#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3is7 s ASP 4 N 0.00 6.87 0.15 1.61 2.15 -1.26 -4.94 116.67 121.26 3is7 s ASP 4 Ca 0.00 2.42 -0.15 0.00 0.43 0.00 0.00 52.55 55.24 3is7 s ASP 4 Cb 0.00 -2.61 0.02 0.00 -0.30 0.00 0.00 42.92 40.03 3is7 s ASP 4 CO 0.00 -0.55 1.76 0.50 -0.17 0.00 0.00 175.17 176.71 3is7 h LYS 5 N 5.41 0.62 0.00 4.34 3.64 -1.99 0.28 116.57 128.87 3is7 h LYS 5 Ca -0.45 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 58.76 3is7 h LYS 5 Cb 1.21 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 3is7 h LYS 5 CO 0.78 0.49 -0.49 0.87 -2.27 0.00 0.00 179.45 178.83 3is7 h LYS 6 N 0.58 0.00 -0.23 1.90 1.57 -1.99 -1.53 116.57 116.87 3is7 h LYS 6 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 3is7 h LYS 6 Cb 0.05 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3is7 h LYS 6 CO -0.03 0.49 0.15 0.28 -0.57 0.00 0.00 179.45 179.78 3is7 h VAL 7 N 0.00 1.08 -0.62 0.50 2.07 -1.73 -1.41 116.25 116.14 3is7 h VAL 7 Ca -0.00 -0.16 0.03 0.00 0.82 0.00 0.00 66.70 67.38 3is7 h VAL 7 Cb 1.14 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 3is7 h VAL 7 CO 0.06 0.07 0.37 0.40 0.02 0.00 0.00 177.57 178.50 3is7 h ILE 8 N 0.30 1.06 -0.43 4.57 2.04 -0.71 -0.72 117.51 123.62 3is7 h ILE 8 Ca 0.08 -0.25 0.01 0.00 1.00 0.00 0.00 64.86 65.71 3is7 h ILE 8 Cb -0.01 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.31 3is7 h ILE 8 CO -0.02 0.13 0.27 1.56 0.00 0.00 0.00 178.15 180.09 3is7 h GLN 9 N 0.73 0.53 -0.66 2.37 4.20 -1.19 -0.64 115.11 120.45 3is7 h GLN 9 Ca 0.25 -0.03 0.05 0.00 0.06 0.00 0.00 58.65 58.98 3is7 h GLN 9 Cb 0.04 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.65 3is7 h GLN 9 CO -0.11 0.35 0.37 0.45 -0.67 0.00 0.00 178.83 179.22 3is7 h HIS 10 N 0.54 0.68 -0.50 2.96 3.86 -0.76 -1.27 115.15 120.66 3is7 h HIS 10 Ca 0.17 0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.33 3is7 h HIS 10 Cb -0.02 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.22 3is7 h HIS 10 CO -0.06 0.33 0.02 -0.07 0.86 0.00 0.00 177.93 179.01 3is7 h LEU 11 N 0.69 0.78 -1.18 2.43 3.38 -0.55 0.34 115.31 121.20 3is7 h LEU 11 Ca 0.29 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 3is7 h LEU 11 Cb 0.16 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3is7 h LEU 11 CO -0.17 0.84 -0.37 0.78 0.09 0.00 0.00 178.44 179.61 3is7 h ASN 12 N 0.76 0.00 0.06 -0.43 2.35 -0.93 -0.71 115.58 116.68 3is7 h ASN 12 Ca 0.15 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.66 3is7 h ASN 12 Cb 0.44 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.82 3is7 h ASN 12 CO 0.02 0.37 -0.91 0.50 -1.65 0.00 0.00 177.43 175.75 3is7 h LYS 13 N 0.00 0.64 -0.46 0.81 3.64 0.07 0.12 116.57 121.39 3is7 h LYS 13 Ca -0.00 -0.62 -0.05 0.00 -1.27 0.00 0.00 60.65 58.71 3is7 h LYS 13 Cb 0.75 0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.71 3is7 h LYS 13 CO 0.05 1.22 0.10 0.82 -2.27 0.00 0.00 179.45 179.37 3is7 h ILE 14 N 0.39 1.24 -0.18 2.00 1.08 -0.61 -2.24 117.51 119.18 3is7 h ILE 14 Ca -0.09 -0.86 0.05 0.00 -0.39 0.00 0.00 64.86 63.58 3is7 h ILE 14 Cb 1.55 0.92 -0.06 0.00 -3.07 0.00 0.00 36.82 36.16 3is7 h ILE 14 CO 0.18 0.30 -0.17 0.25 -0.69 0.00 0.00 178.15 178.02 3is7 h LEU 15 N 0.61 -0.55 -0.78 1.44 5.85 -1.07 -0.53 115.31 120.29 3is7 h LEU 15 Ca 0.14 0.10 0.18 0.00 0.84 0.00 0.00 57.88 59.15 3is7 h LEU 15 Cb 0.35 0.26 -0.12 0.00 0.37 0.00 0.00 40.66 41.52 3is7 h LEU 15 CO 0.00 -0.22 0.18 1.23 -0.34 0.00 0.00 178.44 179.30 3is7 h GLY 16 N -0.19 1.11 1.01 3.75 0.00 -0.79 0.30 103.07 108.26 3is7 h GLY 16 Ca 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.40 3is7 h GLY 16 CO -0.29 -0.25 0.33 3.43 0.00 0.00 0.00 176.54 179.75 3is7 h ASN 17 N 0.24 0.89 -0.68 0.19 2.35 -0.71 -2.59 115.58 115.28 3is7 h ASN 17 Ca 0.46 -0.13 -0.06 0.00 -0.55 0.00 0.00 56.30 56.02 3is7 h ASN 17 Cb 0.82 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.94 3is7 h ASN 17 CO -0.57 0.77 0.20 -0.33 -1.65 0.00 0.00 177.43 175.85 3is7 h GLU 18 N 0.95 1.08 -0.29 0.81 4.39 0.65 -1.93 114.58 120.23 3is7 h GLU 18 Ca 0.24 -0.24 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 3is7 h GLU 18 Cb 0.11 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 3is7 h GLU 18 CO -0.03 0.93 -0.10 -0.07 -1.16 0.00 0.00 179.01 178.59 3is7 h LEU 19 N 1.03 0.46 -0.27 1.33 3.38 -0.28 -0.13 115.31 120.83 3is7 h LEU 19 Ca 0.22 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.98 3is7 h LEU 19 Cb 0.32 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 3is7 h LEU 19 CO -0.00 0.60 -0.23 0.40 0.09 0.00 0.00 178.44 179.30 3is7 h ILE 20 N 0.45 1.31 -0.61 1.22 2.04 -1.13 -3.18 117.51 117.61 3is7 h ILE 20 Ca 0.09 -1.37 -0.08 0.00 1.00 0.00 0.00 64.86 64.49 3is7 h ILE 20 Cb 0.44 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 3is7 h ILE 20 CO 0.02 0.43 0.05 0.00 0.00 0.00 0.00 178.15 178.66 3is7 h ALA 21 N 0.70 0.94 -0.30 1.87 0.00 -0.70 0.44 119.26 122.21 3is7 h ALA 21 Ca 0.05 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.74 3is7 h ALA 21 Cb 0.78 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 3is7 h ALA 21 CO 0.06 0.65 -0.11 0.82 0.00 0.00 0.00 179.25 180.67 3is7 h ILE 22 N 0.95 0.63 -0.03 0.00 2.04 -1.08 0.15 117.51 120.18 3is7 h ILE 22 Ca 0.18 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.92 3is7 h ILE 22 Cb 0.48 0.63 0.01 0.00 -0.74 