#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 1.27 0.02 2.12 2.20 -1.26 -1.83 119.74 122.26 1ii7 s LYS 2 Ca 0.00 -0.41 -0.12 0.00 -0.36 0.00 0.00 55.97 55.07 1ii7 s LYS 2 Cb 0.00 -1.14 0.02 0.00 -1.51 0.00 0.00 37.83 35.19 1ii7 s LYS 2 CO 0.00 0.16 0.26 -0.59 -0.36 0.00 0.00 175.35 174.82 1ii7 s PHE 3 N 0.15 -0.08 -0.06 4.03 -0.12 -0.03 -0.45 117.98 121.42 1ii7 s PHE 3 Ca -0.04 0.00 -0.11 0.00 -0.05 0.00 0.00 56.93 56.74 1ii7 s PHE 3 Cb -0.10 0.05 -0.05 0.00 -0.63 0.00 0.00 43.02 42.30 1ii7 s PHE 3 CO 0.01 -0.43 0.27 0.00 -0.05 0.00 0.00 175.22 175.03 1ii7 s ALA 4 N -2.02 3.78 -0.27 1.99 0.00 -0.75 -0.05 121.76 124.44 1ii7 s ALA 4 Ca -0.09 -0.43 0.02 0.00 0.00 0.00 0.00 51.96 51.46 1ii7 s ALA 4 Cb -0.03 -2.19 0.06 0.00 0.00 0.00 0.00 23.12 20.96 1ii7 s ALA 4 CO -0.00 0.53 -0.08 -1.58 0.00 0.00 0.00 175.76 174.63 1ii7 s HIS 5 N -0.99 3.27 0.45 0.00 2.46 0.12 -0.58 115.29 120.04 1ii7 s HIS 5 Ca 0.19 -2.23 0.05 0.00 0.47 0.00 0.00 55.06 53.54 1ii7 s HIS 5 Cb -0.14 -1.98 -0.05 0.00 -0.13 0.00 0.00 32.58 30.27 1ii7 s HIS 5 CO 0.08 -0.86 0.03 -0.51 -2.47 0.00 0.00 174.74 171.01 1ii7 s LEU 6 N 1.13 2.67 -0.10 8.88 1.43 0.64 -2.21 118.68 131.12 1ii7 s LEU 6 Ca -0.08 -1.46 -0.33 0.00 -1.03 0.00 0.00 54.13 51.24 1ii7 s LEU 6 Cb -0.20 -0.88 0.13 0.00 0.03 0.00 0.00 46.19 45.27 1ii7 s LEU 6 CO -0.04 -0.62 1.23 0.00 0.23 0.00 0.00 176.35 177.15 1ii7 s ALA 7 N -2.77 -2.13 -1.31 4.21 0.00 -1.26 -1.53 121.76 116.97 1ii7 s ALA 7 Ca 0.24 1.14 -0.09 0.00 0.00 0.00 0.00 51.96 53.26 1ii7 s ALA 7 Cb 0.06 0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1ii7 s ALA 7 CO 0.13 -0.82 0.54 -0.25 0.00 0.00 0.00 175.76 175.36 1ii7 n ASP 8 N -0.28 -2.04 0.01 0.00 8.00 -0.44 -4.40 116.55 117.40 1ii7 n ASP 8 Ca -0.04 -1.04 -0.12 0.00 0.71 0.00 0.00 54.79 54.30 1ii7 n ASP 8 Cb 0.60 -3.02 0.01 0.00 -0.02 0.00 0.00 41.12 38.69 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 -1.91 1.33 -6.39 0.53 1.08 -1.34 -3.36 117.51 107.44 1ii7 h ILE 9 Ca -0.65 -1.95 -0.48 0.00 -0.39 0.00 0.00 64.86 61.39 1ii7 h ILE 9 Cb 1.37 1.92 -0.05 0.00 -3.07 0.00 0.00 36.82 36.99 1ii7 h ILE 9 CO 0.57 0.60 -0.83 1.41 -0.69 0.00 0.00 178.15 179.22 1ii7 n HIS 10 N -3.92 -1.89 -1.73 1.37 8.25 -0.66 -4.86 115.22 111.78 1ii7 n HIS 10 Ca -0.05 0.82 -0.42 0.00 -0.26 0.00 0.00 57.72 57.81 1ii7 n HIS 10 Cb 0.67 -3.82 -0.01 0.00 1.12 0.00 0.00 29.99 27.95 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 -4.44 4.08 0.00 2.41 4.77 -0.30 -1.86 117.00 121.66 1ii7 n LEU 11 Ca -0.15 1.21 0.00 0.00 -0.03 0.00 0.00 56.01 57.03 1ii7 n LEU 11 Cb 0.61 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.16 1ii7 n LEU 11 CO 0.75 -0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1ii7 n GLY 12 N 0.86 1.02 3.63 -0.72 0.00 -1.26 -1.19 105.19 107.53 1ii7 n GLY 12 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.68 2.62 -1.15 1.61 6.04 -0.77 -4.91 117.35 118.09 1ii7 s TYR 13 Ca 0.00 0.83 -0.08 0.00 0.04 0.00 0.00 57.07 57.86 1ii7 s TYR 13 Cb 0.00 -3.89 0.25 0.00 -1.04 0.00 0.00 41.96 37.28 1ii7 s TYR 13 CO 0.00 -1.87 1.46 -1.91 -1.54 0.00 0.00 175.55 171.69 1ii7 n GLU 14 N 7.31 3.87 -1.68 4.97 2.13 -1.26 -3.05 120.64 132.94 1ii7 n GLU 14 Ca 0.15 -4.21 -0.45 0.00 0.66 0.00 0.00 57.16 53.32 1ii7 n GLU 14 Cb 0.46 -2.69 -0.04 0.00 0.27 0.00 0.00 31.44 29.45 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 2.90 2.30 -2.40 5.31 7.27 -1.26 -1.29 117.38 130.20 1ii7 n GLN 15 Ca 0.30 0.83 -0.18 0.00 0.07 0.00 0.00 57.00 58.01 1ii7 n GLN 15 Cb 0.37 -2.60 -0.01 0.00 2.41 0.00 0.00 30.24 30.41 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 3.29 -1.11 -2.40 3.69 0.99 -1.26 -1.84 117.46 118.82 1ii7 n PHE 16 Ca 0.16 0.00 -0.16 0.00 -0.00 0.00 0.00 57.45 57.44 1ii7 n PHE 16 Cb 0.31 -3.63 -0.01 0.00 -1.00 0.00 0.00 39.48 35.15 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 -3.82 -1.20 -3.80 1.38 8.25 -0.41 -4.95 115.22 110.68 1ii7 n HIS 17 Ca -0.22 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 56.87 1ii7 n HIS 17 Cb 0.67 -3.33 -0.13 0.00 1.12 0.00 0.00 29.99 28.32 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 -5.01 2.50 0.50 -0.41 1.02 -0.76 -4.95 119.74 112.64 1ii7 s LYS 18 Ca 0.00 -1.28 0.25 0.00 0.02 0.00 0.00 55.97 54.96 1ii7 s LYS 18 Cb 0.00 -3.39 1.36 0.00 -0.52 0.00 0.00 37.83 35.28 1ii7 s LYS 18 CO 0.00 -0.70 1.74 -1.00 -0.92 0.00 0.00 175.35 174.46 1ii7 h PRO 19 N 8.14 0.00 -0.09 -1.68 0.13 -1.90 0.96 132.00 137.55 1ii7 h PRO 19 Ca -0.22 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.73 1ii7 h PRO 19 Cb 1.07 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 1ii7 h PRO 19 CO 0.59 0.00 -0.73 0.37 -0.23 0.00 0.00 178.00 178.01 1ii7 h GLN 20 N 0.00 0.47 -0.42 0.86 4.15 -1.93 -2.41 115.11 115.82 1ii7 h GLN 20 Ca 0.00 -0.38 -0.13 0.00 0.77 0.00 0.00 58.65 58.91 1ii7 h GLN 20 Cb 0.46 0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.21 1ii7 h GLN 20 CO 0.00 1.01 -0.27 0.00 -1.93 0.00 0.00 178.83 177.64 1ii7 h ARG 21 N 0.32 0.89 -0.82 1.69 2.47 -1.09 -0.72 114.38 117.10 1ii7 h ARG 21 Ca -0.03 -0.40 0.07 0.00 -1.26 0.00 0.00 59.98 58.36 1ii7 h ARG 21 Cb 1.31 -0.02 -0.06 0.00 -1.65 0.00 0.00 29.97 29.55 1ii7 h ARG 21 CO 0.13 1.05 0.50 1.49 0.56 0.00 0.00 179.97 183.69 1ii7 h GLU 22 N 0.76 0.86 -0.40 0.04 4.81 -1.45 0.54 114.58 119.74 1ii7 h GLU 22 Ca 0.09 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.18 1ii7 h GLU 22 Cb 0.83 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 1ii7 h GLU 22 CO 0.07 0.57 -0.12 0.93 -0.73 0.00 0.00 179.01 179.73 1ii7 h GLU 23 N 0.89 0.71 -0.16 1.92 5.08 -1.04 -2.47 114.58 119.50 1ii7 h GLU 23 Ca 0.37 -0.23 -0.15 0.00 -1.00 0.00 0.00 59.36 58.34 1ii7 h GLU 23 Cb 0.22 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1ii7 h GLU 23 CO -0.19 0.80 -0.55 0.93 -1.00 0.00 0.00 179.01 179.00 1ii7 h GLU 24 N 0.64 0.48 -0.73 2.33 5.08 0.90 -0.31 114.58 122.96 1ii7 h GLU 24 Ca 0.11 -0.30 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 1ii7 h GLU 24 Cb 0.57 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 1ii7 h GLU 24 CO 0.04 0.90 0.26 0.74 -1.00 0.00 0.00 179.01 179.95 1ii7 h PHE 25 N 0.37 1.15 -0.39 4.33 -1.00 0.12 0.19 116.94 121.70 1ii7 h PHE 25 Ca 0.01 -0.10 -0.06 0.00 2.81 0.00 0.00 57.97 60.62 1ii7 h PHE 25 Cb 1.08 -0.34 -0.01 0.00 3.61 0.00 0.00 35.95 40.29 1ii7 h PHE 25 CO 0.04 0.89 -0.00 0.00 -1.61 0.00 0.00 178.31 177.63 1ii7 h ALA 26 N 1.13 0.52 -0.94 2.45 0.00 -1.23 -2.23 119.26 118.96 1ii7 h ALA 26 Ca 0.24 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ii7 h ALA 26 Cb 0.25 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1ii7 h ALA 26 CO -0.01 0.30 0.56 1.49 0.00 0.00 0.00 179.25 181.59 1ii7 h GLU 27 N 0.51 1.28 -0.36 0.00 4.57 -0.80 -0.49 114.58 119.29 1ii7 h GLU 27 Ca 0.11 -0.12 0.03 0.00 -1.18 0.00 0.00 59.36 58.20 1ii7 h GLU 27 Cb 0.48 -0.27 -0.03 0.00 -0.16 0.00 0.00 28.75 28.77 1ii7 h GLU 27 CO 0.02 0.90 0.17 0.00 -1.18 0.00 0.00 179.01 178.92 1ii7 h ALA 28 N 1.32 0.44 -0.70 2.92 0.00 -0.73 0.16 119.26 122.67 1ii7 h ALA 28 Ca 0.34 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 1ii7 h ALA 28 Cb -0.05 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1ii7 h ALA 28 CO -0.06 -0.20 0.41 0.35 0.00 0.00 0.00 179.25 179.74 1ii7 h PHE 29 N 0.35 0.93 -0.60 0.00 -0.00 -0.77 -0.83 116.94 116.02 1ii7 h PHE 29 Ca 0.15 -0.01 -0.04 0.00 -0.00 0.00 0.00 57.97 58.07 1ii7 h PHE 29 Cb 0.07 -0.30 -0.03 0.00 -0.00 0.00 0.00 35.95 35.69 1ii7 h PHE 29 CO -0.11 0.64 0.23 -0.22 -0.00 0.00 0.00 178.31 178.85 1ii7 h LYS 30 N 0.95 0.91 -0.29 1.11 3.64 -0.42 -1.29 116.57 121.17 1ii7 h LYS 30 Ca 0.25 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1ii7 h LYS 30 Cb -0.01 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1ii7 h LYS 30 CO -0.04 0.78 0.19 -0.91 -2.27 0.00 0.00 179.45 177.20 1ii7 h ASN 31 N 0.84 0.34 -0.21 4.20 2.35 -0.16 -1.77 115.58 121.18 1ii7 h ASN 31 Ca 0.20 -0.02 0.02 0.00 -0.55 0.00 0.00 56.30 55.95 1ii7 h ASN 31 Cb 0.23 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 1ii7 h ASN 31 CO -0.01 0.26 0.08 0.00 -1.65 0.00 0.00 177.43 176.11 1ii7 h ALA 32 N 1.10 0.24 -0.68 -0.83 0.00 -0.91 -1.56 119.26 116.61 1ii7 h ALA 32 Ca 0.11 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1ii7 h ALA 32 Cb -0.03 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1ii7 h ALA 32 CO -0.02 -0.34 0.35 -0.07 0.00 0.00 0.00 179.25 179.16 1ii7 h LEU 33 N 0.18 0.86 -0.84 0.00 3.38 -1.10 -0.38 115.31 117.42 1ii7 h LEU 33 Ca 0.09 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 1ii7 h LEU 33 Cb 0.05 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1ii7 h LEU 33 CO -0.08 0.71 -0.31 -0.33 0.09 0.00 0.00 178.44 178.52 1ii7 h GLU 34 N 0.96 0.51 -0.22 1.13 5.08 -0.90 -1.27 114.58 119.86 1ii7 h GLU 34 Ca 0.24 -0.22 -0.14 0.00 -1.00 0.00 0.00 59.36 58.25 1ii7 h GLU 34 Cb 0.07 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1ii7 h GLU 34 CO -0.03 0.76 -0.44 0.82 -1.00 0.00 0.00 179.01 179.12 1ii7 h ILE 35 N 0.44 1.31 -0.46 3.13 2.04 -0.64 -0.85 117.51 122.47 1ii7 h ILE 35 Ca 0.05 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.28 1ii7 h ILE 35 Cb 0.76 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 1ii7 h ILE 35 CO 0.06 0.51 0.26 0.00 0.00 0.00 0.00 178.15 178.98 1ii7 h ALA 36 N 1.07 0.59 -0.40 1.87 0.00 -0.52 0.33 119.26 122.21 1ii7 h ALA 36 Ca 0.03 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1ii7 h ALA 36 Cb 0.95 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1ii7 h ALA 36 CO 0.08 0.10 0.08 0.28 0.00 0.00 0.00 179.25 179.79 1ii7 h VAL 37 N 0.61 1.24 -0.28 0.00 2.07 -1.13 -2.58 116.25 116.18 1ii7 h VAL 37 Ca 0.16 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1ii7 h VAL 37 Cb 0.03 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1ii7 h VAL 37 CO -0.03 0.29 0.19 1.56 0.02 0.00 0.00 177.57 179.60 1ii7 h GLN 38 N 0.50 0.37 -0.08 1.57 4.20 -0.73 0.25 115.11 121.20 1ii7 h GLN 38 Ca 0.12 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.81 1ii7 h GLN 38 Cb 0.34 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1ii7 h GLN 38 CO 0.00 0.24 0.00 0.39 -0.67 0.00 0.00 178.83 178.80 1ii7 n GLU 39 N -4.50 1.27 -3.78 1.46 -0.58 0.07 -4.91 120.64 109.67 1ii7 n GLU 39 Ca 0.01 -0.42 -0.26 0.00 -0.42 0.00 0.00 57.16 56.07 1ii7 n GLU 39 Cb 0.07 -1.26 0.04 0.00 -0.57 0.00 0.00 31.44 29.73 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 -0.31 -4.05 -4.78 1.62 4.05 0.08 -4.93 115.26 106.95 1ii7 n ASN 40 Ca 0.12 -0.74 -0.32 0.00 0.45 0.00 0.00 54.58 54.08 1ii7 n ASN 40 Cb 0.14 -4.19 0.05 0.00 1.23 0.00 0.00 39.78 37.01 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 -3.40 3.36 0.07 3.44 -7.23 -1.00 -4.95 120.40 110.69 1ii7 s VAL 41 Ca 0.45 0.58 -0.13 0.00 -1.81 0.00 0.00 61.98 61.08 1ii7 s VAL 41 Cb -0.22 -3.11 -0.27 0.00 0.56 0.00 0.00 36.38 33.34 1ii7 s VAL 41 CO 0.80 -0.44 1.14 0.44 -0.31 0.00 0.00 175.10 176.74 1ii7 h ASP 42 N -0.20 0.81 -5.12 4.85 5.19 -1.12 -3.48 116.42 117.35 1ii7 h ASP 42 Ca -0.46 -0.73 -0.03 0.00 -0.62 0.00 0.00 57.03 55.19 1ii7 h ASP 42 Cb 1.24 -0.25 -0.04 0.00 0.18 0.00 0.00 39.33 40.45 1ii7 h ASP 42 CO 0.54 1.54 0.11 0.72 -3.12 0.00 0.00 179.24 179.03 1ii7 s PHE 43 N -3.04 0.20 -0.03 4.55 -0.71 -1.24 -4.15 