114.38 118.18 3iw2 h ARG 308 Ca 0.14 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.14 3iw2 h ARG 308 Cb -0.03 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 3iw2 h ARG 308 CO -0.03 0.31 -0.30 2.35 -1.51 0.00 0.00 179.97 180.79 3iw2 h TRP 309 N 0.48 1.08 -0.00 2.20 2.91 -0.94 -3.28 115.95 118.39 3iw2 h TRP 309 Ca 0.13 -0.29 -0.21 0.00 1.13 0.00 0.00 58.89 59.65 3iw2 h TRP 309 Cb -0.05 -0.24 -0.00 0.00 -0.51 0.00 0.00 29.16 28.35 3iw2 h TRP 309 CO -0.05 1.10 -0.90 0.00 -1.03 0.00 0.00 178.44 177.56 3iw2 h ALA 310 N 0.87 0.44 -6.48 2.65 0.00 -0.12 -3.48 119.26 113.14 3iw2 h ALA 310 Ca 0.08 -0.71 -0.26 0.00 0.00 0.00 0.00 54.91 54.03 3iw2 h ALA 310 Cb 0.88 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3iw2 h ALA 310 CO 0.08 0.85 -0.51 2.41 0.00 0.00 0.00 179.25 182.08 3iw2 n THR 311 N -3.72 -1.38 -0.31 0.00 -1.04 0.88 -4.79 114.28 103.92 3iw2 n THR 311 Ca -0.05 -0.13 0.05 0.00 -2.04 0.00 0.00 64.05 61.87 3iw2 n THR 311 Cb 0.81 -1.21 0.19 0.00 -1.82 0.00 0.00 70.33 68.31 3iw2 n THR 311 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 3iw2 h PRO 312 N 0.39 0.77 -5.36 -2.82 0.11 -1.84 -3.31 132.00 119.94 3iw2 h PRO 312 Ca -0.32 -0.05 -0.65 0.00 0.11 0.00 0.00 66.00 65.09 3iw2 h PRO 312 Cb 0.66 -0.17 -0.15 0.00 0.11 0.00 0.00 31.00 31.45 3iw2 h PRO 312 CO 0.21 0.51 0.27 0.08 -0.21 0.00 0.00 178.00 178.85 3iw2 s VAL 313 N -6.00 4.67 0.14 3.15 1.01 -1.26 -0.02 120.40 122.09 3iw2 s VAL 313 Ca -0.12 -0.14 -0.14 0.00 0.00 0.00 0.00 61.98 61.58 3iw2 s VAL 313 Cb 0.20 -4.39 0.01 0.00 0.00 0.00 0.00 36.38 32.20 3iw2 s VAL 313 CO 0.79 -0.92 1.62 0.74 0.00 0.00 0.00 175.10 177.33 3iw2 h THR 314 N 5.93 1.25 -2.43 3.92 2.02 -1.17 -3.41 112.91 119.01 3iw2 h THR 314 Ca -0.27 -0.91 -0.09 0.00 0.77 0.00 0.00 66.41 65.92 3iw2 h THR 314 Cb 1.09 0.94 -0.23 0.00 -1.74 0.00 0.00 68.15 68.21 3iw2 h THR 314 CO 1.01 0.32 -0.09 0.00 0.37 0.00 0.00 175.52 177.13 3iw2 s ALA 315 N -5.19 -1.33 0.22 6.16 0.00 -1.23 -0.80 121.76 119.58 3iw2 s ALA 315 Ca -0.13 1.54 0.09 0.00 0.00 0.00 0.00 51.96 53.46 3iw2 s ALA 315 Cb 0.11 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.29 3iw2 s ALA 315 CO 0.79 -0.26 -0.16 -0.06 0.00 0.00 0.00 175.76 176.07 3iw2 s PHE 316 N 0.34 1.87 0.44 0.00 0.08 -1.10 -4.66 117.98 114.95 3iw2 s PHE 316 Ca -0.00 -0.50 0.06 0.00 0.12 0.00 0.00 56.93 56.61 3iw2 s PHE 316 Cb -0.04 -0.86 -0.04 0.00 -0.57 0.00 0.00 43.02 41.51 3iw2 s PHE 316 CO -0.00 0.45 0.14 1.14 -0.10 0.00 0.00 175.22 176.85 3iw2 s GLN 317 N -3.49 2.17 0.12 0.44 -2.07 0.66 -0.64 119.66 116.86 3iw2 s GLN 317 Ca 0.23 -2.00 -0.08 0.00 -1.82 0.00 0.00 55.36 51.69 3iw2 s GLN 317 Cb -0.03 -1.86 -0.01 0.00 -1.09 0.00 0.00 33.01 30.03 3iw2 s GLN 317 CO 0.09 -0.19 0.22 1.03 -1.32 0.00 0.00 175.29 175.12 3iw2 s ARG 318 N -3.90 0.98 -0.11 9.60 1.81 -0.48 -4.43 118.95 122.42 3iw2 s ARG 318 Ca 0.34 -1.08 0.02 0.00 -1.72 0.00 0.00 55.73 53.30 3iw2 s ARG 318 Cb 0.04 0.35 0.01 0.00 -0.45 0.00 0.00 34.95 34.90 3iw2 s ARG 318 CO 0.19 -0.33 -0.19 0.99 -0.68 0.00 0.00 175.30 175.28 3iw2 s THR 319 N -3.92 1.76 0.11 0.02 2.01 -0.22 -0.77 115.64 114.63 3iw2 s THR 319 Ca 0.11 -0.81 -0.31 0.00 0.31 0.00 0.00 61.69 60.99 3iw2 s THR 319 Cb 0.04 -1.57 -0.09 0.00 0.01 0.00 0.00 72.50 70.89 3iw2 s THR 319 CO -0.06 0.49 1.66 0.00 -0.69 0.00 0.00 174.62 176.02 3iw2 s ALA 320 N 0.79 3.73 -0.87 7.40 0.00 -0.50 -0.49 121.76 131.82 3iw2 s ALA 320 Ca -0.10 1.30 0.24 0.00 0.00 0.00 0.00 51.96 53.41 3iw2 s ALA 320 Cb -0.16 -3.68 0.33 0.00 0.00 0.00 0.00 23.12 19.61 3iw2 s ALA 320 CO 0.01 -1.02 1.28 1.28 0.00 0.00 0.00 175.76 177.31 3iw2 n LEU 321 N 5.08 0.60 -3.89 0.00 4.77 0.38 0.19 117.00 124.12 3iw2 n LEU 321 Ca 0.16 -0.01 -0.09 0.00 -0.03 0.00 0.00 56.01 56.04 3iw2 n LEU 321 Cb 0.39 -0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 3iw2 n LEU 321 CO 0.63 0.09 0.25 0.00 -1.33 0.00 0.00 177.39 177.03 3iw2 s ARG 322 N -3.06 1.52 0.34 3.23 1.70 -1.26 -4.76 118.95 116.65 3iw2 s ARG 322 Ca 0.09 -1.08 -0.28 0.00 -0.47 0.00 0.00 55.73 53.99 3iw2 s ARG 322 