0.00 0.00 36.82 37.20 3is7 h ILE 22 CO 0.02 0.00 -0.47 0.78 0.00 0.00 0.00 178.15 178.48 3is7 h ASN 23 N -0.05 0.46 0.22 1.72 4.21 -1.46 -1.52 115.58 119.16 3is7 h ASN 23 Ca 0.15 -0.73 -0.00 0.00 1.21 0.00 0.00 56.30 56.93 3is7 h ASN 23 Cb 0.28 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.33 3is7 h ASN 23 CO -0.34 1.12 -0.17 -0.61 -1.29 0.00 0.00 177.43 176.14 3is7 h GLN 24 N -0.16 -0.38 -0.67 0.81 4.15 -0.83 -0.60 115.11 117.42 3is7 h GLN 24 Ca -0.05 0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.40 3is7 h GLN 24 Cb 1.17 0.09 -0.03 0.00 0.21 0.00 0.00 27.48 28.91 3is7 h GLN 24 CO 0.09 -0.25 0.45 1.88 -1.93 0.00 0.00 178.83 179.07 3is7 h TYR 25 N -0.39 0.84 -0.43 3.99 0.05 -0.75 -0.63 116.97 119.66 3is7 h TYR 25 Ca -0.01 0.02 -0.15 0.00 0.05 0.00 0.00 58.73 58.64 3is7 h TYR 25 Cb 0.35 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 3is7 h TYR 25 CO -0.11 0.53 -0.32 0.35 -1.05 0.00 0.00 178.16 177.56 3is7 h PHE 26 N 0.91 1.14 -0.25 4.88 3.04 -0.80 -1.38 116.94 124.47 3is7 h PHE 26 Ca 0.25 -0.31 -0.16 0.00 3.98 0.00 0.00 57.97 61.72 3is7 h PHE 26 Cb -0.10 -0.25 0.00 0.00 2.56 0.00 0.00 35.95 38.16 3is7 h PHE 26 CO -0.00 1.15 -0.47 1.25 -2.02 0.00 0.00 178.31 178.22 3is7 h LEU 27 N 0.80 0.85 -1.20 0.59 5.85 -0.83 -2.07 115.31 119.31 3is7 h LEU 27 Ca 0.08 -0.54 0.05 0.00 0.84 0.00 0.00 57.88 58.31 3is7 h LEU 27 Cb 0.91 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.64 3is7 h LEU 27 CO 0.08 1.23 0.56 0.45 -0.34 0.00 0.00 178.44 180.42 3is7 h HIS 28 N 0.50 0.99 -0.05 1.25 3.86 -0.96 -0.71 115.15 120.05 3is7 h HIS 28 Ca 0.01 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 3is7 h HIS 28 Cb 1.08 -0.33 -0.00 0.00 1.06 0.00 0.00 27.41 29.21 3is7 h HIS 28 CO 0.08 0.55 0.03 1.03 0.86 0.00 0.00 177.93 180.48 3is7 h SER 29 N 1.01 0.06 0.61 2.45 0.87 -0.95 -0.50 113.55 117.09 3is7 h SER 29 Ca 0.35 -0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.78 3is7 h SER 29 Cb 0.12 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 3is7 h SER 29 CO -0.12 0.08 -0.43 0.03 -0.53 0.00 0.00 176.83 175.86 3is7 h ARG 30 N 0.03 0.00 -0.21 2.24 -0.00 -0.96 -1.56 114.38 113.91 3is7 h ARG 30 Ca 0.02 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.47 3is7 h ARG 30 Cb 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 29.99 3is7 h ARG 30 CO -0.00 0.43 0.03 0.52 0.00 0.00 0.00 179.97 180.95 3is7 h MET 31 N 0.00 0.36 -0.45 0.04 2.86 -0.86 0.22 114.93 117.11 3is7 h MET 31 Ca -0.00 -0.10 0.02 0.00 -2.06 0.00 0.00 59.70 57.55 3is7 h MET 31 Cb 0.86 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.45 3is7 h MET 31 CO 0.06 0.52 0.27 -1.49 1.06 0.00 0.00 176.91 177.32 3is7 h TRP 32 N 0.15 0.51 -0.57 -0.22 6.55 -0.86 -1.17 115.95 120.33 3is7 h TRP 32 Ca 0.06 0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.92 3is7 h TRP 32 Cb 0.34 -0.16 -0.03 0.00 -0.86 0.00 0.00 29.16 28.44 3is7 h TRP 32 CO 0.02 0.30 0.36 -0.91 -1.05 0.00 0.00 178.44 177.16 3is7 h ASN 33 N 0.54 0.67 -0.13 -3.49 -0.26 -1.13 0.12 115.58 111.91 3is7 h ASN 33 Ca 0.18 -0.04 -0.00 0.00 -0.56 0.00 0.00 56.30 55.87 3is7 h ASN 33 Cb -0.00 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.08 3is7 h ASN 33 CO -0.07 0.52 0.08 -0.78 -1.06 0.00 0.00 177.43 176.11 3is7 h ASP 34 N 0.77 0.17 0.35 5.81 3.58 -0.15 -1.05 116.42 125.90 3is7 h ASP 34 Ca 0.21 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.65 3is7 h ASP 34 Cb -0.05 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 40.96 3is7 h ASP 34 CO -0.04 0.14 -0.14 0.79 -2.88 0.00 0.00 179.24 177.11 3is7 n TRP 35 N -4.50 0.00 -0.70 0.28 8.01 -0.48 -4.90 117.44 115.15 3is7 n TRP 35 Ca -0.01 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.18 3is7 n TRP 35 Cb 0.09 -0.17 0.00 0.00 -2.01 0.00 0.00 31.31 29.22 3is7 n TRP 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3is7 n GLY 36 N 1.29 0.60 3.16 6.99 0.00 -0.40 -4.98 105.19 111.85 3is7 n GLY 36 Ca 0.14 -0.46 -0.44 0.00 0.00 0.00 0.00 46.02 45.26 3is7 n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3is7 n LEU 37 N 0.00 5.98 0.13 0.99 4.77 0.30 -4.49 117.00 124.69 3is7 n LEU 37 Ca 0.00 -4.82 -0.01 0.00 -0.03 0.00 0.00 56.01 51.15 3is7 n LEU 37 Cb 0.00 -1.47 0.20 0.00 -2.33 0.00 0.00 43.42 39.82 3is7 n LEU 37 CO 0.00 1.28 0.54 0.11 -1.33 0.00 0.00 177.39 177.98 3is7 h LYS 38 N 6.23 0.05 -0.16 3.23 1.57 -0.77 -0.57 116.57 126.14 3is7 h LYS 38 Ca 0.28 -0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.87 3is7 h LYS 38 Cb 0.74 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 3is7 h LYS 38 CO 1.33 0.60 -0.57 -0.09 -0.57 0.00 0.00 179.45 180.14 3is7 h ARG 39 N 0.04 0.51 -0.37 3.15 2.43 -1.39 0.84 114.38 119.57 3is7 h ARG 39 Ca -0.00 -0.33 -0.14 0.00 -0.81 0.00 0.00 59.98 58.70 3is7 h ARG 39 Cb 1.01 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.59 3is7 h ARG 39 CO 0.08 0.94 -0.32 -0.07 -1.51 0.00 0.00 179.97 179.09 3is7 h LEU 40 N 0.38 0.92 -0.13 3.80 3.38 -1.56 -1.89 115.31 120.21 3is7 h LEU 40 Ca 0.00 -0.45 0.02 0.00 0.09 0.00 0.00 57.88 57.54 3is7 h LEU 40 Cb 1.11 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 3is7 h LEU 40 CO 0.10 1.18 -0.01 1.23 0.09 0.00 0.00 178.44 181.03 3is7 h GLY 41 N 0.67 0.12 1.00 0.83 0.00 -0.86 -0.77 103.07 104.05 3is7 h GLY 41 Ca 0.07 0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.33 