#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ioy s LYS 2 N 0.00 4.22 0.38 1.96 0.00 -1.26 -4.76 119.74 120.28 3ioy s LYS 2 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 55.97 56.06 3ioy s LYS 2 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 37.83 34.36 3ioy s LYS 2 CO 0.00 0.14 0.00 -0.40 0.00 0.00 0.00 175.35 175.09 3ioy n ASP 3 N 3.91 -9.70 -0.01 0.03 5.68 -1.26 -4.96 116.55 110.24 3ioy n ASP 3 Ca -0.11 1.40 0.11 0.00 -0.50 0.00 0.00 54.79 55.69 3ioy n ASP 3 Cb 0.52 -5.27 -0.16 0.00 -1.14 0.00 0.00 41.12 35.06 3ioy n ASP 3 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3ioy n PHE 4 N 0.70 0.02 -1.67 2.11 0.99 -1.26 -4.92 117.46 113.43 3ioy n PHE 4 Ca 0.00 0.01 -0.45 0.00 -0.00 0.00 0.00 57.45 57.01 3ioy n PHE 4 Cb 0.00 -0.49 -0.03 0.00 -1.00 0.00 0.00 39.48 37.96 3ioy n PHE 4 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3ioy n ALA 5 N -2.23 1.15 -0.92 4.37 0.00 -1.22 -1.55 120.51 120.10 3ioy n ALA 5 Ca -0.04 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.82 3ioy n ALA 5 Cb 0.56 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.73 3ioy n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ioy n GLY 6 N 2.26 0.51 3.87 0.00 0.00 -1.18 -5.00 105.19 105.64 3ioy n GLY 6 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3ioy n GLY 6 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ioy s ARG 7 N -0.48 3.84 -0.15 1.61 0.52 -0.60 -4.95 118.95 118.74 3ioy s ARG 7 Ca 0.00 0.34 -0.04 0.00 -0.52 0.00 0.00 55.73 55.50 3ioy s ARG 7 Cb 0.00 -2.64 -0.03 0.00 0.52 0.00 0.00 34.95 32.80 3ioy s ARG 7 CO 0.00 0.31 -0.01 0.99 0.02 0.00 0.00 175.30 176.61 3ioy s THR 8 N -1.81 4.12 0.10 0.02 2.01 -1.26 -1.57 115.64 117.25 3ioy s THR 8 Ca 0.47 -0.28 0.09 0.00 0.31 0.00 0.00 61.69 62.28 3ioy s THR 8 Cb -0.11 -2.81 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 3ioy s THR 8 CO 0.21 0.50 -0.20 0.00 -0.69 0.00 0.00 174.62 174.43 3ioy s ALA 9 N 0.23 2.59 -0.14 7.40 0.00 0.68 -1.49 121.76 131.03 3ioy s ALA 9 Ca -0.01 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 50.62 3ioy s ALA 9 Cb -0.13 -0.61 0.02 0.00 0.00 0.00 0.00 23.12 22.40 3ioy s ALA 9 CO 0.02 0.58 -0.12 0.12 0.00 0.00 0.00 175.76 176.36 3ioy s PHE 10 N -1.06 1.96 -0.19 0.00 5.36 -0.18 0.06 117.98 123.93 3ioy s PHE 10 Ca 0.16 -1.08 0.01 0.00 -0.96 0.00 0.00 56.93 55.06 3ioy s PHE 10 Cb -0.10 -1.48 0.03 0.00 -0.34 0.00 0.00 43.02 41.12 3ioy s PHE 10 CO 0.08 -0.62 -0.14 0.08 -1.46 0.00 0.00 175.22 173.15 3ioy s VAL 11 N 1.55 1.80 0.29 3.12 1.01 -0.47 -1.22 120.40 126.48 3ioy s VAL 11 Ca 0.05 -0.97 -0.09 0.00 0.00 0.00 0.00 61.98 60.97 3ioy s VAL 11 Cb -0.13 -1.76 -0.07 0.00 0.00 0.00 0.00 36.38 34.42 3ioy s VAL 11 CO -0.10 0.32 0.62 0.42 0.00 0.00 0.00 175.10 176.36 3ioy s THR 12 N 1.36 4.89 -1.46 3.92 -4.23 -0.42 -0.69 115.64 119.02 3ioy s THR 12 Ca 0.01 0.47 -0.07 0.00 -1.18 0.00 0.00 61.69 60.92 3ioy s THR 12 Cb -0.15 -3.67 0.03 0.00 1.34 0.00 0.00 72.50 70.06 3ioy s THR 12 CO -0.10 -0.23 0.60 0.61 -0.54 0.00 0.00 174.62 174.96 3ioy n GLY 13 N -0.58 -0.51 0.05 3.99 0.00 0.10 -2.98 105.19 105.26 3ioy n GLY 13 Ca 0.01 0.12 0.15 0.00 0.00 0.00 0.00 46.02 46.30 3ioy n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ioy n GLY 14 N -1.43 -1.11 0.06 -0.02 0.00 -1.05 -3.87 105.19 97.78 3ioy n GLY 14 Ca -0.07 -0.20 -0.07 0.00 0.00 0.00 0.00 46.02 45.68 3ioy n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ioy h ALA 15 N 3.57 0.35 -2.14 4.61 0.00 -1.86 -3.13 119.26 120.67 3ioy h ALA 15 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 53.99 3ioy h ALA 15 Cb 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3ioy h ALA 15 CO 0.00 1.25 0.00 0.27 0.00 0.00 0.00 179.25 180.77 3ioy n ASN 16 N -3.35 0.00 0.00 0.00 2.04 -1.26 -4.61 115.26 108.08 3ioy n ASN 16 Ca -0.01 -0.86 0.00 0.00 -0.44 0.00 0.00 54.58 53.27 3ioy n ASN 16 Cb 0.94 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 38.19 3ioy n ASN 16 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3ioy n GLY 17 N 0.00 2.05 0.38 4.83 0.00 -1.26 -2.34 105.19 108.84 3ioy n GLY 17 Ca 0.00 -0.50 0.16 0.00 0.00 0.00 0.00 46.02 45.68 3ioy n GLY 17 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ioy h VAL 18 N 0.00 0.69 -0.41 1.61 2.07 -1.92 -2.71 116.25 115.59 3ioy h VAL 18 Ca 0.00 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.32 3ioy h VAL 18 Cb 0.00 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 29.80 3ioy h VAL 18 CO 0.00 0.11 0.27 1.23 0.02 0.00 0.00 177.57 179.20 3ioy h GLY 19 N 0.59 0.57 1.68 2.17 0.00 -1.57 -1.22 103.07 105.29 3ioy h GLY 19 Ca 0.53 -0.22 -0.11 0.00 0.00 0.00 0.00 47.33 47.54 3ioy h GLY 19 CO -0.28 0.21 -0.35 1.19 0.00 0.00 0.00 176.54 177.32 3ioy h ILE 20 N 0.55 1.29 -0.57 2.60 6.09 -1.41 -1.54 117.51 124.52 3ioy h ILE 20 Ca 0.15 -1.42 -0.02 0.00 -1.37 0.00 0.00 64.86 62.19 3ioy h ILE 20 Cb -0.06 1.54 -0.03 0.00 0.47 0.00 0.00 36.82 38.75 3ioy h ILE 20 CO -0.03 0.44 0.26 1.23 -3.07 0.00 0.00 178.15 176.98 3ioy h GLY 21 N 1.11 0.89 0.91 8.18 0.00 -1.43 -0.25 103.07 112.49 3ioy h GLY 21 Ca 0.04 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 3ioy h GLY 21 CO 0.06 0.43 0.06 1.41 0.00 0.00 0.00 176.54 178.50 3ioy h LEU 22 N 0.78 0.16 -0.16 3.11 3.38 -0.77 -2.25 115.31 119.55 3ioy h LEU 22 Ca 0.20 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.10 3ioy h LEU 22 Cb 0.14 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3ioy h LEU 22 CO -0.02 0.22 -0.08 0.58 0.09 0.00 0.00 178.44 179.23 3ioy h VAL 23 N 0.08 0.75 -0.88 1.22 2.07 -1.10 -0.99 116.25 117.40 3ioy h VAL 23 Ca 0.04 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.60 3ioy h VAL 23 Cb 0.10 0.75 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 3ioy h VAL 23 CO -0.01 0.00 0.56 -0.09 0.02 0.00 0.00 177.57 178.06 3ioy h ARG 24 N -0.06 1.05 -0.02 1.57 2.43 -0.98 -0.67 114.38 117.69 3ioy h ARG 24 Ca 0.09 -0.06 -0.21 0.00 -0.81 0.00 0.00 59.98 58.99 3ioy h ARG 24 Cb 0.20 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.51 3ioy h ARG 24 CO -0.20 0.69 -0.88 1.96 -1.51 0.00 0.00 179.97 180.03 3ioy h GLN 25 N 1.08 0.37 -0.59 0.20 1.08 -1.09 -0.52 115.11 115.65 3ioy h GLN 25 Ca 0.36 -0.38 -0.06 0.00 -1.45 0.00 0.00 58.65 57.12 3ioy h GLN 25 Cb 0.05 0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 3ioy h GLN 25 CO -0.13 1.05 0.15 -0.07 -0.95 0.00 0.00 178.83 178.88 3ioy h LEU 26 N 0.22 0.90 0.09 1.46 4.07 -0.91 -1.92 115.31 119.21 3ioy h LEU 26 Ca -0.06 -0.23 0.00 0.00 0.08 0.00 0.00 57.88 57.67 3ioy h LEU 26 Cb 1.50 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.99 3ioy h LEU 26 CO 0.15 0.89 -0.09 -0.07 -1.08 0.00 0.00 178.44 178.25 3ioy h LEU 27 N 0.86 -0.23 -2.12 1.67 3.38 -0.94 -1.23 115.31 116.71 3ioy h LEU 27 Ca 0.19 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3ioy h LEU 27 Cb 0.35 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 3ioy h LEU 27 CO 0.00 -0.13 0.29 -1.13 0.09 0.00 0.00 178.44 177.56 3ioy h ASN 28 N -0.19 0.00 -0.13 -0.43 -1.24 -0.95 0.43 115.58 113.06 3ioy h ASN 28 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.02 3ioy h ASN 28 Cb 0.19 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.24 3ioy h ASN 28 CO -0.03 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.11 3ioy n GLN 29 N -2.91 1.82 -0.75 6.67 1.13 -0.54 -4.96 117.38 117.85 3ioy n GLN 29 Ca -0.02 -1.22 0.00 0.00 -1.94 0.00 0.00 57.00 53.82 3ioy n GLN 29 Cb 0.34 -1.44 0.00 0.00 0.11 0.00 0.00 30.24 29.26 3ioy n GLN 29 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ioy n GLY 30 N 1.19 0.55 3.86 1.08 0.00 0.15 -3.44 105.19 108.58 3ioy n GLY 30 Ca 0.17 -0.81 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 3ioy n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ioy s LYS 32 N -3.44 4.41 -0.04 0.00 1.02 -0.61 -4.42 119.74 116.66 3ioy s LYS 32 Ca 0.53 0.84 0.05 0.00 0.02 0.00 0.00 55.97 57.41 3ioy s LYS 32 Cb -0.10 -3.41 -0.01 0.00 -0.52 0.00 0.00 37.83 33.79 3ioy s LYS 32 CO 0.25 0.16 -0.18 0.08 -0.92 0.00 0.00 175.35 174.73 3ioy s VAL 33 N 0.48 1.50 -0.25 3.17 1.01 0.06 -0.23 120.40 126.14 3ioy s VAL 33 Ca 0.35 -0.76 -0.09 0.00 0.00 0.00 0.00 61.98 61.48 3ioy s VAL 33 Cb -0.18 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 3ioy s VAL 33 CO 0.18 0.43 0.13 0.00 0.00 0.00 0.00 175.10 175.84 3ioy s ALA 34 N -0.05 3.42 -0.25 5.51 0.00 0.11 -2.03 121.76 128.47 3ioy s ALA 34 Ca -0.02 -1.01 -0.25 0.00 0.00 0.00 0.00 51.96 50.69 3ioy s ALA 34 Cb -0.11 -2.24 -0.00 0.00 0.00 0.00 0.00 23.12 20.76 3ioy s ALA 34 CO 0.02 -0.34 0.84 0.42 0.00 0.00 0.00 175.76 176.69 3ioy s ILE 35 N 1.35 4.83 -0.15 0.00 1.01 0.20 -1.37 121.20 127.07 3ioy s ILE 35 Ca 0.06 1.57 -0.02 0.00 0.00 0.00 0.00 60.65 62.26 3ioy s ILE 35 Cb -0.15 -4.13 -0.02 0.00 0.01 0.00 0.00 42.46 38.17 3ioy s ILE 35 CO 0.06 -0.09 -0.08 0.00 0.00 0.00 0.00 174.94 174.83 3ioy s ALA 36 N 2.87 2.82 0.10 9.38 0.00 0.14 -0.60 121.76 136.46 3ioy s ALA 36 Ca 0.35 -0.87 -0.22 0.00 0.00 0.00 0.00 51.96 51.22 3ioy s ALA 36 Cb -0.15 -1.42 0.06 0.00 0.00 0.00 0.00 23.12 21.60 3ioy s ALA 36 CO 0.07 0.18 0.54 0.34 0.00 0.00 0.00 175.76 176.89 3ioy s ASP 37 N 0.44 -0.46 0.22 0.00 2.15 -1.04 -0.72 116.67 117.26 3ioy s ASP 37 Ca -0.06 0.04 0.01 0.00 0.43 0.00 0.00 52.55 52.96 3ioy s ASP 37 Cb -0.15 0.53 0.19 0.00 -0.30 0.00 0.00 42.92 43.20 3ioy s ASP 37 CO 0.04 -0.83 1.54 -0.29 -0.17 0.00 0.00 175.17 175.46 3ioy h ILE 38 N 2.41 1.34 -3.55 4.11 6.09 -1.81 0.40 117.51 126.51 3ioy h ILE 38 Ca -0.32 -1.84 -0.64 0.00 -1.37 