Cb 0.16 0.51 -0.12 0.00 -0.57 0.00 0.00 34.95 34.93 3iw2 s ARG 322 CO 0.74 -0.65 1.34 -0.25 -1.08 0.00 0.00 175.30 175.40 3iw2 n ASP 323 N -0.37 2.97 -3.69 -2.89 9.92 -1.26 -3.59 116.55 117.63 3iw2 n ASP 323 Ca -0.05 1.20 -0.11 0.00 -0.53 0.00 0.00 54.79 55.31 3iw2 n ASP 323 Cb 0.62 -1.51 -0.11 0.00 -0.64 0.00 0.00 41.12 39.48 3iw2 n ASP 323 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 3iw2 s TYR 324 N -0.98 -0.56 -0.28 1.24 5.04 0.75 -4.90 117.35 117.65 3iw2 s TYR 324 Ca 0.56 1.19 -0.24 0.00 -2.44 0.00 0.00 57.07 56.14 3iw2 s TYR 324 Cb -0.56 0.18 -0.00 0.00 0.35 0.00 0.00 41.96 41.93 3iw2 s TYR 324 CO 0.61 -0.35 0.83 -2.00 -1.34 0.00 0.00 175.55 173.29 3iw2 s GLU 325 N 1.80 4.08 -0.20 4.97 2.12 -1.26 -0.81 118.70 129.40 3iw2 s GLU 325 Ca -0.06 0.79 0.01 0.00 0.36 0.00 0.00 54.97 56.07 3iw2 s GLU 325 Cb -0.10 -3.69 0.04 0.00 0.26 0.00 0.00 34.13 30.64 3iw2 s GLU 325 CO -0.11 -0.62 -0.10 -1.17 -0.54 0.00 0.00 175.26 172.73 3iw2 s LEU 326 N 2.95 2.24 -1.47 2.70 2.96 0.11 -4.77 118.68 123.39 3iw2 s LEU 326 Ca 0.34 -0.88 -0.01 0.00 -0.22 0.00 0.00 54.13 53.36 3iw2 s LEU 326 Cb -0.15 -1.20 0.00 0.00 0.50 0.00 0.00 46.19 45.34 3iw2 s LEU 326 CO 0.10 -0.15 0.21 -1.20 -1.32 0.00 0.00 176.35 173.99 3iw2 n SER 327 N 4.70 0.19 0.00 3.68 7.64 -1.26 -0.66 113.62 127.92 3iw2 n SER 327 Ca -0.14 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.58 3iw2 n SER 327 Cb 0.47 -2.25 0.00 0.00 -1.01 0.00 0.00 64.21 61.41 3iw2 n SER 327 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3iw2 n GLY 328 N -2.30 1.02 3.78 0.23 0.00 -1.26 -5.01 105.19 101.65 3iw2 n GLY 328 Ca -0.31 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.34 3iw2 n GLY 328 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iw2 s VAL 329 N -3.13 5.25 -0.72 1.61 1.01 0.17 -5.03 120.40 119.56 3iw2 s VAL 329 Ca 0.00 0.61 -0.20 0.00 0.00 0.00 0.00 61.98 62.39 3iw2 s VAL 329 Cb 0.00 -3.63 0.10 0.00 0.00 0.00 0.00 36.38 32.85 3iw2 s VAL 329 CO 0.00 0.48 0.92 -1.10 0.00 0.00 0.00 175.10 175.40 3iw2 s GLN 330 N -0.20 3.24 0.10 2.72 -1.52 -1.26 -0.72 119.66 122.02 3iw2 s GLN 330 Ca 0.19 -1.31 -0.30 0.00 -1.95 0.00 0.00 55.36 51.99 3iw2 s GLN 330 Cb -0.14 -4.43 -0.06 0.00 -0.22 0.00 0.00 33.01 28.16 3iw2 s GLN 330 CO 0.07 -1.70 1.05 0.42 -0.25 0.00 0.00 175.29 174.88 3iw2 s ILE 331 N 3.10 4.31 -0.08 1.08 1.01 0.01 -4.94 121.20 125.69 3iw2 s ILE 331 Ca 0.22 1.82 -0.04 0.00 0.00 0.00 0.00 60.65 62.65 3iw2 s ILE 331 Cb -0.16 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 3iw2 s ILE 331 CO 0.03 0.23 0.09 -0.54 0.00 0.00 0.00 174.94 174.76 3iw2 s LYS 332 N 0.31 3.24 -0.16 2.79 -0.14 -1.26 -0.18 119.74 124.33 3iw2 s LYS 332 Ca 0.51 -0.29 -0.23 0.00 -1.36 0.00 0.00 55.97 54.60 3iw2 s LYS 332 Cb -0.26 -3.01 -0.10 0.00 -1.68 0.00 0.00 37.83 32.78 3iw2 s LYS 332 CO 0.31 0.72 0.73 1.17 -0.76 0.00 0.00 175.35 177.52 3iw2 n LYS 333 N 1.78 0.00 0.00 1.68 4.81 -1.24 -1.72 118.16 123.48 3iw2 n LYS 333 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.27 3iw2 n LYS 333 Cb 0.54 -0.77 0.00 0.00 0.02 0.00 0.00 35.03 34.81 3iw2 n LYS 333 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3iw2 n GLY 334 N 1.60 2.52 3.78 3.14 0.00 0.13 -4.96 105.19 111.40 3iw2 n GLY 334 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 3iw2 n GLY 334 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3iw2 s GLN 335 N -0.52 4.37 0.32 1.61 -0.21 -0.70 -4.72 119.66 119.81 3iw2 s GLN 335 Ca 0.00 1.46 -0.21 0.00 0.02 0.00 0.00 55.36 56.63 3iw2 s GLN 335 Cb 0.00 -2.69 -0.09 0.00 1.00 0.00 0.00 33.01 31.22 3iw2 s GLN 335 CO 0.00 0.06 0.84 1.03 -2.12 0.00 0.00 175.29 175.10 3iw2 s ARG 336 N -2.24 4.28 -0.04 2.91 0.52 -1.26 -1.42 118.95 121.69 3iw2 s ARG 336 Ca 0.54 1.00 0.04 0.00 -0.52 0.00 0.00 55.73 56.79 3iw2 s ARG 336 Cb -0.21 -2.59 -0.00 0.00 0.52 0.00 0.00 34.95 32.66 3iw2 s ARG 336 CO 0.27 0.21 -0.18 0.14 0.02 0.00 0.00 175.30 175.76 3iw2 s VAL 337 N -1.81 1.47 -0.21 3.52 -7.23 0.05 -1.06 120.40 115.14 3iw2 s VAL 337 Ca 0.52 -0.74 -0.01 0.00 -1.81 0.00 0.00 61.98 