#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3isf h LYS 2 N 0.00 0.27 -6.90 0.03 2.10 -1.91 -3.46 116.57 106.70 3isf h LYS 2 Ca 0.00 -0.39 -0.48 0.00 -2.00 0.00 0.00 60.65 57.78 3isf h LYS 2 Cb 0.00 0.13 0.01 0.00 -0.90 0.00 0.00 32.23 31.47 3isf h LYS 2 CO 0.00 1.13 0.41 0.20 -2.00 0.00 0.00 179.45 179.19 3isf s GLY 3 N -4.57 2.84 0.22 0.07 0.00 -0.09 -5.00 107.32 100.78 3isf s GLY 3 Ca -0.04 0.69 -0.31 0.00 0.00 0.00 0.00 44.72 45.07 3isf s GLY 3 CO 0.87 1.17 1.53 -0.35 0.00 0.00 0.00 173.10 176.31 3isf s ASP 4 N -1.42 6.57 0.17 1.64 2.15 -1.26 -4.94 116.67 119.59 3isf s ASP 4 Ca 0.52 2.70 -0.10 0.00 0.43 0.00 0.00 52.55 56.11 3isf s ASP 4 Cb -0.23 -2.61 0.05 0.00 -0.30 0.00 0.00 42.92 39.82 3isf s ASP 4 CO 0.30 -0.80 1.62 0.11 -0.17 0.00 0.00 175.17 176.23 3isf h LYS 5 N 5.77 1.05 -0.05 4.34 1.57 -1.97 -0.97 116.57 126.31 3isf h LYS 5 Ca -0.45 -0.36 -0.12 0.00 -1.87 0.00 0.00 60.65 57.85 3isf h LYS 5 Cb 1.21 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.43 3isf h LYS 5 CO 0.84 1.06 -0.52 -0.22 -0.57 0.00 0.00 179.45 180.04 3isf h LYS 6 N 0.94 0.13 -0.13 3.15 3.64 -1.99 -2.08 116.57 120.22 3isf h LYS 6 Ca 0.16 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.48 3isf h LYS 6 Cb 0.61 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 3isf h LYS 6 CO 0.04 0.62 0.01 0.28 -2.27 0.00 0.00 179.45 178.13 3isf h VAL 7 N 0.10 0.92 -0.71 2.00 2.07 -1.79 -0.75 116.25 118.08 3isf h VAL 7 Ca 0.00 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.58 3isf h VAL 7 Cb 0.96 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 31.52 3isf h VAL 7 CO 0.07 0.01 0.38 0.40 0.02 0.00 0.00 177.57 178.46 3isf h ILE 8 N 0.05 0.91 -0.69 4.57 2.04 -1.02 0.53 117.51 123.90 3isf h ILE 8 Ca 0.06 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 3isf h ILE 8 Cb 0.07 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.30 3isf h ILE 8 CO -0.10 0.12 0.18 -0.61 0.00 0.00 0.00 178.15 177.75 3isf h GLN 9 N 0.67 1.10 -0.38 2.37 4.15 -0.99 0.09 115.11 122.13 3isf h GLN 9 Ca 0.34 -0.26 0.02 0.00 0.77 0.00 0.00 58.65 59.52 3isf h GLN 9 Cb 0.29 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.81 3isf h GLN 9 CO -0.23 0.96 0.22 0.45 -1.93 0.00 0.00 178.83 178.30 3isf h HIS 10 N 1.03 0.41 -0.59 3.99 3.86 -0.26 0.55 115.15 124.14 3isf h HIS 10 Ca 0.22 0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.39 3isf h HIS 10 Cb 0.35 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 3isf h HIS 10 CO 0.03 0.24 0.17 -0.07 0.86 0.00 0.00 177.93 179.15 3isf h LEU 11 N 0.45 0.88 -1.26 2.43 3.38 -0.47 -0.97 115.31 119.74 3isf h LEU 11 Ca 0.15 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 3isf h LEU 11 Cb 0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3isf h LEU 11 CO -0.07 0.87 -0.36 0.78 0.09 0.00 0.00 178.44 179.75 3isf h ASN 12 N 0.85 0.01 -0.06 -0.43 2.35 -0.84 -0.64 115.58 116.82 3isf h ASN 12 Ca 0.19 -0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.91 3isf h ASN 12 Cb 0.32 -0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.68 3isf h ASN 12 CO -0.00 0.37 -0.06 0.50 -1.65 0.00 0.00 177.43 176.59 3isf h LYS 13 N 0.01 0.15 -0.77 0.81 3.64 0.33 0.13 116.57 120.87 3isf h LYS 13 Ca -0.00 -0.08 0.10 0.00 -1.27 0.00 0.00 60.65 59.40 3isf h LYS 13 Cb 0.65 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.39 3isf h LYS 13 CO 0.05 0.60 0.40 0.82 -2.27 0.00 0.00 179.45 179.05 3isf h ILE 14 N -0.29 0.85 -0.49 2.00 1.08 -1.15 -1.19 117.51 118.32 3isf h ILE 14 Ca 0.01 -0.23 0.01 0.00 -0.39 0.00 0.00 64.86 64.26 3isf h ILE 14 Cb 0.57 0.13 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 3isf h ILE 14 CO 0.02 0.12 0.31 0.25 -0.69 0.00 0.00 178.15 178.16 3isf h LEU 15 N 0.67 0.52 -0.79 1.44 5.85 -0.99 0.39 115.31 122.39 3isf h LEU 15 Ca 0.38 -0.01 0.11 0.00 0.84 0.00 0.00 57.88 59.20 3isf h LEU 15 Cb 0.40 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.24 3isf h LEU 15 CO -0.27 0.37 0.42 1.23 -0.34 0.00 0.00 178.44 179.85 3isf h GLY 16 N 0.62 1.23 1.15 3.75 0.00 -0.41 0.74 103.07 110.15 3isf h GLY 16 Ca 0.19 -0.27 -0.06 0.00 0.00 0.00 0.00 47.33 47.18 3isf h GLY 16 CO -0.06 0.07 0.17 3.43 0.00 0.00 0.00 176.54 180.15 3isf h ASN 17 N 0.69 1.00 -0.84 0.19 2.35 0.02 -2.35 115.58 116.64 3isf h ASN 17 Ca 0.40 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.91 