0.00 0.00 64.86 60.69 3ioy h ILE 38 Cb 1.25 1.85 -0.20 0.00 0.47 0.00 0.00 36.82 40.19 3ioy h ILE 38 CO 0.41 0.56 -0.60 -0.13 -3.07 0.00 0.00 178.15 175.32 3ioy s ARG 39 N -3.92 3.79 0.26 2.19 0.52 -1.26 -4.61 118.95 115.91 3ioy s ARG 39 Ca -0.06 -0.42 -0.05 0.00 -0.52 0.00 0.00 55.73 54.68 3ioy s ARG 39 Cb 0.12 -3.30 0.31 0.00 0.52 0.00 0.00 34.95 32.59 3ioy s ARG 39 CO 0.82 -0.02 1.93 0.37 0.02 0.00 0.00 175.30 178.42 3ioy h GLN 40 N 7.69 1.27 -0.32 3.54 5.75 -1.98 -2.69 115.11 128.37 3ioy h GLN 40 Ca -0.37 -0.08 0.03 0.00 -0.15 0.00 0.00 58.65 58.09 3ioy h GLN 40 Cb 1.18 -0.29 -0.03 0.00 1.07 0.00 0.00 27.48 29.41 3ioy h GLN 40 CO 0.61 0.84 0.12 -0.44 -2.65 0.00 0.00 178.83 177.31 3ioy h ASP 41 N 1.30 0.15 -0.83 -0.69 3.32 -1.99 -0.54 116.42 117.14 3ioy h ASP 41 Ca 0.37 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.45 3ioy h ASP 41 Cb -0.10 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 3ioy h ASP 41 CO -0.09 0.12 0.51 0.28 -1.72 0.00 0.00 179.24 178.33 3ioy h SER 42 N 0.26 0.99 -0.19 6.45 0.02 -1.95 -2.74 113.55 116.39 3ioy h SER 42 Ca 0.14 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3ioy h SER 42 Cb 0.10 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 3ioy h SER 42 CO -0.13 0.76 0.11 0.40 -1.14 0.00 0.00 176.83 176.83 3ioy h ILE 43 N 1.14 1.09 -0.97 3.27 2.04 -1.09 -2.01 117.51 120.97 3ioy h ILE 43 Ca 0.30 -0.24 0.04 0.00 1.00 0.00 0.00 64.86 65.96 3ioy h ILE 43 Cb -0.05 0.90 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 3ioy h ILE 43 CO -0.06 0.09 0.64 0.44 0.00 0.00 0.00 178.15 179.26 3ioy h ASP 44 N 0.22 1.05 0.33 1.72 3.32 -1.06 0.70 116.42 122.70 3ioy h ASP 44 Ca 0.07 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.97 3ioy h ASP 44 Cb 0.04 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 3ioy h ASP 44 CO -0.01 0.71 -0.57 0.50 -1.72 0.00 0.00 179.24 178.16 3ioy h LYS 45 N 1.22 0.25 -0.16 3.56 3.64 -1.41 -0.01 116.57 123.67 3ioy h LYS 45 Ca 0.39 -0.16 -0.07 0.00 -1.27 0.00 0.00 60.65 59.54 3ioy h LYS 45 Cb 0.03 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3ioy h LYS 45 CO -0.13 0.75 -0.18 0.00 -2.27 0.00 0.00 179.45 177.62 3ioy h ALA 46 N 1.22 0.23 -0.76 5.00 0.00 -0.66 -2.66 119.26 121.62 3ioy h ALA 46 Ca -0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3ioy h ALA 46 Cb 1.05 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 3ioy h ALA 46 CO 0.09 0.15 0.47 -0.07 0.00 0.00 0.00 179.25 179.89 3ioy h LEU 47 N 0.03 0.90 -0.48 0.00 3.38 -0.83 -1.40 115.31 116.91 3ioy h LEU 47 Ca 0.02 -0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.01 3ioy h LEU 47 Cb 0.73 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.19 3ioy h LEU 47 CO 0.04 0.69 0.13 0.00 0.09 0.00 0.00 178.44 179.39 3ioy h ALA 48 N 1.25 0.55 0.00 1.53 0.00 -0.92 -0.40 119.26 121.28 3ioy h ALA 48 Ca 0.28 0.08 -0.16 0.00 0.00 0.00 0.00 54.91 55.10 3ioy h ALA 48 Cb -0.06 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3ioy h ALA 48 CO -0.05 -0.28 -0.99 1.79 0.00 0.00 0.00 179.25 179.72 3ioy h THR 49 N 0.28 0.95 -0.20 0.00 1.35 -1.25 -1.95 112.91 112.09 3ioy h THR 49 Ca 0.23 -2.48 -0.13 0.00 -0.55 0.00 0.00 66.41 63.49 3ioy h THR 49 Cb 0.28 2.41 -0.01 0.00 -1.73 0.00 0.00 68.15 69.11 3ioy h THR 49 CO -0.28 0.54 -0.42 -0.07 -0.25 0.00 0.00 175.52 175.04 3ioy h LEU 50 N 0.00 0.50 -0.57 3.87 3.38 -1.14 -1.46 115.31 119.88 3ioy h LEU 50 Ca -0.08 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 3ioy h LEU 50 Cb 1.59 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 3ioy h LEU 50 CO 0.08 0.86 0.21 -0.33 0.09 0.00 0.00 178.44 179.35 3ioy h GLU 51 N 0.38 0.87 0.00 1.13 4.39 -1.00 -1.48 114.58 118.88 3ioy h GLU 51 Ca 0.03 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.55 3ioy h GLU 51 Cb 0.91 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 29.42 3ioy h GLU 51 CO 0.08 0.76 -0.05 0.00 -1.16 0.00 0.00 179.01 178.64 3ioy h ALA 52 N 1.07 1.75 0.00 3.43 0.00 -1.27 -1.62 119.26 122.62 3ioy h ALA 52 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ioy h ALA 52 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3ioy h ALA 52 CO -0.01 0.06 0.00 0.93 0.00 0.00 0.00 179.25 180.23 3ioy h GLU 53 N 0.00 0.00 0.00 0.00 5.08 -0.60 -3.48 114.58 115.58 3ioy h GLU 53 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ioy h GLU 53 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3ioy h GLU 53 CO 0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.43 3ioy n GLY 54 N 1.12 0.99 0.72 -3.84 0.00 -0.61 -5.00 105.19 98.58 3ioy n GLY 54 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.20 3ioy n GLY 54 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ioy n SER 55 N 0.00 2.26 -0.05 1.61 7.64 -0.62 -4.78 113.62 119.68 3ioy n SER 55 Ca 0.00 -1.75 -0.01 0.00 1.01 0.00 0.00 58.87 58.12 3ioy n SER 55 Cb 0.00 0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.20 3ioy n SER 55 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ioy n GLY 56 N 1.27 -0.51 0.00 0.23 0.00 -1.26 -0.19 105.19 104.74 3ioy n GLY 56 Ca 0.16 0.18 0.04 0.00 0.00 0.00 0.00 46.02 46.40 3ioy n GLY 56 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3ioy n PRO 57 N -3.48 0.05 0.00 1.61 -0.02 -1.26 -3.02 135.00 128.88 3ioy n PRO 57 Ca 0.00 0.29 0.08 0.00 -2.02 0.00 0.00 63.50 61.86 3ioy n PRO 57 Cb 0.03 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 31.98 3ioy n PRO 57 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3ioy n GLU 58 N -1.42 1.60 -4.68 -0.52 4.71 0.74 -4.98 120.64 116.08 3ioy n GLU 58 Ca 0.03 -0.63 -0.28 0.00 -0.01 0.00 0.00 57.16 56.27 3ioy n GLU 58 Cb 0.10 -1.30 -0.14 0.00 -1.01 0.00 0.00 31.44 29.08 3ioy n GLU 58 CO 0.00 0.00 0.00 0.14 0.09 0.00 0.00 177.13 177.36 3ioy s VAL 59 N -2.14 2.00 0.17 2.62 -7.23 -1.17 -0.76 120.40 113.90 3ioy s VAL 59 Ca 0.12 -1.43 -0.01 0.00 -1.81 0.00 0.00 61.98 58.86 3ioy s VAL 59 Cb 0.13 -1.74 -0.04 0.00 0.56 0.00 0.00 36.38 35.29 3ioy s VAL 59 CO 0.50 0.23 0.10 0.00 -0.31 0.00 0.00 175.10 175.62 3ioy s MET 60 N -1.44 1.10 0.06 4.82 0.23 -0.86 -4.96 119.30 118.25 3ioy s MET 60 Ca 0.11 -1.56 0.07 0.00 -1.03 0.00 0.00 55.69 53.28 3ioy s MET 60 Cb -0.10 0.23 -0.03 0.00 -1.53 0.00 0.00 34.83 33.40 3ioy s MET 60 CO 0.03 -0.33 -0.20 0.20 -2.03 0.00 0.00 175.02 172.69 3ioy s GLY 61 N -3.12 1.13 -0.08 3.16 0.00 -1.26 -0.62 107.32 106.53 3ioy s GLY 61 Ca 0.33 -1.10 -0.03 0.00 0.00 0.00 0.00 44.72 43.92 3ioy s GLY 61 CO 0.08 -1.04 0.16 0.54 0.00 0.00 0.00 173.10 172.83 3ioy s VAL 62 N -0.90 -0.20 0.10 1.40 0.11 0.23 -4.92 120.40 116.22 3ioy s VAL 62 Ca 0.07 0.30 -0.31 0.00 -2.93 0.00 0.00 61.98 59.11 3ioy s VAL 62 Cb -0.09 -0.28 -0.07 0.00 -1.53 0.00 0.00 36.38 34.41 3ioy s VAL 62 CO 0.02 0.12 1.26 -1.58 -3.33 0.00 0.00 175.10 171.60 3ioy s GLN 63 N 1.93 4.40 -0.23 1.54 -0.44 -1.26 -2.49 119.66 123.12 3ioy s GLN 63 Ca -0.01 1.88 -0.15 0.00 -2.50 0.00 0.00 55.36 54.58 3ioy s GLN 63 Cb -0.12 -3.30 0.07 0.00 -1.64 0.00 0.00 33.01 28.02 3ioy s GLN 63 CO -0.06 -0.29 0.57 -1.17 0.50 0.00 0.00 175.29 174.84 3ioy s LEU 64 N 0.86 -0.45 -0.43 3.68 2.96 0.14 -4.86 118.68 120.58 3ioy s LEU 64 Ca 0.60 1.21 -0.18 0.00 -0.22 0.00 0.00 54.13 55.54 3ioy s LEU 64 Cb -0.32 1.94 0.03 0.00 0.50 0.00 0.00 46.19 48.33 3ioy s LEU 64 CO 0.31 -0.21 0.48 -0.62 -1.32 0.00 0.00 176.35 174.98 3ioy s ASP 65 N 1.14 6.21 0.51 3.68 2.15 -1.26 -2.43 116.67 126.67 3ioy s ASP 65 Ca -0.07 -0.67 0.34 0.00 0.43 0.00 0.00 52.55 52.59 3ioy s ASP 65 Cb -0.06 -2.24 1.65 0.00 -0.30 0.00 0.00 42.92 41.97 3ioy s ASP 65 CO -0.11 -0.64 2.03 -0.37 -0.17 0.00 0.00 175.17 175.92 3ioy h VAL 66 N 5.76 0.00 0.00 1.11 -1.51 -1.94 -0.92 116.25 118.76 3ioy h VAL 66 Ca -0.26 -0.22 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 3ioy h VAL 66 Cb 1.11 1.11 0.00 0.00 -2.13 0.00 0.00 31.29 31.37 3ioy h VAL 66 CO 0.82 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.16 3ioy h ALA 67 N 2.04 1.00 -2.43 5.19 0.00 -1.88 -3.34 119.26 119.83 3ioy h ALA 67 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 3ioy h ALA 67 Cb 0.24 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.89 3ioy h ALA 67 CO 0.00 0.00 0.03 0.45 0.00 0.00 0.00 179.25 179.73 3ioy s SER 68 N -4.70 6.39 0.07 0.00 0.15 -0.35 -4.89 113.70 110.37 3ioy s SER 68 Ca 0.03 0.17 -0.21 0.00 0.70 0.00 0.00 55.95 56.63 3ioy s SER 68 Cb 0.09 -2.29 -0.11 0.00 -1.71 0.00 0.00 66.02 61.99 3ioy s SER 68 CO 0.43 -0.48 1.57 0.03 1.20 0.00 0.00 173.24 175.99 3ioy h ARG 69 N 8.35 0.23 -0.32 5.44 3.08 -1.87 -0.66 114.38 128.63 3ioy h ARG 69 Ca -0.28 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 59.79 3ioy h ARG 69 Cb 1.12 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 31.07 3ioy h ARG 69 CO 0.78 0.38 -0.17 1.49 -1.07 0.00 0.00 179.97 181.37 3ioy h GLU 70 N 0.05 -0.13 -0.58 0.04 4.81 -1.96 -1.53 114.58 115.28 3ioy h GLU 70 Ca 0.05 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.33 3ioy h GLU 70 Cb 0.25 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.61 3ioy h GLU 70 CO -0.00 -0.08 0.31 0.78 -0.73 0.00 0.00 179.01 179.28 3ioy h GLY 71 N -0.13 0.82 0.97 1.92 0.00 -1.85 -1.52 103.07 103.28 3ioy h GLY 71 Ca 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 3ioy h GLY 71 CO -0.40 0.14 0.24 -2.75 0.00 0.00 0.00 176.54 173.77 3ioy h PHE 72 N 0.59 0.67 -0.09 5.60 -0.00 -0.76 0.15 116.94 123.10 3ioy h PHE 72 Ca 0.25 -0.03 0.01 0.00 -0.00 0.00 0.00 57.97 58.21 3ioy h PHE 72 Cb 0.14 -0.21 -0.01 0.00 -0.00 0.00 0.00 35.95 35.87 3ioy h PHE 72 CO -0.09 0.52 0.00 -0.22 -0.00 0.00 0.00 178.31 178.52 3ioy h LYS 73 N 0.62 0.03 -0.36 1.11 3.64 -1.01 -1.11 116.57 119.49 3ioy h LYS 73 Ca 0.16 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.56 3ioy h LYS 73 Cb 0.09 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 3ioy h LYS 73 CO -0.02 0.02 0.21 0.52 -2.27 0.00 0.00 179.45 177.91 3ioy h MET 74 N 0.04 0.41 -0.79 1.90 2.86 -1.05 -0.33 114.93 117.97 3ioy h MET 74 Ca 0.04 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3ioy h MET 74 Cb 0.05 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.57 3ioy h MET 74 CO -0.07 0.27 0.49 0.00 1.06 0.00 0.00 176.91 178.66 3ioy h ALA 75 N 1.17 1.01 0.01 6.32 0.00 -0.87 -0.95 119.26 125.96 3ioy h ALA 75 Ca 0.15 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3ioy h ALA 75 Cb 0.01 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.49 3ioy h ALA 75 CO -0.07 0.46 -0.01 0.00 0.00 0.00 0.00 179.25 179.63 3ioy h ALA 76 N 1.26 -0.02 -0.36 0.00 0.00 -0.79 -1.56 119.26 117.79 3ioy h ALA 76 Ca 0.29 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.22 3ioy h ALA 76 Cb -0.06 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 3ioy h ALA 76 CO -0.06 -0.48 0.08 -0.44 0.00 0.00 0.00 179.25 178.35 3ioy h ASP 77 N -0.07 0.02 0.19 0.00 3.32 -0.97 0.18 116.42 119.10 3ioy h ASP 77 Ca -0.00 0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.11 3ioy h ASP 77 Cb 0.07 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 3ioy h ASP 77 CO 0.00 0.05 -0.26 -0.08 -1.72 0.00 0.00 179.24 177.23 3ioy h GLU 78 N 0.20 -0.50 -0.79 3.56 4.81 -1.04 -0.31 114.58 120.52 3ioy h GLU 78 Ca 0.17 0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.45 3ioy h GLU 78 Cb 0.19 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 3ioy h GLU 78 CO -0.22 -0.33 0.51 0.28 -0.73 0.00 0.00 179.01 178.52 3ioy h VAL 79 N -0.52 1.17 0.00 0.32 2.07 -1.11 -0.99 116.25 117.19 3ioy h VAL 79 Ca 0.01 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 3ioy h VAL 79 Cb 0.51 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 3ioy h VAL 79 CO -0.10 0.19 -0.22 -0.33 0.02 0.00 0.00 177.57 177.13 3ioy h GLU 80 N 1.03 0.00 -0.11 1.57 5.08 -0.77 0.34 114.58 121.72 3ioy h GLU 80 Ca 0.30 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.44 3ioy h GLU 80 Cb -0.06 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.19 3ioy h GLU 80 CO -0.08 0.22 -0.82 0.00 -1.00 0.00 0.00 179.01 177.32 3ioy h ALA 81 N 1.78 0.34 0.11 3.43 0.00 -0.17 -2.32 119.26 122.44 3ioy h ALA 81 Ca -0.00 -0.62 -0.24 0.00 0.00 0.00 0.00 54.91 54.05 3ioy h ALA 81 Cb 0.70 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3ioy h ALA 81 CO 0.03 0.71 -1.19 -0.09 0.00 0.00 0.00 179.25 178.71 3ioy h ARG 82 N 0.45 0.24 -0.01 0.00 2.43 -0.64 -3.40 114.38 113.45 3ioy h ARG 82 Ca -0.06 -0.40 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 3ioy h ARG 82 Cb 1.44 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 31.14 3ioy h ARG 82 CO 0.16 1.19 -0.08 1.19 -1.51 0.00 0.00 179.97 180.92 3ioy n PHE 83 N -4.03 0.00 0.00 2.20 3.72 0.12 -5.11 117.46 114.36 3ioy n PHE 83 Ca -0.22 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.18 3ioy n PHE 83 Cb 0.85 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.39 3ioy n PHE 83 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ioy n GLY 84 N 0.65 -0.52 3.64 1.37 0.00 -0.87 -4.81 105.19 104.65 3ioy n GLY 84 Ca 0.04 -1.78 -0.46 0.00 0.00 0.00 0.00 46.02 43.82 3ioy n GLY 84 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ioy n PRO 85 N -0.55 1.77 -2.96 1.61 -0.04 -1.26 -4.22 135.00 129.36 3ioy n PRO 85 Ca 0.00 0.63 -0.41 0.00 -0.04 0.00 0.00 63.50 63.68 3ioy n PRO 85 Cb 0.00 -2.24 -0.04 0.00 -0.04 0.00 0.00 33.50 31.17 3ioy n PRO 85 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3ioy s VAL 86 N -0.06 4.96 -0.18 0.52 1.01 -1.26 -4.00 120.40 121.39 3ioy s VAL 86 Ca 0.70 1.56 0.02 0.00 0.00 0.00 0.00 61.98 64.26 3ioy s VAL 86 Cb -0.71 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 31.56 3ioy s VAL 86 CO 0.50 0.13 0.27 -1.54 0.00 0.00 0.00 175.10 174.46 3ioy n SER 87 N 4.52 0.50 -4.09 3.32 3.41 -0.55 -4.84 113.62 115.89 3ioy n SER 87 Ca 0.02 -0.75 -0.31 0.00 -0.26 0.00 0.00 58.87 57.57 3ioy n SER 87 Cb 0.50 0.64 -0.16 0.00 -0.26 0.00 0.00 64.21 64.93 3ioy n SER 87 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3ioy s ILE 88 N -0.86 1.79 -0.16 -1.33 1.01 -1.07 -1.15 121.20 119.43 3ioy s ILE 88 Ca 0.02 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 59.88 3ioy s ILE 88 Cb 0.02 -1.62 0.02 0.00 0.01 0.00 0.00 42.46 40.89 3ioy s ILE 88 CO 0.07 0.50 -0.17 -0.22 0.00 0.00 0.00 174.94 175.12 3ioy s LEU 89 N 1.14 1.88 -0.38 2.97 2.96 -0.31 -1.01 118.68 125.93 3ioy s LEU 89 Ca -0.01 -0.55 -0.05 0.00 -0.22 0.00 0.00 54.13 53.29 3ioy s LEU 89 Cb -0.14 -1.30 0.07 0.00 0.50 0.00 0.00 46.19 45.32 3ioy s LEU 89 CO -0.07 -0.02 0.16 0.00 -1.32 0.00 0.00 176.35 175.10 3ioy s ASN 91 N 1.72 6.69 0.00 0.00 0.01 0.09 -1.30 114.94 122.16 3ioy s ASN 91 Ca 0.02 -2.06 0.11 0.00 -0.71 0.00 0.00 52.86 50.21 3ioy s ASN 91 Cb -0.22 -2.49 -0.11 0.00 0.41 0.00 0.00 41.25 38.85 3ioy s ASN 91 CO -0.00 -1.18 0.47 -3.20 -1.51 0.00 0.00 177.10 171.68 3ioy n ASN 92 N 7.52 0.57 -4.75 -1.22 2.85 -1.21 -1.49 115.26 117.53 3ioy n ASN 92 Ca 0.33 -0.79 -0.39 0.00 -0.11 0.00 0.00 54.58 53.62 3ioy n ASN 92 Cb 0.48 0.96 0.03 0.00 1.24 0.00 0.00 39.78 42.49 3ioy n ASN 92 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3ioy n ALA 93 N -1.17 1.79 -3.57 5.20 0.00 -1.16 -4.71 120.51 116.89 3ioy n ALA 93 Ca 0.02 0.18 -0.11 0.00 0.00 0.00 0.00 53.44 53.54 3ioy n ALA 93 Cb 0.17 -2.37 -0.05 0.00 0.00 0.00 0.00 19.45 17.20 3ioy n ALA 93 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3ioy s GLY 94 N -0.70 -0.29 0.12 0.00 0.00 -1.26 -4.70 107.32 100.49 3ioy s GLY 94 Ca 0.67 1.97 0.01 0.00 0.00 0.00 0.00 44.72 47.37 3ioy s GLY 94 CO 0.53 1.00 -0.03 -1.34 0.00 0.00 0.00 173.10 173.26 3ioy s VAL 95 N -1.18 0.61 0.13 1.40 -7.23 -1.26 -5.03 120.40 107.84 3ioy s VAL 95 Ca -0.02 -1.94 0.01 0.00 -1.81 0.00 0.00 61.98 58.22 3ioy s VAL 95 Cb -0.00 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 35.03 3ioy s VAL 95 CO 0.02 -0.70 -0.01 0.21 -0.31 0.00 0.00 175.10 174.31 3ioy s ASN 96 N -3.08 0.93 -0.28 4.85 3.84 -1.26 -4.93 114.94 115.02 3ioy s ASN 96 Ca 0.17 -1.12 -0.06 0.00 0.21 0.00 0.00 52.86 52.06 3ioy s ASN 96 Cb 0.06 0.16 0.14 0.00 -0.55 0.00 0.00 41.25 41.06 3ioy s ASN 96 CO -0.01 -0.58 0.56 -0.22 -2.79 0.00 0.00 177.10 174.06 3ioy s LEU 97 N -3.09 -1.07 -0.81 3.21 2.96 -1.26 -5.11 118.68 113.50 3ioy s LEU 97 Ca 0.19 1.11 -0.21 0.00 -0.22 0.00 0.00 54.13 55.01 3ioy s LEU 97 Cb 0.06 1.96 0.10 0.00 0.50 0.00 0.00 46.19 48.81 3ioy s LEU 97 CO 0.00 -0.24 1.07 0.12 -1.32 0.00 0.00 176.35 175.97 3ioy s PHE 98 N 2.80 2.89 -0.13 5.38 5.36 -1.26 -4.62 117.98 128.40 3ioy s PHE 98 Ca 0.05 -0.99 -0.29 0.00 -0.96 0.00 0.00 56.93 54.74 3ioy s PHE 98 Cb -0.13 -4.31 0.08 0.00 -0.34 0.00 0.00 43.02 38.32 3ioy s PHE 98 CO -0.18 -1.58 0.72 -0.65 -1.46 0.00 0.00 175.22 172.07 3ioy s GLN 99 N 3.40 0.95 0.69 10.12 -0.21 -1.26 -4.99 119.66 128.37 3ioy s GLN 99 Ca 0.28 0.48 -0.11 0.00 0.02 0.00 0.00 55.36 56.03 3ioy s GLN 99 Cb -0.10 0.45 0.00 0.00 1.00 0.00 0.00 33.01 34.37 3ioy s GLN 99 CO -0.01 -0.25 1.07 -1.25 -2.12 0.00 0.00 175.29 172.74 3ioy s PRO 100 N -0.69 2.99 0.16 2.91 0.04 -1.26 -1.39 135.00 137.76 3ioy s PRO 100 Ca -0.07 0.63 -0.12 0.00 0.04 0.00 0.00 61.00 61.48 3ioy s PRO 100 Cb -0.02 -2.02 0.05 0.00 0.04 0.00 0.00 34.50 32.56 3ioy s PRO 100 CO 0.06 -0.98 1.68 0.82 0.04 0.00 0.00 177.00 178.63 3ioy h ILE 101 N -0.62 1.24 0.00 0.56 2.04 -1.92 -2.76 117.51 116.05 3ioy h ILE 101 Ca -0.45 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 64.58 3ioy h ILE 101 Cb 1.23 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 3ioy h ILE 101 CO 0.62 0.31 0.00 1.05 0.00 0.00 0.00 178.15 180.13 3ioy h GLU 102 N 0.78 0.00 -0.39 2.37 9.09 -1.96 0.29 114.58 124.76 3ioy h GLU 102 Ca 0.18 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.59 3ioy h GLU 102 Cb 0.31 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.41 3ioy h GLU 102 CO -0.00 0.00 0.00 0.39 0.05 0.00 0.00 179.01 179.45 3ioy n GLU 103 N -2.39 2.44 -4.06 1.06 1.02 -1.04 -4.98 120.64 112.69 3ioy n GLU 103 Ca -0.02 -2.24 -0.36 0.00 -0.02 0.00 0.00 57.16 54.52 3ioy n GLU 103 Cb 0.04 -1.48 -0.08 0.00 -0.02 0.00 0.00 31.44 29.91 3ioy n GLU 103 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3ioy s SER 104 N -1.36 5.91 0.53 1.62 0.01 0.09 -4.96 113.70 115.54 3ioy s SER 104 Ca 0.37 0.32 -0.01 0.00 1.31 0.00 0.00 55.95 57.93 3ioy s SER 104 Cb 0.21 -1.85 0.02 0.00 0.21 0.00 0.00 66.02 64.61 3ioy s SER 104 CO 0.29 0.37 0.78 -0.94 0.41 0.00 0.00 173.24 174.15 3ioy s SER 105 N -0.82 5.53 0.26 2.44 1.04 -1.26 -4.95 113.70 115.94 3ioy s SER 105 Ca 0.13 0.29 -0.03 0.00 0.48 0.00 0.00 55.95 56.82 3ioy s SER 105 Cb -0.12 -1.33 0.37 0.00 0.10 0.00 0.00 66.02 65.04 3ioy s SER 105 CO 0.03 -0.98 1.88 1.88 0.98 0.00 0.00 173.24 177.03 3ioy h TYR 106 N 0.11 1.18 -0.92 5.02 0.05 -1.99 -1.61 116.97 118.81 3ioy h TYR 106 Ca -0.45 0.03 0.10 0.00 0.05 0.00 0.00 58.73 58.47 3ioy h TYR 106 Cb 1.27 -0.39 -0.08 0.00 1.01 0.00 0.00 36.73 38.55 3ioy h TYR 106 CO 0.42 0.63 0.55 -0.44 -1.05 0.00 0.00 178.16 178.27 3ioy h ASP 107 N 1.17 0.81 -0.40 3.88 3.32 -1.99 -0.53 116.42 122.69 3ioy h ASP 107 Ca 0.41 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.49 3ioy h ASP 107 Cb 0.12 