59.94 3iw2 s VAL 337 Cb -0.14 -1.26 0.01 0.00 0.56 0.00 0.00 36.38 35.55 3iw2 s VAL 337 CO 0.19 0.42 -0.12 -0.69 -0.31 0.00 0.00 175.10 174.59 3iw2 s VAL 338 N 0.02 2.62 -0.53 1.32 1.01 0.46 -1.38 120.40 123.92 3iw2 s VAL 338 Ca -0.04 -0.83 -0.21 0.00 0.00 0.00 0.00 61.98 60.91 3iw2 s VAL 338 Cb -0.12 -2.19 0.06 0.00 0.00 0.00 0.00 36.38 34.13 3iw2 s VAL 338 CO 0.02 0.43 0.73 -0.04 0.00 0.00 0.00 175.10 176.24 3iw2 s MET 339 N 1.35 3.17 -0.91 2.72 -1.94 0.19 -0.50 119.30 123.39 3iw2 s MET 339 Ca 0.04 -0.75 -0.18 0.00 -1.71 0.00 0.00 55.69 53.09 3iw2 s MET 339 Cb -0.14 -4.10 0.15 0.00 2.01 0.00 0.00 34.83 32.74 3iw2 s MET 339 CO -0.08 -1.34 1.06 -0.06 -0.01 0.00 0.00 175.02 174.59 3iw2 s PHE 340 N 3.06 3.22 0.40 -0.03 0.08 -0.67 -2.72 117.98 121.31 3iw2 s PHE 340 Ca 0.19 -1.48 0.14 0.00 0.12 0.00 0.00 56.93 55.89 3iw2 s PHE 340 Cb -0.18 -4.20 0.97 0.00 -0.57 0.00 0.00 43.02 39.04 3iw2 s PHE 340 CO 0.13 -1.41 1.88 1.88 -0.10 0.00 0.00 175.22 177.60 3iw2 h TYR 341 N 8.67 0.64 -0.30 0.36 0.05 -1.21 -0.60 116.97 124.57 3iw2 h TYR 341 Ca 0.14 0.02 0.06 0.00 0.05 0.00 0.00 58.73 59.01 3iw2 h TYR 341 Cb 1.03 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 38.55 3iw2 h TYR 341 CO 1.14 0.21 0.21 -0.09 -1.05 0.00 0.00 178.16 178.59 3iw2 h ARG 342 N 0.52 0.12 0.03 4.88 9.65 -1.71 -0.28 114.38 127.59 3iw2 h ARG 342 Ca 0.44 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.31 3iw2 h ARG 342 Cb 0.91 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.47 3iw2 h ARG 342 CO -0.18 0.08 -0.01 1.03 2.80 0.00 0.00 179.97 183.69 3iw2 h SER 343 N 0.12 -0.03 -0.47 -3.80 0.87 -1.41 -3.38 113.55 105.45 3iw2 h SER 343 Ca 0.14 -0.66 0.00 0.00 -1.23 0.00 0.00 61.79 60.04 3iw2 h SER 343 Cb 0.40 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.34 3iw2 h SER 343 CO -0.02 0.76 0.30 0.00 -0.53 0.00 0.00 176.83 177.34 3iw2 h ALA 344 N -0.22 1.63 0.00 6.23 0.00 -1.06 -0.88 119.26 124.97 3iw2 h ALA 344 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3iw2 h ALA 344 Cb 0.68 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3iw2 h ALA 344 CO 0.01 0.33 0.00 0.09 0.00 0.00 0.00 179.25 179.68 3iw2 n ASN 345 N -4.45 0.14 -0.44 0.00 3.02 -0.14 -2.63 115.26 110.76 3iw2 n ASN 345 Ca 0.04 0.54 0.07 0.00 -0.03 0.00 0.00 54.58 55.20 3iw2 n ASN 345 Cb 0.07 -0.57 0.18 0.00 -0.61 0.00 0.00 39.78 38.85 3iw2 n ASN 345 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3iw2 n PHE 346 N -1.66 0.00 -2.24 3.10 3.72 -0.34 -4.96 117.46 115.08 3iw2 n PHE 346 Ca 0.02 -1.26 -0.43 0.00 -0.05 0.00 0.00 57.45 55.73 3iw2 n PHE 346 Cb 0.14 -0.21 -0.02 0.00 -0.94 0.00 0.00 39.48 38.45 3iw2 n PHE 346 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3iw2 s ASP 347 N -3.03 6.29 0.62 4.37 -1.08 -1.08 -4.87 116.67 117.89 3iw2 s ASP 347 Ca 0.35 1.13 0.38 0.00 -0.52 0.00 0.00 52.55 53.90 3iw2 s ASP 347 Cb 0.33 -2.54 2.04 0.00 -1.46 0.00 0.00 42.92 41.30 3iw2 s ASP 347 CO -0.04 -1.41 2.25 -0.33 0.52 0.00 0.00 175.17 176.16 3iw2 h GLU 348 N 10.99 0.00 0.00 4.34 3.07 -1.92 -1.05 114.58 130.01 3iw2 h GLU 348 Ca -0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.56 3iw2 h GLU 348 Cb 1.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.04 3iw2 h GLU 348 CO 1.05 0.02 -0.01 0.39 -1.40 0.00 0.00 179.01 179.06 3iw2 n GLU 349 N -3.27 0.25 -0.05 2.33 1.02 -1.26 -4.26 120.64 115.39 3iw2 n GLU 349 Ca -0.02 0.20 -0.08 0.00 -0.02 0.00 0.00 57.16 57.24 3iw2 n GLU 349 Cb 0.14 -1.78 -0.05 0.00 -0.02 0.00 0.00 31.44 29.72 3iw2 n GLU 349 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3iw2 n VAL 350 N -2.21 0.61 -3.94 2.62 0.31 -0.49 -4.99 118.33 110.23 3iw2 n VAL 350 Ca 0.06 -0.23 -0.35 0.00 -0.01 0.00 0.00 64.34 63.81 3iw2 n VAL 350 Cb 0.42 -0.93 -0.11 0.00 -0.91 0.00 0.00 33.84 32.32 3iw2 n VAL 350 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3iw2 s PHE 351 N -2.21 3.20 0.09 3.52 0.08 -0.67 -5.01 117.98 116.98 3iw2 s PHE 351 Ca -0.14 -0.05 -0.31 0.00 0.12 0.00 0.00 56.93 56.55 3iw2 s PHE 351 Cb 0.04 -2.13 -0.07 0.00 -0.57 0.00 0.00 43.02 40.28 