3is7 h GLY 41 CO 0.08 -0.03 -0.08 0.00 0.00 0.00 0.00 176.54 176.50 3is7 h ALA 42 N 1.12 0.59 -0.69 3.60 0.00 -0.73 -1.86 119.26 121.29 3is7 h ALA 42 Ca 0.06 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3is7 h ALA 42 Cb 0.08 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3is7 h ALA 42 CO -0.12 0.45 0.20 1.25 0.00 0.00 0.00 179.25 181.03 3is7 h HIS 43 N 0.64 1.13 -0.18 0.00 6.17 -1.14 -2.28 115.15 119.49 3is7 h HIS 43 Ca 0.11 -0.12 -0.11 0.00 0.71 0.00 0.00 60.37 60.96 3is7 h HIS 43 Cb 0.61 -0.32 -0.01 0.00 2.52 0.00 0.00 27.41 30.21 3is7 h HIS 43 CO 0.05 0.91 -0.36 1.49 0.71 0.00 0.00 177.93 180.73 3is7 h GLU 44 N 1.02 0.38 -0.62 5.26 4.57 -1.05 -1.76 114.58 122.38 3is7 h GLU 44 Ca 0.22 -0.17 0.01 0.00 -1.18 0.00 0.00 59.36 58.24 3is7 h GLU 44 Cb 0.32 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 3is7 h GLU 44 CO -0.00 0.69 0.41 -0.92 -1.18 0.00 0.00 179.01 178.00 3is7 h TYR 45 N 0.32 0.77 -0.30 0.92 3.20 -1.01 -1.44 116.97 119.43 3is7 h TYR 45 Ca 0.04 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.79 3is7 h TYR 45 Cb 0.78 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 3is7 h TYR 45 CO 0.02 0.49 -0.36 0.45 -1.64 0.00 0.00 178.16 177.12 3is7 h HIS 46 N 0.84 0.80 -0.65 -3.82 3.86 -1.05 -1.86 115.15 113.27 3is7 h HIS 46 Ca 0.23 -0.22 0.07 0.00 -1.16 0.00 0.00 60.37 59.28 3is7 h HIS 46 Cb -0.10 -0.18 -0.06 0.00 1.06 0.00 0.00 27.41 28.14 3is7 h HIS 46 CO -0.03 0.95 0.34 0.93 0.86 0.00 0.00 177.93 180.97 3is7 h GLU 47 N 0.57 0.59 -0.67 2.45 4.39 -1.04 -1.69 114.58 119.18 3is7 h GLU 47 Ca 0.06 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.69 3is7 h GLU 47 Cb 0.88 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 29.37 3is7 h GLU 47 CO 0.08 0.39 0.32 1.03 -1.16 0.00 0.00 179.01 179.67 3is7 h SER 48 N 0.61 0.89 -0.62 1.42 0.87 -0.94 -1.82 113.55 113.95 3is7 h SER 48 Ca 0.30 -0.14 -0.03 0.00 -1.23 0.00 0.00 61.79 60.70 3is7 h SER 48 Cb 0.25 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.95 3is7 h SER 48 CO -0.22 0.78 0.28 0.40 -0.53 0.00 0.00 176.83 177.54 3is7 h ILE 49 N 0.93 1.22 -0.74 2.23 1.08 -1.15 0.27 117.51 121.36 3is7 h ILE 49 Ca 0.23 -0.65 -0.02 0.00 -0.39 0.00 0.00 64.86 64.03 3is7 h ILE 49 Cb 0.13 0.50 -0.04 0.00 -3.07 0.00 0.00 36.82 34.35 3is7 h ILE 49 CO -0.03 0.26 0.38 0.44 -0.69 0.00 0.00 178.15 178.52 3is7 h ASP 50 N 0.85 0.94 -0.41 1.72 3.32 -1.04 -0.95 116.42 120.85 3is7 h ASP 50 Ca 0.21 -0.09 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 3is7 h ASP 50 Cb 0.15 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3is7 h ASP 50 CO -0.02 0.77 -0.04 -0.33 -1.72 0.00 0.00 179.24 177.90 3is7 h GLU 51 N 1.04 0.76 -0.79 3.56 4.39 -0.74 -2.51 114.58 120.28 3is7 h GLU 51 Ca 0.26 -0.26 0.14 0.00 0.34 0.00 0.00 59.36 59.83 3is7 h GLU 51 Cb 0.06 -0.06 -0.09 0.00 -0.10 0.00 0.00 28.75 28.57 3is7 h GLU 51 CO -0.04 0.86 0.37 0.52 -1.16 0.00 0.00 179.01 179.57 3is7 h MET 52 N 0.58 0.54 -0.21 2.33 2.86 -0.42 -0.41 114.93 120.20 3is7 h MET 52 Ca 0.11 -0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.63 3is7 h MET 52 Cb 0.54 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 3is7 h MET 52 CO 0.03 0.36 -0.25 0.87 1.06 0.00 0.00 176.91 178.97 3is7 h LYS 53 N 0.55 0.40 -0.27 1.72 1.57 -0.99 -1.86 116.57 117.69 3is7 h LYS 53 Ca 0.43 -0.15 -0.18 0.00 -1.87 0.00 0.00 60.65 58.88 3is7 h LYS 53 Cb 0.60 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.89 3is7 h LYS 53 CO -0.36 0.63 -0.53 0.45 -0.57 0.00 0.00 179.45 179.06 3is7 h HIS 54 N 0.36 1.06 -0.76 -1.35 3.86 -0.97 -2.23 115.15 115.12 3is7 h HIS 54 Ca 0.05 -0.38 0.00 0.00 -1.16 0.00 0.00 60.37 58.88 3is7 h HIS 54 Cb 0.64 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.87 3is7 h HIS 54 CO 0.02 1.21 0.49 0.00 0.86 0.00 0.00 177.93 180.50 3is7 h ALA 55 N 0.66 0.97 -0.51 2.45 0.00 -0.95 -1.12 119.26 120.76 3is7 h ALA 55 Ca 0.01 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.88 3is7 h ALA 55 Cb 1.14 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 3is7 h ALA 55 CO 0.12 0.40 0.30 0.22 0.00 0.00 0.00 179.25 180.29 3is7 h ASP 56 N 1.03 0.47 -0.68 0.00 3.58 -1.18 0.40 116.42 120.06 3is7 h ASP 56 Ca 0.28 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.70 3is7 h ASP 56 Cb -0.09 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 40.83 3is7 h ASP 56 CO -0.06 0.33 0.30 0.11 -2.88 0.00 0.00 179.24 177.05 3is7 h LYS 57 N 0.59 0.99 -0.40 0.28 1.57 -0.96 -1.35 116.57 117.28 3is7 h LYS 57 Ca 0.21 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 3is7 h LYS 57 Cb 0.03 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 3is7 h LYS 57 CO -0.10 0.81 0.21 -0.07 -0.57 0.00 0.00 179.45 179.72 3is7 h LEU 58 N 0.95 0.52 -0.34 2.94 3.38 -0.91 -1.37 115.31 120.48 3is7 h LEU 58 Ca 0.23 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.13 3is7 h LEU 58 Cb 0.16 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 3is7 h LEU 58 CO -0.02 0.48 0.11 0.40 0.09 0.00 0.00 178.44 179.50 3is7 h ILE 59 N 0.52 0.90 -0.66 1.22 2.04 -0.68 -0.38 117.51 120.46 3is7 h ILE 59 Ca 0.14 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 3is7 h ILE 59 Cb 0.09 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 3is7 h ILE 59 CO -0.02 0.05 0.38 -0.33 0.00 0.00 0.00 178.15 178.23 3is7 h GLU 60 N 0.26 0.91 -0.16 2.37 5.08 -1.12 -1.79 114.58 120.12 3is7 h GLU 60 Ca 0.15 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3is7 h GLU 60 Cb 0.13 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3is7 h GLU 60 CO -0.16 0.66 0.10 -0.09 -1.00 0.00 0.00 179.01 178.52 3is7 h ARG 61 N 0.90 0.22 -0.60 2.33 9.65 -0.92 -1.99 114.38 123.98 3is7 h ARG 61 Ca 0.23 -0.02 0.07 0.00 -1.10 0.00 0.00 59.98 59.17 3is7 h ARG 61 Cb 0.00 -0.05 -0.06 0.00 -1.39 0.00 0.00 29.97 28.48 3is7 h ARG 61 CO -0.04 0.19 0.27 0.82 2.80 0.00 0.00 179.97 184.01 3is7 h ILE 62 N 0.18 0.87 -0.23 1.20 2.04 -0.86 -0.41 117.51 120.31 3is7 h ILE 62 Ca 0.06 -0.17 -0.16 0.00 1.00 0.00 0.00 64.86 65.58 3is7 h ILE 62 Cb 0.03 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 3is7 h ILE 62 CO -0.01 0.09 -0.51 -0.07 0.00 0.00 0.00 178.15 177.65 3is7 h LEU 63 N 0.50 0.71 -1.07 1.44 -0.00 -1.25 -0.79 115.31 114.84 3is7 h LEU 63 Ca 0.28 -0.36 0.03 0.00 -0.00 0.00 0.00 57.88 57.83 3is7 h LEU 63 Cb 0.27 -0.20 -0.05 0.00 -0.00 0.00 0.00 40.66 40.67 3is7 h LEU 63 CO -0.23 1.09 0.63 0.15 -0.00 0.00 0.00 178.44 180.07 3is7 h PHE 64 N 0.50 1.17 -0.01 1.13 3.57 -0.66 -1.20 116.94 121.45 3is7 h PHE 64 Ca 0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.55 3is7 h PHE 64 Cb 1.07 -0.39 0.00 0.00 2.79 0.00 0.00 35.95 39.41 3is7 h PHE 64 CO 0.05 0.70 0.00 1.28 -2.23 0.00 0.00 178.31 178.11 3is7 n LEU 65 N -4.43 0.07 -2.00 0.59 4.77 -0.23 -4.89 117.00 110.90 3is7 n LEU 65 Ca 0.12 -0.03 -0.18 0.00 -0.03 0.00 0.00 56.01 55.89 3is7 n LEU 65 Cb 0.07 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 3is7 n LEU 65 CO 0.35 0.02 -0.23 -0.62 -1.33 0.00 0.00 177.39 175.58 3is7 n GLU 66 N -0.69 -1.41 -2.09 3.23 1.02 -0.45 -2.51 120.64 117.73 3is7 n GLU 66 Ca 0.12 0.88 -0.15 0.00 -0.02 0.00 0.00 57.16 57.98 3is7 n GLU 66 Cb 0.06 -5.36 0.07 0.00 -0.02 0.00 0.00 31.44 26.20 3is7 n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3is7 n GLY 67 N -1.00 1.12 3.30 0.62 0.00 -0.36 -4.95 105.19 103.91 3is7 n GLY 67 Ca -0.21 -2.07 -0.37 0.00 0.00 0.00 0.00 46.02 43.37 3is7 n GLY 67 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3is7 s LEU 68 N 0.00 3.82 0.30 0.99 1.43 -1.26 -4.32 118.68 119.63 3is7 s LEU 68 Ca 0.44 -0.82 -0.29 0.00 -1.03 0.00 0.00 54.13 52.43 3is7 s LEU 68 Cb -0.03 -1.84 -0.10 0.00 0.03 0.00 0.00 46.19 44.26 3is7 s LEU 68 CO 0.29 -0.21 1.15 -2.84 0.23 0.00 0.00 176.35 174.97 3is7 s PRO 69 N 1.45 4.56 -0.44 1.29 0.02 -1.26 -4.96 135.00 135.65 3is7 s PRO 69 Ca 0.01 1.90 -0.10 0.00 0.02 0.00 0.00 61.00 62.83 3is7 s PRO 69 Cb -0.18 -3.15 0.09 0.00 0.02 0.00 0.00 34.50 31.29 3is7 s PRO 69 CO 0.01 0.11 0.31 1.21 -0.33 0.00 0.00 177.00 178.30 3is7 s ASN 70 N -0.80 5.74 -0.05 2.53 3.84 -1.26 -4.86 114.94 120.08 3is7 s ASN 70 Ca 0.46 -1.59 0.13 0.00 0.21 0.00 0.00 52.86 52.07 3is7 s ASN 70 Cb -0.34 -2.03 0.39 0.00 -0.55 0.00 0.00 41.25 38.73 3is7 s ASN 70 CO 0.44 -0.60 1.33 0.18 -2.79 0.00 0.00 177.10 175.65 3is7 n LEU 71 N 4.96 3.29 -0.04 3.21 4.32 -1.26 -4.61 117.00 126.87 3is7 n LEU 71 Ca -0.10 -2.25 -0.18 0.00 -0.02 0.00 0.00 56.01 53.46 3is7 n LEU 71 Cb 0.42 -0.33 -0.14 0.00 -1.62 0.00 0.00 43.42 41.76 3is7 n LEU 71 CO 0.42 0.73 -0.95 1.67 -1.22 0.00 0.00 177.39 178.04 3is7 n GLN 72 N 0.36 0.71 -3.07 3.23 -0.06 -1.26 -4.82 117.38 112.47 3is7 n GLN 72 Ca 0.15 0.22 -0.44 0.00 -2.00 0.00 0.00 57.00 54.93 3is7 n GLN 72 Cb 0.57 -1.65 -0.05 0.00 -4.06 0.00 0.00 30.24 25.04 3is7 n GLN 72 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 3is7 s ASP 73 N -6.67 6.20 -0.32 1.69 1.01 -1.26 -5.01 116.67 112.31 3is7 s ASP 73 Ca -0.23 -1.13 -0.12 0.00 0.71 0.00 0.00 52.55 51.79 3is7 s ASP 73 Cb 0.07 -2.32 -0.02 0.00 1.01 0.00 0.00 42.92 41.66 3is7 s ASP 73 CO 0.73 -1.09 0.20 -0.22 0.21 0.00 0.00 175.17 175.01 3is7 s LEU 74 N 2.94 4.29 0.00 1.23 2.96 -1.26 -4.89 118.68 123.95 3is7 s LEU 74 Ca 0.15 -0.36 -0.04 0.00 -0.22 0.00 0.00 54.13 53.66 3is7 s LEU 74 Cb -0.21 -2.10 0.06 0.00 0.50 0.00 0.00 46.19 44.44 3is7 s LEU 74 CO 0.09 -0.18 0.22 0.61 -1.32 0.00 0.00 176.35 175.78 3is7 n GLY 75 N 5.06 -2.30 3.67 7.98 0.00 -1.26 -4.98 105.19 113.37 3is7 n GLY 75 Ca -0.13 -1.49 -0.43 0.00 0.00 0.00 0.00 46.02 43.97 3is7 n GLY 75 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3is7 s LYS 76 N -3.50 4.30 0.37 1.61 2.47 -1.26 -4.90 119.74 118.81 3is7 s LYS 76 Ca 0.14 1.39 -0.26 0.00 -1.56 0.00 0.00 55.97 55.69 3is7 s LYS 76 Cb -0.01 -3.62 -0.09 0.00 -1.46 0.00 0.00 37.83 32.64 3is7 s LYS 76 CO 0.11 -0.56 1.08 -0.51 0.16 0.00 0.00 175.35 175.63 3is7 s LEU 77 N 2.92 4.27 -0.63 5.43 1.02 -1.26 -5.00 118.68 125.43 3is7 s LEU 77 Ca 0.46 2.15 -0.10 0.00 0.02 0.00 0.00 54.13 56.66 3is7 s LEU 77 Cb -0.16 -4.00 0.16 0.00 0.02 0.00 0.00 46.19 42.21 3is7 s LEU 77 CO 0.10 -0.42 0.52 -0.76 0.02 0.00 0.00 176.35 175.80 3is7 s LEU 78 N -2.28 5.98 -0.24 1.79 1.43 -1.26 -5.06 118.68 119.04 3is7 s LEU 78 Ca 0.54 -2.37 -0.13 0.00 -1.03 0.00 0.00 54.13 51.14 3is7 s LEU 78 Cb -0.26 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.86 3is7 s LEU 78 CO 0.33 -0.60 0.27 -0.63 0.23 0.00 0.00 176.35 175.95 3is7 s ILE 79 N 0.67 5.27 0.76 -0.59 -1.09 -1.26 -4.68 121.20 120.28 3is7 s ILE 79 Ca 0.12 0.39 -0.08 0.00 -2.23 0.00 0.00 60.65 58.85 3is7 s ILE 79 Cb -0.20 -3.60 0.09 0.00 -1.58 0.00 0.00 42.46 37.17 3is7 s ILE 79 CO -0.04 0.27 1.08 -0.83 -1.23 