117.98 113.56 1ii7 s PHE 43 Ca -0.09 -0.68 0.03 0.00 -1.04 0.00 0.00 56.93 55.15 1ii7 s PHE 43 Cb 0.06 0.54 -0.00 0.00 -1.21 0.00 0.00 43.02 42.41 1ii7 s PHE 43 CO 0.92 -1.29 -0.12 0.42 -1.34 0.00 0.00 175.22 173.82 1ii7 s ILE 44 N -3.28 1.01 -0.11 -4.49 1.01 -0.29 -1.81 121.20 113.25 1ii7 s ILE 44 Ca 0.18 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.34 1ii7 s ILE 44 Cb -0.04 -0.88 -0.02 0.00 0.01 0.00 0.00 42.46 41.53 1ii7 s ILE 44 CO 0.11 0.30 -0.10 -0.76 0.00 0.00 0.00 174.94 174.49 1ii7 s LEU 45 N 0.10 2.92 -0.32 2.97 1.43 0.26 0.18 118.68 126.21 1ii7 s LEU 45 Ca -0.03 -0.19 0.02 0.00 -1.03 0.00 0.00 54.13 52.90 1ii7 s LEU 45 Cb -0.09 -1.65 0.10 0.00 0.03 0.00 0.00 46.19 44.58 1ii7 s LEU 45 CO 0.01 0.25 0.07 -0.63 0.23 0.00 0.00 176.35 176.27 1ii7 s ILE 46 N -0.12 1.57 -0.02 -0.59 1.01 -0.02 -0.26 121.20 122.76 1ii7 s ILE 46 Ca -0.00 -1.85 -0.05 0.00 0.00 0.00 0.00 60.65 58.75 1ii7 s ILE 46 Cb -0.13 -2.16 -0.24 0.00 0.01 0.00 0.00 42.46 39.94 1ii7 s ILE 46 CO 0.03 -0.62 3.29 0.00 0.00 0.00 0.00 174.94 177.64 1ii7 n ALA 47 N 4.56 5.83 0.00 9.38 0.00 -0.58 -2.59 120.51 137.10 1ii7 n ALA 47 Ca 0.01 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.79 1ii7 n ALA 47 Cb 0.42 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.54 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 2.57 0.44 3.19 0.00 0.00 -1.12 -3.96 105.19 106.31 1ii7 n GLY 48 Ca 0.39 -1.63 -0.16 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.59 -2.79 -0.04 1.61 10.43 -1.26 -1.32 116.55 122.58 1ii7 n ASP 49 Ca 0.00 -0.53 -0.09 0.00 2.57 0.00 0.00 54.79 56.73 1ii7 n ASP 49 Cb 0.00 -4.57 0.06 0.00 1.84 0.00 0.00 41.12 38.45 1ii7 n ASP 49 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 1ii7 h LEU 50 N -1.82 0.72 -9.26 0.64 5.85 -1.93 -0.53 115.31 108.98 1ii7 h LEU 50 Ca -0.52 -0.33 -0.67 0.00 0.84 0.00 0.00 57.88 57.20 1ii7 h LEU 50 Cb 1.31 -0.20 -0.16 0.00 0.37 0.00 0.00 40.66 41.97 1ii7 h LEU 50 CO 0.45 1.04 -0.70 -0.36 -0.34 0.00 0.00 178.44 178.53 1ii7 s PHE 51 N -4.27 2.87 0.22 1.25 0.40 -1.26 -1.15 117.98 116.04 1ii7 s PHE 51 Ca -0.08 -0.06 0.09 0.00 -0.60 0.00 0.00 56.93 56.27 1ii7 s PHE 51 Cb 0.12 -1.56 0.18 0.00 0.51 0.00 0.00 43.02 42.27 1ii7 s PHE 51 CO 0.84 0.40 1.51 1.25 0.70 0.00 0.00 175.22 179.92 1ii7 h HIS 52 N 4.14 0.03 -3.76 0.36 -0.00 -1.32 -3.35 115.15 111.24 1ii7 h HIS 52 Ca -0.48 -0.01 -0.60 0.00 -0.00 0.00 0.00 60.37 59.27 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 0.75 -0.83 0.45 -0.00 0.00 0.00 177.93 178.88 1ii7 s SER 53 N -6.82 2.87 0.00 3.26 0.15 -1.26 -4.76 113.70 107.14 1ii7 s SER 53 Ca -0.01 -0.75 0.30 0.00 0.70 0.00 0.00 55.95 56.19 1ii7 s SER 53 Cb 0.12 -0.18 1.39 0.00 -1.71 0.00 0.00 66.02 65.64 1ii7 s SER 53 CO 0.78 0.09 2.00 -1.54 1.20 0.00 0.00 173.24 175.76 1ii7 n SER 54 N 0.85 0.01 -3.24 5.45 3.41 -1.02 -3.73 113.62 115.34 1ii7 n SER 54 Ca -0.18 0.13 -0.25 0.00 -0.26 0.00 0.00 58.87 58.32 1ii7 n SER 54 Cb 0.54 -0.37 -0.06 0.00 -0.26 0.00 0.00 64.21 64.05 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 -1.38 1.70 -1.85 4.33 0.63 -1.26 -4.54 116.66 114.28 1ii7 n ARG 55 Ca 0.11 -3.96 -0.37 0.00 -0.92 0.00 0.00 57.85 52.72 1ii7 n ARG 55 Cb 0.29 -1.77 0.05 0.00 0.45 0.00 0.00 32.46 31.48 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 -2.08 2.74 0.84 -0.14 0.04 -1.24 -4.99 135.00 130.17 1ii7 s PRO 56 Ca 0.39 1.98 -0.11 0.00 0.04 0.00 0.00 61.00 63.30 1ii7 s PRO 56 Cb 0.20 -1.89 0.10 0.00 0.04 0.00 0.00 34.50 32.94 1ii7 s PRO 56 CO -0.07 -1.43 1.09 -1.54 0.04 0.00 0.00 177.00 175.09 1ii7 s SER 57 N -1.45 3.90 0.29 6.66 1.04 -1.26 -4.81 113.70 118.07 1ii7 s SER 57 Ca 0.80 1.64 0.00 0.00 0.48 0.00 0.00 55.95 58.87 1ii7 s SER 57 Cb -0.35 -2.32 0.51 0.00 0.10 0.00 0.00 66.02 63.96 1ii7 s SER 57 CO 0.37 -2.39 1.87 -0.65 0.98 0.00 0.00 173.24 173.42 1ii7 h PRO 58 N -1.38 1.02 -0.40 4.02 0.11 -1.99 -1.90 132.00 131.48 1ii7 h PRO 58 Ca -0.47 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 1ii7 h PRO 58 Cb 1.26 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1ii7 h PRO 58 CO 0.53 0.68 0.19 0.78 -0.21 0.00 0.00 178.00 179.96 1ii7 h GLY 59 N 1.05 0.63 1.01 -0.55 0.00 -2.00 -1.02 103.07 102.20 1ii7 h GLY 59 Ca 0.45 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 1ii7 h GLY 59 CO -0.20 0.30 0.34 -0.84 0.00 0.00 0.00 176.54 176.14 1ii7 h THR 60 N 0.51 1.24 -0.45 4.70 2.02 -1.77 -1.79 112.91 117.36 1ii7 h THR 60 Ca 0.14 -0.66 -0.00 0.00 0.77 0.00 0.00 66.41 66.65 1ii7 h THR 60 Cb 0.14 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 1ii7 h THR 60 CO -0.02 0.28 0.27 -0.07 0.37 0.00 0.00 175.52 176.35 1ii7 h LEU 61 N 1.01 0.55 -0.68 2.58 3.38 -1.14 0.16 115.31 121.16 1ii7 h LEU 61 Ca 0.25 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1ii7 h LEU 61 Cb 0.12 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1ii7 h LEU 61 CO -0.03 0.45 0.45 0.50 0.09 0.00 0.00 178.44 179.90 1ii7 h LYS 62 N 0.60 0.88 -0.09 1.13 3.64 -0.90 0.15 116.57 121.99 1ii7 h LYS 62 Ca 0.16 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1ii7 h LYS 62 Cb 0.01 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.63 1ii7 h LYS 62 CO -0.03 0.58 0.01 0.87 -2.27 0.00 0.00 179.45 178.61 1ii7 h LYS 63 N 0.91 0.15 -0.99 1.90 1.79 -0.92 -0.54 116.57 118.86 1ii7 h LYS 63 Ca 0.26 -0.04 0.07 0.00 -2.18 0.00 0.00 60.65 58.75 1ii7 h LYS 63 Cb -0.08 -0.02 -0.07 0.00 -1.58 0.00 0.00 32.23 30.49 1ii7 h LYS 63 CO -0.07 0.38 0.64 0.00 -1.08 0.00 0.00 179.45 179.33 1ii7 h ALA 64 N 0.76 1.38 -0.51 3.86 0.00 -0.30 0.17 119.26 124.63 1ii7 h ALA 64 Ca 0.03 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1ii7 h ALA 64 Cb 0.31 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1ii7 h ALA 64 CO 0.00 0.42 -0.00 0.82 0.00 0.00 0.00 179.25 180.50 1ii7 h ILE 65 N 1.16 1.26 -0.40 0.00 2.04 -0.48 0.74 117.51 121.83 1ii7 h ILE 65 Ca 0.43 -1.09 -0.08 0.00 1.00 0.00 0.00 64.86 65.13 1ii7 h ILE 65 Cb 0.18 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1ii7 h ILE 65 CO -0.18 0.38 -0.04 0.00 0.00 0.00 0.00 178.15 178.31 1ii7 h ALA 66 N 0.94 0.55 -0.44 1.87 0.00 -0.22 -2.83 119.26 119.13 1ii7 h ALA 66 Ca 0.14 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ii7 h ALA 66 Cb 0.52 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1ii7 h ALA 66 CO 0.03 0.37 0.18 -0.07 0.00 0.00 0.00 179.25 179.75 1ii7 h LEU 67 N 0.56 0.59 -0.80 0.00 3.38 -0.43 -2.33 115.31 116.28 1ii7 h LEU 67 Ca 0.11 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1ii7 h LEU 67 Cb 0.54 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1ii7 h LEU 67 CO 0.03 0.59 0.00 0.18 0.09 0.00 0.00 178.44 179.33 1ii7 n LEU 68 N -4.62 0.50 0.19 1.67 4.77 0.23 -1.81 117.00 117.92 1ii7 n LEU 68 Ca 0.01 0.66 0.04 0.00 -0.03 0.00 0.00 56.01 56.69 1ii7 n LEU 68 Cb 0.14 -0.65 0.36 0.00 -2.33 0.00 0.00 43.42 40.95 1ii7 n LEU 68 CO 0.37 -0.65 0.70 1.56 -1.33 0.00 0.00 177.39 178.04 1ii7 h GLN 69 N 0.00 0.00 -0.02 3.23 1.08 -1.16 -2.97 115.11 115.27 1ii7 h GLN 69 Ca 0.00 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.23 1ii7 h GLN 69 Cb 0.20 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.57 1ii7 h GLN 69 CO 0.00 0.39 -0.40 0.82 -0.95 0.00 0.00 178.83 178.69 1ii7 h ILE 70 N 0.00 0.19 0.00 2.54 2.04 -1.46 0.23 117.51 121.05 1ii7 h ILE 70 Ca -0.00 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.73 1ii7 h ILE 70 Cb 0.76 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1ii7 h ILE 70 CO 0.05 0.00 -0.60 1.55 0.00 0.00 0.00 178.15 179.15 1ii7 h PRO 71 N -0.54 0.00 -0.24 2.37 0.13 -1.76 -3.16 132.00 128.80 1ii7 h PRO 71 Ca 0.06 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.10 1ii7 h PRO 71 Cb 0.63 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 1ii7 h PRO 71 CO -0.32 0.60 -0.23 -0.22 -0.23 0.00 0.00 178.00 177.60 1ii7 h LYS 72 N 0.00 0.45 0.00 0.86 3.64 -1.25 -0.87 116.57 119.40 1ii7 h LYS 72 Ca -0.01 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1ii7 h LYS 72 Cb 1.21 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1ii7 h LYS 72 CO 0.08 0.66 0.07 -1.91 -2.27 0.00 0.00 179.45 176.08 1ii7 n GLU 73 N -4.14 0.13 -0.01 1.90 4.07 0.76 -0.46 120.64 122.89 1ii7 n GLU 73 Ca -0.00 0.63 0.01 0.00 -0.06 0.00 0.00 57.16 57.74 1ii7 n GLU 73 Cb 0.39 -2.00 0.02 0.00 -0.06 0.00 0.00 31.44 29.78 1ii7 n GLU 73 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 1ii7 n HIS 74 N -2.23 0.00 -3.12 4.31 8.25 -0.75 -5.00 115.22 116.68 1ii7 n HIS 74 Ca -0.01 -0.55 -0.23 0.00 -0.26 0.00 0.00 57.72 56.67 1ii7 n HIS 74 Cb 0.10 -0.06 0.04 0.00 1.12 0.00 0.00 29.99 31.19 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 -0.61 -6.20 -4.52 0.41 7.64 0.39 -4.96 113.62 105.77 1ii7 n SER 75 Ca 0.02 -0.33 -0.42 0.00 1.01 0.00 0.00 58.87 59.15 1ii7 n SER 75 Cb 0.32 -4.97 -0.08 0.00 -1.01 0.00 0.00 64.21 58.47 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 -3.21 4.97 0.57 0.44 1.01 -0.41 -5.01 121.20 119.56 1ii7 s ILE 76 Ca 0.35 0.03 -0.20 0.00 0.00 0.00 0.00 60.65 60.84 1ii7 s ILE 76 Cb -0.16 -4.08 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 1ii7 s ILE 76 CO 0.44 -0.43 1.23 -2.16 0.00 0.00 0.00 174.94 174.01 1ii7 s PRO 77 N 2.47 3.07 -0.22 2.79 0.04 -1.26 -4.42 135.00 137.48 1ii7 s PRO 77 Ca 0.18 1.88 0.02 0.00 0.04 0.00 0.00 61.00 63.12 1ii7 s PRO 77 Cb -0.15 -2.02 0.04 0.00 0.04 0.00 0.00 34.50 32.40 1ii7 s PRO 77 CO 0.16 -1.14 -0.15 0.08 0.04 0.00 0.00 177.00 175.98 1ii7 s VAL 78 N -1.54 2.17 -0.16 -0.36 1.01 -1.26 -1.13 120.40 119.12 1ii7 s VAL 78 Ca 0.75 -1.22 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 1ii7 s VAL 78 Cb -0.32 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 1ii7 s VAL 78 CO 0.35 0.29 0.08 -0.36 0.00 0.00 0.00 175.10 175.47 1ii7 s PHE 79 N 1.22 3.33 0.04 5.22 0.40 0.13 -0.55 117.98 127.77 1ii7 s PHE 79 Ca -0.01 0.22 -0.06 0.00 -0.60 0.00 0.00 56.93 56.48 1ii7 s PHE 79 Cb -0.16 -2.03 -0.01 0.00 0.51 0.00 0.00 43.02 41.33 1ii7 s PHE 79 CO -0.09 0.33 0.12 0.00 0.70 0.00 0.00 175.22 176.27 1ii7 s ALA 80 N -0.05 -0.13 0.25 5.36 0.00 -0.38 -0.84 121.76 125.97 1ii7 s ALA 80 Ca 0.07 -0.51 0.08 0.00 0.00 0.00 0.00 51.96 51.61 1ii7 s ALA 80 Cb -0.12 0.27 -0.05 0.00 0.00 0.00 0.00 23.12 23.22 1ii7 s ALA 80 CO 0.01 -0.34 -0.12 0.96 0.00 0.00 0.00 175.76 176.26 1ii7 s ILE 81 N -2.70 1.86 0.14 0.00 -4.36 -1.07 -1.55 121.20 113.53 1ii7 s ILE 81 Ca -0.04 -2.22 -0.20 0.00 -0.26 0.00 0.00 60.65 57.93 1ii7 s ILE 81 Cb -0.01 -2.26 -0.07 0.00 1.25 0.00 0.00 42.46 41.37 1ii7 s ILE 81 CO -0.05 -0.44 0.65 -1.61 0.24 0.00 0.00 174.94 173.73 1ii7 s GLU 82 N -3.65 4.26 0.49 0.37 2.02 -1.26 -2.78 118.70 118.16 1ii7 s GLU 82 Ca 0.27 0.82 0.02 0.00 0.02 0.00 0.00 54.97 56.10 1ii7 s GLU 82 Cb 0.00 -3.10 0.09 0.00 0.10 0.00 0.00 34.13 31.23 1ii7 s GLU 82 CO 0.10 0.54 0.68 0.41 0.02 0.00 0.00 175.26 177.01 1ii7 n GLY 83 N 1.29 1.07 0.22 -1.39 0.00 -1.26 -1.51 105.19 103.60 1ii7 n GLY 83 Ca -0.06 -2.07 0.08 0.00 0.00 0.00 0.00 46.02 43.97 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 -0.28 0.00 0.10 1.61 -1.07 -1.89 -2.55 115.58 111.51 1ii7 h ASN 84 Ca -0.23 0.00 -0.22 0.00 0.07 0.00 0.00 56.30 55.92 1ii7 h ASN 84 Cb 0.89 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 37.14 1ii7 h ASN 84 CO 0.26 0.25 -0.85 0.45 0.07 0.00 0.00 177.43 177.62 1ii7 h HIS 85 N 0.00 0.82 -0.19 4.14 3.86 -1.89 -3.36 115.15 118.53 1ii7 h HIS 85 Ca -0.00 -0.40 0.00 0.00 -1.16 0.00 0.00 60.37 58.81 1ii7 h HIS 85 Cb 0.61 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.97 1ii7 h HIS 85 CO 0.00 1.21 0.00 -0.40 0.86 0.00 0.00 177.93 179.60 1ii7 n ASP 86 N -3.85 2.68 -4.81 2.45 3.85 -1.16 -2.44 116.55 113.26 1ii7 n ASP 86 Ca -0.07 -1.78 -0.33 0.00 -0.71 0.00 0.00 54.79 51.90 1ii7 n ASP 86 Cb 0.78 -0.12 -0.01 0.00 -1.35 0.00 0.00 41.12 40.42 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 -1.21 3.64 -0.12 0.11 1.70 -0.97 -4.54 118.95 117.56 1ii7 s ARG 87 Ca 0.24 1.15 -0.04 0.00 -0.47 0.00 0.00 55.73 56.60 1ii7 s ARG 87 Cb 0.15 -2.08 -0.04 0.00 -0.57 0.00 0.00 34.95 32.41 1ii7 s ARG 87 CO 0.21 -0.54 0.04 0.95 -1.08 0.00 0.00 175.30 174.87 1ii7 s THR 88 N -2.42 4.59 0.54 4.99 -4.23 -1.26 -4.75 115.64 113.10 1ii7 s THR 88 Ca 0.63 -0.13 0.37 0.00 -1.18 0.00 0.00 61.69 61.38 1ii7 s THR 88 Cb -0.14 -2.98 0.56 0.00 1.34 0.00 0.00 72.50 71.28 1ii7 s THR 88 CO 0.31 0.56 1.80 1.56 -0.54 0.00 0.00 174.62 178.31 1ii7 h GLN 89 N 5.63 0.00 -1.23 3.99 7.50 -1.98 -3.40 115.11 125.62 1ii7 h GLN 89 Ca -0.46 -0.00 0.15 0.00 0.50 0.00 0.00 58.65 58.84 1ii7 h GLN 89 Cb 1.19 -0.00 -0.26 0.00 0.05 0.00 0.00 27.48 28.46 1ii7 h GLN 89 CO 0.60 0.00 0.36 0.50 -1.50 0.00 0.00 178.83 178.79 1ii7 s ARG 90 N -4.95 0.30 0.00 1.46 3.52 -1.26 -5.17 118.95 112.86 1ii7 s ARG 90 Ca -0.05 0.61 0.00 0.00 -0.13 0.00 0.00 55.73 56.16 1ii7 s ARG 90 Cb 0.23 0.21 0.00 0.00 -1.56 0.00 0.00 34.95 33.83 1ii7 s ARG 90 CO 0.81 -0.08 0.00 0.41 -0.81 0.00 0.00 175.30 175.63 1ii7 n GLY 91 N 4.19 -2.05 3.73 8.12 0.00 -1.26 -4.98 105.19 112.93 1ii7 n GLY 91 Ca -0.14 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.34 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 -0.35 4.31 0.67 1.61 0.04 -1.26 -4.75 135.00 135.28 1ii7 s PRO 92 Ca 0.00 2.15 -0.01 0.00 0.04 0.00 0.00 61.00 63.18 1ii7 s PRO 92 Cb 0.00 -3.19 0.09 0.00 0.04 0.00 0.00 34.50 31.44 1ii7 s PRO 92 CO 0.00 -0.41 0.93 -1.54 0.04 0.00 0.00 177.00 176.02 1ii7 s SER 93 N 0.76 4.67 0.44 6.66 1.04 -1.26 -4.93 113.70 121.07 1ii7 s SER 93 Ca 0.62 -0.18 0.19 0.00 0.48 0.00 0.00 55.95 57.07 1ii7 s SER 93 Cb -0.39 -0.38 1.01 0.00 0.10 0.00 0.00 66.02 66.36 1ii7 s SER 93 CO 0.35 -1.62 1.92 1.62 0.98 0.00 0.00 173.24 176.48 1ii7 h VAL 94 N -0.36 0.91 -0.40 5.02 3.04 -1.80 -2.18 116.25 120.49 1ii7 h VAL 94 Ca -0.39 -0.97 -0.14 0.00 -1.01 0.00 0.00 66.70 64.19 1ii7 h VAL 94 Cb 1.28 1.57 -0.01 0.00 -2.01 0.00 0.00 31.29 32.12 1ii7 h VAL 94 CO 0.46 0.25 -0.30 -0.07 -1.01 0.00 0.00 177.57 176.90 1ii7 h LEU 95 N 0.00 0.92 -0.49 3.16 3.38 -1.94 -0.05 115.31 120.28 1ii7 h LEU 95 Ca -0.00 -0.38 0.02 0.00 0.09 0.00 0.00 57.88 57.61 1ii7 h LEU 95 Cb 0.55 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1ii7 h LEU 95 CO 0.03 1.14 0.31 0.78 0.09 0.00 0.00 178.44 180.79 1ii7 h ASN 96 N 0.74 0.51 -0.25 -0.43 -0.26 -1.79 0.24 115.58 114.34 1ii7 h ASN 96 Ca 0.08 -0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.82 1ii7 h ASN 96 Cb 0.86 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 38.00 1ii7 h ASN 96 CO 0.08 0.36 0.15 0.25 -1.06 0.00 0.00 177.43 177.21 1ii7 h LEU 97 N 0.62 0.30 -1.26 1.61 5.85 -1.21 -0.94 115.31 120.27 1ii7 h LEU 97 Ca 0.19 -0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.87 1ii7 h LEU 97 Cb -0.02 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1ii7 h LEU 97 CO -0.07 0.27 0.51 -0.07 -0.34 0.00 0.00 178.44 178.74 1ii7 h LEU 98 N 0.30 0.85 -0.74 2.25 3.38 -0.31 -1.00 115.31 120.05 1ii7 h LEU 98 Ca 0.09 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1ii7 h LEU 98 Cb 0.03 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 1ii7 h LEU 98 CO -0.02 0.60 0.46 -0.08 0.09 0.00 0.00 178.44 179.49 1ii7 h GLU 99 N 0.99 1.00 -0.36 1.13 4.81 0.17 -0.05 114.58 122.27 1ii7 h GLU 99 Ca 0.29 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.47 1ii7 h GLU 99 Cb -0.04 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.11 1ii7 h GLU 99 CO -0.07 0.69 0.24 -0.44 -0.73 0.00 0.00 179.01 178.70 1ii7 h ASP 100 N 1.01 0.31 -0.00 1.04 3.45 0.12 0.18 116.42 122.52 1ii7 h ASP 100 Ca 0.27 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.72 1ii7 h ASP 100 Cb -0.06 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 38.64 1ii7 h ASP 100 CO -0.05 0.21 0.00 0.49 -1.57 0.00 0.00 179.24 178.32 1ii7 n PHE 101 N -4.48 0.00 -1.17 4.55 3.72 -0.11 -4.89 117.46 115.08 1ii7 n PHE 101 Ca 0.03 -0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.37 1ii7 n PHE 101 Cb 0.16 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.68 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 0.95 0.81 0.08 1.37 0.00 0.63 -4.93 105.19 104.09 1ii7 n GLY 102 Ca 0.20 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.66 0.59 -3.98 0.99 4.77 -0.70 -4.98 117.00 113.03 1ii7 n LEU 103 Ca -0.06 0.19 -0.10 0.00 -0.03 0.00 0.00 56.01 56.02 1ii7 n LEU 103 Cb 0.24 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.22 1ii7 n LEU 103 CO 0.09 -0.11 0.08 0.68 -1.33 0.00 0.00 177.39 176.80 1ii7 s VAL 104 N -3.38 0.02 -0.15 4.08 -7.23 -1.25 -4.62 120.40 107.87 1ii7 s VAL 104 Ca -0.02 -1.41 0.01 0.00 -1.81 0.00 0.00 61.98 58.75 1ii7 s VAL 104 Cb 0.11 -2.06 0.02 0.00 0.56 0.00 0.00 36.38 35.01 1ii7 s VAL 104 CO 0.82 -0.11 -0.15 -0.31 -0.31 0.00 0.00 175.10 175.04 1ii7 s TYR 105 N -4.00 2.23 -0.19 2.82 1.51 0.29 -4.32 117.35 115.68 1ii7 s TYR 105 Ca 0.21 -1.23 -0.19 0.00 -1.01 0.00 0.00 57.07 54.86 1ii7 s TYR 105 Cb 0.01 -1.62 -0.03 0.00 -0.11 0.00 0.00 41.96 40.22 1ii7 s TYR 105 CO 0.05 -0.65 0.52 0.08 -1.11 0.00 0.00 175.55 174.44 1ii7 s VAL 106 N 1.36 5.11 0.00 0.71 1.01 -1.26 -1.25 120.40 126.08 1ii7 s VAL 106 Ca 0.03 0.97 -0.04 0.00 0.00 0.00 0.00 61.98 62.93 1ii7 s VAL 106 Cb -0.13 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 1ii7 s VAL 106 CO -0.09 0.18 0.22 -0.63 0.00 0.00 0.00 175.10 174.78 1ii7 s ILE 107 N 1.59 5.38 -0.74 2.22 1.01 -0.60 -4.91 121.20 125.15 1ii7 s ILE 107 Ca 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.85 1ii7 s ILE 107 Cb -0.15 -3.55 0.00 0.00 0.01 0.00 0.00 42.46 38.76 1ii7 s ILE 107 CO 0.10 0.33 0.00 0.61 0.00 0.00 0.00 174.94 175.97 1ii7 n GLY 108 N 0.97 0.55 3.79 6.18 0.00 -0.60 -4.51 105.19 111.57 1ii7 n GLY 108 Ca -0.11 -2.23 -0.38 0.00 0.00 0.00 0.00 46.02 43.30 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 -0.30 4.13 0.05 1.61 -1.94 -1.26 -0.01 119.30 121.58 1ii7 s MET 109 Ca 0.00 0.45 -0.00 0.00 -1.71 0.00 0.00 55.69 54.42 1ii7 s MET 109 Cb 0.00 -3.31 -0.03 0.00 2.01 0.00 0.00 34.83 33.49 1ii7 s MET 109 CO 0.00 0.46 -0.04 -0.98 -0.01 0.00 0.00 175.02 174.46 1ii7 s ARG 110 N -0.37 0.56 0.12 2.03 1.70 -0.41 -4.97 118.95 117.60 1ii7 s ARG 110 Ca 0.25 -1.05 -0.09 0.00 -0.47 0.00 0.00 55.73 54.37 1ii7 s ARG 110 Cb -0.16 0.09 -0.12 0.00 -0.57 0.00 0.00 34.95 34.19 1ii7 s ARG 110 CO 0.12 -0.07 1.30 0.87 -1.08 0.00 0.00 175.30 176.44 1ii7 h LYS 111 N 3.61 0.61 -5.99 3.89 1.57 -1.93 0.11 116.57 118.43 1ii7 h LYS 111 Ca -0.34 -0.57 -0.61 0.00 -1.87 0.00 0.00 60.65 57.26 1ii7 h LYS 111 Cb 1.17 0.14 -0.05 0.00 0.08 0.00 0.00 32.23 33.57 1ii7 h LYS 111 CO 0.58 1.19 -0.27 -2.00 -0.57 0.00 0.00 179.45 178.37 1ii7 s GLU 112 N -3.49 3.76 0.50 3.15 2.12 -1.26 -4.46 118.70 119.01 1ii7 s GLU 112 Ca -0.08 0.20 -0.20 0.00 0.36 0.00 0.00 54.97 55.25 1ii7 s GLU 112 Cb 0.09 -3.11 -0.08 0.00 0.26 0.00 0.00 34.13 31.28 1ii7 s GLU 112 CO 0.89 0.65 1.06 0.21 -0.54 0.00 0.00 175.26 177.52 1ii7 s LYS 113 N -1.48 3.71 -0.05 4.30 2.20 -1.26 -4.88 119.74 122.27 1ii7 s LYS 113 Ca 0.27 1.41 -0.04 0.00 -0.36 0.00 0.00 55.97 57.25 1ii7 s LYS 113 Cb -0.15 -2.08 0.02 0.00 -1.51 0.00 0.00 37.83 34.12 1ii7 s LYS 113 CO 0.14 -0.52 0.13 0.54 -0.36 0.00 0.00 175.35 175.29 1ii7 s VAL 114 N -1.94 -0.01 -0.19 4.02 0.11 -1.26 -5.09 120.40 116.05 1ii7 s VAL 114 Ca 0.68 0.03 -0.04 0.00 -2.93 0.00 0.00 61.98 59.73 1ii7 s VAL 114 Cb -0.18 -0.20 0.09 0.00 -1.53 0.00 0.00 36.38 34.56 1ii7 s VAL 114 CO 0.21 0.01 0.22 -1.61 -3.33 0.00 0.00 175.10 170.60 1ii7 s GLU 115 N 0.28 0.17 0.00 1.54 0.41 -1.26 -2.56 118.70 117.28 1ii7 s GLU 115 Ca -0.02 0.26 0.00 0.00 -0.41 0.00 0.00 54.97 54.81 1ii7 s GLU 115 Cb -0.03 -1.07 0.00 0.00 -1.78 0.00 0.00 34.13 31.25 1ii7 s GLU 115 CO -0.01 -0.60 0.00 0.27 -0.49 0.00 0.00 175.26 174.43 1ii7 n ASN 116 N 5.32 0.00 0.23 -0.19 0.23 -0.52 -5.00 115.26 115.34 1ii7 n ASN 116 Ca -0.05 -0.76 0.15 0.00 -0.53 0.00 0.00 54.58 53.39 1ii7 n ASN 116 Cb 0.50 0.00 0.82 0.00 -2.08 0.00 0.00 39.78 39.01 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 -3.20 114.58 110.36 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 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 178.94 1ii7 n TYR 118 N -3.98 0.00 -4.01 0.92 4.02 -1.26 -4.80 117.16 108.05 1ii7 n TYR 118 Ca -0.00 -0.15 -0.14 0.00 -0.01 0.00 0.00 57.90 57.59 1ii7 n TYR 118 Cb 0.22 -0.02 -0.14 0.00 -0.02 0.00 0.00 39.34 39.38 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 -0.31 1.90 -0.01 7.72 1.43 -1.21 0.46 118.68 128.67 1ii7 s LEU 119 Ca 0.00 -0.05 0.03 0.00 -1.03 0.00 0.00 54.13 53.08 1ii7 s LEU 119 Cb 0.00 -0.15 -0.01 0.00 0.03 0.00 0.00 46.19 46.06 1ii7 s LEU 119 CO 0.00 0.02 -0.10 0.28 0.23 0.00 0.00 176.35 176.78 1ii7 s THR 120 N 0.07 0.78 0.19 5.49 -1.32 -0.38 -1.44 115.64 119.04 1ii7 s THR 120 Ca -0.00 -0.42 0.06 0.00 -1.21 0.00 0.00 61.69 60.12 1ii7 s THR 120 Cb -0.03 -0.65 -0.04 0.00 -1.51 0.00 0.00 72.50 70.28 1ii7 s THR 120 CO -0.00 0.22 0.17 -0.44 -2.21 0.00 0.00 174.62 172.36 1ii7 s SER 121 N -0.20 5.61 -0.29 8.08 0.01 -1.06 -1.18 113.70 124.66 1ii7 s SER 121 Ca 0.03 -0.14 -0.03 0.00 1.31 0.00 0.00 55.95 57.12 1ii7 s SER 121 Cb -0.04 -1.48 0.11 0.00 0.21 0.00 0.00 66.02 64.82 1ii7 s SER 121 CO -0.00 0.03 0.17 -0.70 0.41 0.00 0.00 173.24 173.14 1ii7 s GLU 122 N -3.38 0.22 0.30 12.44 2.12 -0.18 -4.96 118.70 125.24 1ii7 s GLU 122 Ca 0.32 -0.43 -0.29 0.00 0.36 0.00 0.00 54.97 54.93 1ii7 s GLU 122 Cb -0.09 -1.06 -0.13 0.00 0.26 0.00 0.00 34.13 33.11 1ii7 s GLU 122 CO 0.24 -1.01 1.38 -2.13 -0.54 0.00 0.00 175.26 173.20 1ii7 n ARG 123 N 5.26 2.18 -4.08 4.30 0.00 -1.26 -0.92 116.66 122.15 1ii7 n ARG 123 Ca -0.05 0.77 -0.25 0.00 -0.00 0.00 0.00 57.85 58.32 1ii7 n ARG 123 Cb 0.43 -2.41 -0.07 0.00 0.00 0.00 0.00 32.46 30.42 1ii7 n ARG 123 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1ii7 s LEU 124 N -0.55 3.11 0.33 6.15 1.43 0.65 -4.87 118.68 124.93 1ii7 s LEU 124 Ca 0.61 -1.07 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 1ii7 s LEU 124 Cb -0.59 -1.47 0.54 0.00 0.03 0.00 0.00 46.19 44.71 1ii7 s LEU 124 CO 0.56 -0.59 1.99 1.23 0.23 0.00 0.00 176.35 179.77 1ii7 h GLY 125 N 1.36 1.03 -0.72 -3.19 0.00 -1.95 -0.98 103.07 98.62 1ii7 h GLY 125 Ca -0.42 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.52 1ii7 h GLY 125 CO 0.68 0.37 0.00 1.16 0.00 0.00 0.00 176.54 178.75 1ii7 n ASN 126 N -4.43 0.58 0.00 0.19 6.94 -1.26 -4.80 115.26 112.49 1ii7 n ASN 126 Ca 0.08 -1.63 0.00 0.00 -0.02 0.00 0.00 54.58 53.01 1ii7 n ASN 126 Cb 0.04 -0.29 0.00 0.00 -2.36 0.00 0.00 39.78 37.17 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 0.16 2.20 