3isf h ASN 17 Cb 0.43 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 3isf h ASN 17 CO -0.28 0.95 0.39 -0.33 -1.65 0.00 0.00 177.43 176.52 3isf h GLU 18 N 1.01 1.22 -0.38 0.81 4.39 -0.37 -1.90 114.58 119.36 3isf h GLU 18 Ca 0.22 -0.19 -0.11 0.00 0.34 0.00 0.00 59.36 59.62 3isf h GLU 18 Cb 0.34 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 3isf h GLU 18 CO -0.00 0.94 -0.20 -0.07 -1.16 0.00 0.00 179.01 178.52 3isf h LEU 19 N 1.20 0.73 -0.06 1.33 3.38 -0.55 -0.18 115.31 121.17 3isf h LEU 19 Ca 0.29 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3isf h LEU 19 Cb 0.14 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3isf h LEU 19 CO -0.03 0.92 0.04 0.40 0.09 0.00 0.00 178.44 179.86 3isf h ILE 20 N 0.64 1.03 -0.78 1.22 2.04 -1.24 -3.12 117.51 117.29 3isf h ILE 20 Ca 0.09 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.91 3isf h ILE 20 Cb 0.69 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.68 3isf h ILE 20 CO 0.05 0.02 0.51 0.00 0.00 0.00 0.00 178.15 178.74 3isf h ALA 21 N 1.01 1.00 -0.25 1.87 0.00 -0.96 0.51 119.26 122.45 3isf h ALA 21 Ca 0.02 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.95 3isf h ALA 21 Cb 0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 17.79 17.42 3isf h ALA 21 CO -0.00 0.38 -0.20 0.82 0.00 0.00 0.00 179.25 180.25 3isf h ILE 22 N 1.04 0.46 -0.26 0.00 2.04 -1.04 0.57 117.51 120.33 3isf h ILE 22 Ca 0.29 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.99 3isf h ILE 22 Cb -0.09 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 3isf h ILE 22 CO -0.08 0.00 -0.48 0.78 0.00 0.00 0.00 178.15 178.37 3isf h ASN 23 N -0.20 0.87 -0.15 1.72 4.21 -1.26 -1.24 115.58 119.54 3isf h ASN 23 Ca 0.14 -0.54 -0.00 0.00 1.21 0.00 0.00 56.30 57.11 3isf h ASN 23 Cb 0.41 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 37.35 3isf h ASN 23 CO -0.37 1.24 0.07 -0.61 -1.29 0.00 0.00 177.43 176.48 3isf h GLN 24 N 0.53 0.21 -0.20 0.81 4.15 -0.49 -1.76 115.11 118.36 3isf h GLN 24 Ca 0.01 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.28 3isf h GLN 24 Cb 1.09 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.73 3isf h GLN 24 CO 0.11 0.25 -0.39 1.88 -1.93 0.00 0.00 178.83 178.75 3isf h TYR 25 N 0.12 0.52 -0.26 3.99 0.05 -0.92 -0.58 116.97 119.89 3isf h TYR 25 Ca 0.05 -0.14 -0.12 0.00 0.05 0.00 0.00 58.73 58.57 3isf h TYR 25 Cb 0.11 -0.11 -0.00 0.00 1.01 0.00 0.00 36.73 37.73 3isf h TYR 25 CO -0.03 0.77 -0.32 0.35 -1.05 0.00 0.00 178.16 177.87 3isf h PHE 26 N 0.37 0.82 -0.43 4.88 3.04 -1.08 0.46 116.94 125.01 3isf h PHE 26 Ca 0.04 -0.26 -0.07 0.00 3.98 0.00 0.00 57.97 61.65 3isf h PHE 26 Cb 0.85 -0.17 -0.01 0.00 2.56 0.00 0.00 35.95 39.17 3isf h PHE 26 CO 0.03 1.01 -0.02 1.25 -2.02 0.00 0.00 178.31 178.56 3isf h LEU 27 N 0.40 0.76 -0.76 0.59 5.85 -1.30 -2.14 115.31 118.71 3isf h LEU 27 Ca 0.03 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.46 3isf h LEU 27 Cb 0.90 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.68 3isf h LEU 27 CO 0.08 0.90 0.49 0.45 -0.34 0.00 0.00 178.44 180.01 3isf h HIS 28 N 0.60 0.91 -0.03 1.25 3.86 -1.03 0.19 115.15 120.90 3isf h HIS 28 Ca 0.12 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.39 3isf h HIS 28 Cb 0.52 -0.30 -0.05 0.00 1.06 0.00 0.00 27.41 28.64 3isf h HIS 28 CO 0.04 0.53 -0.27 1.03 0.86 0.00 0.00 177.93 180.12 3isf h SER 29 N 0.95 -0.81 0.58 2.45 0.87 -0.79 0.14 113.55 116.94 3isf h SER 29 Ca 0.30 0.11 -0.06 0.00 -1.23 0.00 0.00 61.79 60.92 3isf h SER 29 Cb 0.01 0.33 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 3isf h SER 29 CO -0.11 -0.33 -0.29 0.03 -0.53 0.00 0.00 176.83 175.60 3isf h ARG 30 N -0.39 0.00 -0.12 2.24 -0.00 -1.09 -0.36 114.38 114.66 3isf h ARG 30 Ca 0.07 0.00 -0.05 0.00 -0.50 0.00 0.00 59.98 59.50 3isf h ARG 30 Cb 0.49 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.46 3isf h ARG 30 CO -0.26 0.29 -0.12 0.52 0.00 0.00 0.00 179.97 180.39 3isf h MET 31 N 0.00 0.30 -0.85 0.04 2.86 -0.58 -0.50 114.93 116.20 3isf h MET 31 Ca -0.00 -0.16 0.08 0.00 -2.06 0.00 0.00 59.70 57.56 3isf h MET 31 Cb 0.65 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.25 3isf h MET 31 CO 0.04 0.70 0.50 -1.49 1.06 0.00 0.00 176.91 177.72 3isf h TRP 32 N -0.10 0.92 -0.58 -0.22 6.55 -0.61 -1.61 115.95 120.31 3isf h TRP 32 Ca 0.02 