0.00 0.00 174.94 174.19 3is7 s GLY 80 N 1.28 1.70 0.00 6.18 0.00 -1.26 -4.95 107.32 110.28 3is7 s GLY 80 Ca 0.12 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 43.80 3is7 s GLY 80 CO 0.07 -0.54 0.45 -1.84 0.00 0.00 0.00 173.10 171.24 3is7 n GLU 81 N -3.09 -0.20 -4.21 2.90 0.28 -1.26 -4.76 120.64 110.30 3is7 n GLU 81 Ca 0.10 -0.51 -0.15 0.00 -0.16 0.00 0.00 57.16 56.44 3is7 n GLU 81 Cb 0.60 -0.86 -0.08 0.00 1.43 0.00 0.00 31.44 32.53 3is7 n GLU 81 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 3is7 s ASN 82 N -0.13 0.80 0.16 -1.84 2.20 -1.26 -5.02 114.94 109.85 3is7 s ASN 82 Ca 0.00 -1.52 -0.15 0.00 -0.94 0.00 0.00 52.86 50.25 3is7 s ASN 82 Cb 0.00 0.49 0.05 0.00 -2.00 0.00 0.00 41.25 39.78 3is7 s ASN 82 CO 0.00 -0.98 1.81 0.74 -2.94 0.00 0.00 177.10 175.73 3is7 h THR 83 N 2.37 1.08 -0.61 0.54 2.02 -1.99 0.32 112.91 116.65 3is7 h THR 83 Ca -0.30 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.66 3is7 h THR 83 Cb 1.24 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 3is7 h THR 83 CO 0.44 0.10 0.30 -0.61 0.37 0.00 0.00 175.52 176.13 3is7 h GLN 84 N 0.56 0.87 -0.38 6.66 4.15 -2.00 -1.24 115.11 123.73 3is7 h GLN 84 Ca 0.17 -0.12 -0.15 0.00 0.77 0.00 0.00 58.65 59.32 3is7 h GLN 84 Cb -0.03 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.50 3is7 h GLN 84 CO -0.06 0.69 -0.36 0.93 -1.93 0.00 0.00 178.83 178.10 3is7 h GLU 85 N 0.83 0.90 -0.58 1.69 5.08 -1.72 -1.99 114.58 118.79 3is7 h GLU 85 Ca 0.21 -0.45 0.04 0.00 -1.00 0.00 0.00 59.36 58.15 3is7 h GLU 85 Cb 0.10 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 3is7 h GLU 85 CO -0.03 1.10 0.33 0.52 -1.00 0.00 0.00 179.01 179.94 3is7 h MET 86 N 0.74 0.62 -0.52 2.33 2.86 -0.04 0.54 114.93 121.46 3is7 h MET 86 Ca 0.07 -0.04 -0.10 0.00 -2.06 0.00 0.00 59.70 57.57 3is7 h MET 86 Cb 0.94 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 32.44 3is7 h MET 86 CO 0.09 0.41 -0.07 -0.07 1.06 0.00 0.00 176.91 178.33 3is7 h LEU 87 N 0.64 0.97 -0.94 1.22 3.38 -1.14 -1.96 115.31 117.47 3is7 h LEU 87 Ca 0.24 -0.34 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 3is7 h LEU 87 Cb 0.08 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3is7 h LEU 87 CO -0.13 1.07 -0.03 -0.61 0.09 0.00 0.00 178.44 178.83 3is7 h GLN 88 N 0.84 0.74 -0.35 1.13 5.75 -1.12 -1.36 115.11 120.74 3is7 h GLN 88 Ca 0.14 -0.20 -0.11 0.00 -0.15 0.00 0.00 58.65 58.33 3is7 h GLN 88 Cb 0.62 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.07 3is7 h GLN 88 CO 0.04 0.77 -0.23 0.00 -2.65 0.00 0.00 178.83 176.77 3is7 h ASP 90 N 0.59 1.06 -0.39 0.00 3.32 -1.13 -1.84 116.42 118.04 3is7 h ASP 90 Ca 0.09 -0.23 -0.04 0.00 0.02 0.00 0.00 57.03 56.87 3is7 h ASP 90 Cb 0.70 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 3is7 h ASP 90 CO 0.05 1.02 0.09 0.25 -1.72 0.00 0.00 179.24 178.93 3is7 h LEU 91 N 1.06 0.59 -0.62 1.55 5.85 -0.82 -1.27 115.31 121.65 3is7 h LEU 91 Ca 0.22 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3is7 h LEU 91 Cb 0.37 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 3is7 h LEU 91 CO 0.00 0.67 0.40 0.78 -0.34 0.00 0.00 178.44 179.95 3is7 h ASN 92 N 0.48 0.73 -0.48 1.25 2.35 -0.91 -1.20 115.58 117.80 3is7 h ASN 92 Ca 0.12 -0.03 -0.08 0.00 -0.55 0.00 0.00 56.30 55.76 3is7 h ASN 92 Cb 0.31 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 3is7 h ASN 92 CO 0.00 0.54 0.02 0.25 -1.65 0.00 0.00 177.43 176.59 3is7 h LEU 93 N 0.84 0.86 -0.63 1.61 5.85 -1.04 -2.06 115.31 120.74 3is7 h LEU 93 Ca 0.23 -0.22 -0.15 0.00 0.84 0.00 0.00 57.88 58.58 3is7 h LEU 93 Cb -0.07 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.72 3is7 h LEU 93 CO -0.05 0.92 -0.60 -0.33 -0.34 0.00 0.00 178.44 178.04 3is7 h GLU 94 N 0.83 0.29 -0.47 1.25 4.39 -0.64 -0.13 114.58 120.10 3is7 h GLU 94 Ca 0.16 -0.20 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 3is7 h GLU 94 Cb 0.47 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 3is7 h GLU 94 CO 0.02 0.80 0.22 -0.07 -1.16 0.00 0.00 179.01 178.82 3is7 h LEU 95 N 0.21 0.61 -0.38 1.33 3.38 -1.02 -0.43 115.31 119.01 3is7 h LEU 95 Ca -0.01 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.86 3is7 h LEU 95 Cb 1.11 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 3is7 h LEU 95 CO 0.10 0.57 0.18 0.50 0.09 0.00 0.00 178.44 179.88 3is7 h LYS 96 N 0.61 0.37 -0.84 1.13 1.63 -1.12 -2.12 116.57 116.22 3is7 h LYS 96 Ca 0.16 -0.02 0.04 0.00 -0.85 0.00 0.00 60.65 59.98 3is7 h LYS 96 Cb 0.13 -0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 31.63 3is7 h LYS 96 CO -0.02 0.24 0.55 0.00 -3.45 0.00 0.00 179.45 176.77 3is7 h ALA 97 N 1.21 1.51 -0.05 5.00 0.00 -0.38 -2.22 119.26 124.34 3is7 h ALA 97 Ca 0.16 -0.04 -0.24 0.00 0.00 0.00 0.00 54.91 54.80 3is7 h ALA 97 Cb 0.08 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.61 3is7 h ALA 97 CO -0.12 0.39 -0.93 1.15 0.00 0.00 0.00 179.25 179.74 3is7 h THR 98 N 1.01 1.30 0.01 0.00 2.02 -0.98 -1.04 112.91 115.23 3is7 h THR 98 Ca 0.34 -2.19 0.00 0.00 0.77 0.00 0.00 66.41 65.34 3is7 h THR 98 Cb 0.09 2.24 -0.00 0.00 -1.74 0.00 0.00 68.15 68.74 3is7 h THR 98 CO -0.11 0.68 -0.01 0.50 0.37 0.00 0.00 175.52 176.95 3is7 h LYS 99 N 0.41 -0.02 -0.52 6.66 3.64 -0.93 -1.52 116.57 124.29 3is7 h LYS 99 Ca -0.09 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.35 3is7 h LYS 99 Cb 1.57 