3iw2 s PHE 351 CO 0.24 0.01 1.37 -1.14 -0.10 0.00 0.00 175.22 175.60 3iw2 s GLN 352 N 0.75 4.33 -1.14 0.44 0.74 -1.26 -3.62 119.66 119.90 3iw2 s GLN 352 Ca 0.04 2.02 -0.24 0.00 0.05 0.00 0.00 55.36 57.23 3iw2 s GLN 352 Cb -0.13 -3.31 0.01 0.00 1.10 0.00 0.00 33.01 30.67 3iw2 s GLN 352 CO 0.02 -0.44 0.76 -0.25 -0.55 0.00 0.00 175.29 174.83 3iw2 n ASP 353 N 4.17 -5.07 0.27 6.67 8.00 -1.26 -4.84 116.55 124.48 3iw2 n ASP 353 Ca 0.11 -1.08 0.10 0.00 0.71 0.00 0.00 54.79 54.64 3iw2 n ASP 353 Cb 0.43 -2.91 0.70 0.00 -0.02 0.00 0.00 41.12 39.32 3iw2 n ASP 353 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 3iw2 h PRO 354 N -2.01 0.00 -0.17 -0.24 0.13 -1.89 0.06 132.00 127.87 3iw2 h PRO 354 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 3iw2 h PRO 354 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 3iw2 h PRO 354 CO 0.48 0.02 0.00 1.19 -0.23 0.00 0.00 178.00 179.47 3iw2 n PHE 355 N -4.31 0.23 -3.25 1.56 3.72 -1.26 -4.72 117.46 109.42 3iw2 n PHE 355 Ca -0.03 -0.11 -0.39 0.00 -0.05 0.00 0.00 57.45 56.87 3iw2 n PHE 355 Cb 0.11 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.58 3iw2 n PHE 355 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 3iw2 s THR 356 N -1.77 5.10 -0.29 4.37 2.01 0.01 -5.06 115.64 120.00 3iw2 s THR 356 Ca 0.28 0.93 -0.29 0.00 0.31 0.00 0.00 61.69 62.92 3iw2 s THR 356 Cb 0.15 -3.83 -0.01 0.00 0.01 0.00 0.00 72.50 68.82 3iw2 s THR 356 CO 0.22 0.16 1.43 0.12 -0.69 0.00 0.00 174.62 175.86 3iw2 s PHE 357 N 1.76 2.44 -0.34 4.92 5.36 -1.26 -4.98 117.98 125.87 3iw2 s PHE 357 Ca 0.23 0.73 0.00 0.00 -0.96 0.00 0.00 56.93 56.94 3iw2 s PHE 357 Cb -0.15 -3.99 0.11 0.00 -0.34 0.00 0.00 43.02 38.64 3iw2 s PHE 357 CO 0.09 -2.18 0.13 1.21 -1.46 0.00 0.00 175.22 173.02 3iw2 s ASN 358 N 3.50 3.95 0.00 6.13 2.47 -1.26 -4.93 114.94 124.80 3iw2 s ASN 358 Ca 0.62 -1.92 0.11 0.00 0.42 0.00 0.00 52.86 52.09 3iw2 s ASN 358 Cb -0.19 -0.93 0.54 0.00 -1.45 0.00 0.00 41.25 39.21 3iw2 s ASN 358 CO 0.27 -0.37 1.23 2.30 -3.72 0.00 0.00 177.10 176.80 3iw2 n ILE 359 N 4.48 0.72 -0.96 -5.21 -5.35 -1.26 -0.78 119.36 110.99 3iw2 n ILE 359 Ca 0.01 0.18 0.08 0.00 -0.27 0.00 0.00 62.75 62.75 3iw2 n ILE 359 Cb 0.40 -1.01 0.31 0.00 -1.74 0.00 0.00 39.64 37.61 3iw2 n ILE 359 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3iw2 n LEU 360 N -1.28 4.54 -4.68 7.28 4.77 -1.26 -2.36 117.00 124.02 3iw2 n LEU 360 Ca 0.05 -2.99 -0.46 0.00 -0.03 0.00 0.00 56.01 52.59 3iw2 n LEU 360 Cb 0.08 -0.59 -0.04 0.00 -2.33 0.00 0.00 43.42 40.54 3iw2 n LEU 360 CO 0.08 0.66 1.32 -1.14 -1.33 0.00 0.00 177.39 176.98 3iw2 n ARG 361 N -0.10 2.31 -3.64 3.23 0.63 0.04 -4.95 116.66 114.18 3iw2 n ARG 361 Ca 0.24 0.84 -0.08 0.00 -0.92 0.00 0.00 57.85 57.92 3iw2 n ARG 361 Cb 1.00 -2.65 -0.07 0.00 0.45 0.00 0.00 32.46 31.19 3iw2 n ARG 361 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3iw2 s ASN 362 N 1.91 -0.89 0.98 6.15 2.47 -1.26 -4.43 114.94 119.88 3iw2 s ASN 362 Ca 0.82 1.46 -0.12 0.00 0.42 0.00 0.00 52.86 55.43 3iw2 s ASN 362 Cb -0.64 1.35 0.18 0.00 -1.45 0.00 0.00 41.25 40.69 3iw2 s ASN 362 CO 0.40 -0.24 1.10 -2.16 -3.72 0.00 0.00 177.10 172.49 3iw2 s PRO 363 N 1.44 0.58 -0.47 0.43 0.04 -1.26 -5.06 135.00 130.70 3iw2 s PRO 363 Ca -0.09 0.45 0.06 0.00 0.04 0.00 0.00 61.00 61.47 3iw2 s PRO 363 Cb -0.05 -1.76 0.21 0.00 0.04 0.00 0.00 34.50 32.94 3iw2 s PRO 363 CO -0.16 -2.62 0.49 -1.71 0.04 0.00 0.00 177.00 173.04 3iw2 n ASN 364 N -4.08 0.76 -1.87 6.66 2.85 -1.26 -4.97 115.26 113.34 3iw2 n ASN 364 Ca 0.05 -2.75 -0.09 0.00 -0.11 0.00 0.00 54.58 51.69 3iw2 n ASN 364 Cb 0.58 -0.63 -0.11 0.00 1.24 0.00 0.00 39.78 40.86 3iw2 n ASN 364 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3iw2 n PRO 365 N 1.87 1.71 -1.96 1.20 -0.04 -1.26 -4.95 135.00 131.57 3iw2 n PRO 365 Ca 0.25 -0.78 -0.30 0.00 -0.04 0.00 0.00 63.50 62.63 3iw2 n PRO 365 Cb 0.48 -1.69 0.03 0.00 -0.04 0.00 0.00 33.50 32.27 3iw2 n PRO 365 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 3iw2 s HIS 366 N 0.47 3.45 -0.27 0.54 -3.43 -1.26 -5.00 115.29 109.80 