0.03 -0.05 0.00 0.95 0.00 0.00 58.89 59.83 3isf h TRP 32 Cb 0.65 -0.29 -0.02 0.00 -0.86 0.00 0.00 29.16 28.64 3isf h TRP 32 CO 0.09 0.42 0.15 -0.91 -1.05 0.00 0.00 178.44 177.13 3isf h ASN 33 N 0.87 0.87 -0.94 -3.49 -0.26 -0.86 -0.52 115.58 111.26 3isf h ASN 33 Ca 0.39 -0.23 0.04 0.00 -0.56 0.00 0.00 56.30 55.95 3isf h ASN 33 Cb 0.29 -0.23 -0.06 0.00 -1.06 0.00 0.00 38.32 37.27 3isf h ASN 33 CO -0.22 0.87 0.61 -0.78 -1.06 0.00 0.00 177.43 176.86 3isf h ASP 34 N 0.83 1.01 0.54 5.81 3.58 -0.46 -0.69 116.42 127.04 3isf h ASP 34 Ca 0.18 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.63 3isf h ASP 34 Cb 0.33 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.16 3isf h ASP 34 CO 0.00 0.68 0.00 0.79 -2.88 0.00 0.00 179.24 177.83 3isf n TRP 35 N -4.50 0.00 -0.71 0.28 8.01 -0.66 -4.87 117.44 114.99 3isf n TRP 35 Ca 0.13 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.32 3isf n TRP 35 Cb 0.11 -0.29 0.00 0.00 -2.01 0.00 0.00 31.31 29.12 3isf n TRP 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3isf n GLY 36 N 1.10 0.61 2.77 6.99 0.00 -0.27 -4.96 105.19 111.44 3isf n GLY 36 Ca 0.13 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 3isf n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3isf n LEU 37 N 0.00 7.02 0.10 0.99 4.77 -0.24 -4.47 117.00 125.17 3isf n LEU 37 Ca 0.00 -4.81 -0.01 0.00 -0.03 0.00 0.00 56.01 51.16 3isf n LEU 37 Cb 0.00 -1.41 0.24 0.00 -2.33 0.00 0.00 43.42 39.92 3isf n LEU 37 CO 0.00 1.62 0.65 0.11 -1.33 0.00 0.00 177.39 178.44 3isf h LYS 38 N 5.35 0.21 -0.39 3.23 1.57 -0.57 -1.03 116.57 124.94 3isf h LYS 38 Ca 0.45 -0.10 -0.14 0.00 -1.87 0.00 0.00 60.65 59.00 3isf h LYS 38 Cb 0.53 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 3isf h LYS 38 CO 1.54 0.59 -0.31 -0.09 -0.57 0.00 0.00 179.45 180.60 3isf h ARG 39 N 0.18 0.86 0.10 3.15 2.43 -1.47 -1.02 114.38 118.61 3isf h ARG 39 Ca 0.02 -0.41 -0.00 0.00 -0.81 0.00 0.00 59.98 58.78 3isf h ARG 39 Cb 0.80 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 3isf h ARG 39 CO 0.06 1.05 -0.05 -0.07 -1.51 0.00 0.00 179.97 179.45 3isf h LEU 40 N 0.72 -0.11 -0.83 3.80 3.38 -1.53 -1.83 115.31 118.91 3isf h LEU 40 Ca 0.08 -0.32 0.18 0.00 0.09 0.00 0.00 57.88 57.91 3isf h LEU 40 Cb 0.87 0.03 -0.15 0.00 0.09 0.00 0.00 40.66 41.50 3isf h LEU 40 CO 0.08 0.28 -0.11 1.23 0.09 0.00 0.00 178.44 180.01 3isf h GLY 41 N -0.53 0.77 0.98 0.83 0.00 -1.17 0.70 103.07 104.65 3isf h GLY 41 Ca -0.01 0.21 -0.15 0.00 0.00 0.00 0.00 47.33 47.37 3isf h GLY 41 CO 0.02 -0.34 -0.46 0.00 0.00 0.00 0.00 176.54 175.76 3isf h ALA 42 N 1.82 0.33 -0.59 3.60 0.00 -1.17 -1.43 119.26 121.82 3isf h ALA 42 Ca 0.43 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 3isf h ALA 42 Cb 0.74 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3isf h ALA 42 CO -0.81 0.48 0.16 1.25 0.00 0.00 0.00 179.25 180.33 3isf h HIS 43 N 0.36 0.97 -0.44 0.00 6.17 -0.84 -2.53 115.15 118.85 3isf h HIS 43 Ca -0.00 -0.11 -0.12 0.00 0.71 0.00 0.00 60.37 60.85 3isf h HIS 43 Cb 1.07 -0.28 -0.01 0.00 2.52 0.00 0.00 27.41 30.71 3isf h HIS 43 CO 0.09 0.82 -0.20 1.49 0.71 0.00 0.00 177.93 180.84 3isf h GLU 44 N 0.84 0.87 -0.38 5.26 4.57 -0.88 -2.20 114.58 122.66 3isf h GLU 44 Ca 0.19 -0.35 0.08 0.00 -1.18 0.00 0.00 59.36 58.09 3isf h GLU 44 Cb 0.33 -0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 28.80 3isf h GLU 44 CO -0.00 0.99 -0.11 -0.92 -1.18 0.00 0.00 179.01 177.79 3isf h TYR 45 N 0.76 -0.23 -0.19 0.92 3.20 -1.16 -1.17 116.97 119.09 3isf h TYR 45 Ca 0.10 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.99 3isf h TYR 45 Cb 0.74 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 3isf h TYR 45 CO 0.04 -0.18 0.05 0.45 -1.64 0.00 0.00 178.16 176.88 3isf h HIS 46 N -0.02 0.26 -0.58 -3.82 3.86 -1.22 -0.68 115.15 112.95 3isf h HIS 46 Ca 0.18 -0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.32 3isf h HIS 46 Cb 0.29 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 3isf h HIS 46 CO -0.35 0.24 0.09 0.93 0.86 0.00 0.00 177.93 179.70 3isf h GLU 47 N 0.27 0.97 -0.32 2.45 4.39 -1.00 -1.89 114.58 119.44 3isf h GLU 47 Ca 0.07 -0.26 -0.02 0.00 0.34 0.00 0.00 59.36 59.48 3isf h GLU 47 Cb 0.11 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 3isf h GLU 47 CO -0.00 0.92 0.11 1.03 -1.16 0.00 0.00 179.01 179.91 3isf h SER 48 N 