3.87 4.83 0.00 -0.37 -4.98 105.19 110.90 1ii7 n GLY 127 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1ii7 n GLY 127 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ii7 s GLU 128 N 0.00 3.72 0.03 1.61 2.12 -1.26 -4.68 118.70 120.24 1ii7 s GLU 128 Ca 0.00 0.55 0.01 0.00 0.36 0.00 0.00 54.97 55.89 1ii7 s GLU 128 Cb 0.00 -2.28 -0.04 0.00 0.26 0.00 0.00 34.13 32.07 1ii7 s GLU 128 CO 0.00 -0.22 0.08 0.71 -0.54 0.00 0.00 175.26 175.29 1ii7 s TYR 129 N -2.66 3.25 -0.27 5.30 1.51 0.37 -0.25 117.35 124.61 1ii7 s TYR 129 Ca 0.53 0.16 -0.11 0.00 -1.01 0.00 0.00 57.07 56.63 1ii7 s TYR 129 Cb -0.10 -1.69 -0.05 0.00 -0.11 0.00 0.00 41.96 40.00 1ii7 s TYR 129 CO 0.39 0.54 0.18 -1.17 -1.11 0.00 0.00 175.55 174.37 1ii7 s LEU 130 N -1.98 4.01 -0.17 -1.29 2.96 -0.09 -1.29 118.68 120.83 1ii7 s LEU 130 Ca 0.25 0.00 -0.06 0.00 -0.22 0.00 0.00 54.13 54.11 1ii7 s LEU 130 Cb -0.12 -2.11 -0.03 0.00 0.50 0.00 0.00 46.19 44.43 1ii7 s LEU 130 CO 0.17 -0.03 0.01 -0.69 -1.32 0.00 0.00 176.35 174.49 1ii7 s VAL 131 N 1.63 4.34 0.05 1.68 1.01 0.98 -1.01 120.40 129.08 1ii7 s VAL 131 Ca 0.07 -0.20 0.07 0.00 0.00 0.00 0.00 61.98 61.93 1ii7 s VAL 131 Cb -0.16 -2.93 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 1ii7 s VAL 131 CO 0.10 0.48 -0.18 -0.54 0.00 0.00 0.00 175.10 174.95 1ii7 s LYS 132 N 0.36 2.02 0.43 2.72 1.02 -0.33 -1.56 119.74 124.40 1ii7 s LYS 132 Ca -0.01 -1.02 -0.13 0.00 0.02 0.00 0.00 55.97 54.84 1ii7 s LYS 132 Cb -0.13 -2.17 -0.07 0.00 -0.52 0.00 0.00 37.83 34.93 1ii7 s LYS 132 CO 0.02 0.53 0.83 0.20 -0.92 0.00 0.00 175.35 176.01 1ii7 s GLY 133 N -1.55 2.03 -0.05 -3.33 0.00 0.38 -1.25 107.32 103.55 1ii7 s GLY 133 Ca 0.15 -0.05 0.01 0.00 0.00 0.00 0.00 44.72 44.83 1ii7 s GLY 133 CO 0.06 0.17 -0.05 0.14 0.00 0.00 0.00 173.10 173.42 1ii7 s VAL 134 N -2.40 0.58 -0.26 1.40 1.01 0.17 -0.77 120.40 120.14 1ii7 s VAL 134 Ca 0.54 -0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.35 1ii7 s VAL 134 Cb -0.10 -0.60 0.09 0.00 0.00 0.00 0.00 36.38 35.76 1ii7 s VAL 134 CO 0.29 0.24 0.10 -0.47 0.00 0.00 0.00 175.10 175.26 1ii7 s TYR 135 N 0.97 0.69 0.00 5.22 6.14 -0.48 -4.43 117.35 125.46 1ii7 s TYR 135 Ca -0.10 -0.94 0.00 0.00 0.64 0.00 0.00 57.07 56.67 1ii7 s TYR 135 Cb -0.14 -1.05 0.00 0.00 0.42 0.00 0.00 41.96 41.19 1ii7 s TYR 135 CO -0.00 -0.75 0.00 1.63 0.64 0.00 0.00 175.55 177.07 1ii7 n LYS 136 N 5.14 0.00 -0.10 4.97 5.02 -1.26 -0.24 118.16 131.70 1ii7 n LYS 136 Ca -0.06 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.33 1ii7 n LYS 136 Cb 0.44 0.00 0.34 0.00 -0.02 0.00 0.00 35.03 35.79 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 5.82 1.70 -4.82 4.39 5.75 -1.26 -4.89 116.55 123.24 1ii7 n ASP 137 Ca 0.00 -1.75 -0.34 0.00 -0.01 0.00 0.00 54.79 52.69 1ii7 n ASP 137 Cb 0.00 -0.13 -0.06 0.00 -1.03 0.00 0.00 41.12 39.90 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 -1.48 4.08 0.03 -2.12 2.96 0.67 -4.72 118.68 118.10 1ii7 s LEU 138 Ca 0.31 0.26 0.06 0.00 -0.22 0.00 0.00 54.13 54.54 1ii7 s LEU 138 Cb 0.17 -2.29 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 1ii7 s LEU 138 CO 0.25 0.30 -0.15 -1.61 -1.32 0.00 0.00 176.35 173.82 1ii7 s GLU 139 N -1.59 2.21 -0.29 1.98 2.02 -0.61 -1.38 118.70 121.05 1ii7 s GLU 139 Ca 0.22 -0.90 0.01 0.00 0.02 0.00 0.00 54.97 54.32 1ii7 s GLU 139 Cb -0.12 -2.28 0.06 0.00 0.10 0.00 0.00 34.13 31.89 1ii7 s GLU 139 CO 0.12 0.56 -0.05 0.42 0.02 0.00 0.00 175.26 176.34 1ii7 s ILE 140 N -0.94 2.49 0.24 -1.63 1.01 0.05 -0.80 121.20 121.61 1ii7 s ILE 140 Ca 0.15 -1.65 0.02 0.00 0.00 0.00 0.00 60.65 59.17 1ii7 s ILE 140 Cb -0.11 -2.50 -0.04 0.00 0.01 0.00 0.00 42.46 39.83 1ii7 s ILE 140 CO 0.06 -0.14 0.41 -1.00 0.00 0.00 0.00 174.94 174.27 1ii7 s HIS 141 N 1.13 3.48 0.00 3.97 3.76 0.13 -0.47 115.29 127.29 1ii7 s HIS 141 Ca -0.05 0.21 0.00 0.00 -0.15 0.00 0.00 55.06 55.07 1ii7 s HIS 141 Cb -0.20 -1.76 0.00 0.00 1.11 0.00 0.00 32.58 31.73 1ii7 s HIS 141 CO -0.04 0.35 0.00 0.41 -0.85 0.00 0.00 174.74 174.61 1ii7 n GLY 142 N -1.14 -0.71 3.52 -2.22 0.00 -1.26 -0.07 105.19 103.31 1ii7 n GLY 142 Ca -0.06 -1.15 -0.18 0.00 0.00 0.00 0.00 46.02 44.63 1ii7 n GLY 142 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ii7 s MET 143 N -2.00 1.04 0.88 1.61 1.75 -1.12 -3.56 119.30 117.90 1ii7 s MET 143 Ca 0.00 0.25 -0.12 0.00 -1.25 0.00 0.00 55.69 54.57 1ii7 s MET 143 Cb 0.00 0.49 0.12 0.00 2.84 0.00 0.00 34.83 38.28 1ii7 s MET 143 CO 0.00 -0.33 1.10 -1.59 -0.65 0.00 0.00 175.02 173.55 1ii7 s LYS 144 N -1.20 1.38 0.34 4.11 -2.85 -1.26 -4.27 119.74 115.99 1ii7 s LYS 144 Ca -0.11 0.67 -0.28 0.00 -1.00 0.00 0.00 55.97 55.25 1ii7 s LYS 144 Cb -0.00 -1.84 -0.12 0.00 -2.06 0.00 0.00 37.83 33.81 1ii7 s LYS 144 CO 0.10 -2.12 1.27 0.98 0.10 0.00 0.00 175.35 175.68 1ii7 n TYR 145 N -3.77 2.22 -4.11 1.78 4.19 -0.57 -4.81 117.16 112.08 1ii7 n TYR 145 Ca 0.07 0.56 -0.15 0.00 3.31 0.00 0.00 57.90 61.69 1ii7 n TYR 145 Cb 0.56 -2.41 -0.12 0.00 0.49 0.00 0.00 39.34 37.87 1ii7 n TYR 145 CO 0.00 0.00 0.00 -1.64 0.91 0.00 0.00 176.86 176.13 1ii7 s MET 146 N -1.87 0.66 0.78 2.98 -1.94 -1.26 -4.86 119.30 113.80 1ii7 s MET 146 Ca 0.56 -0.86 -0.11 0.00 -1.71 0.00 0.00 55.69 53.57 1ii7 s MET 146 Cb -0.58 -0.51 0.06 0.00 2.01 0.00 0.00 34.83 35.81 1ii7 s MET 146 CO 0.62 0.10 1.09 -1.54 -0.01 0.00 0.00 175.02 175.28 1ii7 s SER 147 N -1.69 4.49 0.27 3.03 1.04 -1.26 -4.91 113.70 114.68 1ii7 s SER 147 Ca -0.06 1.69 -0.01 0.00 0.48 0.00 0.00 55.95 58.05 1ii7 s SER 147 Cb -0.10 -2.42 0.46 0.00 0.10 0.00 0.00 66.02 64.06 1ii7 s SER 147 CO 0.01 -2.02 1.87 -1.28 0.98 0.00 0.00 173.24 172.80 1ii7 h SER 148 N -1.12 1.00 -0.55 7.02 0.87 -1.90 -1.80 113.55 117.06 1ii7 h SER 148 Ca -0.45 0.02 -0.08 0.00 -1.23 0.00 0.00 61.79 60.06 1ii7 h SER 148 Cb 1.24 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.98 1ii7 h SER 148 CO 0.53 0.61 0.07 0.00 -0.53 0.00 0.00 176.83 177.51 1ii7 h ALA 149 N 1.48 1.00 -0.84 6.23 0.00 -1.94 -2.31 119.26 122.89 1ii7 h ALA 149 Ca 0.45 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1ii7 h ALA 149 Cb 0.26 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1ii7 h ALA 149 CO -0.20 0.63 0.48 2.35 0.00 0.00 0.00 179.25 182.51 1ii7 h TRP 150 N 0.91 1.12 0.00 0.00 7.01 -1.70 0.80 115.95 124.09 1ii7 h TRP 150 Ca 0.18 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.16 1ii7 h TRP 150 Cb 0.44 -0.36 -0.00 0.00 -2.10 0.00 0.00 29.16 27.13 1ii7 h TRP 150 CO 0.03 0.76 -0.02 0.74 -2.79 0.00 0.00 178.44 177.16 1ii7 h PHE 151 N 1.16 0.00 0.00 2.65 -1.00 -1.11 -2.16 116.94 116.48 1ii7 h PHE 151 Ca 0.30 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 61.03 1ii7 h PHE 151 Cb -0.01 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.54 1ii7 h PHE 151 CO 0.01 0.02 -0.75 1.49 -1.61 0.00 0.00 178.31 177.47 1ii7 h GLU 152 N 0.00 0.00 -0.02 1.51 4.81 -0.36 -3.26 114.58 117.27 1ii7 h GLU 152 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1ii7 h GLU 152 Cb 0.52 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1ii7 h GLU 152 CO 0.00 0.13 -0.21 0.00 -0.73 0.00 0.00 179.01 178.21 1ii7 n ALA 153 N -2.21 2.97 -3.17 2.92 0.00 -0.42 -4.37 120.51 116.22 1ii7 n ALA 153 Ca -0.01 -0.53 -0.21 0.00 0.00 0.00 0.00 53.44 52.70 1ii7 n ALA 153 Cb 0.63 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 19.04 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 0.09 1.18 -4.55 0.00 3.02 -0.85 -5.08 115.26 109.06 1ii7 n ASN 154 Ca 0.13 -3.02 -0.51 0.00 -0.03 0.00 0.00 54.58 51.16 1ii7 n ASN 154 Cb 0.43 -0.62 -0.05 0.00 -0.61 0.00 0.00 39.78 38.93 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 0.54 0.89 -1.90 3.52 5.02 -1.25 -1.28 118.16 123.70 1ii7 n LYS 155 Ca 0.25 0.32 -0.17 0.00 -2.02 0.00 0.00 58.31 56.69 1ii7 n LYS 155 Cb 0.59 -1.79 -0.04 0.00 -0.02 0.00 0.00 35.03 33.76 1ii7 n LYS 155 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1ii7 n GLU 156 N 1.76 -1.63 0.02 1.97 -0.58 -1.26 -4.86 120.64 116.05 1ii7 n GLU 156 Ca 0.16 0.90 0.09 0.00 -0.42 0.00 0.00 57.16 57.90 1ii7 n GLU 156 Cb 0.21 -5.35 0.52 0.00 -0.57 0.00 0.00 31.44 26.25 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 0.97 -0.22 -3.67 6.09 -1.52 -2.61 117.51 116.55 1ii7 h ILE 157 Ca -0.36 -0.12 -0.05 0.00 -1.37 0.00 0.00 64.86 62.96 1ii7 h ILE 157 Cb 1.17 0.60 -0.01 0.00 0.47 0.00 0.00 36.82 39.05 1ii7 h ILE 157 CO 0.48 0.06 -0.06 -0.07 -3.07 0.00 0.00 178.15 175.49 1ii7 h LEU 158 N 0.34 0.44 -1.52 2.19 3.38 -1.85 -0.66 115.31 117.63 1ii7 h LEU 158 Ca 0.18 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.72 1ii7 h LEU 158 Cb 0.28 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1ii7 h LEU 158 CO -0.04 0.71 -0.25 0.11 0.09 0.00 0.00 178.44 179.07 1ii7 h LYS 159 N 0.16 0.00 -0.08 1.13 1.57 -1.67 0.58 116.57 118.26 1ii7 h LYS 159 Ca 0.05 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.61 1ii7 h LYS 159 Cb 0.53 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.85 1ii7 h LYS 159 CO 0.02 0.25 -0.85 0.00 -0.57 0.00 0.00 179.45 178.30 1ii7 h ARG 160 N 0.00 0.64 0.10 3.15 3.08 -1.28 -3.36 114.38 116.71 1ii7 h ARG 160 Ca -0.00 -0.58 -0.31 0.00 0.07 0.00 0.00 59.98 59.15 1ii7 h ARG 160 Cb 0.48 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 1ii7 h ARG 160 CO 0.03 1.20 -1.62 -0.07 -1.07 0.00 0.00 179.97 178.44 1ii7 h LEU 161 N 0.41 0.32 -8.13 3.04 3.38 -0.82 -3.45 115.31 110.06 1ii7 h LEU 161 Ca -0.07 -0.51 -0.67 0.00 0.09 0.00 0.00 57.88 56.72 1ii7 h LEU 161 Cb 1.48 -0.11 -0.33 0.00 0.09 0.00 0.00 40.66 41.80 1ii7 h LEU 161 CO 0.16 1.44 -0.79 -0.36 0.09 0.00 0.00 178.44 178.98 1ii7 s PHE 162 N -2.61 2.96 -0.15 1.13 0.40 0.17 -5.06 117.98 114.82 1ii7 s PHE 162 Ca -0.10 -1.55 0.01 0.00 -0.60 0.00 0.00 56.93 54.68 1ii7 s PHE 162 Cb 0.07 -2.00 0.02 0.00 0.51 0.00 0.00 43.02 41.62 1ii7 s PHE 162 CO 0.83 -0.74 -0.17 0.50 0.70 0.00 0.00 175.22 176.35 1ii7 s ARG 163 N 1.32 2.52 0.56 0.44 3.52 -1.26 -4.63 118.95 121.42 1ii7 s ARG 163 Ca 0.02 -0.65 -0.19 0.00 -0.13 0.00 0.00 55.73 54.78 1ii7 s ARG 163 Cb -0.15 -2.21 -0.05 0.00 -1.56 0.00 0.00 34.95 30.97 1ii7 s ARG 163 CO -0.08 -0.18 1.14 -1.25 -0.81 0.00 0.00 175.30 174.13 1ii7 s PRO 164 N 1.29 3.27 0.34 5.12 0.04 -1.26 -5.06 135.00 138.74 1ii7 s PRO 164 Ca 0.02 1.64 0.01 0.00 0.04 0.00 0.00 61.00 62.70 1ii7 s PRO 164 Cb -0.13 -1.99 0.07 0.00 0.04 0.00 0.00 34.50 32.48 1ii7 s PRO 164 CO -0.09 -0.92 0.47 0.25 0.04 0.00 0.00 177.00 176.75 1ii7 n THR 165 N -1.39 0.00 0.28 1.26 -2.24 -1.26 -4.95 114.28 105.97 1ii7 n THR 165 Ca 0.12 -0.80 0.11 0.00 -2.27 0.00 0.00 64.05 61.21 1ii7 n THR 165 Cb 0.51 -1.07 0.77 0.00 -2.10 0.00 0.00 70.33 68.43 1ii7 n THR 165 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1ii7 h ASP 166 N -0.23 0.00 -2.86 3.42 5.19 -1.96 -3.34 116.42 116.64 1ii7 h ASP 166 Ca -0.16 0.00 -0.60 0.00 -0.62 0.00 0.00 57.03 55.65 1ii7 h ASP 166 Cb 0.60 0.00 -0.40 0.00 0.18 0.00 0.00 39.33 39.72 1ii7 h ASP 166 CO 0.18 0.01 -0.81 0.21 -3.12 0.00 0.00 179.24 175.71 1ii7 s ASN 167 N -6.63 2.96 0.05 6.45 3.04 -1.26 -4.97 114.94 114.59 1ii7 s ASN 167 Ca -0.05 -3.02 -0.02 0.00 0.04 0.00 0.00 52.86 49.81 1ii7 s ASN 167 Cb 0.16 -0.86 -0.03 0.00 -1.54 0.00 0.00 41.25 38.98 1ii7 s ASN 167 CO 0.61 -0.19 0.01 0.00 -3.04 0.00 0.00 177.10 174.49 1ii7 s ALA 168 N -0.08 0.35 -0.04 