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 3ioy h ASP 107 CO -0.16 0.45 0.16 0.44 -1.72 0.00 0.00 179.24 178.42 3ioy h ASP 108 N 0.91 0.54 -0.45 6.45 3.32 -1.70 -1.45 116.42 124.04 3ioy h ASP 108 Ca 0.44 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.34 3ioy h ASP 108 Cb 0.40 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 3ioy h ASP 108 CO -0.25 0.55 0.29 -0.50 -1.72 0.00 0.00 179.24 177.62 3ioy h TRP 109 N 0.49 0.56 -0.73 4.55 4.06 -1.14 -1.89 115.95 121.85 3ioy h TRP 109 Ca 0.13 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 61.08 3ioy h TRP 109 Cb 0.18 -0.19 -0.03 0.00 -1.00 0.00 0.00 29.16 28.11 3ioy h TRP 109 CO -0.00 0.35 0.38 -0.44 -3.56 0.00 0.00 178.44 175.17 3ioy h ASP 110 N 0.60 0.94 -0.03 -3.49 3.32 -0.99 0.69 116.42 117.46 3ioy h ASP 110 Ca 0.16 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 3ioy h ASP 110 Cb -0.07 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.24 3ioy h ASP 110 CO -0.04 0.78 -0.00 -0.25 -1.72 0.00 0.00 179.24 178.02 3ioy h TRP 111 N 1.02 0.06 -0.27 4.55 7.01 -1.16 -2.03 115.95 125.12 3ioy h TRP 111 Ca 0.25 -0.01 -0.19 0.00 2.11 0.00 0.00 58.89 61.05 3ioy h TRP 111 Cb 0.08 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 27.12 3ioy h TRP 111 CO 0.00 0.35 -0.57 -0.07 -2.79 0.00 0.00 178.44 175.36 3ioy h LEU 112 N -0.26 0.97 -0.52 0.65 4.07 -1.28 -2.76 115.31 116.19 3ioy h LEU 112 Ca 0.01 -0.53 -0.01 0.00 0.08 0.00 0.00 57.88 57.42 3ioy h LEU 112 Cb 0.33 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.77 3ioy h LEU 112 CO 0.00 1.34 0.27 -0.07 -1.08 0.00 0.00 178.44 178.89 3ioy h LEU 113 N 0.66 0.66 -0.04 1.67 3.38 -0.94 0.02 115.31 120.72 3ioy h LEU 113 Ca 0.01 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 57.90 3ioy h LEU 113 Cb 1.19 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 3ioy h LEU 113 CO 0.13 0.59 -0.23 1.23 0.09 0.00 0.00 178.44 180.24 3ioy h GLY 114 N 0.69 -0.30 0.31 0.83 0.00 -1.31 0.38 103.07 103.67 3ioy h GLY 114 Ca 0.18 0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.78 3ioy h GLY 114 CO -0.03 -0.20 -0.02 -2.08 0.00 0.00 0.00 176.54 174.21 3ioy h VAL 115 N -0.34 1.31 0.18 4.60 2.07 -1.49 -1.25 116.25 121.33 3ioy h VAL 115 Ca 0.07 -1.47 -0.31 0.00 0.82 0.00 0.00 66.70 65.81 3ioy h VAL 115 Cb 0.44 2.23 0.02 0.00 -1.52 0.00 0.00 31.29 32.46 3ioy h VAL 115 CO -0.24 0.35 -1.45 0.78 0.02 0.00 0.00 177.57 177.03 3ioy h ASN 116 N -0.76 0.60 0.00 0.57 2.35 -1.04 -3.04 115.58 114.27 3ioy h ASN 116 Ca -0.01 -0.70 -0.22 0.00 -0.55 0.00 0.00 56.30 54.82 3ioy h ASN 116 Cb 0.63 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.77 3ioy h ASN 116 CO 0.01 1.56 -1.72 -0.11 -1.65 0.00 0.00 177.43 175.52 3ioy n LEU 117 N -3.59 1.88 -0.24 1.61 7.94 -0.35 -4.32 117.00 119.93 3ioy n LEU 117 Ca -0.15 0.32 -0.00 0.00 -1.11 0.00 0.00 56.01 55.07 3ioy n LEU 117 Cb 1.07 -0.75 0.22 0.00 0.53 0.00 0.00 43.42 44.48 3ioy n LEU 117 CO 0.55 0.13 1.23 0.45 -1.11 0.00 0.00 177.39 178.65 3ioy h HIS 118 N -0.95 1.00 -0.90 1.96 3.86 -0.32 -0.57 115.15 119.23 3ioy h HIS 118 Ca -0.34 0.02 0.14 0.00 -1.16 0.00 0.00 60.37 59.02 3ioy h HIS 118 Cb 1.27 -0.34 -0.07 0.00 1.06 0.00 0.00 27.41 29.33 3ioy h HIS 118 CO -0.25 0.64 0.58 0.78 0.86 0.00 0.00 177.93 180.55 3ioy h GLY 119 N 1.08 1.26 0.88 2.45 0.00 -1.09 0.61 103.07 108.26 3ioy h GLY 119 Ca 0.29 -0.32 -0.23 0.00 0.00 0.00 0.00 47.33 47.07 3ioy h GLY 119 CO -0.06 0.10 -1.00 -2.08 0.00 0.00 0.00 176.54 173.51 3ioy h VAL 120 N 0.74 1.43 -0.62 4.60 2.07 -1.48 -1.48 116.25 121.51 3ioy h VAL 120 Ca 0.45 -2.53 0.05 0.00 0.82 0.00 0.00 66.70 65.49 3ioy h VAL 120 Cb 0.67 3.08 -0.05 0.00 -1.52 0.00 0.00 31.29 33.46 3ioy h VAL 120 CO -0.21 0.73 0.34 0.58 0.02 0.00 0.00 177.57 179.04 3ioy h VAL 121 N -0.17 0.97 -0.22 2.57 2.07 -0.48 0.20 116.25 121.20 3ioy h VAL 121 Ca -0.17 -0.22 -0.11 0.00 0.82 0.00 0.00 66.70 67.02 3ioy h VAL 121 Cb 1.77 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 3ioy h VAL 121 CO 0.19 0.12 -0.28 0.78 0.02 0.00 0.00 177.57 178.40 3ioy h ASN 122 N 0.64 0.64 0.28 0.57 2.35 0.17 0.30 115.58 120.53 3ioy h ASN 122 Ca 0.28 -0.50 -0.00 0.00 -0.55 0.00 0.00 56.30 55.53 3ioy h ASN 122 Cb 0.16 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 3ioy h ASN 122 CO -0.17 1.01 -0.25 1.23 -1.65 0.00 0.00 177.43 177.60 3ioy h GLY 123 N 0.28 -0.57 0.84 2.83 0.00 -1.02 0.11 103.07 105.55 3ioy h GLY 123 Ca 0.03 0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.67 3ioy h GLY 123 CO 0.07 -0.23 0.24 -2.08 0.00 0.00 0.00 176.54 174.53 3ioy h VAL 124 N -0.55 1.01 -0.04 4.60 2.07 -0.87 -1.70 116.25 120.78 3ioy h VAL 124 Ca -0.01 -0.16 -0.12 0.00 0.82 0.00 0.00 66.70 67.23 3ioy h VAL 124 Cb 0.49 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 3ioy h VAL 124 CO -0.03 0.09 -0.52 0.74 0.02 0.00 0.00 177.57 177.87 3ioy h THR 125 N 0.47 1.36 -0.21 2.57 2.02 -0.24 -0.46 112.91 118.43 3ioy h THR 125 Ca 0.18 -1.78 -0.19 0.00 0.77 0.00 0.00 66.41 65.39 3ioy h THR 125 Cb 0.05 1.91 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 3ioy h THR 125 CO -0.10 0.52 -0.60 0.74 0.37 0.00 0.00 175.52 176.45 3ioy h THR 126 N 0.09 1.29 0.00 3.16 2.02 -0.54 -3.41 112.91 115.52 3ioy h THR 126 Ca 0.00 -1.80 -0.27 0.00 0.77 0.00 0.00 66.41 65.11 3ioy h THR 126 Cb 0.94 1.84 -0.05 0.00 -1.74 0.00 0.00 68.15 69.15 3ioy h THR 126 CO 0.07 0.57 -2.03 0.49 0.37 0.00 0.00 175.52 175.00 3ioy n PHE 127 N -4.05 0.00 -0.16 3.16 3.01 -0.66 -4.49 117.46 114.27 3ioy n PHE 127 Ca -0.06 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.32 3ioy n PHE 127 Cb 0.65 -0.69 0.01 0.00 -0.01 0.00 0.00 39.48 39.44 3ioy n PHE 127 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3ioy h VAL 128 N 0.00 1.18 -0.20 -4.37 2.07 -1.26 -0.64 116.25 113.03 3ioy h VAL 128 Ca -0.40 -0.51 -0.05 0.00 0.82 0.00 0.00 66.70 66.56 3ioy h VAL 128 Cb 1.63 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 3ioy h VAL 128 CO -0.06 0.20 -0.09 -0.65 0.02 0.00 0.00 177.57 176.99 3ioy h PRO 129 N 0.62 0.31 0.04 1.57 0.11 -1.78 0.16 132.00 133.04 3ioy h PRO 129 Ca 0.16 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.20 3ioy h PRO 129 Cb 0.11 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.17 3ioy h PRO 129 CO -0.02 0.41 -0.02 0.00 -0.21 0.00 0.00 178.00 178.16 3ioy h ARG 130 N 0.30 -0.06 -0.40 1.05 3.08 -1.67 -1.53 114.38 115.15 3ioy h ARG 130 Ca 0.06 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.16 3ioy h ARG 130 Cb 0.35 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 3ioy h ARG 130 CO 0.02 0.05 0.14 0.52 -1.07 0.00 0.00 179.97 179.63 3ioy h MET 131 N -0.15 0.29 -0.75 0.04 2.86 -0.33 -0.70 114.93 116.19 3ioy h MET 131 Ca -0.01 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 3ioy h MET 131 Cb 0.14 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 3ioy h MET 131 CO 0.01 0.19 0.33 0.28 1.06 0.00 0.00 176.91 178.79 3ioy h VAL 132 N 0.30 1.24 -0.35 -2.22 2.07 -0.65 -0.54 116.25 116.10 3ioy h VAL 132 Ca 0.18 -0.73 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 3ioy h VAL 132 Cb 0.16 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3ioy h VAL 132 CO -0.19 0.30 0.06 -0.33 0.02 0.00 0.00 177.57 177.43 3ioy h GLU 133 N 1.08 0.58 -0.17 1.57 5.08 -0.74 -1.65 114.58 120.33 3ioy h GLU 133 Ca 0.26 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 3ioy h GLU 133 Cb 0.15 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3ioy h GLU 133 CO -0.03 0.66 -0.10 0.00 -1.00 0.00 0.00 179.01 178.54 3ioy h ARG 134 N 0.42 0.26 0.03 2.33 3.08 -0.75 -2.06 114.38 117.69 3ioy h ARG 134 Ca 0.11 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 3ioy h ARG 134 Cb 0.36 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3ioy h ARG 134 CO 0.01 0.37 -0.01 0.28 -1.07 0.00 0.00 179.97 179.55 3ioy h VAL 135 N 0.25 1.38 -0.24 2.04 2.07 -0.91 0.35 116.25 121.19 3ioy h VAL 135 Ca 0.05 -1.35 0.07 0.00 0.82 0.00 0.00 66.70 66.29 3ioy h VAL 135 Cb 0.34 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 3ioy h VAL 135 CO 0.02 0.34 0.25 0.11 0.02 0.00 0.00 177.57 178.30 3ioy h LYS 136 N -0.63 0.00 -0.01 1.57 1.57 -1.28 -1.04 116.57 116.75 3ioy h LYS 136 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3ioy h LYS 136 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 3ioy h LYS 136 CO 0.01 0.00 -0.13 0.00 -0.57 0.00 0.00 179.45 178.75 3ioy n ALA 137 N -2.37 2.83 -1.07 3.86 0.00 -0.78 -4.92 120.51 118.06 3ioy n ALA 137 Ca 0.03 -0.38 -0.02 0.00 0.00 0.00 0.00 53.44 53.06 3ioy n ALA 137 Cb 0.38 -1.20 -0.01 0.00 0.00 0.00 0.00 19.45 18.62 3ioy n ALA 137 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ioy n GLY 138 N 1.26 0.47 0.07 0.00 0.00 -0.39 -4.90 105.19 101.70 3ioy n GLY 138 Ca 0.15 -0.13 0.12 0.00 0.00 0.00 0.00 46.02 46.16 3ioy n GLY 138 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ioy h GLU 139 N 0.40 0.00 -4.33 1.61 5.08 -0.57 -3.46 114.58 113.31 3ioy h GLU 139 Ca -0.05 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.97 3ioy h GLU 139 Cb 0.52 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 29.48 3ioy h GLU 139 CO 0.07 0.00 -0.76 -1.14 -1.00 0.00 0.00 179.01 176.18 3ioy s GLN 140 N -3.20 0.48 -0.21 2.33 0.74 -0.53 -4.94 119.66 114.32 3ioy s GLN 140 Ca 0.05 -0.19 0.01 0.00 0.05 0.00 0.00 55.36 55.28 3ioy s GLN 140 Cb 0.13 -0.47 0.05 0.00 1.10 0.00 0.00 33.01 33.81 3ioy s GLN 140 CO 0.74 0.11 -0.11 0.21 -0.55 0.00 0.00 175.29 175.69 3ioy s LYS 141 N -0.05 2.13 0.00 1.67 2.47 -1.26 -4.17 119.74 120.52 3ioy s LYS 141 Ca 0.01 -0.96 0.00 0.00 -1.56 0.00 0.00 55.97 53.46 3ioy s LYS 141 Cb -0.03 -2.55 0.00 0.00 -1.46 0.00 0.00 37.83 33.79 3ioy s LYS 141 CO -0.00 -0.45 0.00 0.41 0.16 0.00 0.00 175.35 175.46 3ioy n GLY 142 N 4.62 -1.46 0.00 5.54 0.00 -1.26 -4.99 105.19 107.64 3ioy n GLY 142 Ca -0.15 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.31 3ioy n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ioy n GLY 143 N -1.69 2.02 3.23 -0.02 0.00 -1.25 -4.92 105.19 102.56 3ioy n GLY 143 Ca 0.00 -1.29 -0.13 0.00 0.00 0.00 0.00 46.02 44.60 3ioy n GLY 143 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ioy s HIS 144 N -1.97 -0.16 -0.14 1.61 2.46 -0.30 -0.75 115.29 116.04 3ioy s HIS 144 Ca 0.00 0.22 0.01 0.00 0.47 0.00 0.00 55.06 55.76 3ioy s HIS 144 Cb 0.00 0.08 0.02 0.00 -0.13 0.00 0.00 32.58 32.55 3ioy s HIS 144 CO 0.00 -0.39 -0.16 0.08 -2.47 0.00 0.00 174.74 171.81 3ioy s VAL 145 N -1.38 1.66 -0.19 0.89 1.01 0.22 -1.17 120.40 121.45 3ioy s VAL 145 Ca -0.13 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.11 3ioy s VAL 145 Cb -0.05 -1.53 -0.02 0.00 0.00 0.00 0.00 36.38 34.78 3ioy s VAL 145 CO 0.04 0.47 -0.05 -0.69 0.00 0.00 0.00 175.10 174.87 3ioy s VAL 146 N 1.31 3.52 -0.17 2.92 1.01 0.25 -0.98 120.40 128.27 3ioy s VAL 146 Ca 0.02 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.51 3ioy s VAL 146 Cb -0.13 -2.56 -0.01 0.00 0.00 0.00 0.00 36.38 33.67 3ioy s VAL 146 CO -0.09 0.46 -0.09 0.20 0.00 0.00 0.00 175.10 175.58 3ioy s ASN 147 N 0.94 4.16 -0.56 3.32 0.01 -0.39 -0.73 114.94 121.69 3ioy s ASN 147 Ca -0.00 -0.35 -0.27 0.00 -0.71 0.00 0.00 52.86 51.53 3ioy s ASN 147 Cb -0.15 -1.67 0.03 0.00 0.41 0.00 0.00 41.25 39.87 3ioy s ASN 147 CO 0.01 0.08 1.09 -0.89 -1.51 0.00 0.00 177.10 175.88 3ioy s THR 148 N 0.88 4.17 0.00 1.60 2.01 -0.56 -1.11 115.64 122.64 3ioy s THR 148 Ca -0.02 0.69 0.00 0.00 0.31 0.00 0.00 61.69 62.66 3ioy s THR 148 Cb -0.15 -4.65 0.00 0.00 0.01 0.00 0.00 72.50 67.72 3ioy s THR 148 CO 0.00 -1.23 0.00 0.00 -0.69 0.00 0.00 174.62 172.70 3ioy n ALA 149 N 8.02 0.00 0.00 7.40 0.00 0.18 -4.90 120.51 131.21 3ioy n ALA 149 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3ioy n ALA 149 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 3ioy n ALA 149 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3ioy n SER 150 N 0.00 0.00 0.28 0.00 2.88 -1.20 -4.64 113.62 110.93 3ioy n SER 150 Ca 0.00 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.73 3ioy n SER 150 Cb 0.00 0.00 0.96 0.00 -0.75 0.00 0.00 64.21 64.42 3ioy n SER 150 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 3ioy h MET 151 N 0.00 0.00 0.00 -1.46 2.86 -1.42 -0.71 114.93 114.21 3ioy h MET 151 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3ioy h MET 151 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3ioy h MET 151 CO 0.00 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.97 3ioy n ALA 152 N -1.99 1.04 1.64 6.32 0.00 -1.26 -0.14 120.51 126.13 3ioy n ALA 152 Ca -0.02 0.15 0.14 0.00 0.00 0.00 0.00 53.44 53.71 3ioy n ALA 152 Cb 0.10 -1.25 0.80 0.00 0.00 0.00 0.00 19.45 19.11 3ioy n ALA 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ioy n ALA 153 N -1.71 2.50 0.00 0.00 0.00 -0.27 -4.07 120.51 116.96 3ioy n ALA 153 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3ioy n ALA 153 Cb 0.03 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.02 3ioy n ALA 153 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3ioy n PHE 154 N -1.08 0.00 -3.79 0.00 3.72 -0.05 -4.66 117.46 111.59 3ioy n PHE 154 Ca 0.19 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.23 3ioy n PHE 154 Cb 0.13 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.56 3ioy n PHE 154 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3ioy s LEU 155 N -3.70 5.17 -0.30 4.37 1.43 0.80 -5.05 118.68 121.41 3ioy s LEU 155 Ca 0.00 -2.27 -0.04 0.00 -1.03 0.00 0.00 54.13 50.79 3ioy s LEU 155 Cb 0.00 -1.81 0.03 0.00 0.03 0.00 0.00 46.19 44.44 3ioy s LEU 155 CO 0.00 -0.48 0.03 0.00 0.23 0.00 0.00 176.35 176.13 3ioy s ALA 156 N 0.79 2.90 0.00 4.21 0.00 -1.26 -4.26 121.76 124.13 3ioy s ALA 156 Ca 0.11 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.45 3ioy s ALA 156 Cb -0.22 -2.01 0.00 0.00 0.00 0.00 0.00 23.12 20.89 3ioy s ALA 156 CO -0.04 -1.10 0.00 0.00 0.00 0.00 0.00 175.76 174.61 3ioy n ALA 157 N 4.74 0.00 -0.02 0.00 0.00 -1.26 -5.05 120.51 118.92 3ioy n ALA 157 Ca -0.14 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.21 3ioy n ALA 157 Cb 0.46 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.87 3ioy n ALA 157 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3ioy h GLY 158 N 0.00 0.09 -3.85 0.00 0.00 -1.98 -3.43 103.07 93.90 3ioy h GLY 158 Ca 0.00 0.07 -0.69 0.00 0.00 0.00 0.00 47.33 46.72 3ioy h GLY 158 CO 0.00 -0.08 -0.87 -0.56 0.00 0.00 0.00 176.54 175.04 3ioy s SER 159 N -5.18 3.32 -0.47 0.19 0.01 -1.26 -3.49 113.70 106.82 3ioy s SER 159 Ca -0.14 -0.76 -0.24 0.00 1.31 0.00 0.00 55.95 56.13 3ioy s SER 159 Cb 0.10 -0.22 0.03 0.00 0.21 0.00 0.00 66.02 66.14 3ioy s SER 159 CO 0.68 0.17 0.85 -2.16 0.41 0.00 0.00 173.24 173.20 3ioy s PRO 160 N -2.11 3.42 0.05 12.44 0.04 -1.26 -4.96 135.00 142.62 3ioy s PRO 160 Ca 0.14 -0.07 -0.25 0.00 0.04 0.00 0.00 61.00 60.86 3ioy s PRO 160 Cb -0.10 -3.96 -0.17 0.00 0.04 0.00 0.00 34.50 30.31 3ioy s PRO 160 CO 0.06 -1.22 1.53 0.78 0.04 0.00 0.00 177.00 178.18 3ioy h GLY 161 N 10.42 -0.14 0.89 0.56 0.00 -1.26 -0.63 103.07 112.90 3ioy h GLY 161 Ca -0.25 0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 3ioy h GLY 161 CO 1.01 -0.05 0.08 -2.22 0.00 0.00 0.00 176.54 175.35 3ioy h ILE 162 N -0.32 1.17 -0.51 2.60 2.04 -1.89 -1.74 117.51 118.86 3ioy h ILE 162 Ca -0.01 -0.51 0.10 0.00 1.00 0.00 0.00 64.86 65.44 3ioy h ILE 162 Cb 0.27 1.14 -0.10 0.00 -0.74 0.00 0.00 36.82 37.39 3ioy h ILE 162 CO 0.02 0.16 -0.19 0.22 0.00 0.00 0.00 178.15 178.37 3ioy h TYR 163 N 0.16 -0.45 -0.90 1.37 3.20 -1.81 -0.83 116.97 117.71 3ioy h TYR 163 Ca 0.07 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 3ioy h TYR 163 Cb 0.19 0.28 -0.04 0.00 1.54 0.00 0.00 36.73 38.69 3ioy h TYR 163 CO -0.01 -0.28 0.53 -0.91 -1.64 0.00 0.00 178.16 175.85 3ioy h ASN 164 N -0.07 1.10 -0.21 -2.11 2.35 -1.00 0.15 115.58 115.80 3ioy h ASN 164 Ca 0.24 -0.08 0.02 0.00 -0.55 0.00 0.00 56.30 55.93 3ioy h ASN 164 Cb 0.44 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 3ioy h ASN 164 CO -0.56 0.86 0.08 0.74 -1.65 0.00 0.00 177.43 176.90 3ioy h THR 165 N 1.25 0.97 -0.03 2.81 2.02 -0.35 -0.76 112.91 118.82 3ioy h THR 165 Ca 0.32 -0.06 -0.10 0.00 0.77 0.00 0.00 66.41 67.34 3ioy h THR 165 Cb -0.02 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 3ioy h THR 165 CO -0.06 0.03 -0.46 0.71 0.37 0.00 0.00 175.52 176.12 3ioy h THR 166 N 0.18 1.33 -0.04 3.16 1.35 -0.09 -1.78 112.91 117.02 3ioy h THR 166 Ca 0.09 -1.60 -0.23 0.00 -0.55 0.00 0.00 66.41 64.12 3ioy h THR 166 Cb 0.04 1.83 0.01 0.00 -1.73 0.00 0.00 68.15 68.30 3ioy h THR 166 CO -0.08 0.46 -0.91 0.11 -0.25 0.00 0.00 175.52 174.85 3ioy h LYS 167 N 0.05 0.57 -0.56 4.72 1.79 -0.70 -1.26 116.57 121.18 3ioy h LYS 167 Ca 0.00 -0.56 -0.01 0.00 -2.18 0.00 0.00 60.65 57.90 3ioy h LYS 167 Cb 0.84 0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 31.60 3ioy h LYS 167 CO 0.06 1.18 0.29 0.74 -1.08 0.00 0.00 179.45 180.64 3ioy h PHE 168 N 0.34 0.78 -0.36 -1.35 -1.00 -1.08 -1.52 116.94 112.75 3ioy h PHE 168 Ca -0.08 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.67 3ioy h PHE 168 Cb 1.54 -0.25 -0.02 0.00 3.61 0.00 0.00 35.95 40.84 3ioy h PHE 168 CO 0.07 0.58 0.23 0.00 -1.61 0.00 0.00 178.31 177.59 3ioy h ALA 169 N 1.13 0.46 -0.92 2.45 0.00 -1.22 -1.27 119.26 119.88 3ioy h ALA 169 Ca 0.19 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3ioy h ALA 169 Cb 0.07 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 3ioy h ALA 169 CO -0.03 -0.06 0.61 0.28 0.00 0.00 0.00 179.25 180.05 3ioy h VAL 170 N 0.48 1.17 -0.21 0.00 2.07 -1.04 -0.34 116.25 118.38 3ioy h VAL 170 Ca 0.13 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 3ioy h VAL 170 Cb -0.02 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.63 3ioy h VAL 170 CO -0.03 0.21 0.10 -0.09 0.02 0.00 0.00 177.57 177.79 3ioy h ARG 171 N 1.18 0.30 -0.67 1.57 2.43 -0.79 0.33 114.38 118.71 3ioy h ARG 171 Ca 0.36 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.43 3ioy h ARG 171 Cb -0.01 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 3ioy h ARG 171 CO -0.11 0.32 0.20 0.78 -1.51 0.00 0.00 179.97 179.66 3ioy h GLY 172 N 0.20 1.13 0.88 2.80 0.00 -0.76 -0.08 103.07 107.25 3ioy h GLY 172 Ca 0.07 -0.68 0.01 0.00 0.00 0.00 0.00 47.33 46.73 3ioy h GLY 172 CO -0.01 0.63 -0.07 -2.00 0.00 0.00 0.00 176.54 175.09 3ioy h LEU 173 N 0.99 -0.20 -0.81 3.11 6.46 -0.97 -2.11 115.31 121.78 3ioy h LEU 173 Ca 0.22 0.02 -0.08 0.00 -0.12 0.00 0.00 57.88 57.92 3ioy h LEU 173 Cb 0.31 0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.29 3ioy h LEU 173 CO -0.01 -0.11 0.06 0.28 -0.62 0.00 0.00 178.44 178.04 3ioy h SER 174 N -0.16 0.91 -0.20 1.25 0.02 -0.50 0.16 113.55 115.04 3ioy h SER 174 Ca 0.01 -0.22 -0.06 0.00 -0.84 0.00 0.00 61.79 60.68 3ioy h SER 174 Cb 0.16 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.46 3ioy h SER 174 CO -0.03 0.94 -0.12 -0.33 -1.14 0.00 0.00 176.83 176.14 3ioy h GLU 175 N 0.89 0.44 -0.17 3.45 5.08 -1.04 0.25 114.58 123.49 3ioy h GLU 175 Ca 0.18 -0.20 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 3ioy h GLU 175 Cb 0.44 