#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ii7 s LYS 2 N 0.00 1.37 0.04 2.12 2.20 -1.26 -1.25 119.74 122.96 1ii7 s LYS 2 Ca 0.00 -0.30 -0.02 0.00 -0.36 0.00 0.00 55.97 55.30 1ii7 s LYS 2 Cb 0.00 -1.19 -0.03 0.00 -1.51 0.00 0.00 37.83 35.10 1ii7 s LYS 2 CO 0.00 -0.01 -0.01 -0.59 -0.36 0.00 0.00 175.35 174.38 1ii7 s PHE 3 N 0.76 0.39 -0.08 4.03 -0.12 -0.22 0.85 117.98 123.58 1ii7 s PHE 3 Ca -0.13 -0.81 -0.11 0.00 -0.05 0.00 0.00 56.93 55.82 1ii7 s PHE 3 Cb -0.15 -0.29 -0.05 0.00 -0.63 0.00 0.00 43.02 41.90 1ii7 s PHE 3 CO 0.02 -0.33 0.26 0.00 -0.05 0.00 0.00 175.22 175.13 1ii7 s ALA 4 N -3.00 3.76 -0.25 1.99 0.00 -0.75 -0.53 121.76 122.98 1ii7 s ALA 4 Ca -0.02 -0.46 0.01 0.00 0.00 0.00 0.00 51.96 51.49 1ii7 s ALA 4 Cb 0.01 -2.20 0.04 0.00 0.00 0.00 0.00 23.12 20.98 1ii7 s ALA 4 CO -0.07 0.47 -0.10 -1.58 0.00 0.00 0.00 175.76 174.49 1ii7 s HIS 5 N -0.77 3.11 0.34 0.00 2.46 0.13 -0.66 115.29 119.89 1ii7 s HIS 5 Ca 0.18 -1.89 0.04 0.00 0.47 0.00 0.00 55.06 53.87 1ii7 s HIS 5 Cb -0.14 -1.99 -0.07 0.00 -0.13 0.00 0.00 32.58 30.25 1ii7 s HIS 5 CO 0.07 -0.81 0.05 -0.51 -2.47 0.00 0.00 174.74 171.07 1ii7 s LEU 6 N 1.23 2.30 -0.04 8.88 1.02 -0.16 -2.37 118.68 129.53 1ii7 s LEU 6 Ca -0.03 -1.38 -0.31 0.00 0.02 0.00 0.00 54.13 52.44 1ii7 s LEU 6 Cb -0.18 -0.47 0.11 0.00 0.02 0.00 0.00 46.19 45.68 1ii7 s LEU 6 CO -0.06 -0.58 1.16 0.00 0.02 0.00 0.00 176.35 176.89 1ii7 s ALA 7 N -3.20 -2.04 -1.38 4.21 0.00 -1.26 0.10 121.76 118.20 1ii7 s ALA 7 Ca 0.36 0.90 -0.01 0.00 0.00 0.00 0.00 51.96 53.22 1ii7 s ALA 7 Cb 0.09 0.28 0.01 0.00 0.00 0.00 0.00 23.12 23.49 1ii7 s ALA 7 CO 0.16 -0.87 0.53 -0.25 0.00 0.00 0.00 175.76 175.33 1ii7 n ASP 8 N -0.34 -0.74 -0.06 0.00 8.00 -0.21 -4.50 116.55 118.70 1ii7 n ASP 8 Ca -0.05 -0.94 -0.15 0.00 0.71 0.00 0.00 54.79 54.36 1ii7 n ASP 8 Cb 0.61 -3.41 -0.04 0.00 -0.02 0.00 0.00 41.12 38.26 1ii7 n ASP 8 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1ii7 h ILE 9 N -1.85 1.28 -6.16 0.53 1.08 -1.61 -3.36 117.51 107.43 1ii7 h ILE 9 Ca -0.62 -1.80 -0.44 0.00 -0.39 0.00 0.00 64.86 61.62 1ii7 h ILE 9 Cb 1.37 1.72 0.03 0.00 -3.07 0.00 0.00 36.82 36.87 1ii7 h ILE 9 CO 0.61 0.58 -0.81 1.41 -0.69 0.00 0.00 178.15 179.25 1ii7 n HIS 10 N -3.98 -2.02 -1.72 1.37 8.25 -0.31 -4.88 115.22 111.93 1ii7 n HIS 10 Ca -0.05 0.86 -0.41 0.00 -0.26 0.00 0.00 57.72 57.86 1ii7 n HIS 10 Cb 0.66 -4.27 0.01 0.00 1.12 0.00 0.00 29.99 27.51 1ii7 n HIS 10 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1ii7 n LEU 11 N -4.40 4.37 0.00 2.41 4.77 -0.41 -2.03 117.00 121.72 1ii7 n LEU 11 Ca -0.21 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.88 1ii7 n LEU 11 Cb 0.64 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 1ii7 n LEU 11 CO 0.70 -0.51 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 1ii7 n GLY 12 N 0.75 1.20 3.60 -0.72 0.00 -1.26 -1.48 105.19 107.27 1ii7 n GLY 12 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1ii7 n GLY 12 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ii7 s TYR 13 N -2.70 2.55 -1.26 1.61 6.04 -0.86 -4.91 117.35 117.82 1ii7 s TYR 13 Ca 0.00 0.70 -0.08 0.00 0.04 0.00 0.00 57.07 57.72 1ii7 s TYR 13 Cb 0.00 -4.33 0.18 0.00 -1.04 0.00 0.00 41.96 36.77 1ii7 s TYR 13 CO 0.00 -1.74 1.87 -1.91 -1.54 0.00 0.00 175.55 172.23 1ii7 n GLU 14 N 7.97 3.83 -1.62 4.97 2.13 -1.26 -3.24 120.64 133.42 1ii7 n GLU 14 Ca 0.15 -3.66 -0.47 0.00 0.66 0.00 0.00 57.16 53.84 1ii7 n GLU 14 Cb 0.48 -2.84 -0.03 0.00 0.27 0.00 0.00 31.44 29.31 1ii7 n GLU 14 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1ii7 n GLN 15 N 3.32 1.54 -2.13 5.31 7.27 -1.26 -0.76 117.38 130.67 1ii7 n GLN 15 Ca 0.40 0.55 -0.16 0.00 0.07 0.00 0.00 57.00 57.86 1ii7 n GLN 15 Cb 0.35 -2.12 -0.03 0.00 2.41 0.00 0.00 30.24 30.86 1ii7 n GLN 15 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1ii7 n PHE 16 N 1.68 -0.94 -2.93 3.69 0.99 -1.26 -1.55 117.46 117.13 1ii7 n PHE 16 Ca 0.14 0.00 -0.22 0.00 -0.00 0.00 0.00 57.45 57.37 1ii7 n PHE 16 Cb 0.28 -3.14 0.02 0.00 -1.00 0.00 0.00 39.48 35.64 1ii7 n PHE 16 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 1ii7 n HIS 17 N -3.15 -1.74 -3.98 1.38 8.25 0.06 -4.98 115.22 111.05 1ii7 n HIS 17 Ca -0.18 0.39 -0.33 0.00 -0.26 0.00 0.00 57.72 57.34 1ii7 n HIS 17 Cb 0.60 -4.04 -0.14 0.00 1.12 0.00 0.00 29.99 27.53 1ii7 n HIS 17 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1ii7 s LYS 18 N -5.60 2.24 0.55 -0.41 1.02 -0.60 -4.97 119.74 111.97 1ii7 s LYS 18 Ca 0.25 -1.39 0.31 0.00 0.02 0.00 0.00 55.97 55.16 1ii7 s LYS 18 Cb -0.11 -3.08 1.47 0.00 -0.52 0.00 0.00 37.83 35.59 1ii7 s LYS 18 CO 0.30 -0.65 1.88 -1.00 -0.92 0.00 0.00 175.35 174.97 1ii7 h PRO 19 N 7.86 0.00 -0.59 -1.68 0.13 -1.90 0.56 132.00 136.39 1ii7 h PRO 19 Ca -0.18 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.98 1ii7 h PRO 19 Cb 1.05 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.14 1ii7 h PRO 19 CO 0.51 0.00 0.35 0.37 -0.23 0.00 0.00 178.00 179.00 1ii7 h GLN 20 N 0.00 0.67 -0.42 0.86 4.15 -1.95 -1.19 115.11 117.24 1ii7 h GLN 20 Ca 0.39 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.74 1ii7 h GLN 20 Cb 1.63 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 29.15 1ii7 h GLN 20 CO -0.00 0.44 0.16 0.00 -1.93 0.00 0.00 178.83 177.50 1ii7 h ARG 21 N 0.69 0.64 -0.72 1.69 2.47 -0.17 -1.17 114.38 117.81 1ii7 h ARG 21 Ca 0.24 -0.12 0.08 0.00 -1.26 0.00 0.00 59.98 58.92 1ii7 h ARG 21 Cb 0.05 -0.10 -0.06 0.00 -1.65 0.00 0.00 29.97 28.21 1ii7 h ARG 21 CO -0.12 0.60 0.39 1.49 0.56 0.00 0.00 179.97 182.90 1ii7 h GLU 22 N 0.54 0.67 -0.76 0.04 4.81 -1.11 0.11 114.58 118.89 1ii7 h GLU 22 Ca 0.14 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 1ii7 h GLU 22 Cb 0.21 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 1ii7 h GLU 22 CO -0.01 0.44 0.33 0.93 -0.73 0.00 0.00 179.01 179.97 1ii7 h GLU 23 N 0.69 1.10 -0.37 1.92 5.08 -0.97 -2.60 114.58 119.44 1ii7 h GLU 23 Ca 0.33 -0.18 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1ii7 h GLU 23 Cb 0.27 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1ii7 h GLU 23 CO -0.22 0.88 -0.12 0.93 -1.00 0.00 0.00 179.01 179.48 1ii7 h GLU 24 N 1.09 0.65 -0.43 2.33 5.08 0.34 0.73 114.58 124.37 1ii7 h GLU 24 Ca 0.26 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 1ii7 h GLU 24 Cb 0.17 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1ii7 h GLU 24 CO -0.03 0.76 -0.09 0.74 -1.00 0.00 0.00 179.01 179.39 1ii7 h PHE 25 N 0.60 0.82 -0.31 4.33 -1.00 -0.55 -0.46 116.94 120.36 1ii7 h PHE 25 Ca 0.10 -0.14 -0.10 0.00 2.81 0.00 0.00 57.97 60.65 1ii7 h PHE 25 Cb 0.56 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.89 1ii7 h PHE 25 CO 0.02 0.81 -0.19 0.00 -1.61 0.00 0.00 178.31 177.34 1ii7 h ALA 26 N 1.21 0.44 -0.87 2.45 0.00 -1.07 -2.81 119.26 118.61 1ii7 h ALA 26 Ca 0.12 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1ii7 h ALA 26 Cb 0.55 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1ii7 h ALA 26 CO 0.03 0.37 0.49 1.49 0.00 0.00 0.00 179.25 181.64 1ii7 h GLU 27 N 0.43 1.21 -0.61 0.00 4.57 -0.69 -0.57 114.58 118.92 1ii7 h GLU 27 Ca 0.06 -0.14 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 1ii7 h GLU 27 Cb 0.73 -0.24 -0.03 0.00 -0.16 0.00 0.00 28.75 29.06 1ii7 h GLU 27 CO 0.05 0.88 0.33 0.00 -1.18 0.00 0.00 179.01 179.09 1ii7 h ALA 28 N 1.26 0.79 -0.71 2.92 0.00 -0.99 -0.01 119.26 122.52 1ii7 h ALA 28 Ca 0.31 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1ii7 h ALA 28 Cb 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1ii7 h ALA 28 CO -0.05 0.32 0.36 0.35 0.00 0.00 0.00 179.25 180.22 1ii7 h PHE 29 N 0.83 1.02 -0.27 0.00 -0.00 -1.20 -1.15 116.94 116.18 1ii7 h PHE 29 Ca 0.21 -0.04 0.03 0.00 -0.00 0.00 0.00 57.97 58.17 1ii7 h PHE 29 Cb 0.06 -0.32 -0.03 0.00 -0.00 0.00 0.00 35.95 35.66 1ii7 h PHE 29 CO -0.01 0.74 0.08 -0.22 -0.00 0.00 0.00 178.31 178.90 1ii7 h LYS 30 N 0.99 0.19 -0.79 1.11 3.64 -0.34 -1.67 116.57 119.70 1ii7 h LYS 30 Ca 0.25 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.60 1ii7 h LYS 30 Cb 0.10 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 1ii7 h LYS 30 CO -0.03 0.12 0.43 -0.91 -2.27 0.00 0.00 179.45 176.79 1ii7 h ASN 31 N 0.19 0.99 -0.64 4.20 2.35 -0.59 -1.41 115.58 120.66 1ii7 h ASN 31 Ca 0.12 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 1ii7 h ASN 31 Cb 0.10 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 1ii7 h ASN 31 CO -0.14 0.81 0.24 0.00 -1.65 0.00 0.00 177.43 176.69 1ii7 h ALA 32 N 1.22 0.84 -0.53 -0.83 0.00 -0.93 -0.50 119.26 118.54 1ii7 h ALA 32 Ca 0.28 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1ii7 h ALA 32 Cb 0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1ii7 h ALA 32 CO -0.04 0.48 -0.09 -0.07 0.00 0.00 0.00 179.25 179.53 1ii7 h LEU 33 N 0.92 0.99 -0.99 0.00 3.38 -1.09 -0.52 115.31 117.99 1ii7 h LEU 33 Ca 0.21 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1ii7 h LEU 33 Cb 0.24 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1ii7 h LEU 33 CO -0.01 1.10 0.19 -0.33 0.09 0.00 0.00 178.44 179.48 1ii7 h GLU 34 N 0.86 0.92 -0.32 1.13 5.08 -0.97 -0.77 114.58 120.51 1ii7 h GLU 34 Ca 0.14 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 1ii7 h GLU 34 Cb 0.65 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1ii7 h GLU 34 CO 0.04 0.79 -0.21 0.82 -1.00 0.00 0.00 179.01 179.46 1ii7 h ILE 35 N 0.90 1.26 -0.40 3.13 2.04 -0.75 -1.38 117.51 122.31 1ii7 h ILE 35 Ca 0.20 -1.24 -0.06 0.00 1.00 0.00 0.00 64.86 64.76 1ii7 h ILE 35 Cb 0.25 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1ii7 h ILE 35 CO -0.01 0.41 -0.01 0.00 0.00 0.00 0.00 178.15 178.53 1ii7 h ALA 36 N 1.24 1.24 0.31 1.87 0.00 -0.34 -0.44 119.26 123.13 1ii7 h ALA 36 Ca 0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ii7 h ALA 36 Cb 0.65 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ii7 h ALA 36 CO 0.05 0.51 -0.15 0.28 0.00 0.00 0.00 179.25 179.93 1ii7 h VAL 37 N 0.60 0.68 -0.38 0.00 2.07 -0.69 -2.60 116.25 115.92 1ii7 h VAL 37 Ca 0.12 -0.63 0.11 0.00 0.82 0.00 0.00 66.70 67.12 1ii7 h VAL 37 Cb 0.40 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1ii7 h VAL 37 CO 0.02 0.12 0.29 1.56 0.02 0.00 0.00 177.57 179.57 1ii7 h GLN 38 N -0.78 0.00 -0.00 1.57 4.20 -1.07 0.25 115.11 119.28 1ii7 h GLN 38 Ca -0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1ii7 h GLN 38 Cb 0.