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.36 3is7 h LYS 99 CO 0.18 -0.02 0.35 -0.44 -2.27 0.00 0.00 179.45 177.25 3is7 h ASP 100 N -0.02 0.40 -0.27 4.20 3.32 -1.27 -2.15 116.42 120.62 3is7 h ASP 100 Ca 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 3is7 h ASP 100 Cb 0.02 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 3is7 h ASP 100 CO -0.00 0.26 -0.19 -0.07 -1.72 0.00 0.00 179.24 177.52 3is7 h LEU 101 N 0.45 0.63 -0.57 1.55 -0.00 -0.70 -1.58 115.31 115.10 3is7 h LEU 101 Ca 0.23 -0.44 0.02 0.00 -0.00 0.00 0.00 57.88 57.69 3is7 h LEU 101 Cb 0.32 -0.18 -0.03 0.00 -0.00 0.00 0.00 40.66 40.77 3is7 h LEU 101 CO -0.06 0.94 0.35 0.03 -0.00 0.00 0.00 178.44 179.70 3is7 h ARG 102 N 0.33 0.68 -0.76 1.13 3.08 -0.90 -0.29 114.38 117.65 3is7 h ARG 102 Ca 0.05 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 3is7 h ARG 102 Cb 0.72 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 3is7 h ARG 102 CO 0.05 0.45 0.40 0.93 -1.07 0.00 0.00 179.97 180.73 3is7 h GLU 103 N 0.70 1.06 -0.38 0.04 5.08 -1.25 -1.91 114.58 117.92 3is7 h GLU 103 Ca 0.22 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.38 3is7 h GLU 103 Cb -0.01 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 3is7 h GLU 103 CO -0.08 0.79 -0.09 0.00 -1.00 0.00 0.00 179.01 178.63 3is7 h ALA 104 N 1.38 0.52 -0.23 3.43 0.00 -0.87 -2.48 119.26 121.01 3is7 h ALA 104 Ca 0.27 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3is7 h ALA 104 Cb 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3is7 h ALA 104 CO -0.04 0.38 0.15 0.82 0.00 0.00 0.00 179.25 180.56 3is7 h ILE 105 N 0.54 1.08 -0.35 0.00 2.04 -0.70 0.20 117.51 120.32 3is7 h ILE 105 Ca 0.10 -0.17 0.08 0.00 1.00 0.00 0.00 64.86 65.86 3is7 h ILE 105 Cb 0.60 0.78 -0.08 0.00 -0.74 0.00 0.00 36.82 37.38 3is7 h ILE 105 CO 0.04 0.08 -0.19 0.58 0.00 0.00 0.00 178.15 178.65 3is7 h VAL 106 N 0.30 0.45 -0.22 1.67 2.07 -1.35 -1.66 116.25 117.52 3is7 h VAL 106 Ca 0.08 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.62 3is7 h VAL 106 Cb -0.00 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 3is7 h VAL 106 CO -0.02 0.00 0.10 -0.74 0.02 0.00 0.00 177.57 176.93 3is7 h HIS 107 N -0.14 0.18 -0.81 1.57 -0.00 -0.91 -2.03 115.15 113.00 3is7 h HIS 107 Ca 0.17 0.01 0.15 0.00 -0.00 0.00 0.00 60.37 60.71 3is7 h HIS 107 Cb 0.41 -0.05 -0.10 0.00 -0.00 0.00 0.00 27.41 27.67 3is7 h HIS 107 CO -0.40 0.10 0.38 0.00 -0.00 0.00 0.00 177.93 178.00 3is7 h GLU 109 N 0.52 0.91 -0.39 0.00 4.57 -1.04 0.57 114.58 119.72 3is7 h GLU 109 Ca 0.45 -0.17 0.01 0.00 -1.18 0.00 0.00 59.36 58.47 3is7 h GLU 109 Cb 0.69 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 3is7 h GLU 109 CO -0.40 0.78 0.25 0.37 -1.18 0.00 0.00 179.01 178.83 3is7 h GLN 110 N 0.85 0.49 -0.58 1.92 4.15 -0.64 -1.57 115.11 119.73 3is7 h GLN 110 Ca 0.20 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.59 3is7 h GLN 110 Cb 0.21 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.79 3is7 h GLN 110 CO -0.02 0.32 0.00 1.33 -1.93 0.00 0.00 178.83 178.54 3is7 n VAL 111 N -4.84 1.08 -2.21 2.39 0.24 -0.80 -4.94 118.33 109.26 3is7 n VAL 111 Ca 0.00 -0.75 -0.15 0.00 -2.04 0.00 0.00 64.34 61.40 3is7 n VAL 111 Cb 0.03 0.08 -0.01 0.00 -1.47 0.00 0.00 33.84 32.47 3is7 n VAL 111 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 3is7 n HIS 112 N 0.74 -0.65 -3.17 6.34 8.25 -0.59 -4.94 115.22 121.19 3is7 n HIS 112 Ca 0.17 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 57.18 3is7 n HIS 112 Cb 0.58 -3.11 -0.00 0.00 1.12 0.00 0.00 29.99 28.58 3is7 n HIS 112 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3is7 s ASP 113 N -2.37 7.19 0.38 0.41 -1.08 0.10 -4.82 116.67 116.49 3is7 s ASP 113 Ca 0.00 -3.30 0.21 0.00 -0.52 0.00 0.00 52.55 48.94 3is7 s ASP 113 Cb 0.00 -2.29 0.42 0.00 -1.46 0.00 0.00 42.92 39.59 3is7 s ASP 113 CO 0.00 -0.49 1.61 1.88 0.52 0.00 0.00 175.17 178.69 3is7 h TYR 114 N 6.94 0.00 -0.05 -5.34 0.05 -1.92 -1.86 116.97 114.79 3is7 h TYR 114 Ca 0.23 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.91 3is7 h TYR 114 Cb 0.88 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.63 3is7 h TYR 114 CO 0.91 0.24 -0.36 0.28 -1.05 0.00 0.00 178.16 178.19 3is7 h VAL 115 N 0.00 1.45 -0.81 -2.88 2.07 -1.97 -0.95 116.25 113.16 3is7 h VAL 115 Ca -0.00 -1.82 0.06 0.00 0.82 0.00 0.00 66.70 65.75 3is7 h VAL 115 Cb 1.07 2.45 -0.06 0.00 -1.52 0.00 0.00 31.29 33.23 3is7 h VAL 115 CO 0.03 0.52 0.49 0.28 0.02 0.00 0.00 177.57 178.91 3is7 h SER 116 N -0.21 0.76 -0.37 0.57 0.02 -1.97 -1.72 113.55 110.64 3is7 h SER 116 Ca -0.03 0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.97 3is7 h SER 116 Cb 1.03 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.40 3is7 h SER 116 CO 0.07 0.49 0.17 -0.09 -1.14 0.00 0.00 176.83 176.33 3is7 h ARG 117 N 0.89 0.34 -0.78 3.45 2.43 -1.20 -1.58 114.38 117.94 3is7 h ARG 117 Ca 0.35 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.50 3is7 h ARG 117 Cb 0.17 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.61 3is7 h ARG 117 CO -0.17 0.22 0.45 0.22 -1.51 0.00 0.00 179.97 179.18 3is7 h ASP 118 N 0.35 0.94 -0.39 -3.80 3.58 -0.31 0.11 116.42 116.91 3is7 h ASP 118 Ca 0.16 -0.08 0.02 0.00 0.42 0.00 0.00 57.03 57.55 3is7 h ASP 118 Cb 0.09 -0.24 -0.03 0.00 1.72 0.00 0.00 39.33 40.88 3is7 h ASP 118 CO -0.13 0.74 0.22 0.25 -2.88 0.00 0.00 179.24 177.44 