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 3ioy h GLU 175 CO 0.02 0.74 0.05 0.77 -1.00 0.00 0.00 179.01 179.59 3ioy h SER 176 N 0.13 0.06 -0.58 1.42 0.02 -1.10 -2.57 113.55 110.94 3ioy h SER 176 Ca 0.04 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 3ioy h SER 176 Cb 0.62 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.15 3ioy h SER 176 CO 0.03 0.06 0.28 0.25 -1.14 0.00 0.00 176.83 176.31 3ioy h LEU 177 N 0.13 0.75 -0.47 5.07 5.85 -0.93 -1.69 115.31 124.02 3ioy h LEU 177 Ca 0.07 -0.13 0.09 0.00 0.84 0.00 0.00 57.88 58.76 3ioy h LEU 177 Cb 0.04 -0.19 -0.10 0.00 0.37 0.00 0.00 40.66 40.78 3ioy h LEU 177 CO -0.08 0.67 -0.26 -0.74 -0.34 0.00 0.00 178.44 177.70 3ioy h HIS 178 N 0.79 -0.67 -0.37 1.25 2.76 -0.74 -0.64 115.15 117.52 3ioy h HIS 178 Ca 0.20 0.06 -0.11 0.00 -2.20 0.00 0.00 60.37 58.31 3ioy h HIS 178 Cb 0.11 0.37 -0.01 0.00 1.55 0.00 0.00 27.41 29.43 3ioy h HIS 178 CO -0.00 -0.33 -0.22 1.88 -1.30 0.00 0.00 177.93 177.95 3ioy h TYR 179 N -0.15 0.83 0.00 5.26 0.05 -1.07 -3.10 116.97 118.79 3ioy h TYR 179 Ca 0.22 -0.18 -0.13 0.00 0.05 0.00 0.00 58.73 58.68 3ioy h TYR 179 Cb 0.50 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 38.02 3ioy h TYR 179 CO -0.52 0.89 -0.60 0.66 -1.05 0.00 0.00 178.16 177.54 3ioy h SER 180 N 0.64 0.00 0.26 3.88 4.64 -0.99 -3.24 113.55 118.75 3ioy h SER 180 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3ioy h SER 180 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3ioy h SER 180 CO 0.06 0.60 -0.34 0.18 -0.87 0.00 0.00 176.83 176.46 3ioy n LEU 181 N -3.69 1.01 -0.18 5.97 4.77 -0.28 -4.27 117.00 120.33 3ioy n LEU 181 Ca -0.01 -0.26 -0.00 0.00 -0.03 0.00 0.00 56.01 55.71 3ioy n LEU 181 Cb 0.63 -0.13 0.09 0.00 -2.33 0.00 0.00 43.42 41.67 3ioy n LEU 181 CO 0.41 0.20 0.85 -0.07 -1.33 0.00 0.00 177.39 177.45 3ioy h LEU 182 N 1.05 -0.20 -1.92 2.23 3.38 -1.56 -1.74 115.31 116.55 3ioy h LEU 182 Ca 0.00 0.13 0.13 0.00 0.09 0.00 0.00 57.88 58.24 3ioy h LEU 182 Cb 0.52 0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 3ioy h LEU 182 CO 0.00 -0.08 0.36 0.07 0.09 0.00 0.00 178.44 178.89 3ioy h LYS 183 N 0.14 0.08 -0.19 1.13 2.10 -1.82 0.15 116.57 118.16 3ioy h LYS 183 Ca 0.29 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.94 3ioy h LYS 183 Cb 0.45 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.77 3ioy h LYS 183 CO -0.46 0.05 0.00 0.66 -2.00 0.00 0.00 179.45 177.70 3ioy n TYR 184 N -4.41 0.24 -3.48 0.07 4.01 -0.69 -4.96 117.16 107.93 3ioy n TYR 184 Ca 0.09 -0.12 -0.25 0.00 -0.16 0.00 0.00 57.90 57.46 3ioy n TYR 184 Cb 0.53 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.55 3ioy n TYR 184 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3ioy n GLU 185 N 0.64 -3.47 -3.60 -0.72 1.02 0.51 -4.61 120.64 110.40 3ioy n GLU 185 Ca 0.17 0.47 -0.37 0.00 -0.02 0.00 0.00 57.16 57.41 3ioy n GLU 185 Cb 0.41 -5.19 -0.10 0.00 -0.02 0.00 0.00 31.44 26.55 3ioy n GLU 185 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3ioy s ILE 186 N -2.99 5.32 0.47 -3.67 1.01 -1.10 -3.85 121.20 116.41 3ioy s ILE 186 Ca 0.45 0.25 -0.18 0.00 0.00 0.00 0.00 60.65 61.17 3ioy s ILE 186 Cb -0.24 -3.54 -0.09 0.00 0.01 0.00 0.00 42.46 38.60 3ioy s ILE 186 CO 0.56 0.30 0.95 -0.83 0.00 0.00 0.00 174.94 175.92 3ioy s GLY 187 N 1.25 2.19 -0.02 6.18 0.00 0.07 -4.32 107.32 112.66 3ioy s GLY 187 Ca 0.09 0.23 -0.00 0.00 0.00 0.00 0.00 44.72 45.04 3ioy s GLY 187 CO 0.07 0.50 0.04 0.14 0.00 0.00 0.00 173.10 173.84 3ioy s VAL 188 N -2.42 -0.07 0.05 1.40 1.01 -1.26 -0.61 120.40 118.50 3ioy s VAL 188 Ca 0.59 0.25 0.06 0.00 0.00 0.00 0.00 61.98 62.88 3ioy s VAL 188 Cb -0.10 -0.10 -0.02 0.00 0.00 0.00 0.00 36.38 36.16 3ioy s VAL 188 CO 0.24 0.10 -0.18 -0.44 0.00 0.00 0.00 175.10 174.83 3ioy s SER 189 N 1.25 2.11 -0.21 3.32 0.01 -0.15 -4.40 113.70 115.62 3ioy s SER 189 Ca -0.07 -0.50 -0.02 0.00 1.31 0.00 0.00 55.95 56.67 3ioy s SER 189 Cb -0.13 -0.16 0.01 0.00 0.21 0.00 0.00 66.02 65.95 3ioy s SER 189 CO -0.03 0.10 -0.10 0.54 0.41 0.00 0.00 173.24 174.16 3ioy s VAL 190 N -0.85 2.85 -0.18 3.43 0.11 0.57 -1.26 120.40 125.06 3ioy s VAL 190 Ca 0.05 -0.75 -0.25 0.00 -2.93 0.00 0.00 61.98 58.09 3ioy s VAL 190 Cb -0.08 -2.31 -0.01 0.00 -1.53 0.00 0.00 36.38 32.45 3ioy s VAL 190 CO 0.02 0.41 0.83 -0.22 -3.33 0.00 0.00 175.10 172.80 3ioy s LEU 191 N 1.39 4.15 -0.61 2.54 2.96 -0.27 -1.30 118.68 127.55 3ioy s LEU 191 Ca 0.04 1.14 0.06 0.00 -0.22 0.00 0.00 54.13 55.15 3ioy s LEU 191 Cb -0.14 -3.22 0.26 0.00 0.50 0.00 0.00 46.19 43.59 3ioy s LEU 191 CO -0.07 -0.42 0.74 0.00 -1.32 0.00 0.00 176.35 175.28 3ioy s PRO 193 N -2.42 2.73 0.00 0.00 0.04 -1.26 -3.96 135.00 130.13 3ioy s PRO 193 Ca 0.40 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.78 3ioy s PRO 193 Cb 0.16 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.76 3ioy s PRO 193 CO -0.03 -1.30 0.00 0.41 0.04 0.00 0.00 177.00 176.12 3ioy n GLY 194 N -0.67 1.31 3.68 0.56 0.00 -1.26 -1.58 105.19 107.23 3ioy n GLY 194 Ca 0.10 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.18 3ioy n GLY 194 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ioy s LEU 195 N 0.00 4.38 -0.04 0.99 1.43 -1.26 -4.94 118.68 119.23 3ioy s LEU 195 Ca 0.00 2.53 -0.03 0.00 -1.03 0.00 0.00 54.13 55.61 3ioy s LEU 195 Cb 0.00 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.63 3ioy s LEU 195 CO 0.00 -0.94 0.11 -0.69 0.23 0.00 0.00 176.35 175.06 3ioy s VAL 196 N 3.11 5.02 -0.02 -1.59 1.01 -1.26 -0.20 120.40 126.46 3ioy s VAL 196 Ca 0.77 -0.19 -0.33 0.00 0.00 0.00 0.00 61.98 62.24 3ioy s VAL 196 Cb -0.41 -3.26 -0.11 0.00 0.00 0.00 0.00 36.38 32.61 3ioy s VAL 196 CO 0.34 0.44 1.90 1.17 0.00 0.00 0.00 175.10 178.95 3ioy n LYS 197 N 1.43 2.45 0.00 2.72 4.81 0.40 -4.54 118.16 125.42 3ioy n LYS 197 Ca -0.15 0.90 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 3ioy n LYS 197 Cb 0.53 -2.78 0.00 0.00 0.02 0.00 0.00 35.03 32.80 3ioy n LYS 197 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3ioy n ALA 227 N 6.76 0.00 -0.86 3.14 0.00 -1.26 -4.95 120.51 123.34 3ioy n ALA 227 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 3ioy n ALA 227 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.79 3ioy n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ioy n GLY 228 N 0.44 0.53 0.18 0.00 0.00 -1.26 -4.96 105.19 100.12 3ioy n GLY 228 Ca 0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 46.02 45.53 3ioy n GLY 228 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ioy h VAL 229 N 0.00 0.63 0.00 1.61 2.07 -2.04 -1.20 116.25 117.32 3ioy h VAL 229 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3ioy h VAL 229 Cb 0.00 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 3ioy h VAL 229 CO 0.00 0.00 0.14 0.00 0.02 0.00 0.00 177.57 177.73 3ioy n HIS 230 N -5.28 0.04 -0.10 1.57 -0.00 -1.26 -2.87 115.22 107.32 3ioy n HIS 230 Ca -0.03 0.02 -0.12 0.00 -0.00 0.00 0.00 57.72 57.59 3ioy n HIS 230 Cb 0.20 -0.40 -0.15 0.00 -0.00 0.00 0.00 29.99 29.64 3ioy n HIS 230 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 3ioy n GLU 231 N -1.43 0.68 -0.53 -1.40 -0.58 -0.46 -4.52 120.64 112.41 3ioy n GLU 231 Ca -0.00 0.05 0.08 0.00 -0.42 0.00 0.00 57.16 56.87 3ioy n GLU 231 Cb 0.14 -1.54 0.30 0.00 -0.57 0.00 0.00 31.44 29.78 3ioy n GLU 231 CO 0.00 0.00 0.00 1.97 -0.48 0.00 0.00 177.13 178.62 3ioy n PHE 232 N -2.91 1.24 -1.04 -0.32 -1.74 -1.14 -4.99 117.46 106.57 3ioy n PHE 232 Ca -0.35 -0.68 -0.31 0.00 -0.56 0.00 0.00 57.45 55.55 3ioy n PHE 232 Cb 1.11 -0.26 0.13 0.00 1.52 0.00 0.00 39.48 41.98 3ioy n PHE 232 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 3ioy s GLY 233 N -1.20 1.66 0.33 4.97 0.00 -1.25 -4.92 107.32 106.91 3ioy s GLY 233 Ca 0.44 0.29 -0.28 0.00 0.00 0.00 0.00 44.72 45.17 3ioy s GLY 233 CO 0.18 0.70 1.23 -0.29 0.00 0.00 0.00 173.10 174.92 3ioy s MET 234 N -4.81 4.38 0.17 2.90 1.75 0.71 -3.65 119.30 120.76 3ioy s MET 234 Ca 0.64 2.05 -0.30 0.00 -1.25 0.00 0.00 55.69 56.82 3ioy s MET 234 Cb -0.19 -3.04 -0.08 0.00 2.84 0.00 0.00 34.83 34.36 3ioy s MET 234 CO 0.57 -0.11 1.31 -1.21 -0.65 0.00 0.00 175.02 174.94 3ioy s GLU 235 N -1.78 4.38 0.39 4.11 0.41 -1.26 -0.46 118.70 124.49 3ioy s GLU 235 Ca 0.49 2.03 0.17 0.00 -0.41 0.00 0.00 54.97 57.25 3ioy s GLU 235 Cb -0.36 -3.22 1.05 0.00 -1.78 0.00 0.00 34.13 29.82 3ioy s GLU 235 CO 0.48 -0.28 1.79 -1.35 -0.49 0.00 0.00 175.26 175.40 3ioy h PRO 236 N 5.72 0.43 -0.21 0.39 0.11 -1.93 -0.63 132.00 135.88 3ioy h PRO 236 Ca -0.44 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 3ioy h PRO 236 Cb 1.21 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3ioy h PRO 236 CO 0.79 0.29 -0.28 -0.44 -0.21 0.00 0.00 178.00 178.15 3ioy h ASP 237 N 0.44 0.41 -0.18 -2.05 3.32 -1.92 0.23 116.42 116.68 3ioy h ASP 237 Ca 0.57 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 57.36 3ioy h ASP 237 Cb 1.36 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.80 3ioy h ASP 237 CO -0.28 0.68 -0.33 0.58 -1.72 0.00 0.00 179.24 178.16 3ioy h VAL 238 N 0.36 1.34 -0.36 -1.35 2.07 -1.54 -1.72 116.25 115.05 3ioy h VAL 238 Ca 0.05 -1.57 0.04 0.00 0.82 0.00 0.00 66.70 66.04 3ioy h VAL 238 Cb 0.67 1.90 -0.04 0.00 -1.52 0.00 0.00 31.29 32.31 3ioy h VAL 238 CO 0.05 0.48 0.15 0.40 0.02 0.00 0.00 177.57 178.67 3ioy h ILE 239 N 0.20 0.93 -0.45 4.57 2.04 -1.04 -2.63 117.51 121.14 3ioy h ILE 239 Ca 0.01 -0.11 0.09 0.00 1.00 0.00 0.00 64.86 65.85 3ioy h ILE 239 Cb 0.93 0.59 -0.07 0.00 -0.74 0.00 0.00 36.82 37.52 3ioy h ILE 239 CO 0.08 0.06 -0.00 1.23 0.00 0.00 0.00 178.15 179.51 3ioy