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1ii7 h GLN 38 CO 0.07 0.00 -0.06 0.39 -0.67 0.00 0.00 178.83 178.56 1ii7 n GLU 39 N -4.32 0.48 -3.70 1.46 -0.58 -0.19 -4.93 120.64 108.86 1ii7 n GLU 39 Ca 0.06 -0.08 -0.26 0.00 -0.42 0.00 0.00 57.16 56.47 1ii7 n GLU 39 Cb 0.47 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 29.90 1ii7 n GLU 39 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1ii7 n ASN 40 N -1.19 -5.33 -4.73 1.62 4.05 0.89 -4.95 115.26 105.61 1ii7 n ASN 40 Ca 0.14 -0.64 -0.33 0.00 0.45 0.00 0.00 54.58 54.20 1ii7 n ASN 40 Cb 0.26 -4.61 0.09 0.00 1.23 0.00 0.00 39.78 36.75 1ii7 n ASN 40 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1ii7 s VAL 41 N -3.33 2.64 0.07 3.44 -7.23 -1.08 -4.92 120.40 109.99 1ii7 s VAL 41 Ca 0.55 0.29 -0.10 0.00 -1.81 0.00 0.00 61.98 60.90 1ii7 s VAL 41 Cb -0.25 -2.76 -0.27 0.00 0.56 0.00 0.00 36.38 33.65 1ii7 s VAL 41 CO 0.77 -0.20 1.14 0.44 -0.31 0.00 0.00 175.10 176.94 1ii7 h ASP 42 N -0.48 0.70 -5.06 4.85 3.45 0.09 -3.48 116.42 116.48 1ii7 h ASP 42 Ca -0.46 -0.66 0.03 0.00 0.43 0.00 0.00 57.03 56.37 1ii7 h ASP 42 Cb 1.27 -0.22 -0.07 0.00 -0.56 0.00 0.00 39.33 39.75 1ii7 h ASP 42 CO 0.50 1.48 0.13 0.72 -1.57 0.00 0.00 179.24 180.51 1ii7 s PHE 43 N -2.92 -0.07 -0.05 4.55 -0.71 -1.23 -4.23 117.98 113.32 1ii7 s PHE 43 Ca -0.07 -0.35 0.06 0.00 -1.04 0.00 0.00 56.93 55.52 1ii7 s PHE 43 Cb 0.06 0.56 -0.01 0.00 -1.21 0.00 0.00 43.02 42.42 1ii7 s PHE 43 CO 0.91 -1.14 -0.23 0.42 -1.34 0.00 0.00 175.22 173.83 1ii7 s ILE 44 N -3.93 1.90 -0.11 -4.49 1.01 -0.46 -1.82 121.20 113.29 1ii7 s ILE 44 Ca 0.13 -0.98 -0.01 0.00 0.00 0.00 0.00 60.65 59.79 1ii7 s ILE 44 Cb -0.04 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.79 1ii7 s ILE 44 CO 0.06 0.53 -0.05 -0.76 0.00 0.00 0.00 174.94 174.72 1ii7 s LEU 45 N -0.14 3.21 -0.32 2.97 1.43 0.16 -0.67 118.68 125.32 1ii7 s LEU 45 Ca -0.03 -0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.02 1ii7 s LEU 45 Cb -0.13 -1.74 0.10 0.00 0.03 0.00 0.00 46.19 44.45 1ii7 s LEU 45 CO 0.03 0.27 0.06 -0.63 0.23 0.00 0.00 176.35 176.30 1ii7 s ILE 46 N -0.23 1.83 -0.25 -0.59 1.01 -0.22 -0.99 121.20 121.76 1ii7 s ILE 46 Ca 0.04 -2.01 -0.06 0.00 0.00 0.00 0.00 60.65 58.62 1ii7 s ILE 46 Cb -0.13 -2.34 -0.22 0.00 0.01 0.00 0.00 42.46 39.78 1ii7 s ILE 46 CO 0.02 -0.59 3.30 0.00 0.00 0.00 0.00 174.94 177.68 1ii7 n ALA 47 N 4.45 6.17 0.00 9.38 0.00 0.12 -2.84 120.51 137.78 1ii7 n ALA 47 Ca 0.01 -1.96 0.00 0.00 0.00 0.00 0.00 53.44 51.50 1ii7 n ALA 47 Cb 0.42 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.39 1ii7 n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ii7 n GLY 48 N 2.72 -0.50 2.91 0.00 0.00 -1.08 -3.93 105.19 105.29 1ii7 n GLY 48 Ca 0.45 -1.58 -0.17 0.00 0.00 0.00 0.00 46.02 44.73 1ii7 n GLY 48 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ii7 n ASP 49 N -0.98 -5.03 -0.27 1.61 9.92 -1.26 -1.04 116.55 119.49 1ii7 n ASP 49 Ca 0.00 -0.34 -0.06 0.00 -0.53 0.00 0.00 54.79 53.85 1ii7 n ASP 49 Cb 0.00 -3.68 0.05 0.00 -0.64 0.00 0.00 41.12 36.85 1ii7 n ASP 49 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1ii7 h LEU 50 N -1.72 1.01 -9.30 0.64 5.85 -1.93 -0.63 115.31 109.23 1ii7 h LEU 50 Ca -0.40 -0.17 -0.67 0.00 0.84 0.00 0.00 57.88 57.49 1ii7 h LEU 50 Cb 1.26 -0.26 -0.15 0.00 0.37 0.00 0.00 40.66 41.88 1ii7 h LEU 50 CO 0.39 0.91 -0.69 -0.36 -0.34 0.00 0.00 178.44 178.35 1ii7 s PHE 51 N -5.55 2.90 0.10 1.25 0.40 -1.26 -1.29 117.98 114.53 1ii7 s PHE 51 Ca -0.12 -0.05 0.13 0.00 -0.60 0.00 0.00 56.93 56.28 1ii7 s PHE 51 Cb 0.15 -1.56 0.21 0.00 0.51 0.00 0.00 43.02 42.33 1ii7 s PHE 51 CO 0.83 0.42 1.51 1.25 0.70 0.00 0.00 175.22 179.93 1ii7 h HIS 52 N 4.01 0.00 -3.82 0.36 -0.00 -1.45 -3.33 115.15 110.93 1ii7 h HIS 52 Ca -0.48 0.00 -0.65 0.00 -0.00 0.00 0.00 60.37 59.24 1ii7 h HIS 52 Cb 1.17 0.00 -0.21 0.00 -0.00 0.00 0.00 27.41 28.36 1ii7 h HIS 52 CO 0.59 0.63 -0.85 0.45 -0.00 0.00 0.00 177.93 178.76 1ii7 s SER 53 N -6.61 3.11 0.00 3.26 0.15 -1.26 -4.71 113.70 107.64 1ii7 s SER 53 Ca 0.01 -0.75 0.28 0.00 0.70 0.00 0.00 55.95 56.19 1ii7 s SER 53 Cb 0.10 -0.20 1.06 0.00 -1.71 0.00 0.00 66.02 65.27 1ii7 s SER 53 CO 0.75 0.13 1.80 -1.54 1.20 0.00 0.00 173.24 175.59 1ii7 n SER 54 N 0.87 0.13 -3.20 5.45 3.41 -0.94 -3.80 113.62 115.54 1ii7 n SER 54 Ca -0.18 0.32 -0.25 0.00 -0.26 0.00 0.00 58.87 58.51 1ii7 n SER 54 Cb 0.54 -0.32 -0.06 0.00 -0.26 0.00 0.00 64.21 64.10 1ii7 n SER 54 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1ii7 n ARG 55 N -1.51 2.05 -0.97 4.33 0.63 -1.26 -4.53 116.66 115.41 1ii7 n ARG 55 Ca 0.07 -4.18 -0.33 0.00 -0.92 0.00 0.00 57.85 52.49 1ii7 n ARG 55 Cb 0.34 -1.93 0.14 0.00 0.45 0.00 0.00 32.46 31.46 1ii7 n ARG 55 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1ii7 s PRO 56 N -2.46 1.41 0.70 -0.14 0.04 -1.25 -5.00 135.00 128.30 1ii7 s PRO 56 Ca 0.41 1.70 -0.11 0.00 0.04 0.00 0.00 61.00 63.04 1ii7 s PRO 56 Cb 0.22 -1.76 0.01 0.00 0.04 0.00 0.00 34.50 33.02 1ii7 s PRO 56 CO -0.08 -2.38 1.09 -1.54 0.04 0.00 0.00 177.00 174.13 1ii7 s SER 57 N -2.31 5.52 0.36 6.66 1.04 -1.26 -4.85 113.70 118.86 1ii7 s SER 57 Ca 0.71 1.19 0.09 0.00 0.48 0.00 0.00 55.95 58.42 1ii7 s SER 57 Cb -0.27 -2.03 0.81 0.00 0.10 0.00 0.00 66.02 64.63 1ii7 s SER 57 CO 0.53 -1.30 1.89 -0.65 0.98 0.00 0.00 173.24 174.69 1ii7 h PRO 58 N -0.62 0.68 -0.27 4.02 0.11 -1.99 -1.34 132.00 132.58 1ii7 h PRO 58 Ca -0.45 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 1ii7 h PRO 58 Cb 1.24 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1ii7 h PRO 58 CO 0.63 0.45 -0.03 0.78 -0.21 0.00 0.00 178.00 179.62 1ii7 h GLY 59 N 0.70 0.53 0.92 -0.55 0.00 -1.99 -0.71 103.07 101.97 1ii7 h GLY 59 Ca 0.41 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1ii7 h GLY 59 CO -0.18 0.38 0.12 -0.84 0.00 0.00 0.00 176.54 176.02 1ii7 h THR 60 N 0.26 1.15 -0.61 4.70 2.02 -1.75 -1.91 112.91 116.77 1ii7 h THR 60 Ca 0.07 -0.43 0.06 0.00 0.77 0.00 0.00 66.41 66.88 1ii7 h THR 60 Cb 0.47 0.96 -0.05 0.00 -1.74 0.00 0.00 68.15 67.79 1ii7 h THR 60 CO 0.02 0.15 0.32 -0.07 0.37 0.00 0.00 175.52 176.31 1ii7 h LEU 61 N 0.28 0.47 -1.04 2.58 3.38 -1.22 0.41 115.31 120.16 1ii7 h LEU 61 Ca 0.09 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1ii7 h LEU 61 Cb 0.13 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 1ii7 h LEU 61 CO -0.01 0.31 0.49 0.50 0.09 0.00 0.00 178.44 179.82 1ii7 h LYS 62 N 0.61 1.15 -0.22 1.13 3.64 -0.86 -0.56 116.57 121.47 1ii7 h LYS 62 Ca 0.27 -0.11 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 1ii7 h LYS 62 Cb 0.18 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.76 1ii7 h LYS 62 CO -0.18 0.82 -0.28 -0.22 -2.27 0.00 0.00 179.45 177.32 1ii7 h LYS 63 N 1.17 0.58 -0.66 1.90 1.63 -0.65 -2.50 116.57 118.03 1ii7 h LYS 63 Ca 0.30 -0.33 0.02 0.00 -0.85 0.00 0.00 60.65 59.79 1ii7 h LYS 63 Cb -0.02 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 31.59 1ii7 h LYS 63 CO -0.05 0.93 0.42 0.00 -3.45 0.00 0.00 179.45 177.30 1ii7 h ALA 64 N 0.64 0.85 -0.36 5.00 0.00 -0.67 -0.01 119.26 124.72 1ii7 h ALA 64 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ii7 h ALA 64 Cb 0.85 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1ii7 h ALA 64 CO 0.07 0.21 0.22 0.82 0.00 0.00 0.00 179.25 180.57 1ii7 h ILE 65 N 0.84 1.11 -0.43 0.00 2.04 -1.09 0.51 117.51 120.50 1ii7 h ILE 65 Ca 0.25 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1ii7 h ILE 65 Cb -0.03 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1ii7 h ILE 65 CO -0.08 0.11 0.15 0.00 0.00 0.00 0.00 178.15 178.32 1ii7 h ALA 66 N 1.11 0.56 -0.62 1.87 0.00 -1.09 -2.66 119.26 118.42 1ii7 h ALA 66 Ca 0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1ii7 h ALA 66 Cb -0.02 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1ii7 h ALA 66 CO -0.03 0.19 0.24 -0.07 0.00 0.00 0.00 179.25 179.58 1ii7 h LEU 67 N 0.54 0.86 -0.42 0.00 3.38 -0.73 -1.88 115.31 117.06 1ii7 h LEU 67 Ca 0.14 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1ii7 h LEU 67 Cb 0.23 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1ii7 h LEU 67 CO -0.01 0.80 0.00 0.18 0.09 0.00 0.00 178.44 179.51 1ii7 n LEU 68 N -4.44 0.33 0.25 1.67 4.77 0.15 -1.77 117.00 117.97 1ii7 n LEU 68 Ca 0.04 0.59 0.13 0.00 -0.03 0.00 0.00 56.01 56.74 1ii7 n LEU 68 Cb 0.17 -0.56 0.60 0.00 -2.33 0.00 0.00 43.42 41.30 1ii7 n LEU 68 CO 0.39 -0.47 0.90 1.56 -1.33 0.00 0.00 177.39 178.44 1ii7 h GLN 69 N 0.00 0.00 0.74 3.23 1.08 -0.98 -2.91 115.11 116.27 1ii7 h GLN 69 Ca 0.00 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 1ii7 h GLN 69 Cb 0.25 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.69 1ii7 h GLN 69 CO 0.00 0.15 -0.36 0.82 -0.95 0.00 0.00 178.83 178.49 1ii7 h ILE 70 N 0.00 0.25 0.00 2.54 2.04 -1.46 0.55 117.51 121.43 1ii7 h ILE 70 Ca -0.00 -0.06 -0.08 0.00 1.00 0.00 0.00 64.86 65.71 1ii7 h ILE 70 Cb 0.57 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1ii7 h ILE 70 CO 0.02 0.01 -0.40 1.55 0.00 0.00 0.00 178.15 179.32 1ii7 h PRO 71 N -1.04 0.00 -0.52 2.37 0.13 -1.75 -2.92 132.00 128.27 1ii7 h PRO 71 Ca -0.10 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.04 1ii7 h PRO 71 Cb 0.77 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.88 1ii7 h PRO 71 CO 0.17 0.40 0.34 -0.22 -0.23 0.00 0.00 178.00 178.46 1ii7 h LYS 72 N 0.00 0.68 -0.52 0.86 1.63 -1.31 -0.57 116.57 117.34 1ii7 h LYS 72 Ca -0.00 -0.04 0.15 0.00 -0.85 0.00 0.00 60.65 59.91 1ii7 h LYS 72 Cb 0.78 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 32.24 1ii7 h LYS 72 CO 0.05 0.45 0.39 0.93 -3.45 0.00 0.00 179.45 177.83 1ii7 h GLU 73 N 0.70 0.00 -0.45 1.90 4.39 -0.68 -1.08 114.58 119.37 1ii7 h GLU 73 Ca 0.19 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.89 1ii7 h GLU 73 Cb -0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1ii7 h GLU 73 CO -0.05 0.00 0.00 0.72 -1.16 0.00 0.00 179.01 178.52 1ii7 n HIS 74 N -4.28 1.32 -3.52 4.33 8.25 -0.69 -4.95 115.22 115.68 1ii7 n HIS 74 Ca 0.10 -0.73 -0.26 0.00 -0.26 0.00 0.00 57.72 56.57 1ii7 n HIS 74 Cb 0.61 -0.31 0.03 0.00 1.12 0.00 0.00 29.99 31.44 1ii7 n HIS 74 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1ii7 n SER 75 N 0.30 -5.07 -4.38 0.41 7.64 -0.41 -4.93 113.62 107.18 1ii7 n SER 75 Ca 0.23 -0.53 -0.45 0.00 1.01 0.00 0.00 58.87 59.13 1ii7 n SER 75 Cb 0.92 -4.08 -0.06 0.00 -1.01 0.00 0.00 64.21 59.97 1ii7 n SER 75 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1ii7 s ILE 76 N -3.18 5.09 0.51 0.44 1.01 -0.31 -5.03 121.20 119.74 1ii7 s ILE 76 Ca 0.50 -1.03 -0.23 0.00 0.00 0.00 0.00 60.65 59.90 1ii7 s ILE 76 Cb -0.25 -4.26 -0.06 0.00 0.01 0.00 0.00 42.46 37.90 1ii7 s ILE 76 CO 0.62 -0.77 1.39 -2.16 0.00 0.00 0.00 174.94 174.02 1ii7 s PRO 77 N 1.99 3.36 -0.29 2.79 0.04 -1.26 -4.43 135.00 137.20 1ii7 s PRO 77 Ca 0.07 2.31 -0.00 0.00 0.04 0.00 0.00 61.00 63.42 1ii7 s PRO 77 Cb -0.24 -2.42 0.06 0.00 0.04 0.00 0.00 34.50 31.94 1ii7 s PRO 77 CO 0.07 -1.04 -0.03 0.08 0.04 0.00 0.00 177.00 176.12 1ii7 s VAL 78 N -1.26 2.73 -0.12 -0.36 1.01 -1.26 -1.35 120.40 119.78 1ii7 s VAL 78 Ca 0.67 -1.51 -0.12 0.00 0.00 0.00 0.00 61.98 61.02 1ii7 s VAL 78 Cb -0.42 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.32 1ii7 s VAL 78 CO 0.51 -0.11 0.28 -0.36 0.00 0.00 0.00 175.10 175.41 1ii7 s PHE 79 N 1.19 3.54 0.06 5.22 0.40 0.16 -0.10 117.98 128.46 1ii7 s PHE 79 Ca -0.06 0.65 -0.08 0.00 -0.60 0.00 0.00 56.93 56.84 1ii7 s PHE 79 Cb -0.20 -2.24 -0.00 0.00 0.51 0.00 0.00 43.02 41.09 1ii7 s PHE 79 CO -0.03 0.42 0.17 0.00 0.70 0.00 0.00 175.22 176.49 1ii7 s ALA 80 N -0.14 -0.23 0.25 5.36 0.00 -0.57 -1.06 121.76 125.36 1ii7 s ALA 80 Ca 0.17 -0.50 0.07 0.00 0.00 0.00 0.00 51.96 51.70 1ii7 s ALA 80 Cb -0.13 0.36 -0.05 0.00 0.00 0.00 0.00 23.12 23.30 1ii7 s ALA 80 CO 0.05 -0.42 -0.10 0.96 0.00 0.00 0.00 175.76 176.26 1ii7 s ILE 81 N -3.19 1.68 0.16 0.00 -4.36 -1.13 -1.59 121.20 112.77 1ii7 s ILE 81 Ca -0.00 -2.17 -0.21 0.00 -0.26 0.00 0.00 60.65 58.02 1ii7 s ILE 81 Cb 0.02 -2.28 -0.08 0.00 1.25 0.00 0.00 42.46 41.38 1ii7 s ILE 81 CO -0.07 -0.42 0.68 -1.61 0.24 0.00 0.00 174.94 173.75 1ii7 s GLU 82 N -3.69 4.30 0.20 0.37 2.02 -1.26 -2.64 118.70 118.00 1ii7 s GLU 82 Ca 0.27 0.87 0.02 0.00 0.02 0.00 0.00 54.97 56.15 1ii7 s GLU 82 Cb 0.02 -3.09 0.04 0.00 0.10 0.00 0.00 34.13 31.19 1ii7 s GLU 82 CO 0.10 0.52 0.27 0.41 0.02 0.00 0.00 175.26 176.58 1ii7 n GLY 83 N 1.25 1.61 0.20 -1.39 0.00 -1.26 -1.77 105.19 103.84 1ii7 n GLY 83 Ca -0.06 -2.11 0.05 0.00 0.00 0.00 0.00 46.02 43.90 1ii7 n GLY 83 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1ii7 h ASN 