3iw2 s HIS 366 Ca 0.45 1.09 0.09 0.00 -0.80 0.00 0.00 55.06 55.90 3iw2 s HIS 366 Cb 0.22 -2.87 0.47 0.00 -1.43 0.00 0.00 32.58 28.98 3iw2 s HIS 366 CO -0.01 -0.91 1.36 1.33 -2.00 0.00 0.00 174.74 174.51 3iw2 n VAL 367 N -2.83 2.45 0.14 -5.38 0.24 -1.26 -4.68 118.33 107.01 3iw2 n VAL 367 Ca 0.06 -3.11 0.05 0.00 -2.04 0.00 0.00 64.34 59.30 3iw2 n VAL 367 Cb 0.56 -0.40 0.49 0.00 -1.47 0.00 0.00 33.84 33.02 3iw2 n VAL 367 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3iw2 h GLY 368 N 1.15 0.24 -3.29 7.63 0.00 -1.91 -1.68 103.07 105.20 3iw2 h GLY 368 Ca 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.39 3iw2 h GLY 368 CO 0.31 0.11 0.00 0.69 0.00 0.00 0.00 176.54 177.65 3iw2 n PHE 369 N -4.41 1.76 0.00 5.60 3.72 -1.26 -4.74 117.46 118.13 3iw2 n PHE 369 Ca -0.01 -0.65 0.00 0.00 -0.05 0.00 0.00 57.45 56.74 3iw2 n PHE 369 Cb 0.16 -0.37 0.00 0.00 -0.94 0.00 0.00 39.48 38.33 3iw2 n PHE 369 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3iw2 n GLY 370 N 0.92 1.04 3.77 1.37 0.00 -0.63 -1.51 105.19 110.14 3iw2 n GLY 370 Ca 0.27 -1.93 -0.35 0.00 0.00 0.00 0.00 46.02 44.01 3iw2 n GLY 370 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3iw2 s GLY 371 N -0.58 2.66 0.39 -0.02 0.00 -1.26 -4.50 107.32 104.01 3iw2 s GLY 371 Ca 0.00 0.86 -0.27 0.00 0.00 0.00 0.00 44.72 45.31 3iw2 s GLY 371 CO 0.00 1.23 1.42 -0.51 0.00 0.00 0.00 173.10 175.24 3iw2 s THR 372 N -1.73 2.23 -5.00 0.90 -4.23 -1.26 -4.10 115.64 102.45 3iw2 s THR 372 Ca 0.73 0.22 0.00 0.00 -1.18 0.00 0.00 61.69 61.47 3iw2 s THR 372 Cb -0.25 -3.14 0.00 0.00 1.34 0.00 0.00 72.50 70.45 3iw2 s THR 372 CO 0.28 0.05 0.00 0.61 -0.54 0.00 0.00 174.62 175.02 3iw2 n GLY 373 N 0.56 -1.44 0.45 3.99 0.00 -1.26 -3.55 105.19 103.95 3iw2 n GLY 373 Ca 0.02 -1.40 0.31 0.00 0.00 0.00 0.00 46.02 44.95 3iw2 n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iw2 h ALA 374 N 0.00 2.56 -0.34 4.61 0.00 -1.88 -2.36 119.26 121.85 3iw2 h ALA 374 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3iw2 h ALA 374 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3iw2 h ALA 374 CO 0.00 -1.07 0.00 0.72 0.00 0.00 0.00 179.25 178.90 3iw2 n HIS 375 N -4.61 0.44 -1.60 0.00 -0.00 -1.26 -5.01 115.22 103.18 3iw2 n HIS 375 Ca 0.31 -0.35 -0.49 0.00 -0.00 0.00 0.00 57.72 57.19 3iw2 n HIS 375 Cb 1.18 -0.01 -0.05 0.00 -0.00 0.00 0.00 29.99 31.12 3iw2 n HIS 375 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.34 177.32 3iw2 n TYR 376 N 0.88 1.57 -1.35 4.41 9.36 -0.89 -4.63 117.16 126.50 3iw2 n TYR 376 Ca 0.14 0.60 -0.57 0.00 3.32 0.00 0.00 57.90 61.39 3iw2 n TYR 376 Cb 0.46 -2.34 -0.10 0.00 -0.63 0.00 0.00 39.34 36.72 3iw2 n TYR 376 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3iw2 h ILE 378 N 6.91 0.45 -0.57 0.00 2.10 -1.92 -2.91 117.51 121.58 3iw2 h ILE 378 Ca -0.18 -0.11 0.00 0.00 1.08 0.00 0.00 64.86 65.64 3iw2 h ILE 378 Cb 1.38 1.08 0.00 0.00 -1.09 0.00 0.00 36.82 38.19 3iw2 h ILE 378 CO 1.06 0.02 0.00 0.61 -1.08 0.00 0.00 178.15 178.76 3iw2 n GLY 379 N -1.14 1.83 0.25 8.18 0.00 -1.26 -4.60 105.19 108.44 3iw2 n GLY 379 Ca -0.03 -0.67 0.02 0.00 0.00 0.00 0.00 46.02 45.34 3iw2 n GLY 379 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iw2 h ALA 380 N 4.19 0.63 -0.00 4.61 0.00 -1.89 0.23 119.26 127.03 3iw2 h ALA 380 Ca 0.00 0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.94 3iw2 h ALA 380 Cb 0.84 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3iw2 h ALA 380 CO 0.00 -0.41 -0.85 -0.91 0.00 0.00 0.00 179.25 177.08 3iw2 h ASN 381 N 0.08 0.24 -0.62 0.00 2.35 -1.87 0.11 115.58 115.88 3iw2 h ASN 381 Ca 0.35 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3iw2 h ASN 381 Cb 0.58 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.85 3iw2 h ASN 381 CO -0.61 0.98 0.41 0.25 -1.65 0.00 0.00 177.43 176.81 3iw2 h LEU 382 N 0.11 0.71 0.32 1.61 5.85 -1.74 -2.32 115.31 119.85 3iw2 h LEU 382 Ca -0.04 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 3iw2 h LEU 382 Cb 1.46 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.32 3iw2 h LEU 382 CO 0.13 0.52 -0.15 0.00 -0.34 0.00 0.00 178.44 178.60 3iw2 h ALA 383 N 1.22 -0.43 -0.85 1.25 0.00 -0.43 -1.70 119.26 118.33 3iw2 h ALA 383 Ca 0.23 -0.12 0.19 0.00 0.00 0.00 0.00 54.91 55.21 3iw2 h ALA 383 Cb -0.09 0.16 -0.11 0.00 0.00 0.00 0.00 17.79 17.75 3iw2 h ALA 383 CO -0.05 -0.70 0.37 0.00 0.00 0.00 0.00 179.25 178.87 3iw2 h ARG 384 N -0.51 0.42 -0.07 0.00 3.08 -0.96 -0.97 114.38 115.38 3iw2 h ARG 384 Ca -0.04 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 3iw2 h ARG 384 Cb 0.38 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 3iw2 h ARG 384 CO 0.07 0.28 0.03 1.98 -1.07 0.00 0.00 179.97 181.26 3iw2 h MET 385 N 0.44 0.10 -0.70 0.04 4.05 -1.36 -0.69 114.93 116.80 3iw2 h MET 385 Ca 0.51 -0.02 0.13 0.00 -0.28 0.00 0.00 59.70 60.04 3iw2 h MET 385 Cb 0.89 -0.02 -0.09 0.00 -0.80 0.00 0.00 31.60 31.58 3iw2 h MET 385 CO -0.48 0.22 0.27 1.15 0.23 0.00 0.00 176.91 178.29 3iw2 h THR 386 N -0.03 0.69 0.13 -0.77 2.02 -0.84 0.89 112.91 114.99 3iw2 h THR 386 Ca 0.02 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 3iw2 h THR 386 Cb 0.15 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 66.79 3iw2 h THR 386 CO -0.00 0.08 -0.06 0.40 0.37 0.00 0.00 175.52 176.30 3iw2 h ILE 387 N 0.42 0.96 -0.56 3.11 2.04 -1.07 -1.43 117.51 120.98 3iw2 h ILE 387 Ca 0.38 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.84 3iw2 h ILE 387 Cb 0.54 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 3iw2 h ILE 387 CO -0.38 0.09 0.24 0.78 0.00 0.00 0.00 178.15 178.88 3iw2 h ASN 388 N -0.35 0.75 -0.34 1.72 2.35 -0.82 -1.33 115.58 117.57 3iw2 h ASN 388 Ca -0.02 -0.16 -0.03 0.00 -0.55 0.00 0.00 56.30 55.55 3iw2 h ASN 388 Cb 0.28 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 3iw2 h ASN 388 CO 0.03 0.70 0.10 -0.07 -1.65 0.00 0.00 177.43 176.54 3iw2 h LEU 389 N 0.75 0.50 -0.80 1.61 3.38 -0.82 -0.19 115.31 119.73 3iw2 h LEU 389 Ca 0.19 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 3iw2 h LEU 389 Cb 0.17 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3iw2 h LEU 389 CO -0.02 0.58 -0.10 -0.29 0.09 0.00 0.00 178.44 178.70 3iw2 h ILE 390 N 0.40 1.26 0.03 1.22 6.09 -1.11 -2.24 117.51 123.14 3iw2 h ILE 390 Ca 0.11 -1.16 -0.23 0.00 -1.37 0.00 0.00 64.86 62.21 3iw2 h ILE 390 Cb 0.26 1.02 -0.00 0.00 0.47 0.00 0.00 36.82 38.57 3iw2 h ILE 390 CO -0.00 0.40 -0.99 -0.26 -3.07 0.00 0.00 178.15 174.23 3iw2 h PHE 391 N 0.72 0.49 -0.47 2.19 -1.00 -1.10 0.10 116.94 117.88 3iw2 h PHE 391 Ca 0.12 -0.29 0.08 0.00 2.81 0.00 0.00 57.97 60.69 3iw2 h PHE 391 Cb 0.58 -0.05 -0.06 0.00 3.61 0.00 0.00 35.95 40.03 3iw2 h PHE 391 CO 0.03 1.13 0.11 -0.91 -1.61 0.00 0.00 178.31 177.06 3iw2 h ASN 392 N 0.16 0.03 -0.27 2.17 2.35 -1.02 0.46 115.58 119.47 3iw2 h ASN 392 Ca -0.08 0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 3iw2 h ASN 392 Cb 1.64 0.10 -0.02 0.00 0.05 0.00 0.00 38.32 40.09 3iw2 h ASN 392 CO 0.16 0.05 -0.09 0.00 -1.65 0.00 0.00 177.43 175.90 3iw2 h ALA 393 N 1.35 1.11 -0.27 -0.83 0.00 -0.97 0.11 119.26 119.77 3iw2 h ALA 393 Ca 0.23 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3iw2 h ALA 393 Cb 0.29 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3iw2 h ALA 393 CO -0.29 0.55 -0.12 0.28 0.00 0.00 0.00 179.25 179.68 3iw2 h VAL 394 N 0.61 1.30 -0.97 0.00 2.07 -0.70 -0.63 116.25 117.92 3iw2 h VAL 394 Ca 0.11 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.44 3iw2 h VAL 394 Cb 0.52 1.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.76 3iw2 h VAL 394 CO 0.03 0.37 0.62 0.00 0.02 0.00 0.00 177.57 178.62 3iw2 h ALA 395 N 0.74 1.27 -0.11 1.67 0.00 -0.58 0.17 119.26 122.42 3iw2 h ALA 395 Ca 0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3iw2 h ALA 395 Cb 0.62 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3iw2 h ALA 395 CO 0.04 0.66 -0.01 -0.44 0.00 0.00 0.00 179.25 179.50 3iw2 h ASP 396 N 1.33 0.19 0.00 0.00 3.32 -0.63 -3.33 116.42 117.30 3iw2 h ASP 396 Ca 0.35 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3iw2 h ASP 396 Cb -0.12 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.38 