h GLY 240 N 0.32 0.45 0.94 5.37 0.00 -0.39 -0.56 103.07 109.20 3ioy h GLY 240 Ca 0.16 0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.56 3ioy h GLY 240 CO -0.14 -0.12 0.40 0.00 0.00 0.00 0.00 176.54 176.68 3ioy h ALA 241 N 1.40 0.81 -0.28 3.60 0.00 -1.24 -1.10 119.26 122.45 3ioy h ALA 241 Ca 0.23 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 3ioy h ALA 241 Cb 0.33 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3ioy h ALA 241 CO -0.38 0.19 -0.20 0.00 0.00 0.00 0.00 179.25 178.86 3ioy h ARG 242 N 0.81 0.51 -0.15 0.00 3.08 -1.04 -2.18 114.38 115.41 3ioy h ARG 242 Ca 0.24 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 3ioy h ARG 242 Cb -0.04 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 3ioy h ARG 242 CO -0.08 0.68 0.04 0.28 -1.07 0.00 0.00 179.97 179.83 3ioy h VAL 243 N 0.46 1.19 -0.37 2.04 2.07 -0.59 -1.57 116.25 119.47 3ioy h VAL 243 Ca 0.07 -0.59 0.04 0.00 0.82 0.00 0.00 66.70 67.04 3ioy h VAL 243 Cb 0.60 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 3ioy h VAL 243 CO 0.04 0.18 0.13 0.40 0.02 0.00 0.00 177.57 178.34 3ioy h ILE 244 N 0.06 0.90 -0.34 4.57 2.04 -0.78 0.19 117.51 124.14 3ioy h ILE 244 Ca 0.05 -0.10 0.03 0.00 1.00 0.00 0.00 64.86 65.84 3ioy h ILE 244 Cb 0.24 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 3ioy h ILE 244 CO -0.00 0.05 0.16 -0.08 0.00 0.00 0.00 178.15 178.29 3ioy h GLU 245 N 0.29 0.33 -0.87 2.37 4.22 -1.39 -1.42 114.58 118.10 3ioy h GLU 245 Ca 0.17 -0.02 -0.02 0.00 0.08 0.00 0.00 59.36 59.57 3ioy h GLU 245 Cb 0.14 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 3ioy h GLU 245 CO -0.17 0.22 0.45 0.00 -2.18 0.00 0.00 179.01 177.33 3ioy h ALA 246 N 1.19 1.12 -0.56 2.92 0.00 -0.67 -2.27 119.26 120.98 3ioy h ALA 246 Ca 0.15 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.95 3ioy h ALA 246 Cb 0.07 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 3ioy h ALA 246 CO -0.11 0.65 0.31 0.52 0.00 0.00 0.00 179.25 180.63 3ioy h MET 247 N 1.23 0.59 -0.40 0.00 2.86 -0.27 -1.82 114.93 117.11 3ioy h MET 247 Ca 0.30 -0.04 0.08 0.00 -2.06 0.00 0.00 59.70 57.99 3ioy h MET 247 Cb 0.07 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 3ioy h MET 247 CO -0.04 0.39 0.28 0.87 1.06 0.00 0.00 176.91 179.46 3ioy h LYS 248 N 0.61 0.20 -0.01 1.72 1.57 -0.74 -1.46 116.57 118.46 3ioy h LYS 248 Ca 0.24 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3ioy h LYS 248 Cb 0.10 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3ioy h LYS 248 CO -0.14 0.13 -0.09 0.00 -0.57 0.00 0.00 179.45 178.78 3ioy n ALA 249 N -2.55 2.75 -4.40 3.86 0.00 -0.78 -4.04 120.51 115.35 3ioy n ALA 249 Ca 0.06 -0.35 -0.37 0.00 0.00 0.00 0.00 53.44 52.77 3ioy n ALA 249 Cb 0.33 -1.25 -0.08 0.00 0.00 0.00 0.00 19.45 18.45 3ioy n ALA 249 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3ioy n ASN 250 N -0.47 -0.87 -4.68 0.00 5.15 -0.55 -4.91 115.26 108.93 3ioy n ASN 250 Ca 0.17 -1.22 -0.42 0.00 -0.60 0.00 0.00 54.58 52.50 3ioy n ASN 250 Cb 0.30 -1.79 -0.03 0.00 -0.53 0.00 0.00 39.78 37.73 3ioy n ASN 250 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 3ioy s ARG 251 N -7.23 4.27 0.06 1.20 3.52 -0.76 -4.88 118.95 115.14 3ioy s ARG 251 Ca 0.48 1.93 -0.37 0.00 -0.13 0.00 0.00 55.73 57.64 3ioy s ARG 251 Cb -0.28 -3.65 -0.20 0.00 -1.56 0.00 0.00 34.95 29.26 3ioy s ARG 251 CO 1.00 -0.62 1.57 1.25 -0.81 0.00 0.00 175.30 177.70 3ioy h LEU 252 N 8.74 -1.15 -8.82 -0.88 5.85 -1.91 -3.41 115.31 113.74 3ioy h LEU 252 Ca -0.36 0.05 -0.65 0.00 0.84 0.00 0.00 57.88 57.75 3ioy h LEU 252 Cb 1.17 0.31 -0.18 0.00 0.37 0.00 0.00 40.66 42.33 3ioy h LEU 252 CO 0.92 -0.79 -0.52 -1.00 -0.34 0.00 0.00 178.44 176.71 3ioy s HIS 253 N -5.98 3.21 -0.56 1.25 3.76 -1.26 -0.32 115.29 115.40 3ioy s HIS 253 Ca -0.20 -0.03 -0.17 0.00 -0.15 0.00 0.00 55.06 54.51 3ioy s HIS 253 Cb 0.02 -2.40 0.11 0.00 1.11 0.00 0.00 32.58 31.43 3ioy s HIS 253 CO 0.60 -0.24 0.58 0.42 -0.85 0.00 0.00 174.74 175.26 3ioy s ILE 254 N 1.74 5.04 -1.03 0.60 1.01 -0.42 -4.97 121.20 123.17 3ioy s ILE 254 Ca 0.07 -1.23 -0.16 0.00 0.00 0.00 0.00 60.65 59.33 3ioy s ILE 254 Cb -0.16 -4.39 0.16 0.00 0.01 0.00 0.00 42.46 38.08 3ioy s ILE 254 CO 0.10 -0.95 1.21 -0.36 0.00 0.00 0.00 174.94 174.93 3ioy s PHE 255 N 2.08 3.38 0.57 3.97 0.08 -1.26 -1.17 117.98 125.63 3ioy s PHE 255 Ca 0.07 -1.78 0.26 0.00 0.12 0.00 0.00 56.93 55.60 3ioy s PHE 255 Cb -0.27 -4.23 1.68 0.00 -0.57 0.00 0.00 43.02 39.64 3ioy s PHE 255 CO 0.05 -1.38 2.23 0.66 -0.10 0.00 0.00 175.22 176.67 3ioy h SER 256 N 8.02 0.00 -3.46 1.36 4.64 -1.94 -3.40 113.55 118.77 3ioy h SER 256 Ca 0.21 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.88 3ioy h SER 256 Cb 0.96 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.80 3ioy h SER 256 CO 1.12 0.00 -0.69 -1.00 -0.87 0.00 0.00 176.83 175.39 3ioy s HIS 257 N -4.75 3.00 -1.26 4.77 3.76 -1.26 -4.98 115.29 114.58 3ioy s HIS 257 Ca -0.05 -0.71 0.24 0.00 -0.15 0.00 0.00 55.06 54.39 3ioy s HIS 257 Cb 0.16 -2.13 1.13 0.00 1.11 0.00 0.00 32.58 32.85 3ioy s HIS 257 CO 0.58 -0.43 1.78 -0.35 -0.85 0.00 0.00 174.74 175.47 3ioy n PRO 258 N 4.69 0.21 -0.32 8.40 -0.04 -1.26 -4.30 135.00 142.37 3ioy n PRO 258 Ca -0.17 0.07 0.11 0.00 -0.04 0.00 0.00 63.50 63.47 3ioy n PRO 258 Cb 0.51 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.72 3ioy n PRO 258 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3ioy h ASP 259 N 0.00 -0.46 -0.25 3.54 5.19 -1.96 -2.76 116.42 119.72 3ioy h ASP 259 Ca 0.00 0.26 0.00 0.00 -0.62 0.00 0.00 57.03 56.67 3ioy h ASP 259 Cb 0.30 0.45 0.00 0.00 0.18 0.00 0.00 39.33 40.26 3ioy h ASP 259 CO 0.00 -0.30 0.00 1.41 -3.12 0.00 0.00 179.24 177.23 3ioy n HIS 260 N -5.45 0.32 -0.12 4.55 8.25 -1.26 -4.56 115.22 116.94 3ioy n HIS 260 Ca 0.20 -0.16 -0.05 0.00 -0.26 0.00 0.00 57.72 57.45 3ioy n HIS 260 Cb 0.66 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.79 3ioy n HIS 260 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3ioy h LYS 261 N 3.19 -0.04 -0.44 -0.41 3.64 -1.79 0.62 116.57 121.33 3ioy h LYS 261 Ca 0.00 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 3ioy h LYS 261 Cb 0.70 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.51 3ioy h LYS 261 CO 0.00 -0.03 0.05 0.93 -2.27 0.00 0.00 179.45 178.14 3ioy h GLU 262 N -0.04 0.74 -0.11 1.90 3.07 -1.86 -0.85 114.58 117.44 3ioy h GLU 262 Ca 0.19 -0.21 -0.00 0.00 -0.50 0.00 0.00 59.36 58.84 3ioy h GLU 262 Cb 0.34 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.16 3ioy h GLU 262 CO -0.43 0.78 0.06 1.49 -1.40 0.00 0.00 179.01 179.51 3ioy h GLU 263 N 0.60 0.15 -0.49 2.33 4.81 -1.77 -1.92 114.58 118.29 3ioy h GLU 263 Ca 0.13 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 3ioy h GLU 263 Cb 0.41 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 3ioy h GLU 263 CO 0.01 0.16 0.27 1.25 -0.73 0.00 0.00 179.01 179.98 3ioy h LEU 264 N 0.09 0.61 -0.77 1.64 5.85 -0.79 0.20 115.31 122.15 3ioy h LEU 264 Ca 0.04 -0.09 0.11 0.00 0.84 0.00 0.00 57.88 58.78 3ioy h LEU 264 Cb 0.05 -0.16 -0.08 0.00 0.37 0.00 0.00 40.66 40.85 3ioy h LEU 264 CO -0.01 0.52 0.39 -0.09 -0.34 0.00 0.00 178.44 178.92 3ioy h ARG 265 N 0.65 0.61 -0.52 1.25 9.65 -0.93 0.62 114.38 125.71 3ioy h ARG 265 Ca 0.17 -0.04 -0.03 0.00 -1.10 0.00 0.00 59.98 58.99 3ioy h ARG 265 Cb 0.04 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.46 3ioy h ARG 265 CO -0.03 0.41 0.21 1.49 2.80 0.00 0.00 179.97 184.84 3ioy h GLU 266 N 0.63 0.77 -0.57 0.20 4.57 -0.64 -0.42 114.58 119.13 3ioy h GLU 266 Ca 0.39 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.43 3ioy h GLU 266 Cb 0.46 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.89 3ioy h GLU 266 CO -0.30 0.68 0.34 0.28 -1.18 0.00 0.00 179.01 178.83 3ioy h VAL 267 N 0.70 1.17 -0.57 0.32 2.07 -0.25 -0.58 116.25 119.11 3ioy h VAL 267 Ca 0.17 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 3ioy h VAL 267 Cb 0.20 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 3ioy h VAL 267 CO -0.01 0.18 0.26 -0.26 0.02 0.00 0.00 177.57 177.75 3ioy h PHE 268 N 0.76 0.84 -0.57 1.57 0.04 -0.63 -1.89 116.94 117.05 3ioy h PHE 268 Ca 0.20 -0.05 0.02 0.00 2.80 0.00 0.00 57.97 60.95 3ioy h PHE 268 Cb -0.01 -0.26 -0.03 0.00 2.20 0.00 0.00 35.95 37.85 3ioy h PHE 268 CO -0.02 0.65 0.36 -0.44 -0.60 0.00 0.00 178.31 178.26 3ioy h ASP 269 N 0.78 0.59 -0.40 2.17 3.32 -0.52 -1.82 116.42 120.54 3ioy h ASP 269 Ca 0.19 -0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.26 3ioy h ASP 269 Cb 0.14 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 3ioy h ASP 269 CO -0.02 0.42 0.22 -0.33 -1.72 0.00 0.00 179.24 177.81 3ioy h GLU 270 N 0.72 0.44 -0.50 3.56 5.08 -0.90 -0.84 114.58 122.13 3ioy h GLU 270 Ca 0.22 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.60 3ioy h GLU 270 Cb -0.01 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.09 3ioy h GLU 270 CO -0.08 0.29 0.25 0.82 -1.00 0.00 0.00 179.01 179.29 3ioy h ILE 271 N 0.45 0.96 -0.80 3.13 2.04 -1.12 -2.44 117.51 119.73 3ioy h ILE 271 Ca 0.16 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 3ioy h ILE 271 Cb 0.03 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 36.50 3ioy h ILE 271 CO -0.09 0.09 0.39 0.40 0.00 0.00 0.00 178.15 178.94 3ioy h ILE 272 N 0.49 1.25 0.00 -0.67 1.08 -1.09 -1.22 117.51 117.34 3ioy h ILE 272 Ca 0.22 -0.68 0.00 0.00 -0.39 0.00 0.00 64.86 64.01 3ioy h ILE 272 Cb 0.13 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 34.09 3ioy h ILE 272 CO -0.15 0.29 0.06 0.00 -0.69 0.00 0.00 178.15 177.66 3ioy h ALA 