84 N -0.03 0.00 -0.14 1.61 -1.07 -1.90 -2.24 115.58 111.81 1ii7 h ASN 84 Ca -0.09 0.00 -0.20 0.00 0.07 0.00 0.00 56.30 56.08 1ii7 h ASN 84 Cb 0.40 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.65 1ii7 h ASN 84 CO 0.12 0.30 -0.65 0.45 0.07 0.00 0.00 177.43 177.72 1ii7 h HIS 85 N 0.00 0.98 -0.16 4.14 3.86 -1.87 -3.36 115.15 118.74 1ii7 h HIS 85 Ca -0.00 -0.39 0.00 0.00 -1.16 0.00 0.00 60.37 58.82 1ii7 h HIS 85 Cb 0.59 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.89 1ii7 h HIS 85 CO 0.00 1.20 0.00 -0.40 0.86 0.00 0.00 177.93 179.59 1ii7 n ASP 86 N -3.96 2.40 -4.85 2.45 3.85 -1.16 -2.21 116.55 113.06 1ii7 n ASP 86 Ca -0.05 -1.70 -0.31 0.00 -0.71 0.00 0.00 54.79 52.02 1ii7 n ASP 86 Cb 0.68 -0.10 0.03 0.00 -1.35 0.00 0.00 41.12 40.38 1ii7 n ASP 86 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1ii7 s ARG 87 N -1.00 3.25 -0.05 0.11 1.70 -0.85 -4.48 118.95 117.63 1ii7 s ARG 87 Ca 0.18 0.77 0.03 0.00 -0.47 0.00 0.00 55.73 56.24 1ii7 s ARG 87 Cb 0.11 -2.04 0.00 0.00 -0.57 0.00 0.00 34.95 32.46 1ii7 s ARG 87 CO 0.16 -0.83 -0.14 0.95 -1.08 0.00 0.00 175.30 174.36 1ii7 s THR 88 N -3.16 1.25 -0.00 4.99 -4.23 -1.26 -4.77 115.64 108.46 1ii7 s THR 88 Ca 0.57 -0.59 -0.23 0.00 -1.18 0.00 0.00 61.69 60.25 1ii7 s THR 88 Cb -0.12 -1.11 -0.18 0.00 1.34 0.00 0.00 72.50 72.43 1ii7 s THR 88 CO 0.54 0.37 1.25 -0.61 -0.54 0.00 0.00 174.62 175.64 1ii7 h GLN 89 N 6.57 0.19 -5.17 3.99 4.15 -1.97 -3.44 115.11 119.44 1ii7 h GLN 89 Ca -0.31 -0.11 -0.67 0.00 0.77 0.00 0.00 58.65 58.32 1ii7 h GLN 89 Cb 1.18 0.01 -0.33 0.00 0.21 0.00 0.00 27.48 28.56 1ii7 h GLN 89 CO 0.48 0.68 -0.84 1.03 -1.93 0.00 0.00 178.83 178.25 1ii7 s ARG 90 N -4.05 3.09 0.00 1.69 0.52 -1.26 -5.04 118.95 113.91 1ii7 s ARG 90 Ca -0.15 -0.81 0.00 0.00 -0.52 0.00 0.00 55.73 54.25 1ii7 s ARG 90 Cb 0.03 -2.54 0.00 0.00 0.52 0.00 0.00 34.95 32.96 1ii7 s ARG 90 CO 0.72 -0.04 0.00 0.41 0.02 0.00 0.00 175.30 176.41 1ii7 n GLY 91 N 4.18 2.29 3.74 -3.53 0.00 -1.26 -5.00 105.19 105.61 1ii7 n GLY 91 Ca -0.20 -1.90 -0.36 0.00 0.00 0.00 0.00 46.02 43.57 1ii7 n GLY 91 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ii7 s PRO 92 N -3.03 2.62 0.58 1.61 0.04 -1.26 -4.78 135.00 130.79 1ii7 s PRO 92 Ca 0.00 1.88 0.03 0.00 0.04 0.00 0.00 61.00 62.95 1ii7 s PRO 92 Cb 0.00 -1.88 0.06 0.00 0.04 0.00 0.00 34.50 32.72 1ii7 s PRO 92 CO 0.00 -1.50 0.80 -1.54 0.04 0.00 0.00 177.00 174.81 1ii7 s SER 93 N -1.65 5.07 0.51 6.66 1.04 -1.26 -4.90 113.70 119.15 1ii7 s SER 93 Ca 0.78 -0.28 0.21 0.00 0.48 0.00 0.00 55.95 57.14 1ii7 s SER 93 Cb -0.32 -0.46 1.32 0.00 0.10 0.00 0.00 66.02 66.66 1ii7 s SER 93 CO 0.38 -1.30 2.09 1.62 0.98 0.00 0.00 173.24 177.01 1ii7 h VAL 94 N 0.01 0.85 -0.47 5.02 3.04 -1.79 -2.14 116.25 120.78 1ii7 h VAL 94 Ca -0.39 -0.38 -0.09 0.00 -1.01 0.00 0.00 66.70 64.83 1ii7 h VAL 94 Cb 1.29 1.22 -0.02 0.00 -2.01 0.00 0.00 31.29 31.77 1ii7 h VAL 94 CO 0.46 0.10 -0.08 -0.07 -1.01 0.00 0.00 177.57 176.98 1ii7 h LEU 95 N 0.00 0.88 -0.48 3.16 3.38 -1.94 -0.59 115.31 119.71 1ii7 h LEU 95 Ca -0.00 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 57.65 1ii7 h LEU 95 Cb 0.21 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1ii7 h LEU 95 CO 0.01 1.02 0.28 0.78 0.09 0.00 0.00 178.44 180.62 1ii7 h ASN 96 N 0.72 0.44 -0.20 -0.43 -0.26 -1.78 0.62 115.58 114.70 1ii7 h ASN 96 Ca 0.12 0.01 0.03 0.00 -0.56 0.00 0.00 56.30 55.90 1ii7 h ASN 96 Cb 0.62 -0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 37.77 1ii7 h ASN 96 CO 0.04 0.31 0.03 0.25 -1.06 0.00 0.00 177.43 177.00 1ii7 h LEU 97 N 0.55 -0.01 -1.67 1.61 5.85 -1.20 -1.87 115.31 118.57 1ii7 h LEU 97 Ca 0.20 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 1ii7 h LEU 97 Cb 0.04 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1ii7 h LEU 97 CO -0.10 0.02 -0.01 -0.07 -0.34 0.00 0.00 178.44 177.94 1ii7 h LEU 98 N 0.10 0.17 -0.67 2.25 3.38 -0.44 -2.07 115.31 118.04 1ii7 h LEU 98 Ca 0.09 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 1ii7 h LEU 98 Cb 0.09 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1ii7 h LEU 98 CO -0.13 0.22 -0.01 -0.08 0.09 0.00 0.00 178.44 178.53 1ii7 h GLU 99 N 0.19 1.02 -0.22 1.13 4.81 -0.13 -1.58 114.58 119.80 1ii7 h GLU 99 Ca 0.05 -0.32 0.06 0.00 -0.13 0.00 0.00 59.36 59.01 1ii7 h GLU 99 Cb 0.15 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1ii7 h GLU 99 CO 0.00 1.01 0.16 -0.44 -0.73 0.00 0.00 179.01 179.01 1ii7 h ASP 100 N 0.93 0.04 0.19 1.04 3.45 -0.69 0.39 116.42 121.77 1ii7 h ASP 100 Ca 0.16 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.62 1ii7 h ASP 100 Cb 0.56 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.32 1ii7 h ASP 100 CO 0.03 0.03 -0.05 0.49 -1.57 0.00 0.00 179.24 178.17 1ii7 n PHE 101 N -4.48 0.00 -1.66 4.55 3.72 -0.68 -4.92 117.46 113.99 1ii7 n PHE 101 Ca 0.02 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.35 1ii7 n PHE 101 Cb 0.27 -0.10 -0.02 0.00 -0.94 0.00 0.00 39.48 38.70 1ii7 n PHE 101 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ii7 n GLY 102 N 1.18 0.52 0.01 1.37 0.00 0.14 -4.94 105.19 103.47 1ii7 n GLY 102 Ca 0.18 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.66 1ii7 n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ii7 n LEU 103 N -0.94 0.16 -3.95 0.99 4.77 -0.70 -5.00 117.00 112.33 1ii7 n LEU 103 Ca -0.08 -0.08 -0.10 0.00 -0.03 0.00 0.00 56.01 55.72 1ii7 n LEU 103 Cb 0.40 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.43 1ii7 n LEU 103 CO 0.11 0.04 0.07 0.68 -1.33 0.00 0.00 177.39 176.96 1ii7 s VAL 104 N -3.39 0.04 -0.14 4.08 -7.23 -1.25 -4.55 120.40 107.96 1ii7 s VAL 104 Ca -0.05 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.80 1ii7 s VAL 104 Cb 0.14 -1.93 0.02 0.00 0.56 0.00 0.00 36.38 35.17 1ii7 s VAL 104 CO 0.88 -0.17 -0.13 -0.31 -0.31 0.00 0.00 175.10 175.06 1ii7 s TYR 105 N -3.98 2.02 -0.24 2.82 1.51 0.86 -4.23 117.35 116.11 1ii7 s TYR 105 Ca 0.18 -1.11 -0.20 0.00 -1.01 0.00 0.00 57.07 54.94 1ii7 s TYR 105 Cb 0.02 -1.51 -0.02 0.00 -0.11 0.00 0.00 41.96 40.33 1ii7 s TYR 105 CO 0.03 -0.63 0.61 0.08 -1.11 0.00 0.00 175.55 174.53 1ii7 s VAL 106 N 1.50 5.01 0.12 0.71 1.01 -1.26 -1.52 120.40 125.97 1ii7 s VAL 106 Ca 0.04 1.10 -0.08 0.00 0.00 0.00 0.00 61.98 63.04 1ii7 s VAL 106 Cb -0.13 -3.92 -0.06 0.00 0.00 0.00 0.00 36.38 32.28 1ii7 s VAL 106 CO -0.10 0.06 0.41 -0.63 0.00 0.00 0.00 175.10 174.84 1ii7 s ILE 107 N 2.34 5.10 -0.32 2.22 1.01 -0.62 -4.92 121.20 126.01 1ii7 s ILE 107 Ca 0.26 0.31 0.00 0.00 0.00 0.00 0.00 60.65 61.21 1ii7 s ILE 107 Cb -0.16 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.68 1ii7 s ILE 107 CO 0.09 0.15 0.00 0.61 0.00 0.00 0.00 174.94 175.79 1ii7 n GLY 108 N 0.47 0.50 3.79 6.18 0.00 -0.53 -4.54 105.19 111.07 1ii7 n GLY 108 Ca -0.05 -2.27 -0.34 0.00 0.00 0.00 0.00 46.02 43.37 1ii7 n GLY 108 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ii7 s MET 109 N -0.13 3.55 -0.13 1.61 -1.94 -1.26 -0.65 119.30 120.35 1ii7 s MET 109 Ca 0.00 1.37 -0.30 0.00 -1.71 0.00 0.00 55.69 55.04 1ii7 s MET 109 Cb 0.00 -2.06 0.13 0.00 2.01 0.00 0.00 34.83 34.91 1ii7 s MET 109 CO 0.00 -0.64 1.02 -0.98 -0.01 0.00 0.00 175.02 174.41 1ii7 s ARG 110 N -3.50 0.58 0.18 2.03 1.70 -0.87 -4.92 118.95 114.16 1ii7 s ARG 110 Ca 0.67 0.00 0.04 0.00 -0.47 0.00 0.00 55.73 55.98 1ii7 s ARG 110 Cb -0.18 0.27 0.04 0.00 -0.57 0.00 0.00 34.95 34.51 1ii7 s ARG 110 CO 0.27 -0.21 1.41 0.87 -1.08 0.00 0.00 175.30 176.55 1ii7 h LYS 111 N 2.33 0.15 -5.71 3.89 1.57 -1.95 -0.65 116.57 116.19 1ii7 h LYS 111 Ca -0.18 -0.16 -0.66 0.00 -1.87 0.00 0.00 60.65 57.78 1ii7 h LYS 111 Cb 1.18 0.04 -0.13 0.00 0.08 0.00 0.00 32.23 33.40 1ii7 h LYS 111 CO 0.30 0.90 -0.58 -2.00 -0.57 0.00 0.00 179.45 177.50 1ii7 s GLU 112 N -3.24 3.34 0.65 3.15 2.12 -1.26 -4.63 118.70 118.83 1ii7 s GLU 112 Ca -0.02 -0.33 -0.16 0.00 0.36 0.00 0.00 54.97 54.82 1ii7 s GLU 112 Cb 0.11 -2.99 -0.00 0.00 0.26 0.00 0.00 34.13 31.50 1ii7 s GLU 112 CO 0.82 0.61 1.15 0.21 -0.54 0.00 0.00 175.26 177.51 1ii7 s LYS 113 N -0.60 2.72 -0.10 4.30 2.20 -1.26 -4.92 119.74 122.08 1ii7 s LYS 113 Ca 0.11 1.59 -0.11 0.00 -0.36 0.00 0.00 55.97 57.19 1ii7 s LYS 113 Cb -0.12 -1.92 0.03 0.00 -1.51 0.00 0.00 37.83 34.31 1ii7 s LYS 113 CO 0.02 -1.35 0.30 0.54 -0.36 0.00 0.00 175.35 174.51 1ii7 s VAL 114 N -2.05 0.01 -0.22 4.02 0.11 -1.26 -5.09 120.40 115.92 1ii7 s VAL 114 Ca 0.71 -0.10 -0.03 0.00 -2.93 0.00 0.00 61.98 59.63 1ii7 s VAL 114 Cb -0.25 -0.46 0.12 0.00 -1.53 0.00 0.00 36.38 34.25 1ii7 s VAL 114 CO 0.39 -0.06 0.32 -1.61 -3.33 0.00 0.00 175.10 170.81 1ii7 s GLU 115 N -0.13 0.28 0.00 1.54 0.41 -1.26 -3.22 118.70 116.32 1ii7 s GLU 115 Ca -0.03 0.42 0.00 0.00 -0.41 0.00 0.00 54.97 54.95 1ii7 s GLU 115 Cb -0.03 -0.74 0.00 0.00 -1.78 0.00 0.00 34.13 31.59 1ii7 s GLU 115 CO 0.01 -0.63 0.00 0.27 -0.49 0.00 0.00 175.26 174.42 1ii7 n ASN 116 N 5.35 0.00 0.30 -0.19 0.23 -0.66 -4.99 115.26 115.30 1ii7 n ASN 116 Ca -0.04 -0.93 0.17 0.00 -0.53 0.00 0.00 54.58 53.25 1ii7 n ASN 116 Cb 0.50 0.00 0.96 0.00 -2.08 0.00 0.00 39.78 39.16 1ii7 n ASN 116 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1ii7 h GLU 117 N 0.00 0.00 0.00 -3.83 4.81 -2.01 -3.21 114.58 110.35 1ii7 h GLU 117 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1ii7 h GLU 117 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1ii7 h GLU 117 CO 0.00 0.02 0.00 0.66 -0.73 0.00 0.00 179.01 178.96 1ii7 n TYR 118 N -3.57 0.00 -3.96 0.92 4.02 -1.26 -4.73 117.16 108.58 1ii7 n TYR 118 Ca -0.03 -0.11 -0.11 0.00 -0.01 0.00 0.00 57.90 57.64 1ii7 n TYR 118 Cb 0.12 -0.01 -0.13 0.00 -0.02 0.00 0.00 39.34 39.30 1ii7 n TYR 118 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1ii7 s LEU 119 N -0.22 2.12 0.01 7.72 1.43 -1.21 -0.01 118.68 128.52 1ii7 s LEU 119 Ca 0.00 -0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 52.82 1ii7 s LEU 119 Cb 0.00 0.00 -0.01 0.00 0.03 0.00 0.00 46.19 46.21 1ii7 s LEU 119 CO 0.00 -0.14 0.02 0.28 0.23 0.00 0.00 176.35 176.74 1ii7 s THR 120 N -0.73 0.09 0.20 5.49 -1.32 -0.76 -1.65 115.64 116.96 1ii7 s THR 120 Ca -0.07 -0.72 0.09 0.00 -1.21 0.00 0.00 61.69 59.78 1ii7 s THR 120 Cb -0.05 -0.27 -0.04 0.00 -1.51 0.00 0.00 72.50 70.63 1ii7 s THR 120 CO -0.00 -0.39 -0.09 -0.44 -2.21 0.00 0.00 174.62 171.48 1ii7 s SER 121 N -1.21 4.23 -0.19 8.08 0.01 -1.20 -1.31 113.70 122.11 1ii7 s SER 121 Ca -0.13 -0.63 -0.04 0.00 1.31 0.00 0.00 55.95 56.46 1ii7 s SER 121 Cb -0.08 -0.70 0.07 0.00 0.21 0.00 0.00 66.02 65.52 1ii7 s SER 121 CO -0.00 0.08 0.08 -0.70 0.41 0.00 0.00 173.24 173.11 1ii7 s GLU 122 N -3.00 0.30 0.33 12.44 2.12 -0.15 -4.95 118.70 125.79 1ii7 s GLU 122 Ca 0.26 -0.27 -0.29 0.00 0.36 0.00 0.00 54.97 55.03 1ii7 s GLU 122 Cb -0.08 -1.87 -0.11 0.00 0.26 0.00 0.00 34.13 32.33 1ii7 s GLU 122 CO 0.16 -0.71 1.44 0.50 -0.54 0.00 0.00 175.26 176.11 1ii7 s ARG 123 N 2.02 4.21 0.33 4.30 3.52 -1.26 -0.48 118.95 131.59 1ii7 s ARG 123 Ca 0.02 2.42 0.08 0.00 -0.13 0.00 0.00 55.73 58.11 1ii7 s ARG 123 Cb -0.16 -3.03 -0.03 0.00 -1.56 0.00 0.00 34.95 30.16 1ii7 s ARG 123 CO -0.12 -0.43 0.26 -0.51 -0.81 0.00 0.00 175.30 173.69 1ii7 s LEU 124 N -1.42 3.56 0.04 -0.88 1.43 0.14 -4.88 118.68 116.67 1ii7 s LEU 124 Ca 0.55 -0.52 0.02 0.00 -1.03 0.00 0.00 54.13 53.15 1ii7 s LEU 124 Cb -0.44 -2.15 0.13 0.00 0.03 0.00 0.00 46.19 43.77 1ii7 s LEU 124 CO 0.54 -0.31 1.03 0.61 0.23 0.00 0.00 176.35 178.45 1ii7 n GLY 125 N -1.32 -0.50 0.55 -3.19 0.00 -1.26 -0.88 105.19 98.59 1ii7 n GLY 125 Ca -0.03 