1.71 0.00 -1.26 -1.57 121.76 120.87 1ii7 s ALA 168 Ca 0.25 -1.06 0.07 0.00 0.00 0.00 0.00 51.96 51.22 1ii7 s ALA 168 Cb -0.09 0.30 -0.02 0.00 0.00 0.00 0.00 23.12 23.31 1ii7 s ALA 168 CO -0.11 -0.38 -0.24 0.42 0.00 0.00 0.00 175.76 175.45 1ii7 s ILE 169 N -3.73 2.20 -0.16 0.00 1.01 0.02 -0.67 121.20 119.86 1ii7 s ILE 169 Ca 0.05 -1.04 -0.03 0.00 0.00 0.00 0.00 60.65 59.63 1ii7 s ILE 169 Cb 0.06 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.72 1ii7 s ILE 169 CO -0.09 0.58 -0.06 -0.22 0.00 0.00 0.00 174.94 175.14 1ii7 s LEU 170 N -0.45 3.05 -0.18 2.97 2.96 -0.63 0.18 118.68 126.59 1ii7 s LEU 170 Ca 0.05 -0.23 0.01 0.00 -0.22 0.00 0.00 54.13 53.74 1ii7 s LEU 170 Cb -0.12 -1.74 0.02 0.00 0.50 0.00 0.00 46.19 44.86 1ii7 s LEU 170 CO 0.01 0.13 -0.20 -0.32 -1.32 0.00 0.00 176.35 174.65 1ii7 s MET 171 N 0.61 3.00 0.05 1.98 -2.45 0.90 -0.45 119.30 122.95 1ii7 s MET 171 Ca -0.04 -0.83 0.01 0.00 -1.25 0.00 0.00 55.69 53.58 1ii7 s MET 171 Cb -0.15 -2.56 -0.03 0.00 1.25 0.00 0.00 34.83 33.34 1ii7 s MET 171 CO 0.03 -0.18 -0.05 -0.51 1.05 0.00 0.00 175.02 175.35 1ii7 s LEU 172 N 1.23 2.36 -0.55 4.11 1.43 -0.98 -2.81 118.68 123.46 1ii7 s LEU 172 Ca 0.03 -0.73 0.01 0.00 -1.03 0.00 0.00 54.13 52.42 1ii7 s LEU 172 Cb -0.13 -0.01 0.14 0.00 0.03 0.00 0.00 46.19 46.22 1ii7 s LEU 172 CO -0.11 -0.36 0.32 -2.28 0.23 0.00 0.00 176.35 174.14 1ii7 s HIS 173 N -2.40 3.30 0.02 0.29 5.65 -1.26 -1.96 115.29 118.94 1ii7 s HIS 173 Ca -0.03 -2.98 -0.20 0.00 0.25 0.00 0.00 55.06 52.10 1ii7 s HIS 173 Cb -0.03 -2.98 0.04 0.00 -1.18 0.00 0.00 32.58 28.43 1ii7 s HIS 173 CO -0.03 -0.79 0.44 -1.14 -0.65 0.00 0.00 174.74 172.57 1ii7 s GLN 174 N -0.14 0.90 -0.14 2.88 2.00 -0.69 -4.25 119.66 120.23 1ii7 s GLN 174 Ca 0.17 -0.23 -0.19 0.00 -2.00 0.00 0.00 55.36 53.11 1ii7 s GLN 174 Cb -0.23 0.41 -0.04 0.00 0.80 0.00 0.00 33.01 33.95 1ii7 s GLN 174 CO -0.02 -0.30 0.51 0.20 -0.50 0.00 0.00 175.29 175.19 1ii7 s GLY 175 N -1.76 2.32 -0.21 2.59 0.00 -1.26 -4.65 107.32 104.35 1ii7 s GLY 175 Ca -0.08 -0.21 -0.12 0.00 0.00 0.00 0.00 44.72 44.31 1ii7 s GLY 175 CO 0.01 0.91 0.22 0.14 0.00 0.00 0.00 173.10 174.37 1ii7 s VAL 176 N 0.94 5.33 0.16 1.40 1.01 -1.26 -1.34 120.40 126.65 1ii7 s VAL 176 Ca 0.27 0.33 -0.30 0.00 0.00 0.00 0.00 61.98 62.28 1ii7 s VAL 176 Cb -0.15 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1ii7 s VAL 176 CO 0.11 0.36 1.54 -0.09 0.00 0.00 0.00 175.10 177.02 1ii7 h ARG 177 N 7.16 -0.09 -0.21 2.72 2.43 -0.80 -0.12 114.38 125.47 1ii7 h ARG 177 Ca -0.39 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 58.85 1ii7 h ARG 177 Cb 1.16 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 1ii7 h ARG 177 CO 0.71 -0.06 0.17 1.05 -1.51 0.00 0.00 179.97 180.33 1ii7 h GLU 178 N -0.09 0.00 0.09 0.20 9.09 -1.96 -0.17 114.58 121.74 1ii7 h GLU 178 Ca 0.16 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.42 1ii7 h GLU 178 Cb 0.48 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.59 1ii7 h GLU 178 CO -0.86 0.00 -0.66 0.28 0.05 0.00 0.00 179.01 177.82 1ii7 h VAL 179 N 0.00 1.52 -0.15 -1.06 2.07 -1.45 -2.30 116.25 114.89 1ii7 h VAL 179 Ca 0.10 -2.38 -0.11 0.00 0.82 0.00 0.00 66.70 65.13 1ii7 h VAL 179 Cb 0.43 3.05 -0.01 0.00 -1.52 0.00 0.00 31.29 33.24 1ii7 h VAL 179 CO -0.00 0.67 -0.38 0.77 0.02 0.00 0.00 177.57 178.65 1ii7 h SER 180 N -0.37 0.33 -0.18 0.57 4.64 -1.12 -2.47 113.55 114.95 1ii7 h SER 180 Ca -0.11 -0.13 -0.06 0.00 -0.47 0.00 0.00 61.79 61.02 1ii7 h SER 180 Cb 1.47 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 63.45 1ii7 h SER 180 CO 0.13 0.69 -0.08 -0.08 -0.87 0.00 0.00 176.83 176.61 1ii7 h GLU 181 N 0.27 0.52 0.00 4.77 4.81 -1.09 0.12 114.58 123.98 1ii7 h GLU 181 Ca 0.03 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1ii7 h GLU 181 Cb 0.79 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.11 1ii7 h GLU 181 CO 0.06 0.60 0.00 0.00 -0.73 0.00 0.00 179.01 178.94 1ii7 n ALA 182 N -2.48 1.95 -2.56 2.92 0.00 -0.86 -2.51 120.51 116.96 1ii7 n ALA 182 Ca 0.01 -0.05 0.03 0.00 0.00 0.00 0.00 53.44 53.43 1ii7 n ALA 182 Cb 0.29 -1.12 0.03 0.00 0.00 0.00 0.00 19.45 18.65 1ii7 n ALA 182 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ii7 n ARG 183 N -0.79 0.39 -0.99 0.00 1.74 -0.46 -4.98 116.66 111.57 1ii7 n ARG 183 Ca 0.06 -2.33 0.00 0.00 -0.77 0.00 0.00 57.85 54.80 1ii7 n ARG 183 Cb 0.03 -0.36 0.00 0.00 -1.02 0.00 0.00 32.46 31.11 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 0.25 0.04 3.92 -0.13 0.00 -1.05 -4.96 105.19 103.27 1ii7 n GLY 184 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.84 3.44 -0.01 1.61 0.41 -0.10 -5.00 118.70 117.23 1ii7 s GLU 185 Ca 0.00 -0.08 0.01 0.00 -0.41 0.00 0.00 54.97 54.49 1ii7 s GLU 185 Cb 0.00 -2.50 0.02 0.00 -1.78 0.00 0.00 34.13 29.87 1ii7 s GLU 185 CO 0.00 -0.10 0.79 -0.40 -0.49 0.00 0.00 175.26 175.06 1ii7 n ASP 186 N -2.08 1.05 -4.69 -0.19 5.75 -1.26 -3.61 116.55 111.51 1ii7 n ASP 186 Ca -0.01 -1.64 -0.37 0.00 -0.01 0.00 0.00 54.79 52.76 1ii7 n ASP 186 Cb 0.56 -0.04 -0.07 0.00 -1.03 0.00 0.00 41.12 40.54 1ii7 n ASP 186 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 1ii7 s TYR 187 N -0.63 3.41 -0.25 2.11 -0.85 -1.26 -5.04 117.35 114.84 1ii7 s TYR 187 Ca 0.02 0.59 -0.35 0.00 -0.52 0.00 0.00 57.07 56.80 1ii7 s TYR 187 Cb 0.02 -2.44 0.16 0.00 0.38 0.00 0.00 41.96 40.07 1ii7 s TYR 187 CO 0.00 0.09 1.31 -0.59 -1.52 0.00 0.00 175.55 174.84 1ii7 s PHE 188 N 0.95 -0.07 -0.05 -3.49 -0.12 -1.26 -4.67 117.98 109.27 1ii7 s PHE 188 Ca 0.17 0.06 0.06 0.00 -0.05 0.00 0.00 56.93 57.17 1ii7 s PHE 188 Cb -0.14 0.50 -0.08 0.00 -0.63 0.00 0.00 43.02 42.67 1ii7 s PHE 188 CO 0.06 -0.10 0.14 0.39 -0.05 0.00 0.00 175.22 175.67 1ii7 n GLU 189 N 0.08 0.97 -4.20 1.99 4.71 -0.45 -4.90 120.64 118.85 1ii7 n GLU 189 Ca 0.02 -0.04 -0.16 0.00 -0.01 0.00 0.00 57.16 56.97 1ii7 n GLU 189 Cb 0.57 -1.08 -0.07 0.00 -1.01 0.00 0.00 31.44 29.86 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 -2.25 0.00 0.29 -3.67 -4.36 -1.18 -4.82 121.20 105.20 1ii7 s ILE 190 Ca -0.01 -1.86 0.08 0.00 -0.26 0.00 0.00 60.65 58.60 1ii7 s ILE 190 Cb 0.04 -2.52 -0.06 0.00 1.25 0.00 0.00 42.46 41.17 1ii7 s ILE 190 CO 0.23 0.00 -0.08 -0.83 0.24 0.00 0.00 174.94 174.50 1ii7 s GLY 191 N -3.27 1.90 0.48 6.27 0.00 -1.26 -0.09 107.32 111.34 1ii7 s GLY 191 Ca 0.37 -1.93 0.17 0.00 0.00 0.00 0.00 44.72 43.32 1ii7 s GLY 191 CO 0.21 -1.89 2.03 1.41 0.00 0.00 0.00 173.10 174.86 1ii7 h LEU 192 N 2.23 0.19 -1.97 0.66 3.38 -1.98 -1.57 115.31 116.25 1ii7 h LEU 192 Ca -0.40 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.56 1ii7 h LEU 192 Cb 1.24 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 1ii7 h LEU 192 CO 0.67 0.12 -0.05 1.23 0.09 0.00 0.00 178.44 180.50 1ii7 h GLY 193 N 0.21 0.00 2.00 0.83 0.00 -2.02 -1.90 103.07 102.20 1ii7 h GLY 193 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.49 1ii7 h GLY 193 CO -0.03 0.00 -0.16 -0.55 0.00 0.00 0.00 176.54 175.80 1ii7 h ASP 194 N 0.00 0.00 -3.72 0.19 3.32 -1.69 -3.45 116.42 111.08 1ii7 h ASP 194 Ca -0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1ii7 h ASP 194 Cb 0.34 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.94 1ii7 h ASP 194 CO 0.01 0.16 0.61 -0.76 -1.72 0.00 0.00 179.24 177.53 1ii7 s LEU 195 N -6.42 4.45 0.29 1.55 1.43 -0.71 -4.18 118.68 115.10 1ii7 s LEU 195 Ca 0.03 2.51 -0.29 0.00 -1.03 0.00 0.00 54.13 55.36 1ii7 s LEU 195 Cb 0.08 -3.63 -0.09 0.00 0.03 0.00 0.00 46.19 42.57 1ii7 s LEU 195 CO 0.65 -0.45 1.09 -2.16 0.23 0.00 0.00 176.35 175.71 1ii7 s PRO 196 N -1.22 4.59 0.70 1.29 0.04 -1.26 -4.94 135.00 134.19 1ii7 s PRO 196 Ca 0.50 1.76 -0.11 0.00 0.04 0.00 0.00 61.00 63.19 1ii7 s PRO 196 Cb -0.37 -3.11 0.01 0.00 0.04 0.00 0.00 34.50 31.06 1ii7 s PRO 196 CO 0.46 0.18 1.08 -1.21 0.04 0.00 0.00 177.00 177.54 1ii7 s GLU 197 N -1.56 2.95 0.00 4.56 2.02 -1.26 -4.33 118.70 121.07 1ii7 s GLU 197 Ca 0.46 0.59 0.00 0.00 0.02 0.00 0.00 54.97 56.04 1ii7 s GLU 197 Cb -0.31 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 31.90 1ii7 s GLU 197 CO 0.39 -1.00 0.00 0.41 0.02 0.00 0.00 175.26 175.08 1ii7 n GLY 198 N -2.76 1.06 3.79 -1.39 0.00 -1.26 -4.62 105.19 100.01 1ii7 n GLY 198 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.24 3.34 -1.06 1.61 1.51 -1.26 -4.78 117.35 114.46 1ii7 s TYR 199 Ca 0.00 1.66 0.28 0.00 -1.01 0.00 0.00 57.07 58.00 1ii7 s TYR 199 Cb 0.00 -3.01 1.00 0.00 -0.11 0.00 0.00 41.96 39.85 1ii7 s TYR 199 CO 0.00 -0.34 1.76 1.28 -1.11 0.00 0.00 175.55 177.13 1ii7 n LEU 200 N -0.19 0.20 -3.64 -1.29 4.77 0.16 -4.70 117.00 112.31 1ii7 n LEU 200 Ca 0.05 0.29 -0.04 0.00 -0.03 0.00 0.00 56.01 56.29 1ii7 n LEU 200 Cb 0.51 -0.39 -0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1ii7 n LEU 200 CO 0.42 0.05 0.75 -0.47 -1.33 0.00 0.00 177.39 176.81 1ii7 s TYR 201 N -2.95 -0.47 -0.45 -1.77 5.04 -1.25 -4.34 117.35 111.15 1ii7 s TYR 201 Ca 0.15 1.00 -0.06 0.00 -2.44 0.00 0.00 57.07 55.72 1ii7 s TYR 201 Cb 0.19 0.34 0.12 0.00 0.35 0.00 0.00 41.96 42.95 1ii7 s TYR 201 CO 0.58 -0.23 0.29 0.71 -1.34 0.00 0.00 175.55 175.55 1ii7 s TYR 202 N 0.90 3.51 -0.57 4.97 1.51 -0.32 -1.60 117.35 125.75 1ii7 s TYR 202 Ca -0.04 -2.18 -0.23 0.00 -1.01 0.00 0.00 57.07 53.61 1ii7 s TYR 202 Cb -0.04 -3.36 0.05 0.00 -0.11 0.00 0.00 41.96 38.51 1ii7 s TYR 202 CO -0.12 -0.98 0.87 0.00 -1.11 0.00 0.00 175.55 174.22 1ii7 s ALA 203 N 1.17 3.20 0.47 3.71 0.00 0.41 -1.49 121.76 129.23 1ii7 s ALA 203 Ca 0.08 -1.53 0.07 0.00 0.00 0.00 0.00 51.96 50.58 1ii7 s ALA 203 Cb -0.24 -3.68 0.01 0.00 0.00 0.00 0.00 23.12 19.20 1ii7 s ALA 203 CO -0.03 -2.41 0.45 -0.51 0.00 0.00 0.00 175.76 173.26 1ii7 s LEU 204 N 3.67 3.21 0.17 0.00 1.43 -0.08 -2.33 118.68 124.75 1ii7 s LEU 204 Ca 0.24 -0.86 -0.20 0.00 -1.03 0.00 0.00 54.13 52.29 1ii7 s LEU 204 Cb -0.15 -1.83 0.05 0.00 0.03 0.00 0.00 46.19 44.29 1ii7 s LEU 204 CO 0.15 -0.85 0.54 -0.83 0.23 0.00 0.00 176.35 175.59 1ii7 s GLY 205 N -4.24 -0.35 0.00 -3.19 0.00 -0.83 -4.18 107.32 94.53 1ii7 s GLY 205 Ca 0.47 0.10 0.00 0.00 0.00 0.00 0.00 44.72 45.29 1ii7 s GLY 205 CO 0.28 -0.09 0.00 1.57 0.00 0.00 0.00 173.10 174.86 1ii7 n HIS 206 N -0.34 0.00 -3.05 1.90 -0.00 -1.26 -1.70 115.22 110.77 1ii7 n HIS 206 Ca -0.14 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.18 1ii7 n HIS 206 Cb 0.64 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.58 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 5.00 -0.10 3.57 1.01 -1.26 -4.98 121.20 124.44 1ii7 s ILE 207 Ca 0.00 1.38 0.24 0.00 0.00 0.00 0.00 60.65 62.27 1ii7 s ILE 207 Cb 0.00 -4.02 0.27 0.00 0.01 0.00 0.00 42.46 38.72 1ii7 s ILE 207 CO 0.00 0.15 1.73 0.45 0.00 0.00 0.00 174.94 177.27 1ii7 h HIS 208 N 7.14 0.00 -3.78 3.97 3.86 -1.97 -3.32 115.15 121.05 1ii7 h HIS 208 Ca -0.35 0.00 -0.64 0.00 -1.16 0.00 0.00 60.37 58.22 1ii7 h HIS 208 Cb 1.16 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 29.47 1ii7 h HIS 208 CO 0.69 0.16 -0.36 0.15 0.86 0.00 0.00 177.93 179.42 1ii7 s LYS 209 N -3.39 3.89 0.71 2.45 1.02 -1.26 -1.38 119.74 121.78 1ii7 s LYS 209 Ca 0.03 -0.20 -0.17 0.00 0.02 0.00 0.00 55.97 55.66 1ii7 s LYS 209 Cb 0.08 -3.69 -0.07 0.00 -0.52 0.00 0.00 37.83 33.63 1ii7 s LYS 209 CO 0.65 -0.29 0.25 2.89 -0.92 0.00 0.00 175.35 177.93 1ii7 n ARG 210 N 5.23 0.21 -3.63 1.68 1.85 -1.26 -4.69 116.66 116.04 1ii7 n ARG 210 Ca -0.11 0.10 -0.11 0.00 -1.00 0.00 0.00 57.85 56.73 1ii7 n ARG 210 Cb 0.51 -1.57 -0.07 0.00 -1.05 0.00 0.00 32.46 30.28 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 -1.94 -0.75 -0.07 2.89 5.04 -0.45 -4.94 117.35 117.13 1ii7 s TYR 211 Ca 0.61 1.75 0.02 0.00 -2.44 0.00 0.00 57.07 57.01 1ii7 s TYR 211 Cb -0.36 0.36 0.01 0.00 0.35 0.00 0.00 41.96 42.32 1ii7 s TYR 211 CO 0.62 -0.37 -0.12 -2.00 -1.34 0.00 0.00 175.55 172.35 1ii7 s GLU 212 N 0.61 1.70 0.00 4.97 2.12 -1.26 -0.98 118.70 125.85 1ii7 s GLU 212 Ca -0.01 -0.40 0.00 0.00 0.36 0.00 0.00 54.97 54.92 1ii7 s GLU 212 Cb -0.05 -1.45 0.00 0.00 0.26 0.00 0.00 34.13 32.89 1ii7 s GLU 212 CO -0.05 -0.02 0.00 -2.37 -0.54 0.00 0.00 175.26 172.28 1ii7 n THR 213 N 3.98 0.00 -3.91 -1.70 5.66 -0.45 -4.99 114.28 112.87 1ii7 n THR 213 Ca -0.21 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.69 1ii7 n THR 213 Cb 0.51 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.24 1ii7 n THR 213 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1ii7 s SER 214 N 1.15 -0.10 -0.28 1.09 1.04 -1.26 -1.19 113.70 114.14 1ii7 s SER 214 Ca 0.00 -0.78 -0.15 0.00 0.48 0.00 0.00 55.95 55.50 1ii7 s SER 214 Cb 0.00 0.54 0.10 0.00 0.10 0.00 0.00 66.02 66.76 1ii7 s SER 214 CO 0.00 -1.04 0.74 -0.47 0.98 0.00 0.00 173.24 173.45 1ii7 s TYR 215 N -3.96 -1.00 -1.41 5.02 5.04 -0.54 -4.83 117.35 115.67 1ii7 s TYR 215 Ca 0.17 1.96 -0.01 0.00 -2.44 0.00 0.00 57.07 56.75 1ii7 s TYR 215 Cb 0.00 0.60 0.01 0.00 0.35 0.00 0.00 41.96 42.92 1ii7 s TYR 215 CO 0.03 -0.50 0.50 -1.13 -1.34 0.00 0.00 175.55 173.11 1ii7 n SER 216 N 4.34 -0.71 -0.01 4.32 3.41 -1.26 -2.09 113.62 121.63 1ii7 n SER 216 Ca -0.19 -0.97 -0.00 0.00 -0.26 0.00 0.00 58.87 57.45 1ii7 n SER 216 Cb 0.58 -3.25 -0.00 0.00 -0.26 0.00 0.00 64.21 61.28 1ii7 n SER 216 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ii7 n GLY 217 N -1.88 0.30 3.24 5.00 0.00 -1.26 -4.72 105.19 105.87 1ii7 n GLY 217 Ca -0.28 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.01 1.75 0.43 1.61 0.01 -0.89 -5.08 113.70 109.52 1ii7 s SER 218 Ca 0.00 -0.98 -0.25 0.00 1.31 0.00 0.00 55.95 56.03 1ii7 s SER 218 Cb 0.00 -0.01 -0.08 0.00 0.21 0.00 0.00 66.02 66.14 1ii7 s SER 218 CO 0.00 -0.32 1.26 -2.84 0.41 0.00 0.00 173.24 171.75 1ii7 s PRO 219 N -3.59 3.83 -0.23 12.44 0.02 -1.26 -1.46 135.00 144.74 1ii7 s PRO 219 Ca 0.15 2.03 0.02 0.00 0.02 0.00 0.00 61.00 63.22 1ii7 s PRO 219 Cb 0.02 -2.60 0.05 0.00 0.02 0.00 0.00 34.50 31.99 1ii7 s PRO 219 CO 0.00 -0.57 -0.10 0.08 -0.33 0.00 0.00 177.00 176.08 1ii7 s VAL 220 N -1.35 1.89 -0.04 3.83 1.01 -0.33 -1.18 120.40 124.22 1ii7 s VAL 220 Ca 0.60 -1.34 0.05 0.00 0.00 0.00 0.00 61.98 61.29 1ii7 s VAL 220 Cb -0.35 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 1ii7 s VAL 220 CO 0.44 0.04 -0.18 -0.69 0.00 0.00 0.00 175.10 174.72 1ii7 s VAL 221 N 1.25 1.46 -0.30 2.92 1.01 -0.55 -1.33 120.40 124.86 1ii7 s VAL 221 Ca -0.05 -0.75 -0.05 0.00 0.00 0.00 0.00 61.98 61.13 1ii7 s VAL 221 Cb -0.18 -1.25 0.03 0.00 0.00 0.00 0.00 36.38 34.97 1ii7 s VAL 221 CO -0.07 0.42 0.06 -0.31 0.00 0.00 0.00 175.10 175.20 1ii7 s TYR 222 N -0.05 3.19 -0.48 5.22 1.51 -0.16 -0.91 117.35 125.67 1ii7 s TYR 222 Ca -0.02 -1.33 0.26 0.00 -1.01 0.00 0.00 57.07 54.97 1ii7 s TYR 222 Cb -0.11 -2.22 0.94 0.00 -0.11 0.00 0.00 41.96 40.46 1ii7 s TYR 222 CO 0.02 -0.68 1.76 -1.00 -1.11 0.00 0.00 175.55 174.54 1ii7 h PRO 223 N 8.17 0.00 -0.52 -1.71 0.13 -1.84 -1.19 132.00 135.03 1ii7 h PRO 223 Ca -0.27 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.91 1ii7 h PRO 223 Cb 1.10 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 1ii7 h PRO 223 CO 0.59 0.00 -0.14 0.41 -0.23 0.00 0.00 178.00 178.63 1ii7 n GLY 224 N 0.47 -2.09 3.79 1.56 0.00 -1.25 -4.28 105.19 103.39 1ii7 n GLY 224 Ca 0.03 -1.43 -0.31 0.00 0.00 0.00 0.00 46.02 44.31 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 -5.30 4.81 0.11 1.61 1.04 -0.48 -4.40 113.70 111.09 1ii7 s SER 225 Ca 0.00 1.74 0.12 0.00 0.48 0.00 0.00 55.95 58.30 1ii7 s SER 225 Cb 0.00 -2.50 -0.13 0.00 0.10 0.00 0.00 66.02 63.49 1ii7 s SER 225 CO 0.00 -1.83 1.09 -0.07 0.98 0.00 0.00 173.24 173.41 1ii7 h LEU 226 N -0.99 0.00 -9.20 2.42 3.38 -1.78 -3.37 115.31 105.77 1ii7 h LEU 226 Ca -0.44 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 56.86 1ii7 h LEU 226 Cb 1.22 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.80 1ii7 h LEU 226 CO 0.53 0.77 -0.74 -1.61 0.09 0.00 0.00 178.44 177.48 1ii7 s GLU 227 N -2.80 2.20 0.21 1.13 0.41 -1.26 -4.48 118.70 114.11 1ii7 s GLU 227 Ca -0.00 -0.96 -0.32 0.00 -0.41 0.00 0.00 54.97 53.28 1ii7 s GLU 227 Cb 0.09 -2.33 -0.12 0.00 -1.78 0.00 0.00 34.13 29.99 1ii7 s GLU 227 CO 0.80 0.53 1.66 0.54 -0.49 0.00 0.00 175.26 178.31 1ii7 n ARG 228 N 1.02 2.59 0.06 1.61 1.74 -1.26 -4.91 116.66 117.50 1ii7 n ARG 228 Ca -0.14 0.93 -0.21 0.00 -0.77 0.00 0.00 57.85 57.66 1ii7 n ARG 228 Cb 0.52 -2.75 -0.15 0.00 -1.02 0.00 0.00 32.46 29.07 1ii7 n ARG 228 CO 0.00 0.00 0.00 2.35 -1.52 0.00 0.00 177.63 178.46 1ii7 h TRP 229 N 6.26 0.60 -2.10 -1.55 2.91 -1.93 -3.50 115.95 116.64 1ii7 h TRP 229 Ca -0.44 -0.44 -0.00 0.00 1.13 0.00 0.00 58.89 59.14 1ii7 h TRP 229 Cb 1.22 -0.02 0.00 0.00 -0.51 0.00 0.00 29.16 29.85 1ii7 h TRP 229 CO 0.63 1.42 0.04 -0.40 -1.03 0.00 0.00 178.44 179.09 1ii7 n ASP 230 N -4.00 -0.30 0.08 2.65 3.85 -1.26 -5.01 116.55 112.56 1ii7 n ASP 230 Ca -0.17 -1.20 0.12 0.00 -0.71 0.00 0.00 54.79 52.83 1ii7 n ASP 230 Cb 0.89 0.49 0.46 0.00 -1.35 0.00 0.00 41.12 41.61 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 -0.07 0.59 0.32 2.11 3.01 -1.26 -1.04 117.46 121.12 1ii7 n PHE 231 Ca -0.01 0.20 0.14 0.00 1.01 0.00 0.00 57.45 58.79 1ii7 n PHE 231 Cb 0.08 -0.82 0.45 0.00 -0.01 0.00 0.00 39.48 39.17 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 3.56 0.00 -4.16 1.37 0.00 -2.01 -2.98 103.07 98.86 1ii7 h GLY 232 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 1ii7 h GLY 232 CO 0.00 0.00 0.79 1.34 0.00 0.00 0.00 176.54 178.67 1ii7 n ASP 233 N -2.87 7.33 -4.76 0.19 4.64 -0.20 -5.01 116.55 115.87 1ii7 n ASP 233 Ca 0.03 -3.61 -0.33 0.00 -1.38 0.00 0.00 54.79 49.49 1ii7 n ASP 233 Cb 0.39 -1.04 0.06 0.00 -1.04 0.00 0.00 41.12 39.49 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 -3.31 2.48 0.04 -0.67 -0.85 -1.13 -4.68 117.35 109.23 1ii7 s TYR 234 Ca 0.55 1.56 -0.14 0.00 -0.52 0.00 0.00 57.07 58.53 1ii7 s TYR 234 Cb 0.43 -3.25 -0.34 0.00 0.38 0.00 0.00 41.96 39.19 1ii7 s TYR 234 CO -0.11 -1.90 1.03 1.49 -1.52 0.00 0.00 175.55 174.54 1ii7 h GLU 235 N 0.01 0.52 -2.91 -3.49 4.81 -1.32 -3.26 114.58 108.94 1ii7 h GLU 235 Ca -0.47 -0.86 -0.15 0.00 -0.13 0.00 0.00 59.36 57.75 1ii7 h GLU 235 Cb 1.26 0.32 -0.26 0.00 0.63 0.00 0.00 28.75 30.70 1ii7 h GLU 235 CO 0.53 1.41 -0.35 0.08 -0.73 0.00 0.00 179.01 179.95 1ii7 s VAL 236 N -2.66 -0.01 -0.17 0.32 1.01 -1.22 -1.67 120.40 116.01 1ii7 s VAL 236 Ca -0.08 0.03 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 1ii7 s VAL 236 Cb 0.05 -0.47 -0.02 0.00 0.00 0.00 0.00 36.38 35.94 1ii7 s VAL 236 CO 0.94 0.01 -0.08 -0.60 0.00 0.00 0.00 175.10 175.38 1ii7 s ARG 237 N 0.48 3.45 -0.13 2.72 3.52 0.18 -1.44 118.95 127.74 1ii7 s ARG 237 Ca -0.02 -0.62 -0.02 0.00 -0.13 0.00 0.00 55.73 54.93 1ii7 s ARG 237 Cb -0.04 -2.84 -0.03 0.00 -1.56 0.00 0.00 34.95 30.48 1ii7 s ARG 237 CO -0.02 0.07 -0.04 0.71 -0.81 0.00 0.00 175.30 175.20 1ii7 s TYR 238 N 0.78 3.03 -0.06 5.12 1.51 0.13 -1.39 117.35 126.45 1ii7 s TYR 238 Ca -0.03 -0.15 0.02 0.00 -1.01 0.00 0.00 57.07 55.90 1ii7 s TYR 238 Cb -0.15 -1.88 0.02 0.00 -0.11 0.00 0.00 41.96 39.84 1ii7 s TYR 238 CO 0.02 0.12 -0.11 -2.00 -1.11 0.00 0.00 175.55 172.47 1ii7 s GLU 239 N -0.09 1.56 -0.11 -0.62 2.12 -0.52 0.26 118.70 121.29 1ii7 s GLU 239 Ca 0.02 -0.36 -0.30 0.00 0.36 0.00 0.00 54.97 54.70 1ii7 s GLU 239 Cb -0.13 -1.33 -0.02 0.00 0.26 0.00 0.00 34.13 32.91 1ii7 s GLU 239 CO 0.03 -0.01 1.19 -0.46 -0.54 0.00 0.00 175.26 175.47 1ii7 s TRP 240 N 0.76 3.13 -2.26 5.30 -0.11 -0.43 0.92 118.94 126.25 1ii7 s TRP 240 Ca -0.13 1.21 0.21 0.00 1.22 0.00 0.00 56.10 58.61 1ii7 s TRP 240 Cb -0.15 -3.41 0.33 0.00 -1.50 0.00 0.00 33.47 28.74 1ii7 s TRP 240 CO 0.03 -1.25 1.29 -0.40 -4.62 0.00 0.00 176.95 172.00 1ii7 n ASP 241 N 5.69 3.15 0.00 5.86 3.85 0.19 -4.81 116.55 130.49 1ii7 n ASP 241 Ca 0.12 -1.92 0.00 0.00 -0.71 0.00 0.00 54.79 52.27 1ii7 n ASP 241 Cb 0.46 -0.18 0.00 0.00 -1.35 0.00 0.00 41.12 40.05 1ii7 n ASP 241 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ii7 n GLY 242 N 1.27 2.42 0.00 6.12 0.00 -1.26 -4.74 105.19 109.00 1ii7 n GLY 242 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.62 0.00 -4.16 -0.61 5.41 -1.26 -5.07 119.36 113.05 1ii7 n ILE 243 Ca 0.00 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.65 1ii7 n ILE 243 Cb 0.00 -0.04 -0.10 0.00 -0.71 0.00 0.00 39.64 38.79 1ii7 n ILE 243 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1ii7 s LYS 244 N -1.04 0.97 -0.28 0.38 2.20 -1.26 -5.11 119.74 115.60 1ii7 s LYS 244 Ca 0.00 -1.47 -0.11 0.00 -0.36 0.00 0.00 55.97 54.03 1ii7 s LYS 244 Cb 0.00 0.20 -0.05 0.00 -1.51 0.00 0.00 37.83 36.47 1ii7 s LYS 244 CO 0.00 -0.26 0.20 -0.06 -0.36 0.00 0.00 175.35 174.87 1ii7 s PHE 245 N -4.03 3.22 0.19 4.03 0.40 -1.26 0.56 117.98 121.10 1ii7 s PHE 245 Ca 0.26 0.14 -0.30 0.00 -0.60 0.00 0.00 56.93 56.43 1ii7 s PHE 245 Cb 0.07 -2.39 -0.08 0.00 0.51 0.00 0.00 43.02 41.13 1ii7 s PHE 245 CO 0.03 -0.16 1.01 0.21 0.70 0.00 0.00 175.22 177.01 1ii7 s LYS 246 N 1.76 4.72 -0.08 0.44 2.20 0.26 -4.79 119.74 124.26 1ii7 s LYS 246 Ca 0.08 1.57 -0.01 0.00 -0.36 0.00 0.00 55.97 57.25 1ii7 s LYS 246 Cb -0.16 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 32.83 1ii7 s LYS 246 CO 0.11 0.28 -0.02 -1.21 -0.36 0.00 0.00 175.35 174.15 1ii7 s GLU 247 N -0.64 2.92 -0.13 4.03 2.02 -1.26 -1.44 118.70 124.20 1ii7 s GLU 247 Ca 0.45 -0.45 -0.02 0.00 0.02 0.00 0.00 54.97 54.97 1ii7 s GLU 247 Cb -0.27 -2.74 0.04 0.00 0.10 0.00 0.00 34.13 31.27 1ii7 s GLU 247 CO 0.33 0.69 0.02 1.03 0.02 0.00 0.00 175.26 177.36 1ii7 s ARG 248 N -0.89 0.59 0.20 1.61 1.81 -0.49 -4.99 118.95 116.79 1ii7 s ARG 248 Ca 0.13 -0.13 -0.14 0.00 -1.72 0.00 0.00 55.73 53.88 1ii7 s ARG 248 Cb -0.11 -1.52 -0.07 0.00 -0.45 0.00 0.00 34.95 32.79 1ii7 s ARG 248 CO 0.02 -0.47 0.59 0.71 -0.68 0.00 0.00 175.30 175.47 1ii7 s TYR 249 N 1.94 3.53 0.00 -0.53 1.51 -1.26 0.51 117.35 123.05 1ii7 s TYR 249 Ca 0.02 1.06 0.00 0.00 -1.01 0.00 0.00 57.07 57.14 1ii7 s TYR 249 Cb -0.15 -2.38 0.00 0.00 -0.11 0.00 0.00 41.96 39.32 1ii7 s TYR 249 CO -0.07 0.33 0.00 0.41 -1.11 0.00 0.00 175.55 175.11 1ii7 n GLY 250 N 0.37 1.18 3.89 0.71 0.00 -0.67 -4.93 105.19 105.74 1ii7 n GLY 250 Ca -0.02 -1.95 -0.31 0.00 0.00 0.00 0.00 46.02 43.74 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 1.19 4.98 0.89 1.61 -7.23 -1.26 -4.97 120.40 115.61 1ii7 s VAL 251 Ca 0.00 0.31 -0.12 0.00 -1.81 0.00 0.00 61.98 60.36 1ii7 s VAL 251 Cb 0.00 -3.65 0.12 0.00 0.56 0.00 0.00 36.38 33.41 1ii7 s VAL 251 CO 0.00 -0.14 1.10 0.20 -0.31 0.00 0.00 175.10 175.95 1ii7 s ASN 252 N -2.61 3.63 0.02 4.85 0.01 -1.26 -4.87 114.94 114.71 1ii7 s ASN 252 Ca 0.46 1.32 0.06 0.00 -0.71 0.00 0.00 52.86 53.99 1ii7 s ASN 252 Cb -0.11 -2.00 -0.03 