273 N 1.29 1.06 0.00 1.87 0.00 -0.70 -1.94 119.26 120.84 3ioy h ALA 273 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3ioy h ALA 273 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3ioy h ALA 273 CO -0.04 -0.06 0.00 0.39 0.00 0.00 0.00 179.25 179.55 3ioy n GLU 274 N -2.72 0.16 -1.99 0.00 1.02 -0.46 -4.79 120.64 111.86 3ioy n GLU 274 Ca -0.02 0.15 -0.41 0.00 -0.02 0.00 0.00 57.16 56.86 3ioy n GLU 274 Cb 0.12 -1.70 -0.02 0.00 -0.02 0.00 0.00 31.44 29.82 3ioy n GLU 274 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3ioy s TYR 275 N -3.07 2.96 0.28 -0.32 2.02 -0.73 -4.99 117.35 113.49 3ioy s TYR 275 Ca 0.11 1.07 0.07 0.00 -0.37 0.00 0.00 57.07 57.95 3ioy s TYR 275 Cb 0.14 -3.84 -0.03 0.00 -0.40 0.00 0.00 41.96 37.83 3ioy s TYR 275 CO 0.55 -2.66 0.30 -0.65 -1.57 0.00 0.00 175.55 171.52 3ioy s GLN 276 N -0.75 3.04 -1.25 -0.62 -1.52 -1.26 -4.98 119.66 112.31 3ioy s GLN 276 Ca 0.58 -1.03 -0.04 0.00 -1.95 0.00 0.00 55.36 52.91 3ioy s GLN 276 Cb -0.43 -2.66 0.17 0.00 -0.22 0.00 0.00 33.01 29.87 3ioy s GLN 276 CO 0.47 0.29 2.24 -0.25 -0.25 0.00 0.00 175.29 177.79 3ioy n ASP 277 N -1.35 7.84 -4.76 5.90 8.00 -1.26 -4.96 116.55 125.97 3ioy n ASP 277 Ca -0.06 -3.27 -0.36 0.00 0.71 0.00 0.00 54.79 51.81 3ioy n ASP 277 Cb 0.58 -1.32 0.03 0.00 -0.02 0.00 0.00 41.12 40.39 3ioy n ASP 277 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3ioy s TYR 278 N -1.90 2.45 0.65 1.24 2.02 -1.26 -5.01 117.35 115.54 3ioy s TYR 278 Ca 0.50 1.50 -0.16 0.00 -0.37 0.00 0.00 57.07 58.54 3ioy s TYR 278 Cb 0.18 -3.51 -0.00 0.00 -0.40 0.00 0.00 41.96 38.23 3ioy s TYR 278 CO -0.10 -2.20 1.13 -1.25 -1.57 0.00 0.00 175.55 171.56 3ioy s PRO 279 N -3.17 2.78 -0.02 -1.71 0.04 -1.26 -4.98 135.00 126.68 3ioy s PRO 279 Ca 0.74 1.50 -0.30 0.00 0.04 0.00 0.00 61.00 62.99 3ioy s PRO 279 Cb -0.31 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.22 3ioy s PRO 279 CO 0.35 -1.28 1.63 0.15 0.04 0.00 0.00 177.00 177.89 3ioy s LYS 280 N -3.91 4.20 0.69 4.56 1.02 -1.26 -5.01 119.74 120.03 3ioy s LYS 280 Ca 0.69 2.21 -0.11 0.00 0.02 0.00 0.00 55.97 58.78 3ioy s LYS 280 Cb -0.23 -3.86 0.00 0.00 -0.52 0.00 0.00 37.83 33.23 3ioy s LYS 280 CO 0.39 -0.79 1.08 0.16 -0.92 0.00 0.00 175.35 175.27 3ioy s ASP 281 N 2.99 5.57 0.11 2.83 -4.77 -1.26 -4.96 116.67 117.17 3ioy s ASP 281 Ca 0.73 1.24 -0.31 0.00 -3.30 0.00 0.00 52.55 50.91 3ioy s ASP 281 Cb -0.35 -2.11 -0.09 0.00 -1.09 0.00 0.00 42.92 39.29 3ioy s ASP 281 CO 0.30 -1.28 1.57 -2.16 0.70 0.00 0.00 175.17 174.31 3ioy s PRO 282 N -5.28 4.22 0.00 2.11 0.04 -1.26 -2.14 135.00 132.69 3ioy s PRO 282 Ca 0.58 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.90 3ioy s PRO 282 Cb -0.11 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.04 3ioy s PRO 282 CO 0.53 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.34 3ioy n GLY 283 N 3.82 0.58 0.09 0.56 0.00 -1.26 -5.00 105.19 103.98 3ioy n GLY 283 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 3ioy n GLY 283 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3ioy h TYR 284 N 0.00 -0.01 -0.33 1.61 3.20 -1.80 -0.84 116.97 118.80 3ioy h TYR 284 Ca 0.00 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 3ioy h TYR 284 Cb 0.00 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 3ioy h TYR 284 CO 0.00 -0.03 0.07 -0.44 -1.64 0.00 0.00 178.16 176.12 3ioy h ASP 285 N 0.05 0.51 -0.75 -2.11 3.45 -1.95 -0.41 116.42 115.21 3ioy h ASP 285 Ca 0.08 -0.24 0.05 0.00 0.43 0.00 0.00 57.03 57.34 3ioy h ASP 285 Cb 0.09 -0.13 -0.05 0.00 -0.56 0.00 0.00 39.33 38.68 3ioy h ASP 285 CO -0.13 0.62 0.45 1.56 -1.57 0.00 0.00 179.24 180.17 3ioy h GLN 286 N 0.37 0.82 -0.21 3.56 4.20 -1.97 -2.05 115.11 119.83 3ioy h GLN 286 Ca 0.10 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 3ioy h GLN 286 Cb 0.32 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 3ioy h GLN 286 CO 0.00 0.54 -0.07 -0.09 -0.67 0.00 0.00 178.83 178.55 3ioy h ARG 287 N 0.84 0.41 -0.00 1.46 2.43 -0.63 -2.43 114.38 116.46 3ioy h ARG 287 Ca 0.32 -0.17 -0.03 0.00 -0.81 0.00 0.00 59.98 59.29 3ioy h ARG 287 Cb 0.13 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 3ioy h ARG 287 CO -0.15 0.67 -0.16 0.28 -1.51 0.00 0.00 179.97 179.10 3ioy h VAL 288 N 0.13 1.12 -0.24 0.20 2.07 -1.05 0.13 116.25 118.60 3ioy h VAL 288 Ca 0.05 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 66.97 3ioy h VAL 288 Cb 0.53 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 3ioy h VAL 288 CO 0.02 0.16 -0.03 0.00 0.02 0.00 0.00 177.57 177.74 3ioy h ALA 289 N 1.84 0.33 -0.58 1.67 0.00 -1.15 -0.49 119.26 120.88 3ioy h ALA 289 Ca -0.00 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 3ioy h ALA 289 Cb 0.29 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3ioy h ALA 289 CO 0.02 0.10 -0.04 0.35 0.00 0.00 0.00 179.25 179.68 3ioy h PHE 290 N 0.21 1.16 -0.26 0.00 3.57 -1.20 -3.15 116.94 117.27 3ioy h PHE 290 Ca 0.07 -0.21 -0.02 0.00 3.53 0.00 0.00 57.97 61.33 3ioy h PHE 290 Cb 0.47 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 3ioy h PHE 290 CO 0.04 1.03 0.07 0.93 -2.23 0.00 0.00 178.31 178.16 3ioy h GLU 291 N 0.95 0.40 0.00 1.11 4.39 -0.55 -1.75 114.58 119.14 3ioy h GLU 291 Ca 0.16 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.77 3ioy h GLU 291 Cb 0.60 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 3ioy h GLU 291 CO 0.04 0.49 0.00 0.87 -1.16 0.00 0.00 179.01 179.24 3ioy h LYS 292 N 0.24 0.00 0.19 2.33 1.79 -1.16 0.70 116.57 120.66 3ioy h LYS 292 Ca 0.08 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.54 3ioy h LYS 292 Cb 0.26 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 3ioy h LYS 292 CO -0.00 0.00 -0.09 0.35 -1.08 0.00 0.00 179.45 178.63 3ioy h PHE 293 N 0.00 -0.24 0.00 -1.35 3.04 -1.27 -2.25 116.94 114.87 3ioy h PHE 293 Ca 0.00 -0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.88 3ioy h PHE 293 Cb 0.10 0.08 -0.01 0.00 2.56 0.00 0.00 35.95 38.68 3ioy h PHE 293 CO 0.00 0.12 -0.29 0.07 -2.02 0.00 0.00 178.31 176.19 3ioy h ARG 294 N -0.95 0.00 -0.83 1.11 -0.00 -1.26 -2.60 114.38 109.85 3ioy h ARG 294 Ca -0.03 0.00 0.04 0.00 -0.00 0.00 0.00 59.98 59.99 3ioy h ARG 294 Cb 0.47 0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 30.39 3ioy h ARG 294 CO 0.04 0.29 0.53 0.00 -0.00 0.00 0.00 179.97 180.83 3ioy h ALA 295 N 1.71 1.10 -0.25 0.08 0.00 -0.94 -1.39 119.26 119.58 3ioy h ALA 295 Ca -0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3ioy h ALA 295 Cb 0.58 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3ioy h ALA 295 CO 0.04 0.34 0.06 -0.44 0.00 0.00 0.00 179.25 179.24 3ioy h ASP 296 N 1.02 0.38 -0.72 0.00 3.32 -1.02 -0.50 116.42 118.90 3ioy h ASP 296 Ca 0.34 -0.24 0.03 0.00 0.02 0.00 0.00 57.03 57.18 3ioy h ASP 296 Cb 0.04 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 3ioy h ASP 296 CO -0.13 0.52 0.47 -1.28 -1.72 0.00 0.00 179.24 177.11 3ioy h SER 297 N 0.23 0.77 0.06 6.45 0.87 -1.33 0.09 113.55 120.68 3ioy h SER 297 Ca 0.08 -0.01 -0.27 0.00 -1.23 0.00 0.00 61.79 60.36 3ioy h SER 297 Cb 0.29 -0.18 0.02 0.00 -0.44 0.00 0.00 62.40 62.09 3ioy h SER 297 CO 0.00 0.53 -1.05 0.15 -0.53 0.00 0.00 176.83 175.93 3ioy h PHE 298 N 0.89 0.99 -0.00 2.24 3.57 -1.04 -1.62 116.94 121.96 3ioy h PHE 298 Ca 0.28 -0.55 -0.09 0.00 3.53 0.00 0.00 57.97 61.14 3ioy h PHE 298 Cb 0.02 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 3ioy h PHE 298 CO -0.00 1.38 -0.45 0.00 -2.23 0.00 0.00 178.31 177.01 3ioy h ALA 299 N 0.44 1.25 0.11 2.41 0.00 -0.92 -1.25 119.26 121.29 3ioy h ALA 299 Ca -0.13 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 3ioy h ALA 299 Cb 1.70 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.42 3ioy h ALA 299 CO 0.20 0.56 -0.05 1.49 0.00 0.00 0.00 179.25 181.45 3ioy h GLU 300 N 0.01 -0.14 -0.98 0.00 4.22 -0.89 -0.45 114.58 116.34 3ioy h GLU 300 Ca -0.00 0.01 0.09 0.00 0.08 0.00 0.00 59.36 59.53 3ioy h GLU 300 Cb 0.80 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 30.01 3ioy h GLU 300 CO 0.06 -0.02 0.63 0.00 -2.18 0.00 0.00 179.01 177.50 3ioy h ALA 301 N 0.67 1.48 -0.32 2.92 0.00 -0.97 -1.31 119.26 121.72 3ioy h ALA 301 Ca -0.01 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 3ioy h ALA 301 Cb 0.18 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3ioy h ALA 301 CO 0.02 0.34 -0.39 0.00 0.00 0.00 0.00 179.25 179.22 3ioy h ARG 302 N 1.08 0.78 -0.62 0.00 3.08 -1.12 -1.89 114.38 115.69 3ioy h ARG 302 Ca 0.45 -0.40 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 3ioy h ARG 302 Cb 0.30 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 3ioy h ARG 302 CO -0.20 1.03 0.10 -0.09 -1.07 0.00 0.00 179.97 179.74 3ioy h ARG 303 N 0.64 1.00 -0.21 0.04 2.43 -0.55 -2.19 114.38 115.54 3ioy h ARG 303 Ca 0.05 -0.26 -0.11 0.00 -0.81 0.00 0.00 59.98 58.86 3ioy h ARG 303 Cb 0.95 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 3ioy h ARG 303 CO 0.09 0.93 -0.32 1.96 -1.51 0.00 0.00 179.97 181.12 3ioy h GLN 304 N 0.94 0.43 -0.25 0.20 4.20 -1.20 -2.97 115.11 116.47 3ioy h GLN 304 Ca 0.19 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 3ioy h GLN 304 Cb 0.41 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 3ioy h GLN 304 CO 0.01 0.71 0.12 1.03 -0.67 0.00 0.00 178.83 180.03 3ioy h SER 305 N 0.37 0.30 -0.00 1.46 0.87 -0.80 -3.52 113.55 112.23 3ioy h SER 305 Ca 0.05 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 3ioy h SER 305 Cb 0.75 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 3ioy h SER 305 CO 0.06 0.26 0.00 0.54 -0.53 0.00 0.00 176.83 177.16