0.87 0.46 -0.89 1.42 0.87 -0.25 -2.25 113.55 113.78 3isf h SER 48 Ca 0.18 -0.19 0.06 0.00 -1.23 0.00 0.00 61.79 60.60 3isf h SER 48 Cb 0.43 -0.12 -0.06 0.00 -0.44 0.00 0.00 62.40 62.21 3isf h SER 48 CO 0.01 0.53 0.56 0.40 -0.53 0.00 0.00 176.83 177.80 3isf h ILE 49 N 0.37 1.06 -0.53 2.23 1.08 -1.12 -0.72 117.51 119.89 3isf h ILE 49 Ca 0.11 -0.35 -0.06 0.00 -0.39 0.00 0.00 64.86 64.16 3isf h ILE 49 Cb 0.23 -0.05 -0.02 0.00 -3.07 0.00 0.00 36.82 33.90 3isf h ILE 49 CO -0.00 0.19 0.09 0.44 -0.69 0.00 0.00 178.15 178.17 3isf h ASP 50 N 1.03 0.78 -0.08 1.72 3.32 -1.00 -1.12 116.42 121.06 3isf h ASP 50 Ca 0.38 -0.16 -0.14 0.00 0.02 0.00 0.00 57.03 57.14 3isf h ASP 50 Cb 0.15 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 3isf h ASP 50 CO -0.17 0.79 -0.40 -0.33 -1.72 0.00 0.00 179.24 177.42 3isf h GLU 51 N 0.79 0.61 -0.78 3.56 4.39 -0.80 -1.58 114.58 120.76 3isf h GLU 51 Ca 0.17 -0.31 -0.03 0.00 0.34 0.00 0.00 59.36 59.53 3isf h GLU 51 Cb 0.35 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.97 3isf h GLU 51 CO 0.01 0.90 0.36 0.52 -1.16 0.00 0.00 179.01 179.64 3isf h MET 52 N 0.50 1.13 -0.64 2.33 2.86 -0.39 -0.61 114.93 120.10 3isf h MET 52 Ca 0.04 -0.17 -0.05 0.00 -2.06 0.00 0.00 59.70 57.46 3isf h MET 52 Cb 0.91 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 32.34 3isf h MET 52 CO 0.08 0.88 0.20 0.87 1.06 0.00 0.00 176.91 180.00 3isf h LYS 53 N 1.12 1.00 -0.42 1.72 1.57 -0.96 -1.71 116.57 118.89 3isf h LYS 53 Ca 0.27 -0.22 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 3isf h LYS 53 Cb 0.13 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 3isf h LYS 53 CO -0.03 0.88 0.10 0.45 -0.57 0.00 0.00 179.45 180.28 3isf h HIS 54 N 0.93 0.71 -0.81 -1.35 3.86 -1.07 -2.12 115.15 115.30 3isf h HIS 54 Ca 0.21 -0.08 0.14 0.00 -1.16 0.00 0.00 60.37 59.47 3isf h HIS 54 Cb 0.30 -0.20 -0.09 0.00 1.06 0.00 0.00 27.41 28.48 3isf h HIS 54 CO 0.02 0.67 0.39 0.00 0.86 0.00 0.00 177.93 179.87 3isf h ALA 55 N 0.96 1.19 -0.35 2.45 0.00 -0.97 -1.61 119.26 120.92 3isf h ALA 55 Ca 0.13 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3isf h ALA 55 Cb 0.32 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3isf h ALA 55 CO 0.00 -0.12 0.21 0.22 0.00 0.00 0.00 179.25 179.55 3isf h ASP 56 N 0.57 0.42 -0.76 0.00 3.58 -1.01 -0.48 116.42 118.73 3isf h ASP 56 Ca 0.44 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.80 3isf h ASP 56 Cb 0.62 -0.11 -0.04 0.00 1.72 0.00 0.00 39.33 41.53 3isf h ASP 56 CO -0.37 0.36 0.39 0.11 -2.88 0.00 0.00 179.24 176.85 3isf h LYS 57 N 0.45 1.10 -0.39 0.28 1.57 -0.89 -1.37 116.57 117.32 3isf h LYS 57 Ca 0.12 -0.15 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 3isf h LYS 57 Cb 0.02 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 3isf h LYS 57 CO -0.02 0.84 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.52 3isf h LEU 58 N 1.10 0.77 -0.69 2.94 3.38 -1.02 -1.51 115.31 120.27 3isf h LEU 58 Ca 0.27 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3isf h LEU 58 Cb 0.09 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3isf h LEU 58 CO -0.04 0.96 0.42 0.40 0.09 0.00 0.00 178.44 180.27 3isf h ILE 59 N 0.57 1.20 -0.42 1.22 2.04 -0.83 0.16 117.51 121.45 3isf h ILE 59 Ca 0.10 -0.43 -0.04 0.00 1.00 0.00 0.00 64.86 65.48 3isf h ILE 59 Cb 0.63 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 3isf h ILE 59 CO 0.04 0.20 0.09 -0.33 0.00 0.00 0.00 178.15 178.15 3isf h GLU 60 N 0.93 0.68 -0.17 2.37 5.08 -1.08 -1.98 114.58 120.41 3isf h GLU 60 Ca 0.25 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3isf h GLU 60 Cb -0.04 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 3isf h GLU 60 CO -0.05 0.71 0.07 -0.09 -1.00 0.00 0.00 179.01 178.65 3isf h ARG 61 N 0.54 0.25 -0.39 2.33 9.65 -1.13 -1.66 114.38 123.97 3isf h ARG 61 Ca 0.13 -0.04 0.08 0.00 -1.10 0.00 0.00 59.98 59.04 3isf h ARG 61 Cb 0.34 -0.04 -0.07 0.00 -1.39 0.00 0.00 29.97 28.81 3isf h ARG 61 CO 0.00 0.31 -0.05 0.82 2.80 0.00 0.00 179.97 183.86 3isf h ILE 62 N 0.13 0.66 -0.53 1.20 2.04 -0.87 -1.55 117.51 118.59 3isf h ILE 62 Ca 0.06 -0.02 -0.05 0.00 1.00 0.00 0.00 64.86 65.85 3isf h ILE 62 Cb 0.15 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 3isf h ILE 62 CO -0.01 0.01 0.13 -0.07 0.00 0.00 0.00 178.15 178.22 3isf h LEU 63 N 0.05 0.75 -0.81 1.44 -0.00 -1.27 -1.59 115.31 113.87 3isf h LEU 63 Ca 0.19 -0.13 0.01 0.00 -0.00 0.00 0.00 57.88 57.95 3isf h LEU 63 Cb 0.28 -0.20 -0.04 0.00 -0.00 0.00 0.00 40.66 40.71 3isf h LEU 63 CO -0.36 0.74 0.53 0.15 -0.00 0.00 0.00 178.44 179.49 3isf h PHE 64 N 0.78 1.03 0.00 1.13 3.57 -0.83 -2.31 116.94 120.32 3isf h PHE 64 Ca 0.17 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.69 3isf h PHE 64 Cb 0.28 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.67 3isf h PHE 64 CO 0.02 0.66 0.00 1.28 -2.23 0.00 0.00 178.31 178.03 3isf n LEU 65 N -4.51 0.00 -1.14 0.59 4.77 -0.62 -4.86 117.00 111.23 3isf n LEU 65 Ca 0.08 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.95 3isf n LEU 65 Cb 0.02 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.09 3isf n LEU 65 CO 0.36 0.00 -0.13 -0.62 -1.33 0.00 0.00 177.39 175.67 3isf n GLU 66 N -0.83 -0.87 -2.78 3.23 1.02 -0.87 -0.92 120.64 118.62 3isf n GLU 66 Ca 0.13 0.70 -0.21 0.00 -0.02 0.00 0.00 57.16 57.75 3isf n GLU 66 Cb 0.06 -4.78 0.08 0.00 -0.02 0.00 0.00 31.44 26.78 3isf n GLU 66 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3isf s GLY 67 N -2.64 1.76 -0.34 0.62 0.00 -0.67 -4.53 107.32 101.52 3isf s GLY 67 Ca 0.00 -1.86 -0.05 0.00 0.00 0.00 0.00 44.72 42.81 3isf s GLY 67 CO 0.00 -1.37 0.09 1.08 0.00 0.00 0.00 173.10 172.90 3isf s LEU 68 N -4.89 4.33 0.23 0.66 1.43 -1.26 -4.29 118.68 114.89 3isf s LEU 68 Ca 0.63 -1.26 -0.32 0.00 -1.03 0.00 0.00 54.13 52.16 3isf s LEU 68 Cb -0.06 -1.83 -0.13 0.00 0.03 0.00 0.00 46.19 44.20 3isf s LEU 68 CO 0.41 -0.34 1.54 -2.65 0.23 0.00 0.00 176.35 175.55 3isf n PRO 69 N 4.75 2.33 -3.33 1.29 -0.02 -1.26 -4.97 135.00 133.79 3isf n PRO 69 Ca -0.12 0.83 -0.45 0.00 -2.02 0.00 0.00 63.50 61.75 3isf n PRO 69 Cb 0.44 -2.58 -0.07 0.00 -0.02 0.00 0.00 33.50 31.27 3isf n PRO 69 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3isf s ASN 70 N 0.63 6.17 -0.00 2.55 3.84 -1.26 -4.85 114.94 122.02 3isf s ASN 70 Ca 0.71 -1.34 0.11 0.00 0.21 0.00 0.00 52.86 52.56 3isf s ASN 70 Cb -0.60 -2.21 0.32 0.00 -0.55 0.00 0.00 41.25 38.22 3isf s ASN 70 CO 0.44 -0.73 1.27 0.18 -2.79 0.00 0.00 177.10 175.47 3isf n LEU 71 N 5.39 2.98 0.02 3.21 4.32 -1.26 -4.63 117.00 127.03 3isf n LEU 71 Ca -0.12 -2.02 -0.13 0.00 -0.02 0.00 0.00 56.01 53.72 3isf n LEU 71 Cb 0.43 -0.25 -0.14 0.00 -1.62 0.00 0.00 43.42 41.85 3isf n LEU 71 CO 0.50 0.74 -0.46 -0.61 -1.22 0.00 0.00 177.39 176.33 3isf h GLN 72 N 2.11 0.13 -5.33 3.23 5.75 -2.02 -3.44 115.11 115.53 3isf h GLN 72 Ca 0.00 -0.21 -0.62 0.00 -0.15 0.00 0.00 58.65 57.67 3isf h GLN 72 Cb 0.75 0.08 -0.13 0.00 1.07 0.00 0.00 27.48 29.26 3isf h GLN 72 CO 0.00 0.86 -0.08 -0.51 -2.65 0.00 0.00 178.83 176.46 3isf s ASP 73 N -6.60 6.40 -0.23 -0.69 1.01 -1.26 -5.03 116.67 110.28 3isf s ASP 73 Ca -0.09 0.48 0.02 0.00 0.71 0.00 0.00 52.55 53.67 3isf s ASP 73 Cb 0.08 -2.26 0.04 0.00 1.01 0.00 0.00 42.92 41.78 3isf s ASP 73 CO 0.82 -0.24 -0.14 -0.22 0.21 0.00 0.00 175.17 175.61 3isf s LEU 74 N 2.12 2.90 0.00 1.23 2.96 -1.26 -4.90 118.68 121.72 3isf s LEU 74 Ca 0.20 -1.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.08 3isf s LEU 74 Cb -0.16 -1.54 0.00 0.00 0.50 0.00 0.00 46.19 45.00 3isf s LEU 74 CO 0.09 -0.11 0.00 0.61 -1.32 0.00 0.00 176.35 175.62 3isf n GLY 75 N 4.54 -1.80 3.66 7.98 0.00 -1.26 -4.96 105.19 113.35 3isf n GLY 75 Ca -0.17 -1.52 -0.43 0.00 0.00 0.00 0.00 46.02 43.90 3isf n GLY 75 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3isf s LYS 76 N -2.03 4.26 0.18 1.61 2.47 -1.26 -4.90 119.74 120.07 3isf s LYS 76 Ca 0.00 1.47 -0.30 0.00 -1.56 0.00 0.00 55.97 55.58 3isf s LYS 76 Cb 0.00 -3.68 -0.08 0.00 -1.46 0.00 0.00 37.83 32.61 3isf s LYS 76 CO 0.00 -0.64 1.18 -0.51 0.16 0.00 0.00 175.35 175.54 3isf s LEU 77 N 3.24 4.45 -0.77 5.43 1.02 -1.26 -4.99 118.68 125.81 3isf s LEU 77 Ca 0.48 2.21 -0.14 0.00 0.02 0.00 0.00 54.13 56.70 3isf s LEU 77 Cb -0.17 -3.61 0.20 0.00 0.02 0.00 0.00 46.19 42.63 3isf s LEU 77 CO 0.09 -0.35 0.71 -0.76 0.02 0.00 0.00 176.35 176.07 3isf s LEU 78 N -0.25 6.64 -0.26 1.79 1.43 -1.26 -5.04 118.68 121.74 3isf s LEU 78 Ca 0.52 -2.53 -0.16 0.00 -1.03 0.00 0.00 54.13 50.94 3isf s LEU 78 Cb -0.32 -2.21 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 3isf s LEU 78 CO 0.36 -0.62 0.40 -0.63 0.23 0.00 0.00 176.35 176.09 3isf s ILE 79 N 0.42 