0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1ii7 n GLY 125 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ii7 n ASN 126 N -1.55 1.98 0.00 1.61 6.94 -1.26 -4.95 115.26 118.02 1ii7 n ASN 126 Ca -0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 54.58 53.07 1ii7 n ASN 126 Cb 0.05 0.23 0.00 0.00 -2.36 0.00 0.00 39.78 37.70 1ii7 n ASN 126 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ii7 n GLY 127 N 1.36 3.00 3.73 4.83 0.00 -0.06 -5.05 105.19 112.99 1ii7 n GLY 127 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1ii7 n GLY 127 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ii7 s GLU 128 N -0.03 0.28 -0.05 1.61 2.02 -1.26 -4.70 118.70 116.55 1ii7 s GLU 128 Ca 0.00 0.15 0.06 0.00 0.02 0.00 0.00 54.97 55.19 1ii7 s GLU 128 Cb 0.00 -1.75 -0.01 0.00 0.10 0.00 0.00 34.13 32.47 1ii7 s GLU 128 CO 0.00 -2.75 -0.23 0.71 0.02 0.00 0.00 175.26 173.01 1ii7 s TYR 129 N -3.22 2.23 -0.33 1.61 1.51 -0.25 -0.68 117.35 118.21 1ii7 s TYR 129 Ca 0.67 -0.65 -0.20 0.00 -1.01 0.00 0.00 57.07 55.88 1ii7 s TYR 129 Cb -0.13 -1.47 -0.00 0.00 -0.11 0.00 0.00 41.96 40.25 1ii7 s TYR 129 CO 0.55 -0.20 0.63 -1.17 -1.11 0.00 0.00 175.55 174.24 1ii7 s LEU 130 N -0.12 4.20 -0.19 -1.29 2.96 0.37 -2.04 118.68 122.58 1ii7 s LEU 130 Ca -0.03 0.28 -0.09 0.00 -0.22 0.00 0.00 54.13 54.06 1ii7 s LEU 130 Cb -0.13 -2.79 -0.05 0.00 0.50 0.00 0.00 46.19 43.72 1ii7 s LEU 130 CO 0.03 -0.53 0.13 -0.69 -1.32 0.00 0.00 176.35 173.97 1ii7 s VAL 131 N 2.64 5.39 0.10 1.68 1.01 0.17 -0.97 120.40 130.42 1ii7 s VAL 131 Ca 0.24 0.18 0.10 0.00 0.00 0.00 0.00 61.98 62.50 1ii7 s VAL 131 Cb -0.15 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 1ii7 s VAL 131 CO 0.13 0.47 -0.24 -0.54 0.00 0.00 0.00 175.10 174.92 1ii7 s LYS 132 N 0.14 1.63 0.26 2.72 1.02 -0.43 -1.45 119.74 123.64 1ii7 s LYS 132 Ca 0.09 -1.23 -0.17 0.00 0.02 0.00 0.00 55.97 54.68 1ii7 s LYS 132 Cb -0.11 -1.99 -0.08 0.00 -0.52 0.00 0.00 37.83 35.12 1ii7 s LYS 132 CO -0.01 0.48 0.72 0.20 -0.92 0.00 0.00 175.35 175.81 1ii7 s GLY 133 N -1.87 2.48 -0.06 -3.33 0.00 0.56 -1.82 107.32 103.28 1ii7 s GLY 133 Ca 0.15 0.08 0.02 0.00 0.00 0.00 0.00 44.72 44.97 1ii7 s GLY 133 CO 0.06 0.37 -0.10 0.14 0.00 0.00 0.00 173.10 173.57 1ii7 s VAL 134 N -1.73 0.97 -0.33 1.40 1.01 0.99 -0.36 120.40 122.35 1ii7 s VAL 134 Ca 0.48 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 62.06 1ii7 s VAL 134 Cb -0.14 -0.91 0.12 0.00 0.00 0.00 0.00 36.38 35.46 1ii7 s VAL 134 CO 0.19 0.32 0.17 -0.47 0.00 0.00 0.00 175.10 175.31 1ii7 s TYR 135 N 0.73 0.71 0.00 5.22 6.14 -0.26 -4.31 117.35 125.58 1ii7 s TYR 135 Ca -0.14 -1.39 0.00 0.00 0.64 0.00 0.00 57.07 56.18 1ii7 s TYR 135 Cb -0.15 -1.02 0.00 0.00 0.42 0.00 0.00 41.96 41.20 1ii7 s TYR 135 CO 0.03 -0.83 0.00 1.63 0.64 0.00 0.00 175.55 177.02 1ii7 n LYS 136 N 4.53 0.00 0.05 4.97 5.02 -1.26 -1.14 118.16 130.33 1ii7 n LYS 136 Ca 0.04 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.44 1ii7 n LYS 136 Cb 0.39 0.00 0.46 0.00 -0.02 0.00 0.00 35.03 35.86 1ii7 n LYS 136 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1ii7 n ASP 137 N 6.18 0.32 -4.84 4.39 5.75 -1.26 -4.83 116.55 122.26 1ii7 n ASP 137 Ca 0.00 0.55 -0.37 0.00 -0.01 0.00 0.00 54.79 54.96 1ii7 n ASP 137 Cb 0.00 -0.63 -0.06 0.00 -1.03 0.00 0.00 41.12 39.40 1ii7 n ASP 137 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1ii7 s LEU 138 N -3.65 4.40 0.01 -2.12 2.96 -0.29 -4.67 118.68 115.33 1ii7 s LEU 138 Ca 0.09 0.66 0.05 0.00 -0.22 0.00 0.00 54.13 54.71 1ii7 s LEU 138 Cb 0.13 -2.30 -0.03 0.00 0.50 0.00 0.00 46.19 44.49 1ii7 s LEU 138 CO 0.44 0.34 -0.13 -1.61 -1.32 0.00 0.00 176.35 174.07 1ii7 s GLU 139 N -0.85 2.32 -0.30 1.98 2.02 -0.87 -1.10 118.70 121.89 1ii7 s GLU 139 Ca 0.18 -0.84 0.01 0.00 0.02 0.00 0.00 54.97 54.34 1ii7 s GLU 139 Cb -0.14 -2.33 0.07 0.00 0.10 0.00 0.00 34.13 31.82 1ii7 s GLU 139 CO 0.07 0.58 -0.02 0.42 0.02 0.00 0.00 175.26 176.33 1ii7 s ILE 140 N -0.93 2.56 0.23 -1.63 1.01 0.51 -0.87 121.20 122.08 1ii7 s ILE 140 Ca 0.15 -1.68 0.02 0.00 0.00 0.00 0.00 60.65 59.14 1ii7 s ILE 140 Cb -0.11 -2.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 1ii7 s ILE 140 CO 0.06 -0.19 0.38 -1.00 0.00 0.00 0.00 174.94 174.18 1ii7 s HIS 141 N 1.13 3.47 0.00 3.97 3.76 0.08 -0.32 115.29 127.38 1ii7 s HIS 141 Ca -0.04 0.15 0.00 0.00 -0.15 0.00 0.00 55.06 55.03 1ii7 s HIS 141 Cb -0.20 -1.71 0.00 0.00 1.11 0.00 0.00 32.58 31.78 1ii7 s HIS 141 CO -0.04 0.40 0.00 0.41 -0.85 0.00 0.00 174.74 174.66 1ii7 n GLY 142 N -1.08 0.61 3.59 -2.22 0.00 -1.26 0.05 105.19 104.88 1ii7 n GLY 142 Ca -0.07 -1.22 -0.09 0.00 0.00 0.00 0.00 46.02 44.64 1ii7 n GLY 142 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1ii7 s MET 143 N -1.99 1.49 0.93 1.61 0.23 -1.18 -3.22 119.30 117.17 1ii7 s MET 143 Ca 0.00 -1.03 -0.13 0.00 -1.03 0.00 0.00 55.69 53.50 1ii7 s MET 143 Cb 0.00 0.51 0.15 0.00 -1.53 0.00 0.00 34.83 33.96 1ii7 s MET 143 CO 0.00 -0.63 1.14 -1.59 -2.03 0.00 0.00 175.02 171.91 1ii7 s LYS 144 N -3.93 0.94 0.38 3.16 -2.85 -1.26 -4.30 119.74 111.87 1ii7 s LYS 144 Ca 0.14 0.26 -0.28 0.00 -1.00 0.00 0.00 55.97 55.09 1ii7 s LYS 144 Cb -0.01 -1.82 -0.11 0.00 -2.06 0.00 0.00 37.83 33.83 1ii7 s LYS 144 CO 0.03 -2.33 1.49 -0.47 0.10 0.00 0.00 175.35 174.17 1ii7 s TYR 145 N -3.27 2.57 0.03 1.78 6.14 -0.73 -4.78 117.35 119.10 1ii7 s TYR 145 Ca 0.65 1.16 0.03 0.00 0.64 0.00 0.00 57.07 59.55 1ii7 s TYR 145 Cb -0.14 -4.03 -0.02 0.00 0.42 0.00 0.00 41.96 38.18 1ii7 s TYR 145 CO 0.54 -3.03 -0.10 -1.64 0.64 0.00 0.00 175.55 171.96 1ii7 s MET 146 N -2.12 0.64 0.88 4.97 -1.94 -1.26 -4.88 119.30 115.60 1ii7 s MET 146 Ca 0.53 -0.66 -0.11 0.00 -1.71 0.00 0.00 55.69 53.74 1ii7 s MET 146 Cb -0.47 -0.54 0.12 0.00 2.01 0.00 0.00 34.83 35.95 1ii7 s MET 146 CO 0.63 0.13 1.09 -1.54 -0.01 0.00 0.00 175.02 175.32 1ii7 s SER 147 N -1.17 3.59 0.12 3.03 1.04 -1.26 -4.90 113.70 114.15 1ii7 s SER 147 Ca -0.04 1.53 -0.27 0.00 0.48 0.00 0.00 55.95 57.65 1ii7 s SER 147 Cb -0.08 -2.21 -0.07 0.00 0.10 0.00 0.00 66.02 63.77 1ii7 s SER 147 CO 0.01 -2.57 1.63 0.28 0.98 0.00 0.00 173.24 173.57 1ii7 h SER 148 N -1.50 -0.79 -0.78 7.02 0.02 -1.88 -2.27 113.55 113.38 1ii7 h SER 148 Ca -0.49 0.10 0.17 0.00 -0.84 0.00 0.00 61.79 60.74 1ii7 h SER 148 Cb 1.28 0.31 -0.14 0.00 0.14 0.00 0.00 62.40 63.99 1ii7 h SER 148 CO 0.54 -0.35 -0.06 0.00 -1.14 0.00 0.00 176.83 175.82 1ii7 h ALA 149 N 0.31 0.72 0.00 3.77 0.00 -1.94 0.54 119.26 122.66 1ii7 h ALA 149 Ca 0.05 0.27 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 1ii7 h ALA 149 Cb 0.51 0.49 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1ii7 h ALA 149 CO -0.20 -0.43 -0.21 2.35 0.00 0.00 0.00 179.25 180.76 1ii7 h TRP 150 N 0.06 0.00 0.01 0.00 7.01 -1.79 -1.85 115.95 119.39 1ii7 h TRP 150 Ca 0.41 0.00 -0.20 0.00 2.11 0.00 0.00 58.89 61.21 1ii7 h TRP 150 Cb 0.71 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.75 1ii7 h TRP 150 CO -0.49 0.21 -0.93 0.74 -2.79 0.00 0.00 178.44 175.18 1ii7 h PHE 151 N 0.00 0.12 -0.01 2.65 -1.00 0.40 -2.99 116.94 116.11 1ii7 h PHE 151 Ca -0.00 -0.08 -0.09 0.00 2.81 0.00 0.00 57.97 60.61 1ii7 h PHE 151 Cb 0.42 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.96 1ii7 h PHE 151 CO 0.00 0.96 -0.42 0.93 -1.61 0.00 0.00 178.31 178.17 1ii7 h GLU 152 N 0.03 0.02 -0.45 1.51 5.08 -0.35 -2.91 114.58 117.51 1ii7 h GLU 152 Ca -0.03 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1ii7 h GLU 152 Cb 1.61 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.86 1ii7 h GLU 152 CO 0.13 0.43 0.00 0.00 -1.00 0.00 0.00 179.01 178.57 1ii7 n ALA 153 N -2.46 2.43 -2.92 3.43 0.00 -0.76 -4.26 120.51 115.97 1ii7 n ALA 153 Ca -0.02 -0.87 -0.13 0.00 0.00 0.00 0.00 53.44 52.43 1ii7 n ALA 153 Cb 0.45 -0.97 0.03 0.00 0.00 0.00 0.00 19.45 18.96 1ii7 n ALA 153 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ii7 n ASN 154 N 1.00 -0.17 -4.49 0.00 3.02 -1.10 -5.06 115.26 108.44 1ii7 n ASN 154 Ca 0.18 -3.08 -0.49 0.00 -0.03 0.00 0.00 54.58 51.16 1ii7 n ASN 154 Cb 0.45 0.24 -0.03 0.00 -0.61 0.00 0.00 39.78 39.82 1ii7 n ASN 154 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1ii7 n LYS 155 N 0.15 0.55 -1.85 3.52 4.76 -1.21 -0.64 118.16 123.44 1ii7 n LYS 155 Ca 0.14 0.19 -0.14 0.00 -2.87 0.00 0.00 58.31 55.63 1ii7 n LYS 155 Cb 0.72 -1.45 -0.04 0.00 -1.84 0.00 0.00 35.03 32.43 1ii7 n LYS 155 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1ii7 n GLU 156 N 1.15 -1.65 -0.13 1.97 -0.58 -1.26 -4.84 120.64 115.30 1ii7 n GLU 156 Ca 0.16 0.78 0.02 0.00 -0.42 0.00 0.00 57.16 57.69 1ii7 n GLU 156 Cb 0.24 -5.19 0.32 0.00 -0.57 0.00 0.00 31.44 26.24 1ii7 n GLU 156 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 1ii7 h ILE 157 N 0.00 1.16 -0.30 -3.67 6.09 -1.22 -2.11 117.51 117.46 1ii7 h ILE 157 Ca -0.31 -0.29 -0.02 0.00 -1.37 0.00 0.00 64.86 62.87 1ii7 h ILE 157 Cb 1.07 0.25 -0.01 0.00 0.47 0.00 0.00 36.82 38.59 1ii7 h ILE 157 CO 0.42 0.15 0.13 -0.07 -3.07 0.00 0.00 178.15 175.71 1ii7 h LEU 158 N 0.84 0.41 -1.52 2.19 3.38 -1.84 0.14 115.31 118.90 1ii7 h LEU 158 Ca 0.23 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1ii7 h LEU 158 Cb -0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1ii7 h LEU 158 CO -0.05 0.45 -0.08 0.11 0.09 0.00 0.00 178.44 178.96 1ii7 h LYS 159 N 0.34 0.20 -0.00 1.13 1.57 -1.64 -0.14 116.57 118.03 1ii7 h LYS 159 Ca 0.10 -0.04 -0.24 0.00 -1.87 0.00 0.00 60.65 58.61 1ii7 h LYS 159 Cb 0.16 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.45 1ii7 h LYS 159 CO -0.01 0.30 -0.97 0.00 -0.57 0.00 0.00 179.45 178.20 1ii7 h ARG 160 N 0.20 0.50 0.24 3.15 3.08 -0.91 -3.36 114.38 117.29 1ii7 h ARG 160 Ca 0.04 -0.54 -0.33 0.00 0.07 0.00 0.00 59.98 59.22 1ii7 h ARG 160 Cb 0.28 0.15 0.03 0.00 0.08 0.00 0.00 29.97 30.52 1ii7 h ARG 160 CO 0.01 1.18 -1.46 -0.07 -1.07 0.00 0.00 179.97 178.56 1ii7 h LEU 161 N 0.28 0.79 -7.98 3.04 3.38 -0.43 -3.44 115.31 110.96 1ii7 h LEU 161 Ca -0.10 -0.85 -0.68 0.00 0.09 0.00 0.00 57.88 56.34 1ii7 h LEU 161 Cb 1.61 -0.26 -0.33 0.00 0.09 0.00 0.00 40.66 41.77 1ii7 h LEU 161 CO 0.18 1.67 -0.67 -0.36 0.09 0.00 0.00 178.44 179.34 1ii7 s PHE 162 N -2.61 3.35 -0.28 1.13 0.40 -0.09 -5.05 117.98 114.83 1ii7 s PHE 162 Ca -0.08 -2.02 -0.05 0.00 -0.60 0.00 0.00 56.93 54.18 1ii7 s PHE 162 Cb 0.04 -2.37 0.02 0.00 0.51 0.00 0.00 43.02 41.22 1ii7 s PHE 162 CO 0.94 -0.84 0.03 1.03 0.70 0.00 0.00 175.22 177.07 1ii7 s ARG 163 N 1.22 2.99 0.50 0.44 0.52 -1.26 -4.70 118.95 118.66 1ii7 s ARG 163 Ca -0.02 -0.90 -0.22 0.00 -0.52 0.00 0.00 55.73 54.07 1ii7 s ARG 163 Cb -0.20 -3.22 -0.06 0.00 0.52 0.00 0.00 34.95 31.98 1ii7 s ARG 163 CO -0.02 -0.42 1.20 -1.25 0.02 0.00 0.00 175.30 174.83 1ii7 s PRO 164 N 1.43 3.49 0.00 3.54 0.04 -1.26 -5.04 135.00 137.20 1ii7 s PRO 164 Ca 0.02 1.84 0.00 0.00 0.04 0.00 0.00 61.00 62.89 1ii7 s PRO 164 Cb -0.17 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.11 1ii7 s PRO 164 CO -0.00 -0.79 0.00 0.25 0.04 0.00 0.00 177.00 176.50 1ii7 n THR 165 N -0.84 0.00 -0.08 1.26 -2.24 -1.26 -4.94 114.28 106.18 1ii7 n THR 165 Ca 0.09 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.88 1ii7 n THR 165 Cb 0.48 -1.72 0.30 0.00 -2.10 0.00 0.00 70.33 67.29 1ii7 n THR 165 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1ii7 h ASP 166 N 0.00 0.63 -2.94 3.42 -0.00 -1.94 -3.36 116.42 112.24 1ii7 h ASP 166 Ca 0.00 -0.06 -0.60 0.00 -0.00 0.00 0.00 57.03 56.37 1ii7 h ASP 166 Cb 0.00 -0.16 -0.39 0.00 -0.00 0.00 0.00 39.33 