0.00 0.41 0.00 0.00 41.25 39.52 1ii7 s ASN 252 CO 0.24 -2.52 -0.17 -0.54 -1.51 0.00 0.00 177.10 172.60 1ii7 s LYS 253 N -5.05 2.17 0.00 -0.60 -0.14 -1.26 -4.77 119.74 110.10 1ii7 s LYS 253 Ca 0.63 -0.92 0.00 0.00 -1.36 0.00 0.00 55.97 54.32 1ii7 s LYS 253 Cb -0.17 -2.23 0.00 0.00 -1.68 0.00 0.00 37.83 33.75 1ii7 s LYS 253 CO 0.56 0.56 0.00 0.41 -0.76 0.00 0.00 175.35 176.12 1ii7 n GLY 254 N 1.72 -0.65 1.80 -3.33 0.00 -1.26 -0.76 105.19 102.72 1ii7 n GLY 254 Ca -0.16 -0.40 -0.06 0.00 0.00 0.00 0.00 46.02 45.40 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 2.42 -1.33 -5.03 1.61 1.16 -0.69 -4.51 117.46 111.09 1ii7 n PHE 255 Ca 0.00 -1.06 -0.30 0.00 -1.87 0.00 0.00 57.45 54.21 1ii7 n PHE 255 Cb 0.00 0.38 -0.15 0.00 -1.61 0.00 0.00 39.48 38.09 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 -4.79 2.31 -0.18 2.97 1.51 -0.94 -0.75 117.35 117.48 1ii7 s TYR 256 Ca 0.11 -0.42 -0.04 0.00 -1.01 0.00 0.00 57.07 55.71 1ii7 s TYR 256 Cb -0.02 -1.42 -0.02 0.00 -0.11 0.00 0.00 41.96 40.40 1ii7 s TYR 256 CO 0.08 0.07 -0.04 0.42 -1.11 0.00 0.00 175.55 174.98 1ii7 s ILE 257 N -0.74 3.74 -0.18 2.71 1.01 -0.32 0.14 121.20 127.57 1ii7 s ILE 257 Ca 0.11 -0.40 -0.01 0.00 0.00 0.00 0.00 60.65 60.35 1ii7 s ILE 257 Cb -0.10 -2.66 -0.00 0.00 0.01 0.00 0.00 42.46 39.71 1ii7 s ILE 257 CO 0.01 0.46 -0.11 -0.69 0.00 0.00 0.00 174.94 174.61 1ii7 s VAL 258 N 0.75 2.92 -0.08 2.92 1.01 0.92 0.08 120.40 128.92 1ii7 s VAL 258 Ca -0.01 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.32 1ii7 s VAL 258 Cb -0.14 -2.27 0.01 0.00 0.00 0.00 0.00 36.38 33.98 1ii7 s VAL 258 CO 0.02 0.49 -0.15 -0.70 0.00 0.00 0.00 175.10 174.76 1ii7 s GLU 259 N 1.05 2.03 -1.53 2.72 2.12 -0.94 -0.85 118.70 123.31 1ii7 s GLU 259 Ca -0.00 -0.52 -0.05 0.00 0.36 0.00 0.00 54.97 54.75 1ii7 s GLU 259 Cb -0.15 -1.65 0.01 0.00 0.26 0.00 0.00 34.13 32.60 1ii7 s GLU 259 CO -0.02 0.04 0.59 -0.25 -0.54 0.00 0.00 175.26 175.08 1ii7 n ASP 260 N 3.84 -5.85 -1.42 -1.70 10.43 -0.76 -1.52 116.55 119.57 1ii7 n ASP 260 Ca -0.21 -0.30 -0.19 0.00 2.57 0.00 0.00 54.79 56.66 1ii7 n ASP 260 Cb 0.52 -4.74 -0.08 0.00 1.84 0.00 0.00 41.12 38.66 1ii7 n ASP 260 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 1ii7 n PHE 261 N -4.45 0.00 -3.69 1.24 3.01 -1.26 -4.95 117.46 107.36 1ii7 n PHE 261 Ca -0.10 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 57.97 1ii7 n PHE 261 Cb 0.61 -3.26 -0.12 0.00 -0.01 0.00 0.00 39.48 36.71 1ii7 n PHE 261 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1ii7 s LYS 262 N -3.57 2.77 0.15 -1.08 2.20 -0.58 -4.70 119.74 114.95 1ii7 s LYS 262 Ca 0.00 -1.09 -0.30 0.00 -0.36 0.00 0.00 55.97 54.22 1ii7 s LYS 262 Cb 0.00 -3.55 -0.07 0.00 -1.51 0.00 0.00 37.83 32.70 1ii7 s LYS 262 CO 0.00 -0.65 1.02 -1.25 -0.36 0.00 0.00 175.35 174.12 1ii7 s PRO 263 N 1.48 4.67 -0.16 4.03 0.04 -1.26 -2.22 135.00 141.58 1ii7 s PRO 263 Ca 0.00 1.57 0.01 0.00 0.04 0.00 0.00 61.00 62.63 1ii7 s PRO 263 Cb -0.19 -3.32 0.02 0.00 0.04 0.00 0.00 34.50 31.05 1ii7 s PRO 263 CO 0.04 0.18 -0.17 0.50 0.04 0.00 0.00 177.00 177.59 1ii7 s ARG 264 N -0.28 2.63 0.13 4.56 3.52 0.11 -4.97 118.95 124.65 1ii7 s ARG 264 Ca 0.47 -0.69 -0.30 0.00 -0.13 0.00 0.00 55.73 55.08 1ii7 s ARG 264 Cb -0.26 -2.31 -0.07 0.00 -1.56 0.00 0.00 34.95 30.75 1ii7 s ARG 264 CO 0.32 -0.20 1.22 0.12 -0.81 0.00 0.00 175.30 175.95 1ii7 s PHE 265 N 1.34 3.41 -0.24 5.12 5.36 -1.26 -1.17 117.98 130.53 1ii7 s PHE 265 Ca 0.04 1.32 0.01 0.00 -0.96 0.00 0.00 56.93 57.34 1ii7 s PHE 265 Cb -0.13 -3.46 0.04 0.00 -0.34 0.00 0.00 43.02 39.13 1ii7 s PHE 265 CO -0.11 -1.38 -0.11 0.08 -1.46 0.00 0.00 175.22 172.25 1ii7 s VAL 266 N 0.47 2.40 0.21 3.12 1.01 0.07 -4.94 120.40 122.73 1ii7 s VAL 266 Ca 0.56 -1.31 -0.22 0.00 0.00 0.00 0.00 61.98 61.01 1ii7 s VAL 266 Cb -0.32 -2.28 -0.08 0.00 0.00 0.00 0.00 36.38 33.70 1ii7 s VAL 266 CO 0.33 0.14 0.76 -0.70 0.00 0.00 0.00 175.10 175.64 1ii7 s GLU 267 N 1.21 4.41 -0.15 2.72 2.12 -1.26 -1.70 118.70 126.05 1ii7 s GLU 267 Ca -0.03 1.03 0.00 0.00 0.36 0.00 0.00 54.97 56.33 1ii7 s GLU 267 Cb -0.18 -3.02 0.03 0.00 0.26 0.00 0.00 34.13 31.22 1ii7 s GLU 267 CO -0.06 0.45 -0.12 0.42 -0.54 0.00 0.00 175.26 175.42 1ii7 s ILE 268 N -1.38 1.45 0.08 -3.70 1.01 0.06 -4.95 121.20 113.77 1ii7 s ILE 268 Ca 0.41 -0.63 -0.31 0.00 0.00 0.00 0.00 60.65 60.12 1ii7 s ILE 268 Cb -0.19 -1.42 -0.08 0.00 0.01 0.00 0.00 42.46 40.78 1ii7 s ILE 268 CO 0.23 0.37 1.48 -0.54 0.00 0.00 0.00 174.94 176.49 1ii7 s LYS 269 N 1.53 4.27 0.21 2.79 1.02 -1.26 -4.50 119.74 123.79 1ii7 s LYS 269 Ca 0.04 2.15 0.02 0.00 0.02 0.00 0.00 55.97 58.20 1ii7 s LYS 269 Cb -0.13 -3.39 -0.05 0.00 -0.52 0.00 0.00 37.83 33.73 1ii7 s LYS 269 CO -0.10 -0.57 0.02 0.08 -0.92 0.00 0.00 175.35 173.87 1ii7 s VAL 270 N 1.78 0.79 0.20 3.17 1.01 -1.26 -5.12 120.40 120.98 1ii7 s VAL 270 Ca 0.67 -2.00 -0.32 0.00 0.00 0.00 0.00 61.98 60.33 1ii7 s VAL 270 Cb -0.37 -2.31 -0.14 0.00 0.00 0.00 0.00 36.38 33.56 1ii7 s VAL 270 CO 0.30 -0.32 1.33 -1.14 0.00 0.00 0.00 175.10 175.27 1ii7 n ARG 271 N -0.35 1.70 -2.77 2.72 0.63 -1.26 -4.94 116.66 112.39 1ii7 n ARG 271 Ca -0.05 0.61 -0.34 0.00 -0.92 0.00 0.00 57.85 57.15 1ii7 n ARG 271 Cb 0.64 -2.21 -0.06 0.00 0.45 0.00 0.00 32.46 31.27 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 -0.27 4.27 -0.11 -0.14 0.04 -1.26 -4.83 135.00 132.70 1ii7 s PRO 272 Ca 0.71 1.21 0.03 0.00 0.04 0.00 0.00 61.00 63.00 1ii7 s PRO 272 Cb -0.73 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 31.47 1ii7 s PRO 272 CO 0.50 -0.00 -0.23 -0.06 0.04 0.00 0.00 177.00 177.25 1ii7 s PHE 273 N -2.01 2.60 -0.14 0.56 0.40 -1.26 -1.72 117.98 116.42 1ii7 s PHE 273 Ca 0.60 -1.08 0.01 0.00 -0.60 0.00 0.00 56.93 55.86 1ii7 s PHE 273 Cb -0.13 -1.74 -0.00 0.00 0.51 0.00 0.00 43.02 41.66 1ii7 s PHE 273 CO 0.17 -0.45 -0.18 0.42 0.70 0.00 0.00 175.22 175.89 1ii7 s ILE 274 N 0.44 2.50 -0.12 0.64 -1.09 0.29 -0.83 121.20 123.04 1ii7 s ILE 274 Ca -0.16 -0.84 -0.04 0.00 -2.23 0.00 0.00 60.65 57.38 1ii7 s ILE 274 Cb -0.17 -2.03 -0.04 0.00 -1.58 0.00 0.00 42.46 38.64 1ii7 s ILE 274 CO 0.06 0.53 0.03 -0.62 -1.23 0.00 0.00 174.94 173.72 1ii7 s ASP 275 N 0.69 5.45 -0.04 3.58 3.68 -0.52 -1.58 116.67 127.93 1ii7 s ASP 275 Ca -0.08 0.14 0.03 0.00 2.13 0.00 0.00 52.55 54.77 1ii7 s ASP 275 Cb -0.16 -1.72 0.01 0.00 -1.45 0.00 0.00 42.92 39.60 1ii7 s ASP 275 CO 0.02 0.31 -0.12 -0.69 0.13 0.00 0.00 175.17 174.82 1ii7 s VAL 276 N -0.44 1.01 -0.14 1.11 1.01 0.16 0.17 120.40 123.27 1ii7 s VAL 276 Ca 0.09 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.63 1ii7 s VAL 276 Cb -0.12 -0.90 0.01 0.00 0.00 0.00 0.00 36.38 35.37 1ii7 s VAL 276 CO 0.02 0.31 -0.20 -0.75 0.00 0.00 0.00 175.10 174.48 1ii7 s LYS 277 N 0.31 2.86 -0.05 2.72 2.20 0.14 -0.44 119.74 127.48 1ii7 s LYS 277 Ca -0.06 -0.79 -0.02 0.00 -0.36 0.00 0.00 55.97 54.73 1ii7 s LYS 277 Cb -0.11 -2.37 0.03 0.00 -1.51 0.00 0.00 37.83 33.87 1ii7 s LYS 277 CO 0.02 -0.07 0.11 0.42 -0.36 0.00 0.00 175.35 175.46 1ii7 s ILE 278 N 0.97 -0.05 0.06 5.43 1.01 -0.91 -1.31 121.20 126.39 1ii7 s ILE 278 Ca -0.04 0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.83 1ii7 s ILE 278 Cb -0.15 -0.18 -0.03 0.00 0.01 0.00 0.00 42.46 42.11 1ii7 s ILE 278 CO -0.05 0.07 -0.13 -0.75 0.00 0.00 0.00 174.94 174.09 1ii7 s LYS 279 N 1.03 0.78 0.00 2.79 2.20 -1.26 -1.29 119.74 123.99 1ii7 s LYS 279 Ca -0.08 -0.85 0.00 0.00 -0.36 0.00 0.00 55.97 54.68 1ii7 s LYS 279 Cb -0.11 -0.75 0.00 0.00 -1.51 0.00 0.00 37.83 35.46 1ii7 s LYS 279 CO -0.05 0.17 0.00 0.41 -0.36 0.00 0.00 175.35 175.52 1ii7 n GLY 280 N 1.52 0.90 3.84 5.54 0.00 -0.47 -4.79 105.19 111.73 1ii7 n GLY 280 Ca -0.20 -1.95 -0.30 0.00 0.00 0.00 0.00 46.02 43.56 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 -4.00 4.98 0.25 1.61 1.04 -1.26 -3.30 113.70 113.01 1ii7 s SER 281 Ca 0.00 1.29 -0.04 0.00 0.48 0.00 0.00 55.95 57.68 1ii7 s SER 281 Cb 0.00 -2.07 0.42 0.00 0.10 0.00 0.00 66.02 64.47 1ii7 s SER 281 CO 0.00 -1.66 1.80 -0.08 0.98 0.00 0.00 173.24 174.29 1ii7 h GLU 282 N -0.87 0.75 -0.29 4.02 4.81 -1.96 0.23 114.58 121.27 1ii7 h GLU 282 Ca -0.46 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.72 1ii7 h GLU 282 Cb 1.25 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 1ii7 h GLU 282 CO 0.61 0.49 0.16 1.05 -0.73 0.00 0.00 179.01 180.59 1ii7 h GLU 283 N 0.77 0.41 -0.68 1.92 9.09 -1.99 0.17 114.58 124.26 1ii7 h GLU 283 Ca 0.41 -0.05 -0.01 0.00 0.05 0.00 0.00 59.36 59.76 1ii7 h GLU 283 Cb 0.41 -0.08 -0.03 0.00 -1.65 0.00 0.00 28.75 27.39 1ii7 h GLU 283 CO -0.26 0.35 0.39 1.49 0.05 0.00 0.00 179.01 181.03 1ii7 h GLU 284 N 0.36 0.93 -0.65 1.06 4.57 -1.63 -1.57 114.58 117.65 1ii7 h GLU 284 Ca 0.10 -0.09 -0.03 0.00 -1.18 0.00 0.00 59.36 58.16 1ii7 h GLU 284 Cb 0.06 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.43 1ii7 h GLU 284 CO -0.02 0.68 0.28 0.82 -1.18 0.00 0.00 179.01 179.59 1ii7 h ILE 285 N 0.92 1.22 -0.59 2.32 2.04 0.01 -1.16 117.51 122.27 1ii7 h ILE 285 Ca 0.24 -0.67 -0.10 0.00 1.00 0.00 0.00 64.86 65.34 1ii7 h ILE 285 Cb -0.00 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 1ii7 h ILE 285 CO -0.04 0.27 -0.01 -0.09 0.00 0.00 0.00 178.15 178.27 1ii7 h ARG 286 N 0.93 1.04 0.02 2.37 2.43 -0.15 0.18 114.38 121.21 1ii7 h ARG 286 Ca 0.22 -0.33 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1ii7 h ARG 286 Cb 0.15 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1ii7 h ARG 286 CO -0.02 1.02 -0.04 -0.22 -1.51 0.00 0.00 179.97 179.21 1ii7 h LYS 287 N 0.95 -0.07 -0.18 0.20 3.64 -0.80 -2.07 116.57 118.24 1ii7 h LYS 287 Ca 0.17 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1ii7 h LYS 287 Cb 0.57 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 1ii7 h LYS 287 CO 0.03 -0.05 0.09 0.00 -2.27 0.00 0.00 179.45 177.26 1ii7 h ALA 288 N 0.90 0.23 -0.59 5.00 0.00 -0.99 -2.79 119.26 121.01 1ii7 h ALA 288 Ca 0.01 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.94 1ii7 h ALA 288 Cb 0.08 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1ii7 h ALA 288 CO -0.02 -0.23 0.40 0.82 0.00 0.00 0.00 179.25 180.22 1ii7 h ILE 289 N 0.18 0.92 -0.50 0.00 1.08 -0.85 -0.23 117.51 118.11 1ii7 h ILE 289 Ca 0.06 -0.15 -0.12 0.00 -0.39 0.00 0.00 64.86 64.26 1ii7 h ILE 289 Cb 0.09 0.43 -0.02 0.00 -3.07 0.00 0.00 36.82 34.25 1ii7 h ILE 289 CO -0.01 0.08 -0.16 0.50 -0.69 0.00 0.00 178.15 177.87 1ii7 h LYS 290 N 0.45 0.97 0.00 2.37 3.64 -1.11 -2.18 116.57 120.70 1ii7 h LYS 290 Ca 0.27 -0.38 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1ii7 h LYS 290 Cb 0.47 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1ii7 h LYS 290 CO -0.08 1.05 -0.01 0.00 -2.27 0.00 0.00 179.45 178.14 1ii7 h ARG 291 N 0.85 0.00 0.12 1.90 3.08 -0.94 -3.23 114.38 116.17 1ii7 h ARG 291 Ca 0.12 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.88 1ii7 h ARG 291 Cb 0.72 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.79 1ii7 h ARG 291 CO 0.05 0.01 -1.24 1.25 -1.07 0.00 0.00 179.97 178.98 1ii7 h LEU 292 N 0.00 0.80 -0.99 3.04 5.85 -0.71 -3.37 115.31 119.94 1ii7 h LEU 292 Ca -0.00 -0.75 0.22 0.00 0.84 0.00 0.00 57.88 58.19 1ii7 h LEU 292 Cb 0.77 -0.25 -0.19 0.00 0.37 0.00 0.00 40.66 41.36 1ii7 h LEU 292 CO 0.00 1.56 -0.16 0.40 -0.34 0.00 0.00 178.44 179.91 1ii7 h ILE 293 N 0.24 0.01 