5.16 0.56 -0.59 -1.09 -1.26 -4.68 121.20 119.73 3isf s ILE 79 Ca 0.15 0.64 0.02 0.00 -2.23 0.00 0.00 60.65 59.24 3isf s ILE 79 Cb -0.14 -3.72 0.05 0.00 -1.58 0.00 0.00 42.46 37.07 3isf s ILE 79 CO -0.07 0.16 0.79 -0.83 -1.23 0.00 0.00 174.94 173.76 3isf s GLY 80 N 1.54 1.83 0.00 6.18 0.00 -1.26 -4.97 107.32 110.63 3isf s GLY 80 Ca 0.17 -1.50 0.05 0.00 0.00 0.00 0.00 44.72 43.44 3isf s GLY 80 CO 0.09 -1.17 0.26 -1.84 0.00 0.00 0.00 173.10 170.44 3isf n GLU 81 N -2.35 4.85 -4.15 2.90 0.28 -1.26 -4.77 120.64 116.14 3isf n GLU 81 Ca 0.10 -0.06 -0.15 0.00 -0.16 0.00 0.00 57.16 56.88 3isf n GLU 81 Cb 0.60 -0.78 -0.06 0.00 1.43 0.00 0.00 31.44 32.63 3isf n GLU 81 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 3isf s ASN 82 N -1.42 0.89 0.12 -1.84 2.20 -1.26 -5.02 114.94 108.61 3isf s ASN 82 Ca 0.02 -1.49 -0.22 0.00 -0.94 0.00 0.00 52.86 50.24 3isf s ASN 82 Cb 0.04 0.58 -0.04 0.00 -2.00 0.00 0.00 41.25 39.82 3isf s ASN 82 CO 0.21 -1.14 1.69 0.74 -2.94 0.00 0.00 177.10 175.66 3isf h THR 83 N 2.22 0.72 -0.99 0.54 2.02 -1.99 0.94 112.91 116.37 3isf h THR 83 Ca -0.28 0.00 0.02 0.00 0.77 0.00 0.00 66.41 66.91 3isf h THR 83 Cb 1.24 0.72 -0.05 0.00 -1.74 0.00 0.00 68.15 68.32 3isf h THR 83 CO 0.40 0.00 0.66 -0.61 0.37 0.00 0.00 175.52 176.34 3isf h GLN 84 N -0.11 1.28 -0.24 6.66 4.15 -2.00 -1.61 115.11 123.25 3isf h GLN 84 Ca 0.08 -0.08 -0.20 0.00 0.77 0.00 0.00 58.65 59.22 3isf h GLN 84 Cb 0.22 -0.29 0.00 0.00 0.21 0.00 0.00 27.48 27.63 3isf h GLN 84 CO -0.19 0.85 -0.62 0.93 -1.93 0.00 0.00 178.83 177.88 3isf h GLU 85 N 1.32 0.84 -0.67 1.69 5.08 -1.75 -2.19 114.58 118.90 3isf h GLU 85 Ca 0.37 -0.57 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 3isf h GLU 85 Cb -0.12 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 3isf h GLU 85 CO -0.09 1.20 0.38 0.52 -1.00 0.00 0.00 179.01 180.02 3isf h MET 86 N 0.62 0.92 -0.41 2.33 2.86 -0.57 0.18 114.93 120.86 3isf h MET 86 Ca -0.01 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 3isf h MET 86 Cb 1.23 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.69 3isf h MET 86 CO 0.13 0.68 0.15 -0.07 1.06 0.00 0.00 176.91 178.86 3isf h LEU 87 N 0.91 0.58 -0.90 1.22 3.38 -1.28 -1.48 115.31 117.75 3isf h LEU 87 Ca 0.24 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3isf h LEU 87 Cb 0.01 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 3isf h LEU 87 CO -0.04 0.61 0.32 -0.61 0.09 0.00 0.00 178.44 178.80 3isf h GLN 88 N 0.52 1.12 -0.38 1.13 5.75 -0.99 -0.35 115.11 121.91 3isf h GLN 88 Ca 0.13 -0.19 -0.02 0.00 -0.15 0.00 0.00 58.65 58.43 3isf h GLN 88 Cb 0.22 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 3isf h GLN 88 CO -0.01 0.90 0.17 0.00 -2.65 0.00 0.00 178.83 177.24 3isf h ASP 90 N 0.47 0.78 -0.34 0.00 3.32 -0.78 -1.09 116.42 118.78 3isf h ASP 90 Ca 0.13 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 3isf h ASP 90 Cb 0.14 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 3isf h ASP 90 CO -0.01 0.51 0.03 0.25 -1.72 0.00 0.00 179.24 178.30 3isf h LEU 91 N 0.92 0.57 -1.05 1.55 5.85 -0.63 -0.64 115.31 121.88 3isf h LEU 91 Ca 0.33 -0.28 0.02 0.00 0.84 0.00 0.00 57.88 58.79 3isf h LEU 91 Cb 0.11 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 3isf h LEU 91 CO -0.15 0.71 0.64 0.78 -0.34 0.00 0.00 178.44 180.08 3isf h ASN 92 N 0.41 1.11 -0.10 1.25 2.35 -0.64 -0.55 115.58 119.41 3isf h ASN 92 Ca 0.10 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3isf h ASN 92 Cb 0.40 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.49 3isf h ASN 92 CO 0.01 0.79 0.06 0.25 -1.65 0.00 0.00 177.43 176.89 3isf h LEU 93 N 1.30 0.12 -1.19 1.61 5.85 -0.84 -2.78 115.31 119.39 3isf h LEU 93 Ca 0.36 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.97 3isf h LEU 93 Cb -0.12 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 3isf h LEU 93 CO -0.09 0.15 -0.00 -0.33 -0.34 0.00 0.00 178.44 177.83 3isf h GLU 94 N 0.09 0.56 -0.38 1.25 4.39 -0.44 -1.22 114.58 118.83 3isf h GLU 94 Ca 0.04 -0.12 -0.12 0.00 0.34 0.00 0.00 59.36 59.49 3isf h GLU 94 Cb 0.05 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 3isf h GLU 94 CO -0.01 0.58 -0.25 -0.07 -1.16 0.00 0.00 179.01 178.10 3isf h LEU 95 N 0.53 0.81 -0.44 1.33 3.38 -1.02 -1.06 115.31 118.84 3isf h LEU 95 Ca 0.11 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 