38.77 1ii7 h ASP 166 CO 0.00 0.56 -0.81 0.21 -0.00 0.00 0.00 179.24 179.20 1ii7 s ASN 167 N -6.60 3.05 0.05 2.28 3.04 -1.26 -4.98 114.94 110.52 1ii7 s ASN 167 Ca -0.09 -2.76 -0.00 0.00 0.04 0.00 0.00 52.86 50.04 1ii7 s ASN 167 Cb 0.17 -0.79 -0.03 0.00 -1.54 0.00 0.00 41.25 39.05 1ii7 s ASN 167 CO 0.77 -0.23 -0.04 0.00 -3.04 0.00 0.00 177.10 174.56 1ii7 s ALA 168 N 0.26 0.44 0.05 1.71 0.00 -1.26 -2.05 121.76 120.91 1ii7 s ALA 168 Ca 0.22 -1.01 0.07 0.00 0.00 0.00 0.00 51.96 51.24 1ii7 s ALA 168 Cb -0.15 0.21 -0.03 0.00 0.00 0.00 0.00 23.12 23.15 1ii7 s ALA 168 CO -0.06 -0.27 -0.17 0.42 0.00 0.00 0.00 175.76 175.67 1ii7 s ILE 169 N -3.00 2.87 -0.13 0.00 -1.09 -0.05 -0.30 121.20 119.50 1ii7 s ILE 169 Ca -0.00 -1.21 0.02 0.00 -2.23 0.00 0.00 60.65 57.22 1ii7 s ILE 169 Cb 0.01 -2.23 0.00 0.00 -1.58 0.00 0.00 42.46 38.66 1ii7 s ILE 169 CO -0.06 0.30 -0.20 -0.22 -1.23 0.00 0.00 174.94 173.53 1ii7 s LEU 170 N -1.57 2.27 -0.15 2.97 2.96 -0.74 -0.74 118.68 123.68 1ii7 s LEU 170 Ca 0.15 -0.52 0.01 0.00 -0.22 0.00 0.00 54.13 53.56 1ii7 s LEU 170 Cb -0.11 -1.48 0.00 0.00 0.50 0.00 0.00 46.19 45.11 1ii7 s LEU 170 CO 0.06 0.12 -0.18 -0.32 -1.32 0.00 0.00 176.35 174.71 1ii7 s MET 171 N 0.57 3.13 0.04 1.98 -2.45 0.11 -0.49 119.30 122.19 1ii7 s MET 171 Ca -0.12 -0.80 -0.05 0.00 -1.25 0.00 0.00 55.69 53.47 1ii7 s MET 171 Cb -0.16 -2.53 -0.01 0.00 1.25 0.00 0.00 34.83 33.37 1ii7 s MET 171 CO 0.04 0.01 0.09 -0.51 1.05 0.00 0.00 175.02 175.70 1ii7 s LEU 172 N 0.79 1.82 -0.49 4.11 1.43 -0.95 -3.10 118.68 122.30 1ii7 s LEU 172 Ca -0.07 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.51 1ii7 s LEU 172 Cb -0.15 0.60 0.13 0.00 0.03 0.00 0.00 46.19 46.79 1ii7 s LEU 172 CO -0.00 -0.52 0.23 -2.28 0.23 0.00 0.00 176.35 174.01 1ii7 s HIS 173 N -2.70 3.36 -0.00 0.29 5.65 -1.26 -1.80 115.29 118.83 1ii7 s HIS 173 Ca -0.04 -3.05 -0.27 0.00 0.25 0.00 0.00 55.06 51.94 1ii7 s HIS 173 Cb -0.01 -2.91 0.06 0.00 -1.18 0.00 0.00 32.58 28.55 1ii7 s HIS 173 CO -0.05 -0.81 0.62 -0.65 -0.65 0.00 0.00 174.74 173.20 1ii7 s GLN 174 N 0.07 1.06 0.09 2.88 -1.52 -0.99 -4.18 119.66 117.07 1ii7 s GLN 174 Ca 0.15 0.04 -0.24 0.00 -1.95 0.00 0.00 55.36 53.36 1ii7 s GLN 174 Cb -0.24 0.49 -0.06 0.00 -0.22 0.00 0.00 33.01 32.98 1ii7 s GLN 174 CO -0.02 -0.36 0.74 0.20 -0.25 0.00 0.00 175.29 175.60 1ii7 s GLY 175 N -1.55 2.82 -0.17 3.09 0.00 -1.26 -4.73 107.32 105.52 1ii7 s GLY 175 Ca -0.09 0.28 -0.07 0.00 0.00 0.00 0.00 44.72 44.84 1ii7 s GLY 175 CO 0.04 0.94 0.08 0.14 0.00 0.00 0.00 173.10 174.31 1ii7 s VAL 176 N -0.54 5.00 0.17 1.40 1.01 -1.26 -1.76 120.40 124.41 1ii7 s VAL 176 Ca 0.36 0.04 -0.25 0.00 0.00 0.00 0.00 61.98 62.13 1ii7 s VAL 176 Cb -0.21 -3.23 0.04 0.00 0.00 0.00 0.00 36.38 32.98 1ii7 s VAL 176 CO 0.23 0.50 1.58 -0.09 0.00 0.00 0.00 175.10 177.32 1ii7 h ARG 177 N 6.24 -0.24 -0.44 2.72 2.43 -1.19 -0.78 114.38 123.12 1ii7 h ARG 177 Ca -0.42 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 58.80 1ii7 h ARG 177 Cb 1.18 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.76 1ii7 h ARG 177 CO 0.68 -0.16 0.29 0.93 -1.51 0.00 0.00 179.97 180.20 1ii7 h GLU 178 N -0.25 0.45 -0.06 0.20 3.07 -1.96 0.54 114.58 116.57 1ii7 h GLU 178 Ca 0.18 -0.03 -0.24 0.00 -0.50 0.00 0.00 59.36 58.77 1ii7 h GLU 178 Cb 0.57 -0.10 0.02 0.00 -0.84 0.00 0.00 28.75 28.39 1ii7 h GLU 178 CO -0.64 0.30 -0.91 0.28 -1.40 0.00 0.00 179.01 176.64 1ii7 h VAL 179 N 0.46 1.29 -0.11 3.13 2.07 -1.68 -1.99 116.25 119.42 1ii7 h VAL 179 Ca 0.18 -2.12 -0.04 0.00 0.82 0.00 0.00 66.70 65.54 1ii7 h VAL 179 Cb 0.14 2.24 -0.00 0.00 -1.52 0.00 0.00 31.29 32.15 1ii7 h VAL 179 CO -0.04 0.66 -0.10 0.28 0.02 0.00 0.00 177.57 178.39 1ii7 h SER 180 N 0.42 0.27 -0.50 0.57 0.02 -0.72 -3.20 113.55 110.40 1ii7 h SER 180 Ca -0.10 -0.47 0.03 0.00 -0.84 0.00 0.00 61.79 60.41 1ii7 h SER 180 Cb 1.56 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.99 1ii7 h SER 180 CO 0.18 0.69 0.29 -0.33 -1.14 0.00 0.00 176.83 176.52 1ii7 h GLU 181 N -0.15 0.55 -1.08 3.45 5.08 -0.94 0.20 114.58 121.70 1ii7 h GLU 181 Ca 0.02 -0.03 0.29 0.00 -1.00 0.00 0.00 59.36 58.64 1ii7 h GLU 181 Cb 0.61 -0.13 -0.09 0.00 0.50 0.00 0.00 28.75 29.64 1ii7 h GLU 181 CO 0.02 0.37 0.71 0.00 -1.00 0.00 0.00 179.01 179.11 1ii7 h ALA 182 N 1.24 2.43 -0.59 3.43 0.00 -1.36 0.51 119.26 124.91 1ii7 h ALA 182 Ca 0.21 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ii7 h ALA 182 Cb 0.05 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ii7 h ALA 182 CO -0.11 -0.84 0.00 0.54 0.00 0.00 0.00 179.25 178.84 1ii7 n ARG 183 N -4.55 4.29 -1.04 0.00 1.74 -0.60 -4.94 116.66 111.56 1ii7 n ARG 183 Ca 0.26 -3.03 -0.02 0.00 -0.77 0.00 0.00 57.85 54.30 1ii7 n ARG 183 Cb 0.98 -2.08 -0.01 0.00 -1.02 0.00 0.00 32.46 30.34 1ii7 n ARG 183 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ii7 n GLY 184 N 0.79 0.32 3.94 -0.13 0.00 0.18 -5.00 105.19 105.30 1ii7 n GLY 184 Ca 0.27 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 1ii7 n GLY 184 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ii7 s GLU 185 N -1.46 3.33 -0.26 1.61 2.02 -0.04 -4.96 118.70 118.94 1ii7 s GLU 185 Ca 0.00 -0.32 0.12 0.00 0.02 0.00 0.00 54.97 54.79 1ii7 s GLU 185 Cb 0.00 -2.58 0.46 0.00 0.10 0.00 0.00 34.13 32.11 1ii7 s GLU 185 CO 0.00 -0.06 1.18 -0.40 0.02 0.00 0.00 175.26 176.00 1ii7 n ASP 186 N -1.96 3.57 -4.12 -0.19 5.75 -1.26 -3.49 116.55 114.85 1ii7 n ASP 186 Ca -0.02 -3.35 -0.33 0.00 -0.01 0.00 0.00 54.79 51.08 1ii7 n ASP 186 Cb 0.57 -0.39 -0.15 0.00 -1.03 0.00 0.00 41.12 40.11 1ii7 n ASP 186 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1ii7 s TYR 187 N -3.40 3.19 0.06 2.11 2.02 -1.26 -5.08 117.35 114.98 1ii7 s TYR 187 Ca 0.43 -2.03 -0.26 0.00 -0.37 0.00 0.00 57.07 54.84 1ii7 s TYR 187 Cb 0.39 -1.99 0.08 0.00 -0.40 0.00 0.00 41.96 40.04 1ii7 s TYR 187 CO -0.00 -0.83 0.72 -0.59 -1.57 0.00 0.00 175.55 173.28 1ii7 s PHE 188 N 1.19 -0.49 -0.07 2.71 -0.12 -1.26 -4.66 117.98 115.29 1ii7 s PHE 188 Ca -0.05 0.43 0.02 0.00 -0.05 0.00 0.00 56.93 57.27 1ii7 s PHE 188 Cb -0.19 0.53 -0.03 0.00 -0.63 0.00 0.00 43.02 42.70 1ii7 s PHE 188 CO -0.05 -0.69 0.07 0.39 -0.05 0.00 0.00 175.22 174.89 1ii7 n GLU 189 N -0.09 4.23 -4.01 1.99 4.71 -0.72 -4.83 120.64 121.92 1ii7 n GLU 189 Ca -0.14 -0.01 -0.11 0.00 -0.01 0.00 0.00 57.16 56.89 1ii7 n GLU 189 Cb 0.62 -0.75 -0.04 0.00 -1.01 0.00 0.00 31.44 30.27 1ii7 n GLU 189 CO 0.00 0.00 0.00 0.96 0.09 0.00 0.00 177.13 178.18 1ii7 s ILE 190 N -1.51 0.00 0.28 -3.67 -4.36 -1.20 -4.78 121.20 105.96 1ii7 s ILE 190 Ca 0.00 -1.45 0.09 0.00 -0.26 0.00 0.00 60.65 59.04 1ii7 s ILE 190 Cb 0.01 -2.46 -0.06 0.00 1.25 0.00 0.00 42.46 41.20 1ii7 s ILE 190 CO 0.09 0.00 -0.12 -0.83 0.24 0.00 0.00 174.94 174.32 1ii7 s GLY 191 N -3.11 1.88 0.31 6.27 0.00 -1.26 -0.60 107.32 110.80 1ii7 s GLY 191 Ca 0.25 -1.91 0.06 0.00 0.00 0.00 0.00 44.72 43.12 1ii7 s GLY 191 CO 0.14 -1.91 1.78 1.41 0.00 0.00 0.00 173.10 174.51 1ii7 h LEU 192 N 2.25 0.78 -2.15 0.66 3.38 -1.97 0.23 115.31 118.48 1ii7 h LEU 192 Ca -0.40 0.10 0.07 0.00 0.09 0.00 0.00 57.88 57.74 1ii7 h LEU 192 Cb 1.24 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1ii7 h LEU 192 CO 0.65 0.27 0.25 1.23 0.09 0.00 0.00 178.44 180.94 1ii7 h GLY 193 N 0.76 0.00 2.00 0.83 0.00 -2.03 -0.35 103.07 104.28 1ii7 h GLY 193 Ca 0.58 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.86 1ii7 h GLY 193 CO -0.38 0.00 -0.23 -0.55 0.00 0.00 0.00 176.54 175.38 1ii7 h ASP 194 N 0.00 0.00 -3.91 0.19 3.32 -0.94 -3.45 116.42 111.64 1ii7 h ASP 194 Ca 0.12 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.64 1ii7 h ASP 194 Cb 0.62 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.25 1ii7 h ASP 194 CO -0.00 0.23 0.67 -0.76 -1.72 0.00 0.00 179.24 177.66 1ii7 s LEU 195 N -6.66 4.37 0.31 1.55 1.43 -0.14 -4.30 118.68 115.22 1ii7 s LEU 195 Ca 0.01 2.77 -0.28 0.00 -1.03 0.00 0.00 54.13 55.60 1ii7 s LEU 195 Cb 0.09 -3.69 -0.09 0.00 0.03 0.00 0.00 46.19 42.53 1ii7 s LEU 195 CO 0.65 -0.66 1.12 -2.16 0.23 0.00 0.00 176.35 175.53 1ii7 s PRO 196 N -1.93 4.52 0.47 1.29 0.04 -1.26 -4.94 135.00 133.18 1ii7 s PRO 196 Ca 0.51 1.82 -0.14 0.00 0.04 0.00 0.00 61.00 63.23 1ii7 s PRO 196 Cb -0.41 -3.07 -0.07 0.00 0.04 0.00 0.00 34.50 30.99 1ii7 s PRO 196 CO 0.55 0.10 0.89 -1.21 0.04 0.00 0.00 177.00 177.36 1ii7 s GLU 197 N -1.65 3.87 0.00 4.56 2.02 -1.26 -4.36 118.70 121.87 1ii7 s GLU 197 Ca 0.47 0.73 0.00 0.00 0.02 0.00 0.00 54.97 56.19 1ii7 s GLU 197 Cb -0.32 -2.25 0.00 0.00 0.10 0.00 0.00 34.13 31.66 1ii7 s GLU 197 CO 0.41 -0.17 0.00 0.41 0.02 0.00 0.00 175.26 175.93 1ii7 n GLY 198 N -1.47 1.57 3.82 -1.39 0.00 -1.26 -4.74 105.19 101.71 1ii7 n GLY 198 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1ii7 n GLY 198 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ii7 s TYR 199 N -2.23 3.27 -0.90 1.61 1.51 -1.26 -4.80 117.35 114.55 1ii7 s TYR 199 Ca 0.00 1.59 0.28 0.00 -1.01 0.00 0.00 57.07 57.93 1ii7 s TYR 199 Cb 0.00 -2.88 1.01 0.00 -0.11 0.00 0.00 41.96 39.98 1ii7 s TYR 199 CO 0.00 -0.24 1.81 1.28 -1.11 0.00 0.00 175.55 177.30 1ii7 n LEU 200 N -0.76 0.33 -3.64 -1.29 4.77 0.59 -4.73 117.00 112.27 1ii7 n LEU 200 Ca 0.07 0.47 -0.09 0.00 -0.03 0.00 0.00 56.01 56.44 1ii7 n LEU 200 Cb 0.54 -0.41 -0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1ii7 n LEU 200 CO 0.38 -0.05 0.61 -0.47 -1.33 0.00 0.00 177.39 176.54 1ii7 s TYR 201 N -3.04 -0.63 -0.47 -1.77 5.04 -1.25 -4.39 117.35 110.85 1ii7 s TYR 201 Ca 0.12 1.44 -0.04 0.00 -2.44 0.00 0.00 57.07 56.15 1ii7 s TYR 201 Cb 0.17 0.37 0.12 0.00 0.35 0.00 0.00 41.96 42.97 1ii7 s TYR 201 CO 0.57 -0.30 0.28 0.71 -1.34 0.00 0.00 175.55 175.47 1ii7 s TYR 202 N 0.59 3.53 -0.68 4.97 1.51 -0.29 -1.79 117.35 125.20 1ii7 s TYR 202 Ca -0.01 -2.39 -0.24 0.00 -1.01 0.00 0.00 57.07 53.42 1ii7 s TYR 202 Cb -0.05 -3.27 0.05 0.00 -0.11 0.00 0.00 41.96 38.58 1ii7 s TYR 202 CO -0.07 -0.95 1.07 0.00 -1.11 0.00 0.00 175.55 174.49 1ii7 s ALA 203 N 0.92 3.00 0.45 3.71 0.00 0.36 -1.50 121.76 128.69 1ii7 s ALA 203 Ca 0.10 -1.63 0.08 0.00 0.00 0.00 0.00 51.96 50.50 1ii7 s ALA 203 Cb -0.23 -3.99 0.01 0.00 0.00 0.00 0.00 23.12 18.92 1ii7 s ALA 203 CO -0.04 -2.92 0.54 -0.51 0.00 0.00 0.00 175.76 172.83 1ii7 s LEU 204 N 4.62 3.43 0.13 0.00 1.43 -0.10 -2.23 118.68 125.96 1ii7 s LEU 204 Ca 0.27 -0.64 -0.20 0.00 -1.03 0.00 0.00 54.13 52.53 1ii7 s LEU 204 Cb -0.14 -2.22 0.05 0.00 0.03 0.00 0.00 46.19 43.91 1ii7 s LEU 204 CO 0.13 -0.84 0.50 -0.83 0.23 0.00 0.00 176.35 175.54 1ii7 s GLY 205 N -4.33 -0.44 0.00 -3.19 0.00 -0.75 -4.28 107.32 94.33 1ii7 s GLY 205 Ca 0.53 0.28 0.00 0.00 0.00 0.00 0.00 44.72 45.53 1ii7 s GLY 205 CO 0.32 -0.01 0.00 1.57 0.00 0.00 0.00 173.10 174.97 1ii7 n HIS 206 N -0.18 0.00 -3.11 1.90 -0.00 -1.26 -2.34 115.22 110.23 1ii7 n HIS 206 Ca -0.17 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.16 1ii7 n HIS 206 Cb 0.64 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.57 1ii7 n HIS 206 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1ii7 s ILE 207 N 0.00 5.05 -0.64 3.57 1.01 -1.26 -4.97 121.20 123.95 1ii7 s ILE 207 Ca 0.00 1.27 0.26 0.00 0.00 0.00 0.00 60.65 62.18 1ii7 s ILE 207 Cb 0.00 -3.97 0.28 0.00 0.01 0.00 0.00 42.46 38.78 1ii7 s ILE 207 CO 0.00 0.19 1.76 0.45 0.00 0.00 0.00 174.94 177.34 1ii7 h HIS 208 N 7.09 0.00 -3.63 3.97 3.86 -1.98 -3.32 115.15 121.14 1ii7 h HIS 208 Ca -0.36 0.00 -0.68 0.00 -1.16 0.00 0.00 60.37 58.17 1ii7 h HIS 208 Cb 1.17 0.00 -0.24 0.00 1.06 0.00 0.00 