3is7 h LEU 119 N 1.07 0.35 -0.87 2.28 6.46 -1.16 -1.94 115.31 121.50 3is7 h LEU 119 Ca 0.28 0.01 -0.10 0.00 -0.12 0.00 0.00 57.88 57.94 3is7 h LEU 119 Cb -0.01 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 39.83 3is7 h LEU 119 CO -0.05 0.25 -0.24 -0.07 -0.62 0.00 0.00 178.44 177.72 3is7 h LEU 120 N 0.45 0.57 -1.12 2.25 3.38 -0.87 -2.05 115.31 117.91 3is7 h LEU 120 Ca 0.15 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 3is7 h LEU 120 Cb 0.02 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3is7 h LEU 120 CO -0.08 0.80 -0.22 0.50 0.09 0.00 0.00 178.44 179.53 3is7 h LYS 121 N 0.50 0.34 -0.41 1.13 3.64 -0.72 -0.48 116.57 120.57 3is7 h LYS 121 Ca 0.07 -0.11 -0.12 0.00 -1.27 0.00 0.00 60.65 59.22 3is7 h LYS 121 Cb 0.68 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 3is7 h LYS 121 CO 0.05 0.55 -0.20 -0.44 -2.27 0.00 0.00 179.45 177.14 3is7 h ASP 122 N 0.31 0.89 -0.45 4.20 3.32 -0.78 -1.77 116.42 122.15 3is7 h ASP 122 Ca 0.05 -0.41 -0.02 0.00 0.02 0.00 0.00 57.03 56.67 3is7 h ASP 122 Cb 0.57 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 3is7 h ASP 122 CO 0.04 1.10 0.20 0.40 -1.72 0.00 0.00 179.24 179.26 3is7 h ILE 123 N 0.68 1.19 -0.86 0.35 2.04 -1.19 -2.49 117.51 117.24 3is7 h ILE 123 Ca 0.09 -0.57 0.06 0.00 1.00 0.00 0.00 64.86 65.43 3is7 h ILE 123 Cb 0.77 0.73 -0.06 0.00 -0.74 0.00 0.00 36.82 37.52 3is7 h ILE 123 CO 0.06 0.22 0.54 0.25 0.00 0.00 0.00 178.15 179.22 3is7 h LEU 124 N 0.59 0.85 -0.69 1.44 5.85 -0.92 0.28 115.31 122.72 3is7 h LEU 124 Ca 0.15 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 3is7 h LEU 124 Cb 0.15 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 3is7 h LEU 124 CO -0.02 0.56 0.13 -0.08 -0.34 0.00 0.00 178.44 178.69 3is7 h GLU 125 N 0.99 1.13 -0.19 1.25 4.81 -1.21 0.22 114.58 121.58 3is7 h GLU 125 Ca 0.37 -0.29 -0.11 0.00 -0.13 0.00 0.00 59.36 59.20 3is7 h GLU 125 Cb 0.14 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3is7 h GLU 125 CO -0.16 1.02 -0.34 1.03 -0.73 0.00 0.00 179.01 179.82 3is7 h SER 126 N 1.06 0.42 0.04 1.04 0.87 -0.97 -1.95 113.55 114.07 3is7 h SER 126 Ca 0.21 -0.16 -0.12 0.00 -1.23 0.00 0.00 61.79 60.49 3is7 h SER 126 Cb 0.42 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 3is7 h SER 126 CO 0.01 0.74 -0.37 -0.33 -0.53 0.00 0.00 176.83 176.34 3is7 h GLU 127 N 0.35 0.44 -0.05 2.24 4.39 -0.60 -1.98 114.58 119.38 3is7 h GLU 127 Ca 0.04 -0.21 -0.13 0.00 0.34 0.00 0.00 59.36 59.40 3is7 h GLU 127 Cb 0.77 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.40 3is7 h GLU 127 CO 0.06 0.75 -0.58 0.93 -1.16 0.00 0.00 179.01 179.02 3is7 h GLU 128 N 0.37 0.14 -0.72 2.33 5.08 -0.66 -1.43 114.58 119.69 3is7 h GLU 128 Ca 0.04 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3is7 h GLU 128 Cb 0.83 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.06 3is7 h GLU 128 CO 0.07 0.68 0.36 0.93 -1.00 0.00 0.00 179.01 180.05 3is7 h GLU 129 N 0.11 1.02 -0.76 2.33 5.08 -1.18 -0.55 114.58 120.63 3is7 h GLU 129 Ca -0.00 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 3is7 h GLU 129 Cb 1.05 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 30.08 3is7 h GLU 129 CO 0.08 0.79 0.39 1.25 -1.00 0.00 0.00 179.01 180.52 3is7 h HIS 130 N 1.00 1.07 -0.79 4.33 2.76 -1.00 -1.74 115.15 120.78 3is7 h HIS 130 Ca 0.25 -0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.34 3is7 h HIS 130 Cb 0.10 -0.34 -0.04 0.00 1.55 0.00 0.00 27.41 28.68 3is7 h HIS 130 CO 0.00 0.77 0.36 0.82 -1.30 0.00 0.00 177.93 178.59 3is7 h ILE 131 N 1.06 1.25 -0.27 6.26 2.04 -0.94 0.24 117.51 127.14 3is7 h ILE 131 Ca 0.26 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 3is7 h ILE 131 Cb 0.08 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 3is7 h ILE 131 CO -0.04 0.31 0.13 -0.78 0.00 0.00 0.00 178.15 177.77 3is7 h ASP 132 N 1.13 0.35 -0.36 1.72 3.58 -0.81 -1.23 116.42 120.80 3is7 h ASP 132 Ca 0.27 -0.12 0.03 0.00 0.42 0.00 0.00 57.03 57.63 3is7 h ASP 132 Cb 0.14 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 3is7 h ASP 132 CO -0.03 0.37 0.16 0.22 -2.88 0.00 0.00 179.24 177.08 3is7 h TYR 133 N 0.31 0.29 0.15 0.28 3.20 -0.67 -1.52 116.97 119.00 3is7 h TYR 133 Ca 0.09 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 3is7 h TYR 133 Cb 0.11 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.30 3is7 h TYR 133 CO -0.02 0.15 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.50 3is7 h LEU 134 N 0.34 -0.17 -0.99 2.82 -0.00 -0.71 -0.06 115.31 116.54 3is7 h LEU 134 Ca 0.16 -0.17 0.11 0.00 -0.00 0.00 0.00 57.88 57.97 3is7 h LEU 134 Cb 0.09 0.04 -0.08 0.00 -0.00 0.00 0.00 40.66 40.71 3is7 h LEU 134 CO -0.13 0.07 0.63 -0.33 -0.00 0.00 0.00 178.44 178.68 3is7 h GLU 135 N -0.41 1.00 -0.33 1.13 5.08 -1.24 -1.69 114.58 118.12 3is7 h GLU 135 Ca -0.02 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.30 3is7 h GLU 135 Cb 0.32 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 3is7 h GLU 135 CO 0.03 0.66 0.18 1.15 -1.00 0.00 0.00 179.01 180.03 3is7 h THR 136 N 1.03 1.01 -0.55 1.13 2.02 -0.93 -1.06 112.91 115.57 3is7 h THR 136 Ca 0.48 -0.13 -0.11 0.00 0.77 0.00 0.00 66.41 67.42 3is7 h THR 136 Cb 0.40 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 3is7 h THR 136 CO -0.24 0.07 -0.09 1.56 0.37 0.00 0.00 175.52 177.19 3is7 h GLN 137 N 0.37 1.01 -0.41 6.66 1.08 -0.15 -0.85 