3isf h LEU 95 Cb 0.35 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3isf h LEU 95 CO 0.01 1.03 0.10 0.50 0.09 0.00 0.00 178.44 180.17 3isf h LYS 96 N 0.68 0.72 -0.77 1.13 1.63 -1.26 -2.70 116.57 116.00 3isf h LYS 96 Ca 0.09 -0.18 0.03 0.00 -0.85 0.00 0.00 60.65 59.74 3isf h LYS 96 Cb 0.78 -0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 32.27 3isf h LYS 96 CO 0.06 0.73 0.49 0.00 -3.45 0.00 0.00 179.45 177.29 3isf h ALA 97 N 0.96 1.01 -0.35 5.00 0.00 -0.88 -1.56 119.26 123.44 3isf h ALA 97 Ca 0.14 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.85 3isf h ALA 97 Cb 0.34 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3isf h ALA 97 CO 0.00 0.31 -0.44 1.15 0.00 0.00 0.00 179.25 180.27 3isf h THR 98 N 0.97 1.27 -0.38 0.00 2.02 -1.25 -0.55 112.91 114.99 3isf h THR 98 Ca 0.31 -1.62 -0.01 0.00 0.77 0.00 0.00 66.41 65.86 3isf h THR 98 Cb -0.00 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 3isf h THR 98 CO -0.11 0.54 0.21 0.50 0.37 0.00 0.00 175.52 177.03 3isf h LYS 99 N 0.73 0.53 -0.45 6.66 3.64 -1.09 -2.48 116.57 124.10 3isf h LYS 99 Ca 0.05 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 3isf h LYS 99 Cb 1.04 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.73 3isf h LYS 99 CO 0.10 0.44 0.19 -0.44 -2.27 0.00 0.00 179.45 177.47 3isf h ASP 100 N 0.49 0.58 -0.29 4.20 3.32 -0.94 -2.65 116.42 121.13 3isf h ASP 100 Ca 0.13 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.09 3isf h ASP 100 Cb 0.06 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3isf h ASP 100 CO -0.02 0.52 0.03 -0.07 -1.72 0.00 0.00 179.24 177.97 3isf h LEU 101 N 0.64 0.47 -0.48 1.55 -0.00 -0.87 -1.84 115.31 114.79 3isf h LEU 101 Ca 0.16 -0.28 0.06 0.00 -0.00 0.00 0.00 57.88 57.82 3isf h LEU 101 Cb 0.11 -0.13 -0.05 0.00 -0.00 0.00 0.00 40.66 40.59 3isf h LEU 101 CO -0.02 0.64 0.19 0.03 -0.00 0.00 0.00 178.44 179.28 3isf h ARG 102 N 0.29 0.36 -0.57 1.13 3.08 -1.28 -0.74 114.38 116.66 3isf h ARG 102 Ca 0.08 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 3isf h ARG 102 Cb 0.38 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 3isf h ARG 102 CO 0.01 0.24 0.14 0.93 -1.07 0.00 0.00 179.97 180.22 3isf h GLU 103 N 0.38 0.88 -0.57 0.04 5.08 -1.29 -1.19 114.58 117.90 3isf h GLU 103 Ca 0.23 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 3isf h GLU 103 Cb 0.21 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3isf h GLU 103 CO -0.21 0.79 0.18 0.00 -1.00 0.00 0.00 179.01 178.77 3isf h ALA 104 N 1.30 0.75 -0.38 3.43 0.00 -0.89 -2.67 119.26 120.79 3isf h ALA 104 Ca 0.18 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3isf h ALA 104 Cb 0.31 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3isf h ALA 104 CO -0.00 0.41 0.00 0.82 0.00 0.00 0.00 179.25 180.48 3isf h ILE 105 N 0.80 1.26 -0.52 0.00 2.04 -0.74 -0.49 117.51 119.86 3isf h ILE 105 Ca 0.18 -0.99 0.10 0.00 1.00 0.00 0.00 64.86 65.16 3isf h ILE 105 Cb 0.28 1.15 -0.10 0.00 -0.74 0.00 0.00 36.82 37.41 3isf h ILE 105 CO -0.01 0.33 -0.19 0.58 0.00 0.00 0.00 178.15 178.87 3isf h VAL 106 N 0.49 0.39 -0.49 1.67 2.07 -1.16 -1.34 116.25 117.88 3isf h VAL 106 Ca 0.11 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.50 3isf h VAL 106 Cb 0.46 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 3isf h VAL 106 CO 0.02 0.00 -0.18 -0.74 0.02 0.00 0.00 177.57 176.69 3isf h HIS 107 N -0.07 1.13 -0.96 1.57 -0.00 -1.06 -2.39 115.15 113.38 3isf h HIS 107 Ca 0.24 -0.26 0.07 0.00 -0.00 0.00 0.00 60.37 60.42 3isf h HIS 107 Cb 0.44 -0.27 -0.07 0.00 -0.00 0.00 0.00 27.41 27.52 3isf h HIS 107 CO -0.48 1.08 0.61 0.00 -0.00 0.00 0.00 177.93 179.14 3isf h GLU 109 N 1.09 -0.41 -0.47 0.00 4.57 -1.08 0.47 114.58 118.75 3isf h GLU 109 Ca 0.42 0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.72 3isf h GLU 109 Cb 0.20 0.09 -0.10 0.00 -0.16 0.00 0.00 28.75 28.78 3isf h GLU 109 CO -0.18 -0.21 -0.22 0.37 -1.18 0.00 0.00 179.01 177.59 3isf h GLN 110 N -0.51 -0.11 -0.67 1.92 4.15 -1.08 -1.88 115.11 116.92 3isf h GLN 110 Ca -0.04 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.38 3isf h GLN 110 Cb 0.38 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.10 3isf h GLN 110 CO 0.07 -0.07 0.00 1.33 -1.93 0.00 0.00 178.83 178.23 3isf n VAL 111 N -5.40 1.35 -2.78 2.39 0.24 -0.72 -4.93 118.33 108.47 3isf