27.41 29.40 1ii7 h HIS 208 CO 0.68 0.00 -0.58 0.15 0.86 0.00 0.00 177.93 179.04 1ii7 s LYS 209 N -3.17 3.19 0.31 2.45 1.02 -1.26 -1.24 119.74 121.04 1ii7 s LYS 209 Ca 0.09 -0.81 -0.24 0.00 0.02 0.00 0.00 55.97 55.03 1ii7 s LYS 209 Cb 0.11 -3.50 -0.16 0.00 -0.52 0.00 0.00 37.83 33.76 1ii7 s LYS 209 CO 0.55 -0.45 0.27 2.89 -0.92 0.00 0.00 175.35 177.69 1ii7 n ARG 210 N 4.94 0.00 -3.72 1.68 1.85 -1.26 -4.71 116.66 115.44 1ii7 n ARG 210 Ca -0.14 0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 56.58 1ii7 n ARG 210 Cb 0.48 -0.99 -0.10 0.00 -1.05 0.00 0.00 32.46 30.80 1ii7 n ARG 210 CO 0.00 0.00 0.00 -0.47 -0.01 0.00 0.00 177.63 177.15 1ii7 s TYR 211 N -1.38 -0.49 -0.05 2.89 5.04 -0.42 -4.95 117.35 118.00 1ii7 s TYR 211 Ca 0.61 1.20 -0.02 0.00 -2.44 0.00 0.00 57.07 56.42 1ii7 s TYR 211 Cb -0.76 0.17 0.03 0.00 0.35 0.00 0.00 41.96 41.75 1ii7 s TYR 211 CO 0.60 -0.24 0.04 -2.00 -1.34 0.00 0.00 175.55 172.60 1ii7 s GLU 212 N 0.23 0.19 0.00 4.97 2.12 -1.26 -0.89 118.70 124.06 1ii7 s GLU 212 Ca -0.00 0.26 0.00 0.00 0.36 0.00 0.00 54.97 55.59 1ii7 s GLU 212 Cb -0.03 -0.68 0.00 0.00 0.26 0.00 0.00 34.13 33.68 1ii7 s GLU 212 CO 0.01 -0.31 0.00 -2.37 -0.54 0.00 0.00 175.26 172.05 1ii7 n THR 213 N 5.17 0.00 -4.15 -1.70 5.66 0.39 -4.97 114.28 114.68 1ii7 n THR 213 Ca -0.06 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.78 1ii7 n THR 213 Cb 0.50 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.14 1ii7 n THR 213 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1ii7 s SER 214 N 0.54 0.66 -0.15 1.09 0.15 -1.26 -1.30 113.70 113.42 1ii7 s SER 214 Ca 0.00 -0.16 -0.09 0.00 0.70 0.00 0.00 55.95 56.40 1ii7 s SER 214 Cb 0.00 -0.06 0.05 0.00 -1.71 0.00 0.00 66.02 64.31 1ii7 s SER 214 CO 0.00 0.03 0.38 -0.47 1.20 0.00 0.00 173.24 174.38 1ii7 s TYR 215 N -0.29 -0.52 -1.48 3.44 5.04 0.52 -4.89 117.35 119.17 1ii7 s TYR 215 Ca 0.00 1.15 -0.12 0.00 -2.44 0.00 0.00 57.07 55.67 1ii7 s TYR 215 Cb -0.03 0.21 0.07 0.00 0.35 0.00 0.00 41.96 42.56 1ii7 s TYR 215 CO -0.00 -0.30 0.81 0.45 -1.34 0.00 0.00 175.55 175.17 1ii7 n SER 216 N 4.02 -4.73 0.00 4.32 2.88 -1.26 -0.45 113.62 118.40 1ii7 n SER 216 Ca -0.22 -0.62 0.00 0.00 -1.33 0.00 0.00 58.87 56.70 1ii7 n SER 216 Cb 0.55 -3.81 0.00 0.00 -0.75 0.00 0.00 64.21 60.20 1ii7 n SER 216 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ii7 n GLY 217 N -1.54 0.58 3.41 0.46 0.00 -1.26 -4.65 105.19 102.20 1ii7 n GLY 217 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 1ii7 n GLY 217 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ii7 s SER 218 N -2.29 2.80 0.40 1.61 0.01 0.40 -5.08 113.70 111.55 1ii7 s SER 218 Ca 0.00 -1.12 -0.25 0.00 1.31 0.00 0.00 55.95 55.89 1ii7 s SER 218 Cb 0.00 -0.17 -0.09 0.00 0.21 0.00 0.00 66.02 65.97 1ii7 s SER 218 CO 0.00 -0.25 1.12 -2.84 0.41 0.00 0.00 173.24 171.68 1ii7 s PRO 219 N -3.68 4.10 -0.19 12.44 0.02 -1.26 -0.35 135.00 146.08 1ii7 s PRO 219 Ca 0.27 1.70 0.01 0.00 0.02 0.00 0.00 61.00 63.00 1ii7 s PRO 219 Cb 0.01 -2.63 0.04 0.00 0.02 0.00 0.00 34.50 31.94 1ii7 s PRO 219 CO 0.11 -0.24 -0.12 0.08 -0.33 0.00 0.00 177.00 176.49 1ii7 s VAL 220 N -1.50 1.71 -0.05 3.83 1.01 -0.42 -1.13 120.40 123.85 1ii7 s VAL 220 Ca 0.57 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.62 1ii7 s VAL 220 Cb -0.27 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.40 1ii7 s VAL 220 CO 0.34 0.27 -0.13 -0.69 0.00 0.00 0.00 175.10 174.89 1ii7 s VAL 221 N 1.38 1.13 -0.25 2.92 1.01 -0.56 -0.46 120.40 125.58 1ii7 s VAL 221 Ca 0.00 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.42 1ii7 s VAL 221 Cb -0.15 -1.01 -0.00 0.00 0.00 0.00 0.00 36.38 35.22 1ii7 s VAL 221 CO -0.09 0.34 0.01 -0.31 0.00 0.00 0.00 175.10 175.05 1ii7 s TYR 222 N 0.36 3.05 -0.92 5.22 1.51 -0.07 -0.93 117.35 125.57 1ii7 s TYR 222 Ca -0.08 -0.97 0.28 0.00 -1.01 0.00 0.00 57.07 55.28 1ii7 s TYR 222 Cb -0.13 -2.16 1.10 0.00 -0.11 0.00 0.00 41.96 40.66 1ii7 s TYR 222 CO 0.02 -0.56 1.88 -0.35 -1.11 0.00 0.00 175.55 175.44 1ii7 n PRO 223 N 4.82 0.08 -0.14 -1.71 -0.04 -1.26 -1.29 135.00 135.46 1ii7 n PRO 223 Ca -0.17 0.07 0.02 0.00 -0.04 0.00 0.00 63.50 63.38 1ii7 n PRO 223 Cb 0.49 -1.60 -0.01 0.00 -0.04 0.00 0.00 33.50 32.35 1ii7 n PRO 223 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ii7 n GLY 224 N 1.42 -1.72 3.81 0.55 0.00 -1.25 -4.24 105.19 103.76 1ii7 n GLY 224 Ca 0.07 -1.48 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 1ii7 n GLY 224 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ii7 s SER 225 N -4.06 4.90 -0.01 1.61 1.04 -0.37 -4.44 113.70 112.36 1ii7 s SER 225 Ca 0.00 1.47 -0.15 0.00 0.48 0.00 0.00 55.95 57.75 1ii7 s SER 225 Cb 0.00 -2.27 -0.34 0.00 0.10 0.00 0.00 66.02 63.52 1ii7 s SER 225 CO 0.00 -1.73 0.86 -0.07 0.98 0.00 0.00 173.24 173.28 1ii7 h LEU 226 N -0.92 0.73 -9.98 2.42 3.38 -1.80 -3.36 115.31 105.78 1ii7 h LEU 226 Ca -0.45 -0.93 -0.54 0.00 0.09 0.00 0.00 57.88 56.05 1ii7 h LEU 226 Cb 1.24 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.71 1ii7 h LEU 226 CO 0.58 1.72 -0.49 -1.61 0.09 0.00 0.00 178.44 178.73 1ii7 s GLU 227 N -2.58 3.26 0.16 1.13 0.41 -1.26 -4.44 118.70 115.39 1ii7 s GLU 227 Ca -0.12 -0.72 -0.32 0.00 -0.41 0.00 0.00 54.97 53.40 1ii7 s GLU 227 Cb 0.04 -2.84 -0.11 0.00 -1.78 0.00 0.00 34.13 29.44 1ii7 s GLU 227 CO 0.90 0.49 1.67 1.03 -0.49 0.00 0.00 175.26 178.87 1ii7 s ARG 228 N -3.34 4.17 -0.02 1.61 0.52 -1.26 -4.92 118.95 115.71 1ii7 s ARG 228 Ca 0.33 2.48 -0.23 0.00 -0.52 0.00 0.00 55.73 57.80 1ii7 s ARG 228 Cb -0.10 -3.24 -0.22 0.00 0.52 0.00 0.00 34.95 31.91 1ii7 s ARG 228 CO 0.27 -0.71 1.11 2.35 0.02 0.00 0.00 175.30 178.34 1ii7 h TRP 229 N 7.23 0.37 -2.20 -0.53 -0.00 -1.93 -3.49 115.95 115.40 1ii7 h TRP 229 Ca -0.43 -0.18 0.02 0.00 -0.00 0.00 0.00 58.89 58.30 1ii7 h TRP 229 Cb 1.20 -0.05 -0.00 0.00 -0.00 0.00 0.00 29.16 30.31 1ii7 h TRP 229 CO 0.68 0.94 0.17 -0.40 -0.00 0.00 0.00 178.44 179.83 1ii7 n ASP 230 N -4.46 -0.81 0.08 2.65 3.85 -1.26 -5.00 116.55 111.60 1ii7 n ASP 230 Ca -0.09 -1.51 0.10 0.00 -0.71 0.00 0.00 54.79 52.58 1ii7 n ASP 230 Cb 0.51 1.34 0.42 0.00 -1.35 0.00 0.00 41.12 42.04 1ii7 n ASP 230 CO 0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.20 176.68 1ii7 n PHE 231 N -0.25 0.51 0.56 2.11 3.01 -1.26 0.03 117.46 122.17 1ii7 n PHE 231 Ca -0.02 0.20 0.13 0.00 1.01 0.00 0.00 57.45 58.76 1ii7 n PHE 231 Cb 0.23 -0.82 0.42 0.00 -0.01 0.00 0.00 39.48 39.30 1ii7 n PHE 231 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1ii7 h GLY 232 N 2.35 0.00 -4.63 1.37 0.00 -2.00 -3.18 103.07 96.98 1ii7 h GLY 232 Ca 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 47.33 46.61 1ii7 h GLY 232 CO 0.00 0.00 0.78 1.34 0.00 0.00 0.00 176.54 178.66 1ii7 n ASP 233 N -2.30 7.24 -4.78 0.19 4.64 0.10 -5.02 116.55 116.62 1ii7 n ASP 233 Ca 0.05 -3.81 -0.33 0.00 -1.38 0.00 0.00 54.79 49.32 1ii7 n ASP 233 Cb 0.39 -0.96 0.04 0.00 -1.04 0.00 0.00 41.12 39.56 1ii7 n ASP 233 CO 0.00 0.00 0.00 -0.72 -0.82 0.00 0.00 177.20 175.66 1ii7 s TYR 234 N -3.94 2.67 0.01 -0.67 -0.85 -1.20 -4.64 117.35 108.73 1ii7 s TYR 234 Ca 0.55 1.54 -0.18 0.00 -0.52 0.00 0.00 57.07 58.47 1ii7 s TYR 234 Cb 0.45 -3.14 -0.30 0.00 0.38 0.00 0.00 41.96 39.35 1ii7 s TYR 234 CO -0.27 -1.62 1.02 1.49 -1.52 0.00 0.00 175.55 174.66 1ii7 h GLU 235 N 0.04 0.48 -3.12 -3.49 4.81 -1.32 -3.27 114.58 108.70 1ii7 h GLU 235 Ca -0.47 -0.69 -0.15 0.00 -0.13 0.00 0.00 59.36 57.93 1ii7 h GLU 235 Cb 1.24 0.24 -0.23 0.00 0.63 0.00 0.00 28.75 30.62 1ii7 h GLU 235 CO 0.54 1.30 -0.38 0.08 -0.73 0.00 0.00 179.01 179.83 1ii7 s VAL 236 N -2.80 0.03 -0.14 0.32 1.01 -1.23 -0.76 120.40 116.83 1ii7 s VAL 236 Ca -0.11 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1ii7 s VAL 236 Cb 0.04 -0.45 0.00 0.00 0.00 0.00 0.00 36.38 35.97 1ii7 s VAL 236 CO 0.89 -0.11 -0.20 -0.60 0.00 0.00 0.00 175.10 175.07 1ii7 s ARG 237 N -0.41 3.09 -0.07 2.72 3.52 0.14 -2.33 118.95 125.61 1ii7 s ARG 237 Ca -0.05 -0.82 0.02 0.00 -0.13 0.00 0.00 55.73 54.75 1ii7 s ARG 237 Cb -0.03 -2.47 -0.03 0.00 -1.56 0.00 0.00 34.95 30.86 1ii7 s ARG 237 CO 0.01 0.04 -0.12 0.71 -0.81 0.00 0.00 175.30 175.13 1ii7 s TYR 238 N 0.71 2.79 -0.11 5.12 1.51 0.13 -1.39 117.35 126.11 1ii7 s TYR 238 Ca -0.09 -0.16 -0.01 0.00 -1.01 0.00 0.00 57.07 55.80 1ii7 s TYR 238 Cb -0.16 -1.68 0.03 0.00 -0.11 0.00 0.00 41.96 40.04 1ii7 s TYR 238 CO 0.01 0.18 -0.01 -2.00 -1.11 0.00 0.00 175.55 172.62 1ii7 s GLU 239 N -0.61 0.80 0.05 -0.62 2.12 -0.72 -1.09 118.70 118.63 1ii7 s GLU 239 Ca 0.09 -0.09 -0.30 0.00 0.36 0.00 0.00 54.97 55.02 1ii7 s GLU 239 Cb -0.11 -1.36 -0.08 0.00 0.26 0.00 0.00 34.13 32.83 1ii7 s GLU 239 CO 0.01 -0.38 1.69 -0.46 -0.54 0.00 0.00 175.26 175.59 1ii7 s TRP 240 N 1.89 2.24 -0.26 5.30 -0.11 -0.81 -0.16 118.94 127.04 1ii7 s TRP 240 Ca 0.04 0.21 0.13 0.00 1.22 0.00 0.00 56.10 57.70 1ii7 s TRP 240 Cb -0.13 -3.99 0.66 0.00 -1.50 0.00 0.00 33.47 28.51 1ii7 s TRP 240 CO -0.06 -4.07 1.63 -0.40 -4.62 0.00 0.00 176.95 169.43 1ii7 n ASP 241 N 5.99 4.43 0.00 5.86 5.68 0.12 -4.74 116.55 133.88 1ii7 n ASP 241 Ca 0.16 -3.17 0.00 0.00 -0.50 0.00 0.00 54.79 51.29 1ii7 n ASP 241 Cb 0.41 -0.66 0.00 0.00 -1.14 0.00 0.00 41.12 39.73 1ii7 n ASP 241 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ii7 n GLY 242 N -0.25 2.89 0.00 6.12 0.00 -1.26 -4.65 105.19 108.03 1ii7 n GLY 242 Ca 0.31 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1ii7 n GLY 242 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ii7 n ILE 243 N 0.00 0.00 -4.08 -0.61 2.08 -1.26 -5.07 119.36 110.42 1ii7 n ILE 243 Ca 0.00 0.00 -0.10 0.00 0.56 0.00 0.00 62.75 63.21 1ii7 n ILE 243 Cb 0.00 -0.47 -0.08 0.00 -0.75 0.00 0.00 39.64 38.34 1ii7 n ILE 243 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1ii7 s LYS 244 N -1.78 1.12 -0.21 0.38 2.20 -1.26 -5.10 119.74 115.10 1ii7 s LYS 244 Ca 0.00 -1.36 -0.19 0.00 -0.36 0.00 0.00 55.97 54.05 1ii7 s LYS 244 Cb 0.00 0.32 -0.03 0.00 -1.51 0.00 0.00 37.83 36.61 1ii7 s LYS 244 CO 0.00 -0.38 0.57 -0.06 -0.36 0.00 0.00 175.35 175.12 1ii7 s PHE 245 N -4.04 3.35 0.62 4.03 0.40 -1.26 -0.71 117.98 120.38 1ii7 s PHE 245 Ca 0.24 0.82 -0.14 0.00 -0.60 0.00 0.00 56.93 57.25 1ii7 s PHE 245 Cb 0.05 -2.74 -0.02 0.00 0.51 0.00 0.00 43.02 40.81 1ii7 s PHE 245 CO 0.04 -0.18 1.05 0.15 0.70 0.00 0.00 175.22 176.98 1ii7 s LYS 246 N 1.92 3.25 0.08 0.44 1.02 0.78 -4.79 119.74 122.43 1ii7 s LYS 246 Ca 0.26 1.07 0.07 0.00 0.02 0.00 0.00 55.97 57.39 1ii7 s LYS 246 Cb -0.16 -2.03 -0.03 0.00 -0.52 0.00 0.00 37.83 35.09 1ii7 s LYS 246 CO 0.10 -0.86 -0.19 -1.21 -0.92 0.00 0.00 175.35 172.27 1ii7 s GLU 247 N -4.47 1.08 -0.10 1.68 2.02 -1.26 -1.75 118.70 115.89 1ii7 s GLU 247 Ca 0.61 -1.05 -0.04 0.00 0.02 0.00 0.00 54.97 54.51 1ii7 s GLU 247 Cb -0.14 -1.24 0.05 0.00 0.10 0.00 0.00 34.13 32.89 1ii7 s GLU 247 CO 0.44 0.29 0.21 0.50 0.02 0.00 0.00 175.26 176.72 1ii7 s ARG 248 N -1.69 0.11 0.06 1.61 3.52 -0.49 -4.99 118.95 117.07 1ii7 s ARG 248 Ca 0.04 0.59 -0.17 0.00 -0.13 0.00 0.00 55.73 56.06 1ii7 s ARG 248 Cb -0.10 -0.15 -0.06 0.00 -1.56 0.00 0.00 34.95 33.08 1ii7 s ARG 248 CO 0.03 -0.26 0.52 0.71 -0.81 0.00 0.00 175.30 175.49 1ii7 s TYR 249 N 2.01 3.77 0.00 5.12 1.51 -1.26 0.23 117.35 128.72 1ii7 s TYR 249 Ca -0.01 1.17 0.00 0.00 -1.01 0.00 0.00 57.07 57.22 1ii7 s TYR 249 Cb -0.12 -2.42 0.00 0.00 -0.11 0.00 0.00 41.96 39.31 1ii7 s TYR 249 CO -0.07 0.59 0.00 0.41 -1.11 0.00 0.00 175.55 175.37 1ii7 n GLY 250 N 1.66 0.08 3.82 0.71 0.00 0.06 -4.94 105.19 