3iw2 h ASP 396 CO -0.07 0.47 -1.51 1.41 -1.72 0.00 0.00 179.24 177.82 3iw2 n HIS 397 N -4.79 0.00 -2.99 4.55 8.25 -0.26 -4.69 115.22 115.29 3iw2 n HIS 397 Ca -0.06 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.26 3iw2 n HIS 397 Cb 0.21 -0.27 0.02 0.00 1.12 0.00 0.00 29.99 31.08 3iw2 n HIS 397 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 3iw2 n MET 398 N -1.89 1.00 0.29 -0.41 2.81 0.58 -4.76 117.12 114.73 3iw2 n MET 398 Ca -0.01 -2.81 0.18 0.00 -1.81 0.00 0.00 57.70 53.26 3iw2 n MET 398 Cb 0.44 -1.40 0.82 0.00 -0.71 0.00 0.00 33.22 32.37 3iw2 n MET 398 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 3iw2 h PRO 399 N 2.97 0.00 -0.39 0.03 0.13 -1.66 -3.04 132.00 130.05 3iw2 h PRO 399 Ca 0.01 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.94 3iw2 h PRO 399 Cb 1.03 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.04 3iw2 h PRO 399 CO 0.35 0.02 -0.04 -0.25 -0.23 0.00 0.00 178.00 177.85 3iw2 n ASP 400 N -3.15 2.53 -4.77 1.44 8.00 -1.26 -5.04 116.55 114.30 3iw2 n ASP 400 Ca -0.01 -3.78 -0.41 0.00 0.71 0.00 0.00 54.79 51.31 3iw2 n ASP 400 Cb 0.24 -0.65 -0.02 0.00 -0.02 0.00 0.00 41.12 40.68 3iw2 n ASP 400 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 3iw2 s LEU 401 N -3.26 4.41 -0.01 0.64 0.05 -1.15 -4.69 118.68 114.68 3iw2 s LEU 401 Ca 0.45 2.73 0.01 0.00 0.05 0.00 0.00 54.13 57.38 3iw2 s LEU 401 Cb 0.41 -3.65 -0.00 0.00 -2.05 0.00 0.00 46.19 40.90 3iw2 s LEU 401 CO 0.00 -0.58 -0.05 -0.54 -0.55 0.00 0.00 176.35 174.64 3iw2 s LYS 402 N -1.78 0.39 0.54 1.48 1.02 -0.11 -4.98 119.74 116.30 3iw2 s LYS 402 Ca 0.50 -0.16 -0.20 0.00 0.02 0.00 0.00 55.97 56.12 3iw2 s LYS 402 Cb -0.41 -0.38 -0.05 0.00 -0.52 0.00 0.00 37.83 36.47 3iw2 s LYS 402 CO 0.54 0.09 1.19 -1.25 -0.92 0.00 0.00 175.35 175.00 3iw2 s PRO 403 N -0.06 3.30 -0.21 -1.68 0.04 -1.26 0.25 135.00 135.38 3iw2 s PRO 403 Ca 0.01 1.79 -0.01 0.00 0.04 0.00 0.00 61.00 62.83 3iw2 s PRO 403 Cb -0.02 -2.10 -0.20 0.00 0.04 0.00 0.00 34.50 32.21 3iw2 s PRO 403 CO -0.00 -0.93 -0.02 -0.89 0.04 0.00 0.00 177.00 175.20 3iw2 n ILE 404 N -1.17 1.59 -4.04 0.56 5.41 0.42 -4.70 119.36 117.44 3iw2 n ILE 404 Ca 0.11 -0.60 -0.10 0.00 1.00 0.00 0.00 62.75 63.16 3iw2 n ILE 404 Cb 0.49 -1.53 -0.06 0.00 -0.71 0.00 0.00 39.64 37.83 3iw2 n ILE 404 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3iw2 s SER 405 N -6.70 0.09 0.50 4.38 1.04 -1.10 -5.04 113.70 106.86 3iw2 s SER 405 Ca -0.31 -1.09 -0.23 0.00 0.48 0.00 0.00 55.95 54.81 3iw2 s SER 405 Cb 0.08 0.57 -0.06 0.00 0.10 0.00 0.00 66.02 66.71 3iw2 s SER 405 CO 0.66 -1.12 1.28 0.00 0.98 0.00 0.00 173.24 175.04 3iw2 s ALA 406 N -3.88 2.93 0.42 5.32 0.00 -1.26 -4.27 121.76 121.03 3iw2 s ALA 406 Ca 0.26 1.18 -0.26 0.00 0.00 0.00 0.00 51.96 53.14 3iw2 s ALA 406 Cb 0.01 -3.49 -0.09 0.00 0.00 0.00 0.00 23.12 19.54 3iw2 s ALA 406 CO 0.11 -1.06 1.41 -2.14 0.00 0.00 0.00 175.76 174.09 3iw2 s PRO 407 N -2.76 3.84 -0.28 0.00 0.02 -1.26 -4.65 135.00 129.90 3iw2 s PRO 407 Ca 0.67 2.39 -0.14 0.00 0.02 0.00 0.00 61.00 63.94 3iw2 s PRO 407 Cb -0.36 -2.75 -0.04 0.00 0.02 0.00 0.00 34.50 31.38 3iw2 s PRO 407 CO 0.43 -0.68 0.32 -1.21 -0.33 0.00 0.00 177.00 175.53 3iw2 s GLU 408 N -2.32 3.93 0.37 5.54 2.02 -0.66 -5.02 118.70 122.56 3iw2 s GLU 408 Ca 0.58 -0.13 -0.17 0.00 0.02 0.00 0.00 54.97 55.28 3iw2 s GLU 408 Cb -0.43 -3.68 -0.10 0.00 0.10 0.00 0.00 34.13 30.03 3iw2 s GLU 408 CO 0.56 -0.28 0.82 1.03 0.02 0.00 0.00 175.26 177.41 3iw2 s ARG 409 N 1.97 4.08 0.07 1.61 0.52 -1.26 -0.32 118.95 125.62 3iw2 s ARG 409 Ca 0.12 0.84 -0.25 0.00 -0.52 0.00 0.00 55.73 55.92 3iw2 s ARG 409 Cb -0.16 -2.33 -0.06 0.00 0.52 0.00 0.00 34.95 32.92 3iw2 s ARG 409 CO 0.10 0.07 0.78 -1.17 0.02 0.00 0.00 175.30 175.10 3iw2 s LEU 410 N -3.10 4.47 -0.93 2.53 2.96 -0.38 -4.68 118.68 119.56 3iw2 s LEU 410 Ca 0.57 1.49 -0.24 0.00 -0.22 0.00 0.00 54.13 55.73 3iw2 s LEU 410 Cb -0.10 -3.26 0.02 0.00 0.50 0.00 0.00 46.19 43.35 3iw2 s LEU 410 CO 0.16 0.04 1.57 -0.60 -1.32 0.00 0.00 176.35 176.21 3iw2 s ARG 411 N -0.22 3.22 -0.08 1.98 3.52 -1.26 -3.91 118.95 122.21 3iw2 s ARG 411 Ca 0.38 -0.69 -0.09 0.00 -0.13 0.00 0.00 55.73 55.21 3iw2 s ARG 411 Cb -0.21 -5.06 0.02 0.00 -1.56 0.00 0.00 34.95 28.14 3iw2 s ARG 411 CO 0.24 -2.52 0.24 0.45 -0.81 0.00 0.00 175.30 172.89 3iw2 s SER 412 N 5.76 -0.22 0.00 -2.12 0.15 -1.26 -2.83 113.70 113.17 3iw2 s SER 412 Ca 0.52 0.38 0.22 0.00 0.70 0.00 0.00 55.95 57.77 3iw2 s SER 412 Cb -0.04 0.45 0.57 0.00 -1.71 0.00 0.00 66.02 65.30 3iw2 s SER 412 CO -0.02 -0.15 1.48 0.61 1.20 0.00 0.00 173.24 176.36 3iw2 n GLY 413 N 2.65 2.02 0.00 9.45 0.00 -1.26 -4.48 105.19 113.57 3iw2 n GLY 413 Ca -0.14 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.15 3iw2 n GLY 413 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 3iw2 n TRP 414 N 1.46 0.00 -3.64 1.61 4.27 -1.26 -4.59 117.44 115.28 3iw2 n TRP 414 Ca 0.22 0.00 -0.36 0.00 -3.89 0.00 0.00 57.50 53.47 3iw2 n TRP 414 Cb 0.57 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.45 3iw2 n TRP 414 CO 0.00 0.00 0.00 -1.17 -2.29 0.00 0.00 177.69 174.23 3iw2 s LEU 415 N -0.83 4.20 -0.86 5.67 2.96 -1.26 -1.04 118.68 127.52 3iw2 s LEU 415 Ca 0.00 0.31 -0.19 0.00 -0.22 0.00 0.00 54.13 54.04 3iw2 s LEU 415 Cb 0.00 -2.20 0.13 0.00 0.50 0.00 0.00 46.19 44.62 3iw2 s LEU 415 CO 0.00 0.13 1.04 0.21 -1.32 0.00 0.00 176.35 176.40 3iw2 s ASN 416 N 0.53 6.56 0.11 3.68 2.47 0.97 -4.54 114.94 124.72 3iw2 s ASN 416 Ca 0.11 -1.95 0.11 0.00 0.42 0.00 0.00 52.86 51.54 3iw2 s ASN 416 Cb -0.12 -2.37 -0.04 0.00 -1.45 0.00 0.00 41.25 37.27 3iw2 s ASN 416 CO 0.01 -1.05 -0.27 -0.83 -3.72 0.00 0.00 177.10 171.24 3iw2 s GLY 417 N 3.48 1.54 -0.20 1.21 0.00 -1.26 -4.71 107.32 107.37 3iw2 s GLY 417 Ca 0.28 -1.43 0.02 0.00 0.00 0.00 0.00 44.72 43.59 3iw2 s GLY 417 CO -0.06 -1.39 -0.17 -0.42 0.00 0.00 0.00 173.10 171.06 3iw2 s ILE 418 N -1.01 2.09 0.04 0.90 -1.09 -1.26 -1.25 121.20 119.61 3iw2 s ILE 418 Ca 0.13 -1.14 -0.18 0.00 -2.23 0.00 0.00 60.65 57.23 3iw2 s ILE 418 Cb -0.10 -1.98 -0.18 0.00 -1.58 0.00 0.00 42.46 38.62 3iw2 s ILE 418 CO 0.05 0.38 1.23 0.11 -1.23 0.00 0.00 174.94 175.47 3iw2 h LYS 419 N 7.89 0.51 -3.21 2.79 1.57 -0.95 -3.47 116.57 121.70 3iw2 h LYS 419 Ca -0.38 -0.41 -0.11 0.00 -1.87 0.00 0.00 60.65 57.87 3iw2 h LYS 419 Cb 1.11 0.09 -0.19 0.00 0.08 0.00 0.00 32.23 33.32 3iw2 h LYS 419 CO 0.59 1.04 -0.29 -1.01 -0.57 0.00 0.00 179.45 179.21 3iw2 s HIS 420 N -3.68 -0.11 -0.29 -1.35 3.76 -1.23 -4.76 115.29 107.62 3iw2 s HIS 420 Ca -0.13 0.08 -0.02 0.00 -0.15 0.00 0.00 55.06 54.84 3iw2 s HIS 420 Cb 0.05 0.07 0.18 0.00 1.11 0.00 0.00 32.58 34.00 3iw2 s HIS 420 CO 0.82 -0.42 0.58 -0.46 -0.85 0.00 0.00 174.74 174.41 3iw2 s TRP 421 N -1.87 -1.52 -0.25 1.40 -0.00 -1.26 -1.66 118.94 113.78 3iw2 s TRP 421 Ca -0.10 1.69 -0.27 0.00 -0.00 0.00 0.00 56.10 57.42 3iw2 s TRP 421 Cb -0.03 0.54 0.00 0.00 -0.00 0.00 0.00 33.47 33.98 3iw2 s TRP 421 CO 0.01 -0.85 0.93 -1.14 -0.00 0.00 0.00 176.95 175.90 3iw2 s GLN 422 N 2.83 4.19 0.08 5.86 2.00 -1.26 0.04 119.66 133.40 3iw2 s GLN 422 Ca 0.18 1.09 0.03 0.00 -2.00 0.00 0.00 55.36 54.67 3iw2 s GLN 422 Cb -0.15 -3.66 -0.03 0.00 0.80 0.00 0.00 33.01 29.97 3iw2 s GLN 422 CO -0.20 -0.60 -0.09 0.14 -0.50 0.00 0.00 175.29 174.03 3iw2 s VAL 423 N 3.05 0.81 -0.49 1.34 -7.23 0.35 -0.43 120.40 117.80 3iw2 s VAL 423 Ca 0.39 -1.46 -0.16 0.00 -1.81 0.00 0.00 61.98 58.94 3iw2 s VAL 423 Cb -0.15 -1.13 0.08 0.00 0.56 0.00 0.00 36.38 35.74 3iw2 s VAL 423 CO 0.08 -0.50 0.44 -0.62 -0.31 0.00 0.00 175.10 174.19 3iw2 s ASP 424 N -2.16 6.16 0.37 4.85 3.68 0.14 -1.31 116.67 128.40 3iw2 s ASP 424 Ca 0.01 -1.32 0.11 0.00 2.13 0.00 0.00 52.55 53.47 3iw2 s ASP 424 Cb -0.05 -2.20 0.73 0.00 -1.45 0.00 0.00 42.92 39.95 3iw2 s ASP 424 CO -0.00 -0.71 1.86 1.88 0.13 0.00 0.00 175.17 178.33 3iw2 h TYR 425 N 8.81 0.13 -0.02 -5.34 0.05 -1.41 -0.27 116.97 118.92 3iw2 h TYR 425 Ca -0.28 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.47 3iw2 h TYR 425 Cb 1.11 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.81 3iw2 h TYR 425 CO 0.66 0.39 0.00 0.25 -1.05 0.00 0.00 178.16 178.41