115.11 122.82 3is7 h GLN 137 Ca 0.13 -0.36 -0.12 0.00 -1.45 0.00 0.00 58.65 56.85 3is7 h GLN 137 Cb 0.02 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 3is7 h GLN 137 CO -0.07 1.04 -0.22 -0.07 -0.95 0.00 0.00 178.83 178.56 3is7 h LEU 138 N 0.91 0.83 -1.24 1.46 4.07 -1.31 -1.35 115.31 118.66 3is7 h LEU 138 Ca 0.15 -0.30 -0.02 0.00 0.08 0.00 0.00 57.88 57.78 3is7 h LEU 138 Cb 0.65 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 42.13 3is7 h LEU 138 CO 0.04 1.02 0.24 1.23 -1.08 0.00 0.00 178.44 179.89 3is7 h GLY 139 N 0.95 0.81 1.40 0.83 0.00 -0.66 -3.11 103.07 103.30 3is7 h GLY 139 Ca 0.10 -0.39 -0.21 0.00 0.00 0.00 0.00 47.33 46.83 3is7 h GLY 139 CO 0.06 0.37 -0.78 1.41 0.00 0.00 0.00 176.54 177.60 3is7 h LEU 140 N 0.76 0.69 -0.93 3.11 3.38 -0.52 -1.15 115.31 120.65 3is7 h LEU 140 Ca 0.19 -0.47 0.16 0.00 0.09 0.00 0.00 57.88 57.85 3is7 h LEU 140 Cb 0.11 -0.21 -0.10 0.00 0.09 0.00 0.00 40.66 40.56 3is7 h LEU 140 CO -0.02 1.24 0.53 0.40 0.09 0.00 0.00 178.44 180.68 3is7 h ILE 141 N 0.39 0.75 -0.31 1.22 2.04 -1.23 0.13 117.51 120.51 3is7 h ILE 141 Ca -0.05 -0.25 -0.18 0.00 1.00 0.00 0.00 64.86 65.38 3is7 h ILE 141 Cb 1.39 -0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.42 3is7 h ILE 141 CO 0.15 0.13 -0.52 1.56 0.00 0.00 0.00 178.15 179.47 3is7 h GLN 142 N 0.73 0.88 0.02 2.37 1.08 -1.41 -1.55 115.11 117.23 3is7 h GLN 142 Ca 0.51 -0.54 -0.24 0.00 -1.45 0.00 0.00 58.65 56.93 3is7 h GLN 142 Cb 0.72 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.21 3is7 h GLN 142 CO -0.36 1.18 -1.00 0.87 -0.95 0.00 0.00 178.83 178.58 3is7 h LYS 143 N 0.69 0.40 -0.00 1.46 1.57 -0.37 -3.36 116.57 116.96 3is7 h LYS 143 Ca 0.02 -0.47 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3is7 h LYS 143 Cb 1.12 0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.57 3is7 h LYS 143 CO 0.12 1.14 -0.56 1.33 -0.57 0.00 0.00 179.45 180.90 3is7 n VAL 144 N -3.72 0.00 0.00 0.50 0.24 0.39 -5.08 118.33 110.66 3is7 n VAL 144 Ca -0.07 -0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 3is7 n VAL 144 Cb 0.87 1.05 0.00 0.00 -1.47 0.00 0.00 33.84 34.29 3is7 n VAL 144 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3is7 n GLY 145 N 1.26 -0.36 0.35 7.63 0.00 -0.59 -4.45 105.19 109.03 3is7 n GLY 145 Ca 0.04 -1.45 0.05 0.00 0.00 0.00 0.00 46.02 44.65 3is7 n GLY 145 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3is7 h LEU 146 N 0.00 0.90 -0.35 0.99 5.85 -1.89 -1.47 115.31 119.35 3is7 h LEU 146 Ca 0.00 0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.63 3is7 h LEU 146 Cb 0.00 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 3is7 h LEU 146 CO 0.00 0.52 -0.28 -0.33 -0.34 0.00 0.00 178.44 178.01 3is7 h GLU 147 N 1.00 0.81 -0.68 1.25 5.08 -1.92 -0.76 114.58 119.35 3is7 h GLU 147 Ca 0.46 -0.40 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 3is7 h GLU 147 Cb 0.37 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 3is7 h GLU 147 CO -0.24 1.03 0.16 -0.91 -1.00 0.00 0.00 179.01 178.05 3is7 h ASN 148 N 0.59 1.04 -0.35 1.42 2.35 -1.74 -0.93 115.58 117.97 3is7 h ASN 148 Ca 0.06 -0.24 0.03 0.00 -0.55 0.00 0.00 56.30 55.60 3is7 h ASN 148 Cb 0.85 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.91 3is7 h ASN 148 CO 0.07 1.01 0.16 0.22 -1.65 0.00 0.00 177.43 177.25 3is7 h TYR 149 N 1.03 0.30 -0.49 1.19 3.20 -1.12 -1.49 116.97 119.59 3is7 h TYR 149 Ca 0.21 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.02 3is7 h TYR 149 Cb 0.38 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.55 3is7 h TYR 149 CO 0.03 0.15 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.62 3is7 h LEU 150 N 0.34 0.86 -0.59 2.82 3.38 -1.07 -2.92 115.31 118.13 3is7 h LEU 150 Ca 0.15 -0.32 0.09 0.00 0.09 0.00 0.00 57.88 57.89 3is7 h LEU 150 Cb 0.07 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.52 3is7 h LEU 150 CO -0.11 0.97 0.22 -0.61 0.09 0.00 0.00 178.44 178.99 3is7 h GLN 151 N 0.73 0.39 0.00 1.13 4.15 -0.93 -1.40 115.11 119.17 3is7 h GLN 151 Ca 0.14 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.53 3is7 h GLN 151 Cb 0.54 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.14 3is7 h GLN 151 CO 0.03 0.26 0.00 0.43 -1.93 0.00 0.00 178.83 177.61 3is7 n SER 152 N -5.00 0.03 -0.47 -0.69 7.64 -0.58 -2.29 113.62 112.27 3is7 n SER 152 Ca 0.08 0.51 0.06 0.00 1.01 0.00 0.00 58.87 60.53 3is7 n SER 152 Cb 0.26 -0.51 0.14 0.00 -1.01 0.00 0.00 64.21 63.09 3is7 n SER 152 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3is7 n HIS 153 N -1.53 0.40 -0.03 1.43 8.25 -0.54 -4.66 115.22 118.53 3is7 n HIS 153 Ca 0.03 -0.66 -0.14 0.00 -0.26 0.00 0.00 57.72 56.69 3is7 n HIS 153 Cb 0.13 -0.12 -0.10 0.00 1.12 0.00 0.00 29.99 31.02 3is7 n HIS 153 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 3is7 h MET 154 N 1.20 0.12 -5.61 -0.41 2.86 -1.30 -1.32 114.93 110.47 3is7 h MET 154 Ca 0.00 -0.09 -0.65 0.00 -2.06 0.00 0.00 59.70 56.90 3is7 h MET 154 Cb 0.88 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 32.48 3is7 h MET 154 CO 0.05 0.71 -0.45 -1.01 1.06 0.00 0.00 176.91 177.27 3is7 s HIS 155 N -3.77 3.58 -2.00 -0.22 3.76 -1.26 -1.87 115.29 113.50 3is7 s HIS 155 Ca -0.16 0.54 0.13 0.00 -0.15 0.00 0.00 55.06 55.42 3is7 s HIS 155 Cb 0.02 -2.01 0.75 0.00 1.11 0.00 0.00 32.58 32.44 3is7 s HIS 155 CO 0.71 0.65 1.18 0.39 -0.85 0.00 0.00 174.74 176.82