106.59 1ii7 n GLY 250 Ca -0.11 -1.73 -0.32 0.00 0.00 0.00 0.00 46.02 43.87 1ii7 n GLY 250 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ii7 s VAL 251 N 0.56 4.87 0.65 1.61 -7.23 -1.25 -4.98 120.40 114.63 1ii7 s VAL 251 Ca 0.00 -0.50 -0.15 0.00 -1.81 0.00 0.00 61.98 59.52 1ii7 s VAL 251 Cb 0.00 -3.31 -0.01 0.00 0.56 0.00 0.00 36.38 33.63 1ii7 s VAL 251 CO 0.00 0.23 1.10 0.20 -0.31 0.00 0.00 175.10 176.32 1ii7 s ASN 252 N -2.14 5.23 -0.04 4.85 0.01 -1.26 -4.87 114.94 116.72 1ii7 s ASN 252 Ca 0.28 1.96 0.01 0.00 -0.71 0.00 0.00 52.86 54.40 1ii7 s ASN 252 Cb -0.12 -2.55 -0.03 0.00 0.41 0.00 0.00 41.25 38.96 1ii7 s ASN 252 CO 0.20 -1.55 -0.04 -0.54 -1.51 0.00 0.00 177.10 173.66 1ii7 s LYS 253 N -4.12 2.73 0.00 -0.60 -0.14 -1.26 -4.72 119.74 111.63 1ii7 s LYS 253 Ca 0.66 -0.59 0.00 0.00 -1.36 0.00 0.00 55.97 54.68 1ii7 s LYS 253 Cb -0.19 -2.61 0.00 0.00 -1.68 0.00 0.00 37.83 33.34 1ii7 s LYS 253 CO 0.41 0.64 0.00 0.41 -0.76 0.00 0.00 175.35 176.06 1ii7 n GLY 254 N 1.84 -0.66 0.97 -3.33 0.00 -1.26 -1.35 105.19 101.40 1ii7 n GLY 254 Ca -0.17 -0.47 -0.04 0.00 0.00 0.00 0.00 46.02 45.34 1ii7 n GLY 254 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1ii7 n PHE 255 N 3.97 -0.82 -5.15 1.61 1.16 -0.56 -4.54 117.46 113.12 1ii7 n PHE 255 Ca 0.00 -0.64 -0.30 0.00 -1.87 0.00 0.00 57.45 54.64 1ii7 n PHE 255 Cb 0.00 0.17 -0.16 0.00 -1.61 0.00 0.00 39.48 37.89 1ii7 n PHE 255 CO 0.00 0.00 0.00 0.71 -1.87 0.00 0.00 176.76 175.60 1ii7 s TYR 256 N -4.85 2.23 -0.22 2.97 1.51 -1.00 -0.23 117.35 117.76 1ii7 s TYR 256 Ca 0.08 -0.42 -0.05 0.00 -1.01 0.00 0.00 57.07 55.67 1ii7 s TYR 256 Cb -0.00 -1.41 -0.02 0.00 -0.11 0.00 0.00 41.96 40.42 1ii7 s TYR 256 CO 0.05 0.00 0.00 0.42 -1.11 0.00 0.00 175.55 174.92 1ii7 s ILE 257 N -0.64 3.79 -0.23 2.71 -1.09 0.03 0.19 121.20 125.95 1ii7 s ILE 257 Ca 0.10 -0.36 -0.05 0.00 -2.23 0.00 0.00 60.65 58.11 1ii7 s ILE 257 Cb -0.10 -2.74 -0.02 0.00 -1.58 0.00 0.00 42.46 38.03 1ii7 s ILE 257 CO -0.00 0.40 0.01 -0.69 -1.23 0.00 0.00 174.94 173.43 1ii7 s VAL 258 N 1.41 3.82 -0.27 2.92 1.01 0.31 -0.45 120.40 129.15 1ii7 s VAL 258 Ca 0.05 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.70 1ii7 s VAL 258 Cb -0.15 -2.76 0.05 0.00 0.00 0.00 0.00 36.38 33.52 1ii7 s VAL 258 CO 0.00 0.38 -0.07 -1.61 0.00 0.00 0.00 175.10 173.81 1ii7 s GLU 259 N 1.54 2.37 -1.36 2.72 2.02 -0.78 -1.06 118.70 124.15 1ii7 s GLU 259 Ca 0.06 -1.28 -0.08 0.00 0.02 0.00 0.00 54.97 53.69 1ii7 s GLU 259 Cb -0.15 -3.00 0.02 0.00 0.10 0.00 0.00 34.13 31.10 1ii7 s GLU 259 CO 0.00 -0.57 1.09 -0.25 0.02 0.00 0.00 175.26 175.55 1ii7 n ASP 260 N 4.53 -5.05 -1.42 -0.19 9.92 -0.38 -1.92 116.55 122.04 1ii7 n ASP 260 Ca -0.14 -0.61 -0.18 0.00 -0.53 0.00 0.00 54.79 53.33 1ii7 n ASP 260 Cb 0.43 -4.81 -0.07 0.00 -0.64 0.00 0.00 41.12 36.03 1ii7 n ASP 260 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1ii7 n PHE 261 N -4.76 -0.09 -3.79 1.24 3.01 -1.26 -4.98 117.46 106.83 1ii7 n PHE 261 Ca -0.06 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.03 1ii7 n PHE 261 Cb 0.58 -3.07 -0.13 0.00 -0.01 0.00 0.00 39.48 36.85 1ii7 n PHE 261 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1ii7 s LYS 262 N -3.64 2.80 0.07 -1.08 -0.14 -0.81 -4.76 119.74 112.19 1ii7 s LYS 262 Ca 0.00 -1.04 -0.30 0.00 -1.36 0.00 0.00 55.97 53.26 1ii7 s LYS 262 Cb 0.00 -3.35 -0.05 0.00 -1.68 0.00 0.00 37.83 32.75 1ii7 s LYS 262 CO 0.00 -0.55 1.12 -1.25 -0.76 0.00 0.00 175.35 173.92 1ii7 s PRO 263 N 1.42 4.50 -0.11 -1.68 0.04 -1.26 -1.87 135.00 136.03 1ii7 s PRO 263 Ca -0.00 1.67 0.02 0.00 0.04 0.00 0.00 61.00 62.73 1ii7 s PRO 263 Cb -0.18 -3.36 0.01 0.00 0.04 0.00 0.00 34.50 31.00 1ii7 s PRO 263 CO 0.01 -0.14 -0.19 0.50 0.04 0.00 0.00 177.00 177.22 1ii7 s ARG 264 N 0.78 2.62 0.23 4.56 3.52 0.41 -4.98 118.95 126.09 1ii7 s ARG 264 Ca 0.55 -0.71 -0.30 0.00 -0.13 0.00 0.00 55.73 55.14 1ii7 s ARG 264 Cb -0.27 -2.12 -0.09 0.00 -1.56 0.00 0.00 34.95 30.91 1ii7 s ARG 264 CO 0.30 0.01 1.09 0.12 -0.81 0.00 0.00 175.30 176.00 1ii7 s PHE 265 N 0.77 3.63 -0.25 5.12 5.36 -1.26 -0.79 117.98 130.55 1ii7 s PHE 265 Ca -0.10 1.67 0.02 0.00 -0.96 0.00 0.00 56.93 57.56 1ii7 s PHE 265 Cb -0.16 -3.25 0.06 0.00 -0.34 0.00 0.00 43.02 39.33 1ii7 s PHE 265 CO 0.01 -0.48 -0.08 0.08 -1.46 0.00 0.00 175.22 173.29 1ii7 s VAL 266 N -0.75 1.81 0.15 3.12 1.01 0.68 -4.90 120.40 121.51 1ii7 s VAL 266 Ca 0.46 -1.41 -0.25 0.00 0.00 0.00 0.00 61.98 60.78 1ii7 s VAL 266 Cb -0.30 -2.01 -0.08 0.00 0.00 0.00 0.00 36.38 33.99 1ii7 s VAL 266 CO 0.37 -0.08 0.76 -0.70 0.00 0.00 0.00 175.10 175.46 1ii7 s GLU 267 N 1.26 4.54 -0.21 2.72 2.12 -1.26 -1.50 118.70 126.37 1ii7 s GLU 267 Ca -0.07 1.12 0.01 0.00 0.36 0.00 0.00 54.97 56.39 1ii7 s GLU 267 Cb -0.19 -3.27 0.05 0.00 0.26 0.00 0.00 34.13 30.97 1ii7 s GLU 267 CO -0.06 0.55 -0.10 0.42 -0.54 0.00 0.00 175.26 175.54 1ii7 s ILE 268 N -1.04 1.65 0.36 -3.70 1.01 -0.46 -4.96 121.20 114.06 1ii7 s ILE 268 Ca 0.36 -1.07 -0.28 0.00 0.00 0.00 0.00 60.65 59.65 1ii7 s ILE 268 Cb -0.23 -1.75 -0.11 0.00 0.01 0.00 0.00 42.46 40.38 1ii7 s ILE 268 CO 0.26 0.12 1.47 -0.54 0.00 0.00 0.00 174.94 176.25 1ii7 s LYS 269 N 1.38 4.14 0.13 2.79 -0.14 -1.26 -4.59 119.74 122.20 1ii7 s LYS 269 Ca -0.02 2.52 -0.01 0.00 -1.36 0.00 0.00 55.97 57.10 1ii7 s LYS 269 Cb -0.17 -2.99 -0.04 0.00 -1.68 0.00 0.00 37.83 32.95 1ii7 s LYS 269 CO -0.08 -0.50 0.06 0.54 -0.76 0.00 0.00 175.35 174.61 1ii7 s VAL 270 N -0.99 0.10 0.11 3.17 0.11 -1.26 -5.11 120.40 116.53 1ii7 s VAL 270 Ca 0.53 -1.92 -0.36 0.00 -2.93 0.00 0.00 61.98 57.31 1ii7 s VAL 270 Cb -0.46 -2.07 -0.16 0.00 -1.53 0.00 0.00 36.38 32.16 1ii7 s VAL 270 CO 0.60 -0.44 1.41 -1.14 -3.33 0.00 0.00 175.10 172.20 1ii7 n ARG 271 N -0.10 1.44 -2.68 1.54 0.63 -1.26 -4.92 116.66 111.30 1ii7 n ARG 271 Ca -0.05 0.52 -0.37 0.00 -0.92 0.00 0.00 57.85 57.03 1ii7 n ARG 271 Cb 0.64 -2.20 -0.06 0.00 0.45 0.00 0.00 32.46 31.29 1ii7 n ARG 271 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1ii7 s PRO 272 N 0.61 4.43 -0.18 -0.14 0.04 -1.26 -4.82 135.00 133.68 1ii7 s PRO 272 Ca 0.83 1.41 -0.01 0.00 0.04 0.00 0.00 61.00 63.26 1ii7 s PRO 272 Cb -0.87 -2.70 -0.00 0.00 0.04 0.00 0.00 34.50 30.96 1ii7 s PRO 272 CO 0.44 0.12 -0.11 -0.06 0.04 0.00 0.00 177.00 177.42 1ii7 s PHE 273 N -1.63 2.85 -0.17 0.56 0.40 -1.26 -1.36 117.98 117.37 1ii7 s PHE 273 Ca 0.53 -1.02 -0.00 0.00 -0.60 0.00 0.00 56.93 55.84 1ii7 s PHE 273 Cb -0.20 -1.97 0.00 0.00 0.51 0.00 0.00 43.02 41.37 1ii7 s PHE 273 CO 0.25 -0.50 -0.14 0.42 0.70 0.00 0.00 175.22 175.95 1ii7 s ILE 274 N 1.04 2.66 -0.23 0.64 1.01 -0.08 -0.84 121.20 125.41 1ii7 s ILE 274 Ca -0.01 -0.75 -0.09 0.00 0.00 0.00 0.00 60.65 59.80 1ii7 s ILE 274 Cb -0.15 -2.14 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 1ii7 s ILE 274 CO -0.02 0.50 0.12 -0.62 0.00 0.00 0.00 174.94 174.92 1ii7 s ASP 275 N 1.06 5.84 -0.05 3.58 3.68 -0.98 -0.98 116.67 128.82 1ii7 s ASP 275 Ca -0.01 0.06 0.03 0.00 2.13 0.00 0.00 52.55 54.77 1ii7 s ASP 275 Cb -0.15 -2.04 0.00 0.00 -1.45 0.00 0.00 42.92 39.29 1ii7 s ASP 275 CO -0.04 0.08 -0.15 -0.69 0.13 0.00 0.00 175.17 174.50 1ii7 s VAL 276 N 0.94 1.30 -0.22 1.11 1.01 0.15 -0.69 120.40 124.00 1ii7 s VAL 276 Ca 0.06 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 1ii7 s VAL 276 Cb -0.13 -1.14 0.01 0.00 0.00 0.00 0.00 36.38 35.12 1ii7 s VAL 276 CO 0.03 0.38 -0.11 -0.54 0.00 0.00 0.00 175.10 174.87 1ii7 s LYS 277 N 0.32 3.04 -0.02 2.72 1.02 -0.25 0.67 119.74 127.24 1ii7 s LYS 277 Ca -0.09 -0.83 0.07 0.00 0.02 0.00 0.00 55.97 55.14 1ii7 s LYS 277 Cb -0.13 -2.84 -0.02 0.00 -0.52 0.00 0.00 37.83 34.32 1ii7 s LYS 277 CO 0.03 -0.28 -0.22 0.42 -0.92 0.00 0.00 175.35 174.39 1ii7 s ILE 278 N 1.35 1.72 0.22 2.17 1.01 -0.42 -1.92 121.20 125.33 1ii7 s ILE 278 Ca 0.03 -0.93 0.05 0.00 0.00 0.00 0.00 60.65 59.80 1ii7 s ILE 278 Cb -0.15 -1.43 -0.05 0.00 0.01 0.00 0.00 42.46 40.84 1ii7 s ILE 278 CO -0.07 0.49 -0.05 -0.54 0.00 0.00 0.00 174.94 174.77 1ii7 s LYS 279 N -0.48 1.31 0.00 2.79 1.02 -1.26 -0.08 119.74 123.04 1ii7 s LYS 279 Ca 0.08 -1.64 0.00 0.00 0.02 0.00 0.00 55.97 54.43 1ii7 s LYS 279 Cb -0.09 -0.76 0.00 0.00 -0.52 0.00 0.00 37.83 36.46 1ii7 s LYS 279 CO -0.01 -0.01 0.00 0.41 -0.92 0.00 0.00 175.35 174.83 1ii7 n GLY 280 N -0.40 -0.97 3.78 -3.33 0.00 -1.17 -4.67 105.19 98.43 1ii7 n GLY 280 Ca -0.07 -2.21 -0.30 0.00 0.00 0.00 0.00 46.02 43.45 1ii7 n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ii7 s SER 281 N -2.43 4.02 0.23 1.61 1.04 -1.26 -4.44 113.70 112.48 1ii7 s SER 281 Ca 0.00 1.28 -0.07 0.00 0.48 0.00 0.00 55.95 57.64 1ii7 s SER 281 Cb 0.00 -1.97 0.27 0.00 0.10 0.00 0.00 66.02 64.42 1ii7 s SER 281 CO 0.00 -2.26 1.87 -0.08 0.98 0.00 0.00 173.24 173.75 1ii7 h GLU 282 N -1.29 1.00 -0.23 4.02 4.81 -1.96 0.02 114.58 120.95 1ii7 h GLU 282 Ca -0.48 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 58.72 1ii7 h GLU 282 Cb 1.29 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 30.41 1ii7 h GLU 282 CO 0.59 0.66 0.03 1.49 -0.73 0.00 0.00 179.01 181.05 1ii7 h GLU 283 N 1.03 0.11 -0.34 1.92 4.81 -1.99 0.71 114.58 120.84 1ii7 h GLU 283 Ca 0.35 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.49 1ii7 h GLU 283 Cb 0.05 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1ii7 h GLU 283 CO -0.13 0.07 -0.11 1.49 -0.73 0.00 0.00 179.01 179.61 1ii7 h GLU 284 N 0.11 0.67 -0.79 1.92 4.81 -1.81 -2.37 114.58 117.12 1ii7 h GLU 284 Ca 0.11 -0.27 0.11 0.00 -0.13 0.00 0.00 59.36 59.18 1ii7 h GLU 284 Cb 0.12 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.41 1ii7 h GLU 284 CO -0.15 0.85 0.52 0.82 -0.73 0.00 0.00 179.01 180.31 1ii7 h ILE 285 N 0.45 0.90 -0.62 2.32 2.04 -0.70 0.56 117.51 122.47 1ii7 h ILE 285 Ca 0.08 -0.23 -0.04 0.00 1.00 0.00 0.00 64.86 65.67 1ii7 h ILE 285 Cb 0.62 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 1ii7 h ILE 285 CO 0.04 0.12 0.22 -0.09 0.00 0.00 0.00 178.15 178.43 1ii7 h ARG 286 N 0.66 0.94 0.11 2.37 2.43 -0.44 -1.89 114.38 118.56 1ii7 h ARG 286 Ca 0.37 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.35 1ii7 h ARG 286 Cb 0.55 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1ii7 h ARG 286 CO -0.14 0.82 -0.05 -0.22 -1.51 0.00 0.00 179.97 178.86 1ii7 h LYS 287 N 0.87 -0.14 -0.64 0.20 3.64 0.14 -2.56 116.57 118.08 1ii7 h LYS 287 Ca 0.20 0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.73 1ii7 h LYS 287 Cb 0.25 0.03 -0.11 0.00 -0.41 0.00 0.00 32.23 31.99 1ii7 h LYS 287 CO -0.01 0.15 -0.05 0.00 -2.27 0.00 0.00 179.45 177.27 1ii7 h ALA 288 N 0.41 0.57 0.00 5.00 0.00 0.03 0.29 119.26 125.56 1ii7 h ALA 288 Ca -0.01 0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1ii7 h ALA 288 Cb 0.36 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1ii7 h ALA 288 CO 0.02 -0.41 -0.12 0.82 0.00 0.00 0.00 179.25 179.56 1ii7 h ILE 289 N 0.07 0.91 -0.10 0.00 1.08 -1.27 -0.91 117.51 117.28 1ii7 h ILE 289 Ca 0.33 -0.43 -0.11 0.00 -0.39 0.00 0.00 64.86 64.26 1ii7 h ILE 289 Cb 0.54 1.24 -0.01 0.00 -3.07 0.00 0.00 36.82 35.52 1ii7 h ILE 289 CO -0.59 0.12 -0.44 0.50 -0.69 0.00 0.00 178.15 177.04 1ii7 h LYS 290 N 0.00 0.24 0.00 2.37 3.64 -0.02 -2.79 116.57 120.00 1ii7 h LYS 290 Ca -0.00 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.20 1ii7 h LYS 290 Cb 0.23 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1ii7 h LYS 290 CO 0.02 0.64 -0.78 0.00 -2.27 0.00 0.00 179.45 177.06 1ii7 h ARG 291 N 0.20 0.00 -0.28 1.90 3.08 -0.63 -3.35 114.38 115.30 1ii7 h ARG 291 Ca 0.01 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.89 1ii7 h ARG 291 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1ii7 h ARG 291 CO 0.07 0.17 -0.51 1.25 -1.07 0.00 0.00 179.97 179.89 1ii7 h LEU 292 N 0.00 0.93 -0.81 3.04 5.85 -1.09 -3.37 115.31 119.85 1ii7 h LEU 292 Ca -0.04 -0.53 0.08 0.00 0.84 0.00 0.00 57.88 58.22 1ii7 h LEU 292 Cb 1.22 -0.27 -0.10 0.00 0.37 0.00 0.00 40.66 41.89 1ii7 h LEU 292 CO 0.02 1.28 -0.47 -0.38 -0.34 0.00 0.00 178.44 178.55 1ii7 n ILE 293 N -4.06 -0.55 0.30 4.05 5.41 -1.07 0.20 119.36 123.65 1ii7 n ILE 293 Ca -0.05 1.97 0.18 0.00 1.00 0.00 0.00 62.75 65.85 1ii7 n ILE 293 Cb 0.60 -2.44 0.95 0.00 -0.71 0.00 0.00 39.64 38.04 1ii7 n ILE 293 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 1ii7 h PRO 294 N 0.00 0.00 0.00 0.38 0.13 -1.83 -1.98 132.00 128.70 1ii7 h PRO 294 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1ii7 h PRO 294 Cb 0.