0.00 4.05 1.08 -1.42 0.43 117.51 121.91 1ii7 h ILE 293 Ca -0.18 -0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.29 1ii7 h ILE 293 Cb 1.92 0.01 0.00 0.00 -3.07 0.00 0.00 36.82 35.68 1ii7 h ILE 293 CO 0.23 0.00 0.00 -0.81 -0.69 0.00 0.00 178.15 176.88 1ii7 n PRO 294 N -5.58 0.17 0.12 2.37 -0.04 -1.26 -2.99 135.00 127.79 1ii7 n PRO 294 Ca 0.18 0.35 0.12 0.00 -0.04 0.00 0.00 63.50 64.11 1ii7 n PRO 294 Cb 0.58 -1.80 0.20 0.00 -0.04 0.00 0.00 33.50 32.45 1ii7 n PRO 294 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1ii7 h LEU 295 N 0.00 0.00 -8.89 1.53 3.38 -0.33 -3.45 115.31 107.54 1ii7 h LEU 295 Ca 0.00 -0.07 -0.64 0.00 0.09 0.00 0.00 57.88 57.26 1ii7 h LEU 295 Cb 0.42 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.01 1ii7 h LEU 295 CO 0.00 0.03 -0.38 -0.63 0.09 0.00 0.00 178.44 177.55 1ii7 s ILE 296 N -3.19 5.24 0.44 1.22 1.01 -1.16 -5.08 121.20 119.68 1ii7 s ILE 296 Ca 0.06 0.30 -0.23 0.00 0.00 0.00 0.00 60.65 60.79 1ii7 s ILE 296 Cb 0.10 -3.63 -0.08 0.00 0.01 0.00 0.00 42.46 38.86 1ii7 s ILE 296 CO 0.69 0.17 1.08 -2.16 0.00 0.00 0.00 174.94 174.71 1ii7 s PRO 297 N 1.91 3.96 0.37 2.79 0.04 -1.26 -4.93 135.00 137.87 1ii7 s PRO 297 Ca 0.11 1.54 0.10 0.00 0.04 0.00 0.00 61.00 62.79 1ii7 s PRO 297 Cb -0.16 -2.39 0.86 0.00 0.04 0.00 0.00 34.50 32.85 1ii7 s PRO 297 CO 0.11 -0.33 1.87 -0.22 0.04 0.00 0.00 177.00 178.47 1ii7 h LYS 298 N 2.13 0.63 0.00 4.56 3.64 -1.97 -1.72 116.57 123.84 1ii7 h LYS 298 Ca -0.49 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 1ii7 h LYS 298 Cb 1.23 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1ii7 h LYS 298 CO 0.61 0.41 0.00 0.27 -2.27 0.00 0.00 179.45 178.47 1ii7 n ASN 299 N -4.55 0.00 -4.82 4.20 6.94 -1.26 -3.03 115.26 112.73 1ii7 n ASN 299 Ca 0.17 -1.28 -0.32 0.00 -0.02 0.00 0.00 54.58 53.13 1ii7 n ASN 299 Cb 0.49 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.91 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 -2.00 2.83 -0.14 -2.53 0.00 -0.65 -4.67 121.76 114.60 1ii7 s ALA 300 Ca 0.33 0.28 -0.05 0.00 0.00 0.00 0.00 51.96 52.52 1ii7 s ALA 300 Cb 0.15 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 1ii7 s ALA 300 CO 0.25 -0.72 0.04 0.71 0.00 0.00 0.00 175.76 176.04 1ii7 s TYR 301 N -2.61 3.24 -0.01 0.00 1.51 -0.70 -3.52 117.35 115.25 1ii7 s TYR 301 Ca 0.61 0.13 0.04 0.00 -1.01 0.00 0.00 57.07 56.84 1ii7 s TYR 301 Cb -0.14 -1.94 -0.01 0.00 -0.11 0.00 0.00 41.96 39.76 1ii7 s TYR 301 CO 0.39 0.32 -0.13 0.08 -1.11 0.00 0.00 175.55 175.10 1ii7 s VAL 302 N -0.26 1.01 -0.10 0.71 1.01 0.47 -0.55 120.40 122.69 1ii7 s VAL 302 Ca 0.07 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 61.55 1ii7 s VAL 302 Cb -0.12 -0.85 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 1ii7 s VAL 302 CO 0.02 0.29 -0.22 -0.60 0.00 0.00 0.00 175.10 174.59 1ii7 s ARG 303 N -0.22 3.02 -0.17 2.72 3.52 -0.61 0.08 118.95 127.29 1ii7 s ARG 303 Ca 0.03 -0.84 -0.01 0.00 -0.13 0.00 0.00 55.73 54.78 1ii7 s ARG 303 Cb -0.06 -2.34 -0.01 0.00 -1.56 0.00 0.00 34.95 30.98 1ii7 s ARG 303 CO -0.00 0.23 -0.12 -0.51 -0.81 0.00 0.00 175.30 174.09 1ii7 s LEU 304 N 0.23 2.64 -0.36 -0.88 1.43 0.60 -0.67 118.68 121.67 1ii7 s LEU 304 Ca -0.14 -0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 52.45 1ii7 s LEU 304 Cb -0.17 -1.62 0.03 0.00 0.03 0.00 0.00 46.19 44.46 1ii7 s LEU 304 CO 0.07 0.07 0.16 0.20 0.23 0.00 0.00 176.35 177.09 1ii7 s ASN 305 N 0.90 5.56 -0.20 2.29 -0.87 0.41 -0.11 114.94 122.92 1ii7 s ASN 305 Ca -0.03 -1.02 -0.03 0.00 -1.57 0.00 0.00 52.86 50.20 1ii7 s ASN 305 Cb -0.15 -1.96 -0.01 0.00 -0.02 0.00 0.00 41.25 39.11 1ii7 s ASN 305 CO -0.01 -0.35 -0.06 -0.63 -2.57 0.00 0.00 177.10 173.49 1ii7 s ILE 306 N 1.50 3.39 -0.48 0.60 1.01 0.12 -2.15 121.20 125.19 1ii7 s ILE 306 Ca 0.01 -0.50 -0.16 0.00 0.00 0.00 0.00 60.65 59.99 1ii7 s ILE 306 Cb -0.19 -2.52 0.07 0.00 0.01 0.00 0.00 42.46 39.84 1ii7 s ILE 306 CO 0.05 0.45 0.45 -0.83 0.00 0.00 0.00 174.94 175.06 1ii7 s GLY 307 N 1.13 2.00 0.15 6.18 0.00 -0.41 -1.02 107.32 115.34 1ii7 s GLY 307 Ca 0.02 -2.07 0.05 0.00 0.00 0.00 0.00 44.72 42.72 1ii7 s GLY 307 CO -0.01 1.14 0.09 0.66 0.00 0.00 0.00 173.10 174.98 1ii7 s TRP 308 N 1.83 3.07 0.02 1.90 -2.14 -0.82 -1.36 118.94 121.44 1ii7 s TRP 308 Ca 0.06 -0.03 -0.24 0.00 2.66 0.00 0.00 56.10 58.55 1ii7 s TRP 308 Cb -0.24 -1.50 -0.17 0.00 -3.10 0.00 0.00 33.47 28.46 1ii7 s TRP 308 CO 0.07 0.52 1.41 -0.09 -2.66 0.00 0.00 176.95 176.20 1ii7 h ARG 309 N 2.66 0.07 -3.52 3.25 2.43 -1.88 -2.57 114.38 114.81 1ii7 h ARG 309 Ca -0.47 -0.03 -0.18 0.00 -0.81 0.00 0.00 59.98 58.49 1ii7 h ARG 309 Cb 1.19 -0.00 -0.24 0.00 -0.42 0.00 0.00 29.97 30.50 1ii7 h ARG 309 CO 0.62 0.40 -0.56 -1.59 -1.51 0.00 0.00 179.97 177.33 1ii7 s LYS 310 N -4.81 0.27 0.48 0.20 -2.85 -1.26 -4.57 119.74 107.20 1ii7 s LYS 310 Ca -0.15 -0.10 -0.24 0.00 -1.00 0.00 0.00 55.97 54.48 1ii7 s LYS 310 Cb 0.04 0.12 -0.08 0.00 -2.06 0.00 0.00 37.83 35.85 1ii7 s LYS 310 CO 0.68 -0.05 1.31 -0.35 0.10 0.00 0.00 175.35 177.04 1ii7 n PRO 311 N 2.34 1.84 -4.15 1.78 -0.04 -1.26 -4.93 135.00 130.58 1ii7 n PRO 311 Ca -0.17 0.66 -0.16 0.00 -0.04 0.00 0.00 63.50 63.80 1ii7 n PRO 311 Cb 0.57 -2.47 -0.06 0.00 -0.04 0.00 0.00 33.50 31.50 1ii7 n PRO 311 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1ii7 s PHE 312 N -1.25 1.26 -0.02 0.54 -0.71 -1.26 -5.12 117.98 111.42 1ii7 s PHE 312 Ca 0.65 -1.39 -0.30 0.00 -1.04 0.00 0.00 56.93 54.85 1ii7 s PHE 312 Cb -0.46 -0.30 -0.06 0.00 -1.21 0.00 0.00 43.02 40.99 1ii7 s PHE 312 CO 0.54 -1.02 1.63 0.34 -1.34 0.00 0.00 175.22 175.37 1ii7 s ASP 313 N -3.27 6.68 0.00 1.98 3.68 -1.26 -4.89 116.67 119.59 1ii7 s ASP 313 Ca 0.34 2.27 0.21 0.00 2.13 0.00 0.00 52.55 57.50 1ii7 s ASP 313 Cb 0.01 -2.54 0.71 0.00 -1.45 0.00 0.00 42.92 39.65 1ii7 s ASP 313 CO 0.22 -0.89 1.53 0.18 0.13 0.00 0.00 175.17 176.33 1ii7 n LEU 314 N 6.65 1.87 -0.31 -1.34 4.77 -1.26 -4.35 117.00 123.02 1ii7 n LEU 314 Ca 0.17 -0.78 -0.04 0.00 -0.03 0.00 0.00 56.01 55.33 1ii7 n LEU 314 Cb 0.42 -0.12 0.08 0.00 -2.33 0.00 0.00 43.42 41.48 1ii7 n LEU 314 CO 0.62 0.39 1.21 0.74 -1.33 0.00 0.00 177.39 179.02 1ii7 h THR 315 N 2.50 1.23 0.72 -5.08 2.02 -1.99 -0.95 112.91 111.35 1ii7 h THR 315 Ca 0.00 -0.47 -0.04 0.00 0.77 0.00 0.00 66.41 66.68 1ii7 h THR 315 Cb 0.55 0.01 0.01 0.00 -1.74 0.00 0.00 68.15 66.98 1ii7 h THR 315 CO 0.00 0.23 -0.35 -0.08 0.37 0.00 0.00 175.52 175.70 1ii7 h GLU 316 N 1.16 -0.93 -0.38 6.66 4.81 -1.99 -1.48 114.58 122.42 1ii7 h GLU 316 Ca 0.31 0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.67 1ii7 h GLU 316 Cb -0.08 0.21 -0.06 0.00 0.63 0.00 0.00 28.75 29.45 1ii7 h GLU 316 CO -0.06 -0.60 0.04 0.82 -0.73 0.00 0.00 179.01 178.47 1ii7 h ILE 317 N -1.03 0.76 -0.50 2.32 2.04 -1.83 -0.06 117.51 119.22 1ii7 h ILE 317 Ca -0.10 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 65.74 1ii7 h ILE 317 Cb 0.76 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 1ii7 h ILE 317 CO 0.16 0.03 0.28 0.11 0.00 0.00 0.00 178.15 178.73 1ii7 h LYS 318 N 0.15 0.54 0.00 2.37 1.57 -1.09 -2.15 116.57 117.95 1ii7 h LYS 318 Ca 0.19 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 1ii7 h LYS 318 Cb 0.24 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1ii7 h LYS 318 CO -0.28 0.36 -0.08 0.93 -0.57 0.00 0.00 179.45 179.81 1ii7 h GLU 319 N 0.56 0.00 -0.08 3.15 5.08 -0.90 -2.97 114.58 119.42 1ii7 h GLU 319 Ca 0.21 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.37 1ii7 h GLU 319 Cb 0.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 1ii7 h GLU 319 CO -0.11 0.08 -0.76 -0.07 -1.00 0.00 0.00 179.01 177.15 1ii7 h LEU 320 N 0.00 0.55 -8.53 1.33 3.38 -0.40 -3.41 115.31 108.24 1ii7 h LEU 320 Ca -0.00 -0.37 -0.60 0.00 0.09 0.00 0.00 57.88 56.99 1ii7 h LEU 320 Cb 0.78 -0.16 -0.12 0.00 0.09 0.00 0.00 40.66 41.25 1ii7 h LEU 320 CO 0.01 1.12 0.59 -0.76 0.09 0.00 0.00 178.44 179.50 1ii7 s LEU 321 N -7.99 4.04 -1.21 1.67 1.43 -0.91 -4.95 118.68 110.75 1ii7 s LEU 321 Ca -0.06 -0.23 -0.08 0.00 -1.03 0.00 0.00 54.13 52.72 1ii7 s LEU 321 Cb 0.10 -2.92 0.21 0.00 0.03 0.00 0.00 46.19 43.61 1ii7 s LEU 321 CO 0.85 -1.21 1.69 -0.46 0.23 0.00 0.00 176.35 177.45 1ii7 n ASN 322 N 7.47 5.50 -4.52 2.29 6.94 -1.26 -4.92 115.26 126.75 1ii7 n ASN 322 Ca 0.03 -3.18 -0.27 0.00 -0.02 0.00 0.00 54.58 51.14 1ii7 n ASN 322 Cb 0.48 -1.42 -0.10 0.00 -2.36 0.00 0.00 39.78 36.37 1ii7 n ASN 322 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1ii7 s VAL 323 N -0.48 2.91 0.50 3.53 -7.23 -1.26 -4.74 120.40 113.64 1ii7 s VAL 323 Ca 0.37 -1.78 0.18 0.00 -1.81 0.00 0.00 61.98 58.94 1ii7 s VAL 323 Cb 0.06 -2.43 0.26 0.00 0.56 0.00 0.00 36.38 34.83 1ii7 s VAL 323 CO 0.03 -0.11 2.11 -0.33 -0.31 0.00 0.00 175.10 176.49 1ii7 h GLU 324 N 3.00 0.00 -2.53 4.82 5.08 -1.58 -3.42 114.58 119.96 1ii7 h GLU 324 Ca -0.47 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.80 1ii7 h GLU 324 Cb 1.21 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.20 1ii7 h GLU 324 CO 0.52 0.06 -0.26 -0.47 -1.00 0.00 0.00 179.01 177.87 1ii7 s TYR 325 N -4.81 -0.70 -0.07 4.33 5.04 -1.25 -5.06 117.35 114.82 1ii7 s TYR 325 Ca -0.05 1.45 -0.00 0.00 -2.44 0.00 0.00 57.07 56.03 1ii7 s TYR 325 Cb 0.16 0.33 0.02 0.00 0.35 0.00 0.00 41.96 42.83 1ii7 s TYR 325 CO 0.65 -0.39 -0.03 -1.17 -1.34 0.00 0.00 175.55 173.27 1ii7 s LEU 326 N 1.60 0.98 -0.06 6.97 2.96 -1.26 -0.40 118.68 129.48 1ii7 s LEU 326 Ca -0.09 -0.15 0.03 0.00 -0.22 0.00 0.00 54.13 53.71 1ii7 s LEU 326 Cb -0.08 -0.53 -0.03 0.00 0.50 0.00 0.00 46.19 46.05 1ii7 s LEU 326 CO -0.14 -0.12 -0.13 -0.75 -1.32 0.00 0.00 176.35 173.89 1ii7 s LYS 327 N 1.52 2.57 -0.14 1.98 2.20 0.11 -4.98 119.74 123.00 1ii7 s LYS 327 Ca -0.01 -0.67 -0.00 0.00 -0.36 0.00 0.00 55.97 54.93 1ii7 s LYS 327 Cb -0.13 -2.43 0.03 0.00 -1.51 0.00 0.00 37.83 33.79 1ii7 s LYS 327 CO -0.04 0.62 -0.10 0.42 -0.36 0.00 0.00 175.35 175.89 1ii7 s ILE 328 N -0.72 1.32 0.00 5.43 1.01 -1.26 -0.29 121.20 126.68 1ii7 s ILE 328 Ca 0.11 -0.55 0.03 0.00 0.00 0.00 0.00 60.65 60.23 1ii7 s ILE 328 Cb -0.11 -1.32 -0.03 0.00 0.01 0.00 0.00 42.46 41.01 1ii7 s ILE 328 CO 0.01 0.34 -0.05 -1.81 0.00 0.00 0.00 174.94 173.43 1ii7 s ASP 329 N 1.58 4.74 0.02 3.58 -0.00 0.84 -4.97 116.67 122.46 1ii7 s ASP 329 Ca 0.04 -0.11 -0.00 0.00 -0.00 0.00 0.00 52.55 52.47 1ii7 s ASP 329 Cb -0.13 -1.14 -0.02 0.00 -0.00 0.00 0.00 42.92 41.63 1ii7 s ASP 329 CO -0.09 0.28 -0.03 0.42 -0.00 0.00 0.00 175.17 175.76 1ii7 s THR 330 N -1.01 0.10 -0.07 -1.27 -4.23 -1.26 0.14 115.64 108.03 1ii7 s THR 330 Ca 0.17 -0.82 -0.10 0.00 -1.18 0.00 0.00 61.69 59.76 1ii7 s THR 330 Cb -0.11 -0.23 0.02 0.00 1.34 0.00 0.00 72.50 73.52 1ii7 s THR 330 CO 0.08 -0.45 0.26 -1.66 -0.54 0.00 0.00 174.62 172.31 1ii7 s TRP 331 N -1.31 -0.24 0.26 3.99 1.48 -0.19 -4.93 118.94 117.99 1ii7 s TRP 331 Ca -0.14 0.54 -0.29 0.00 -1.06 0.00 0.00 56.10 55.15 1ii7 s TRP 331 Cb -0.09 0.08 -0.09 0.00 -1.16 0.00 0.00 33.47 32.21 1ii7 s TRP 331 CO -0.01 -0.21 0.93 1.03 -4.06 0.00 0.00 176.95 174.64 1ii7 s ARG 332 N -0.32 4.77 0.00 3.25 0.52 -1.26 -1.95 118.95 123.96 1ii7 s ARG 332 Ca -0.04 1.43 0.23 0.00 -0.52 0.00 0.00 55.73 56.83 1ii7 s ARG 332 Cb -0.03 -3.16 1.40 0.00 0.52 0.00 0.00 34.95 33.68 1ii7 s ARG 332 CO 0.01 0.46 1.77 -0.89 0.02 0.00 0.00 175.30 176.67