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.47 1ii7 h PRO 294 CO -0.77 0.03 0.00 -0.07 -0.23 0.00 0.00 178.00 176.97 1ii7 h LEU 295 N 0.00 0.00 -8.81 1.56 3.38 -0.44 -3.44 115.31 107.56 1ii7 h LEU 295 Ca -0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 1ii7 h LEU 295 Cb 0.20 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.79 1ii7 h LEU 295 CO 0.00 0.00 -0.27 -0.63 0.09 0.00 0.00 178.44 177.63 1ii7 s ILE 296 N -3.26 5.17 0.44 1.22 -1.09 -0.75 -5.06 121.20 117.87 1ii7 s ILE 296 Ca 0.07 0.23 -0.24 0.00 -2.23 0.00 0.00 60.65 58.48 1ii7 s ILE 296 Cb 0.10 -3.78 -0.08 0.00 -1.58 0.00 0.00 42.46 37.13 1ii7 s ILE 296 CO 0.51 -0.01 1.18 -2.16 -1.23 0.00 0.00 174.94 173.24 1ii7 s PRO 297 N 2.05 3.86 0.44 2.79 0.04 -1.26 -4.89 135.00 138.02 1ii7 s PRO 297 Ca 0.13 1.84 0.20 0.00 0.04 0.00 0.00 61.00 63.20 1ii7 s PRO 297 Cb -0.16 -2.52 1.14 0.00 0.04 0.00 0.00 34.50 33.00 1ii7 s PRO 297 CO 0.11 -0.48 1.86 -0.22 0.04 0.00 0.00 177.00 178.31 1ii7 h LYS 298 N 2.29 0.33 -0.54 4.56 3.64 -1.95 -1.86 116.57 123.04 1ii7 h LYS 298 Ca -0.49 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1ii7 h LYS 298 Cb 1.24 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1ii7 h LYS 298 CO 0.61 0.22 0.00 0.27 -2.27 0.00 0.00 179.45 178.28 1ii7 n ASN 299 N -4.48 2.64 -4.81 4.20 6.94 -1.26 -4.10 115.26 114.39 1ii7 n ASN 299 Ca 0.19 -2.19 -0.33 0.00 -0.02 0.00 0.00 54.58 52.23 1ii7 n ASN 299 Cb 0.73 -0.39 -0.03 0.00 -2.36 0.00 0.00 39.78 37.73 1ii7 n ASN 299 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ii7 s ALA 300 N -1.66 2.90 -0.15 -2.53 0.00 -0.70 -4.57 121.76 115.05 1ii7 s ALA 300 Ca 0.27 0.42 -0.05 0.00 0.00 0.00 0.00 51.96 52.60 1ii7 s ALA 300 Cb 0.17 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1ii7 s ALA 300 CO 0.14 -0.36 0.02 0.71 0.00 0.00 0.00 175.76 176.26 1ii7 s TYR 301 N -2.28 3.16 0.02 0.00 1.51 -0.46 -3.78 117.35 115.51 1ii7 s TYR 301 Ca 0.64 -0.04 0.07 0.00 -1.01 0.00 0.00 57.07 56.73 1ii7 s TYR 301 Cb -0.14 -1.98 -0.02 0.00 -0.11 0.00 0.00 41.96 39.71 1ii7 s TYR 301 CO 0.26 0.15 -0.22 0.08 -1.11 0.00 0.00 175.55 174.71 1ii7 s VAL 302 N 0.11 1.77 -0.20 0.71 1.01 -0.78 -0.90 120.40 122.13 1ii7 s VAL 302 Ca 0.02 -1.10 0.01 0.00 0.00 0.00 0.00 61.98 60.91 1ii7 s VAL 302 Cb -0.13 -1.50 0.03 0.00 0.00 0.00 0.00 36.38 34.78 1ii7 s VAL 302 CO 0.02 0.36 -0.17 -0.60 0.00 0.00 0.00 175.10 174.71 1ii7 s ARG 303 N -0.87 2.70 -0.27 2.72 3.52 -0.15 -0.50 118.95 126.09 1ii7 s ARG 303 Ca 0.09 -0.92 -0.09 0.00 -0.13 0.00 0.00 55.73 54.67 1ii7 s ARG 303 Cb -0.09 -2.59 -0.04 0.00 -1.56 0.00 0.00 34.95 30.68 1ii7 s ARG 303 CO 0.01 -0.31 0.14 -0.51 -0.81 0.00 0.00 175.30 173.82 1ii7 s LEU 304 N 1.27 3.83 -0.66 -0.88 1.43 0.29 0.33 118.68 124.29 1ii7 s LEU 304 Ca 0.01 -0.16 -0.10 0.00 -1.03 0.00 0.00 54.13 52.85 1ii7 s LEU 304 Cb -0.15 -2.03 0.17 0.00 0.03 0.00 0.00 46.19 44.21 1ii7 s LEU 304 CO -0.11 -0.07 0.56 0.21 0.23 0.00 0.00 176.35 177.17 1ii7 s ASN 305 N 1.69 6.07 -0.44 2.29 2.47 0.21 -1.09 114.94 126.14 1ii7 s ASN 305 Ca 0.06 -2.44 -0.20 0.00 0.42 0.00 0.00 52.86 50.70 1ii7 s ASN 305 Cb -0.16 -2.08 0.02 0.00 -1.45 0.00 0.00 41.25 37.59 1ii7 s ASN 305 CO 0.08 -0.59 0.63 -0.63 -3.72 0.00 0.00 177.10 172.87 1ii7 s ILE 306 N 0.57 4.84 -0.38 -5.21 1.01 -0.95 -1.30 121.20 119.78 1ii7 s ILE 306 Ca 0.13 0.09 -0.20 0.00 0.00 0.00 0.00 60.65 60.67 1ii7 s ILE 306 Cb -0.19 -4.19 0.01 0.00 0.01 0.00 0.00 42.46 38.09 1ii7 s ILE 306 CO -0.04 -0.58 0.62 -0.83 0.00 0.00 0.00 174.94 174.11 1ii7 s GLY 307 N 1.99 1.75 0.22 6.18 0.00 0.88 -4.25 107.32 114.09 1ii7 s GLY 307 Ca 0.22 -0.96 0.10 0.00 0.00 0.00 0.00 44.72 44.08 1ii7 s GLY 307 CO 0.19 1.47 -0.19 0.66 0.00 0.00 0.00 173.10 175.22 1ii7 s TRP 308 N 2.69 2.07 -0.54 1.90 -2.14 -1.26 -3.02 118.94 118.64 1ii7 s TRP 308 Ca 0.23 -0.42 0.24 0.00 2.66 0.00 0.00 56.10 58.82 1ii7 s TRP 308 Cb -0.14 -0.96 0.38 0.00 -3.10 0.00 0.00 33.47 29.64 1ii7 s TRP 308 CO 0.16 0.52 1.42 -0.09 -2.66 0.00 0.00 176.95 176.29 1ii7 h ARG 309 N 2.73 0.00 -1.61 3.25 2.43 -1.95 -3.46 114.38 115.77 1ii7 h ARG 309 Ca -0.41 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 58.82 1ii7 h ARG 309 Cb 1.23 0.00 -0.26 0.00 -0.42 0.00 0.00 29.97 30.52 1ii7 h ARG 309 CO 0.56 0.00 0.42 0.21 -1.51 0.00 0.00 179.97 179.65 1ii7 s LYS 310 N -3.20 0.50 1.22 0.20 2.20 -1.26 -5.18 119.74 114.21 1ii7 s LYS 310 Ca 0.06 0.64 -0.14 0.00 -0.36 0.00 0.00 55.97 56.17 1ii7 s LYS 310 Cb 0.11 0.21 0.31 0.00 -1.51 0.00 0.00 37.83 36.95 1ii7 s LYS 310 CO 0.70 -0.07 1.01 -1.25 -0.36 0.00 0.00 175.35 175.38 1ii7 s PRO 311 N 0.49 -1.34 -0.04 4.03 0.04 -1.26 -4.93 135.00 131.99 1ii7 s PRO 311 Ca 0.00 0.72 -0.31 0.00 0.04 0.00 0.00 61.00 61.46 1ii7 s PRO 311 Cb -0.05 -1.51 0.11 0.00 0.04 0.00 0.00 34.50 33.09 1ii7 s PRO 311 CO -0.08 -3.97 1.13 -0.59 0.04 0.00 0.00 177.00 173.53 1ii7 s PHE 312 N -2.42 -0.14 0.17 0.56 -0.71 -1.26 -5.12 117.98 109.07 1ii7 s PHE 312 Ca 0.69 0.01 -0.33 0.00 -1.04 0.00 0.00 56.93 56.26 1ii7 s PHE 312 Cb -0.24 0.55 -0.13 0.00 -1.21 0.00 0.00 43.02 42.00 1ii7 s PHE 312 CO 0.64 -0.40 1.69 -3.47 -1.34 0.00 0.00 175.22 172.34 1ii7 n ASP 313 N -0.31 3.64 -0.56 1.98 -0.08 -1.26 -4.90 116.55 115.06 1ii7 n ASP 313 Ca -0.05 1.06 0.11 0.00 -1.51 0.00 0.00 54.79 54.39 1ii7 n ASP 313 Cb 0.61 -1.51 0.01 0.00 2.34 0.00 0.00 41.12 42.57 1ii7 n ASP 313 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1ii7 n LEU 314 N 4.02 2.14 -0.16 -2.67 4.77 -1.26 -4.45 117.00 119.38 1ii7 n LEU 314 Ca 0.17 -0.80 0.21 0.00 -0.03 0.00 0.00 56.01 55.55 1ii7 n LEU 314 Cb 0.33 0.00 0.60 0.00 -2.33 0.00 0.00 43.42 42.01 1ii7 n LEU 314 CO 0.64 0.39 1.22 0.74 -1.33 0.00 0.00 177.39 179.05 1ii7 h THR 315 N 2.72 0.69 0.76 -5.08 2.02 -1.99 0.11 112.91 112.14 1ii7 h THR 315 Ca 0.00 -0.08 -0.04 0.00 0.77 0.00 0.00 66.41 67.07 1ii7 h THR 315 Cb 0.76 0.44 0.01 0.00 -1.74 0.00 0.00 68.15 67.63 1ii7 h THR 315 CO 0.00 0.04 -0.36 -0.08 0.37 0.00 0.00 175.52 175.49 1ii7 h GLU 316 N 0.22 -0.98 -0.41 6.66 4.81 -2.00 -2.35 114.58 120.54 1ii7 h GLU 316 Ca 0.39 0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.75 1ii7 h GLU 316 Cb 1.19 0.22 -0.06 0.00 0.63 0.00 0.00 28.75 30.73 1ii7 h GLU 316 CO -0.08 -0.65 0.06 0.82 -0.73 0.00 0.00 179.01 178.42 1ii7 h ILE 317 N -1.12 0.76 -0.73 2.32 2.04 -1.68 -1.11 117.51 117.99 1ii7 h ILE 317 Ca -0.10 -0.06 0.13 0.00 1.00 0.00 0.00 64.86 65.82 1ii7 h ILE 317 Cb 0.78 0.56 -0.09 0.00 -0.74 0.00 0.00 36.82 37.33 1ii7 h ILE 317 CO 0.17 0.03 0.29 0.11 0.00 0.00 0.00 178.15 178.75 1ii7 h LYS 318 N 0.18 0.43 0.00 2.37 1.57 -1.01 -1.40 116.57 118.71 1ii7 h LYS 318 Ca 0.20 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.92 1ii7 h LYS 318 Cb 0.25 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 1ii7 h LYS 318 CO -0.28 0.28 -0.16 0.93 -0.57 0.00 0.00 179.45 179.66 1ii7 h GLU 319 N 0.44 0.00 -0.07 3.15 5.08 -0.96 -2.94 114.58 119.28 1ii7 h GLU 319 Ca 0.39 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.61 1ii7 h GLU 319 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1ii7 h GLU 319 CO -0.38 0.16 -0.60 1.25 -1.00 0.00 0.00 179.01 178.44 1ii7 h LEU 320 N 0.00 0.28 0.18 1.33 5.85 -0.14 -3.26 115.31 119.55 1ii7 h LEU 320 Ca -0.00 -0.16 -0.27 0.00 0.84 0.00 0.00 57.88 58.29 1ii7 h LEU 320 Cb 1.12 -0.08 0.02 0.00 0.37 0.00 0.00 40.66 42.09 1ii7 h LEU 320 CO 0.02 0.81 -1.21 -0.07 -0.34 0.00 0.00 178.44 177.65 1ii7 h LEU 321 N 0.18 0.61 -2.59 2.25 3.38 -1.44 -3.49 115.31 114.22 1ii7 h LEU 321 Ca -0.01 -0.93 -0.45 0.00 0.09 0.00 0.00 57.88 56.58 1ii7 h LEU 321 Cb 1.10 -0.20 0.03 0.00 0.09 0.00 0.00 40.66 41.69 1ii7 h LEU 321 CO 0.09 1.57 -0.91 -3.20 0.09 0.00 0.00 178.44 176.09 1ii7 n ASN 322 N -3.91 -3.05 -4.68 -0.43 4.05 -1.11 -4.98 115.26 101.15 1ii7 n ASN 322 Ca -0.17 -0.99 -0.27 0.00 0.45 0.00 0.00 54.58 53.60 1ii7 n ASN 322 Cb 0.96 -3.34 -0.07 0.00 1.23 0.00 0.00 39.78 38.55 1ii7 n ASN 322 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1ii7 s VAL 323 N -3.66 3.81 0.30 3.44 -7.23 -1.26 -5.00 120.40 110.80 1ii7 s VAL 323 Ca 0.25 -1.37 0.06 0.00 -1.81 0.00 0.00 61.98 59.11 1ii7 s VAL 323 Cb -0.09 -2.92 0.31 0.00 0.56 0.00 0.00 36.38 34.24 1ii7 s VAL 323 CO 0.86 -0.10 1.67 -0.33 -0.31 0.00 0.00 175.10 176.90 1ii7 h GLU 324 N 2.70 0.32 -2.99 4.82 4.39 -1.71 -3.40 114.58 118.70 1ii7 h GLU 324 Ca -0.47 -0.02 -0.16 0.00 0.34 0.00 0.00 59.36 59.05 1ii7 h GLU 324 Cb 1.20 -0.07 -0.26 0.00 -0.10 0.00 0.00 28.75 29.52 1ii7 h GLU 324 CO 0.59 0.21 -0.39 -0.47 -1.16 0.00 0.00 179.01 177.78 1ii7 s TYR 325 N -5.84 -0.35 -0.09 4.33 5.04 -1.26 -5.09 117.35 114.08 1ii7 s TYR 325 Ca -0.11 0.83 -0.02 0.00 -2.44 0.00 0.00 57.07 55.33 1ii7 s TYR 325 Cb 0.27 0.11 0.04 0.00 0.35 0.00 0.00 41.96 42.73 1ii7 s TYR 325 CO 0.78 -0.19 0.04 -1.17 -1.34 0.00 0.00 175.55 173.66 1ii7 s LEU 326 N 0.53 0.51 -0.21 6.97 2.96 -1.26 -1.87 118.68 126.31 1ii7 s LEU 326 Ca -0.03 -0.22 -0.07 0.00 -0.22 0.00 0.00 54.13 53.58 1ii7 s LEU 326 Cb -0.05 -0.35 -0.04 0.00 0.50 0.00 0.00 46.19 46.26 1ii7 s LEU 326 CO -0.03 -0.25 0.07 -0.75 -1.32 0.00 0.00 176.35 174.07 1ii7 s LYS 327 N 2.03 3.84 -0.17 1.98 2.20 0.34 -5.00 119.74 124.96 1ii7 s LYS 327 Ca 0.04 -0.40 0.00 0.00 -0.36 0.00 0.00 55.97 55.25 1ii7 s LYS 327 Cb -0.13 -3.27 0.01 0.00 -1.51 0.00 0.00 37.83 32.93 1ii7 s LYS 327 CO -0.06 0.07 -0.16 0.42 -0.36 0.00 0.00 175.35 175.26 1ii7 s ILE 328 N 0.92 2.44 0.53 5.43 1.01 -1.26 -0.55 121.20 129.72 1ii7 s ILE 328 Ca 0.04 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.90 1ii7 s ILE 328 Cb -0.14 -2.04 0.02 0.00 0.01 0.00 0.00 42.46 40.32 1ii7 s ILE 328 CO 0.03 0.52 0.27 -1.81 0.00 0.00 0.00 174.94 173.94 1ii7 s ASP 329 N 1.12 4.46 -0.29 3.58 -0.00 -0.25 -4.99 116.67 120.30 1ii7 s ASP 329 Ca 0.01 -1.38 -0.23 0.00 -0.00 0.00 0.00 52.55 50.94 1ii7 s ASP 329 Cb -0.14 0.45 0.17 0.00 -0.00 0.00 0.00 42.92 43.40 1ii7 s ASP 329 CO -0.06 -1.02 1.26 0.28 -0.00 0.00 0.00 175.17 175.63 1ii7 s THR 330 N -2.81 0.00 -0.05 -1.27 -1.32 -1.26 -2.25 115.64 106.68 1ii7 s THR 330 Ca 0.24 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.72 1ii7 s THR 330 Cb -0.01 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.95 1ii7 s THR 330 CO 0.15 0.00 0.02 -1.66 -2.21 0.00 0.00 174.62 170.92 1ii7 s TRP 331 N 0.31 3.18 -2.12 9.09 1.48 -1.26 -5.04 118.94 124.57 1ii7 s TRP 331 Ca 0.03 0.18 0.17 0.00 -1.06 0.00 0.00 56.10 55.42 1ii7 s TRP 331 Cb -0.05 -1.75 0.13 0.00 -1.16 0.00 0.00 33.47 30.65 1ii7 s TRP 331 CO -0.12 0.49 1.04 0.54 -4.06 0.00 0.00 176.95 174.84