n VAL 111 Ca 0.04 -0.76 -0.20 0.00 -2.04 0.00 0.00 64.34 61.38 3isf n VAL 111 Cb 0.31 -0.20 0.02 0.00 -1.47 0.00 0.00 33.84 32.50 3isf n VAL 111 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 3isf n HIS 112 N 0.47 -1.54 -2.99 6.34 8.25 -0.71 -4.92 115.22 120.12 3isf n HIS 112 Ca 0.16 0.34 -0.44 0.00 -0.26 0.00 0.00 57.72 57.53 3isf n HIS 112 Cb 0.69 -4.04 0.00 0.00 1.12 0.00 0.00 29.99 27.77 3isf n HIS 112 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3isf n ASP 113 N -1.96 5.76 0.08 0.41 -0.08 0.08 -4.81 116.55 116.04 3isf n ASP 113 Ca -0.14 -3.19 -0.05 0.00 -1.51 0.00 0.00 54.79 49.90 3isf n ASP 113 Cb 0.63 -1.38 0.11 0.00 2.34 0.00 0.00 41.12 42.81 3isf n ASP 113 CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 3isf h TYR 114 N 6.10 0.31 -0.36 -0.67 0.05 -1.92 -1.80 116.97 118.68 3isf h TYR 114 Ca 0.24 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.90 3isf h TYR 114 Cb 0.73 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 38.40 3isf h TYR 114 CO 0.98 0.80 0.24 0.28 -1.05 0.00 0.00 178.16 179.41 3isf h VAL 115 N 0.18 1.10 -0.69 -2.88 2.07 -1.97 -1.81 116.25 112.24 3isf h VAL 115 Ca -0.01 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 3isf h VAL 115 Cb 1.14 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 3isf h VAL 115 CO 0.10 0.09 0.39 0.28 0.02 0.00 0.00 177.57 178.45 3isf h SER 116 N 0.49 0.86 -0.46 0.57 0.02 -1.94 -2.02 113.55 111.07 3isf h SER 116 Ca 0.13 -0.09 0.09 0.00 -0.84 0.00 0.00 61.79 61.08 3isf h SER 116 Cb -0.05 -0.22 -0.08 0.00 0.14 0.00 0.00 62.40 62.19 3isf h SER 116 CO -0.03 0.70 -0.02 -0.09 -1.14 0.00 0.00 176.83 176.25 3isf h ARG 117 N 0.95 0.08 -0.45 3.45 2.43 -1.24 -2.10 114.38 117.51 3isf h ARG 117 Ca 0.25 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.39 3isf h ARG 117 Cb 0.03 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 3isf h ARG 117 CO -0.04 0.06 0.22 0.22 -1.51 0.00 0.00 179.97 178.91 3isf h ASP 118 N 0.09 0.59 -0.74 -3.80 3.58 -0.93 1.00 116.42 116.20 3isf h ASP 118 Ca 0.23 -0.13 0.06 0.00 0.42 0.00 0.00 57.03 57.62 3isf h ASP 118 Cb 0.34 -0.15 -0.06 0.00 1.72 0.00 0.00 39.33 41.18 3isf h ASP 118 CO -0.40 0.55 0.43 0.25 -2.88 0.00 0.00 179.24 177.19 3isf h LEU 119 N 0.59 0.65 -0.87 2.28 6.46 -1.25 -1.98 115.31 121.19 3isf h LEU 119 Ca 0.16 0.03 -0.11 0.00 -0.12 0.00 0.00 57.88 57.83 3isf h LEU 119 Cb 0.12 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 39.93 3isf h LEU 119 CO -0.02 0.41 -0.54 -0.07 -0.62 0.00 0.00 178.44 177.61 3isf h LEU 120 N 0.78 0.00 -0.60 2.25 3.38 -0.77 -2.34 115.31 118.01 3isf h LEU 120 Ca 0.33 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.15 3isf h LEU 120 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3isf h LEU 120 CO -0.19 0.54 -0.53 0.50 0.09 0.00 0.00 178.44 178.85 3isf h LYS 121 N 0.00 0.47 -0.29 1.13 3.64 -0.25 -0.87 116.57 120.40 3isf h LYS 121 Ca -0.01 -0.28 -0.19 0.00 -1.27 0.00 0.00 60.65 58.90 3isf h LYS 121 Cb 1.00 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 3isf h LYS 121 CO 0.07 0.88 -0.55 -0.44 -2.27 0.00 0.00 179.45 177.14 3isf h ASP 122 N 0.36 0.97 -0.30 4.20 3.32 -1.07 -1.16 116.42 122.74 3isf h ASP 122 Ca 0.01 -0.53 -0.02 0.00 0.02 0.00 0.00 57.03 56.52 3isf h ASP 122 Cb 1.05 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 3isf h ASP 122 CO 0.09 1.33 0.12 0.40 -1.72 0.00 0.00 179.24 179.46 3isf h ILE 123 N 0.67 1.18 -0.54 0.35 2.04 -1.37 -2.45 117.51 117.39 3isf h ILE 123 Ca 0.01 -0.55 0.09 0.00 1.00 0.00 0.00 64.86 65.41 3isf h ILE 123 Cb 1.16 0.98 -0.07 0.00 -0.74 0.00 0.00 36.82 38.15 3isf h ILE 123 CO 0.12 0.19 0.13 0.25 0.00 0.00 0.00 178.15 178.85 3isf h LEU 124 N 0.34 0.05 -0.35 1.44 5.85 -0.99 0.21 115.31 121.87 3isf h LEU 124 Ca 0.10 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.96 3isf h LEU 124 Cb 0.18 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 3isf h LEU 124 CO -0.01 0.05 0.07 -0.08 -0.34 0.00 0.00 178.44 178.13 3isf h GLU 125 N 0.28 0.18 -0.66 1.25 4.81 -1.13 0.40 114.58 119.70 3isf h GLU 125 Ca 0.27 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.45 3isf h GLU 125 Cb 0.37 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 3isf h GLU 125 CO -0.33 0.12 0.26 1.03 -0.73 0.00 0.00 179.01 179.36 3isf h SER 126 N 0.19 0.92 -0.02 1.04 0.87 -0.86 -0.33 113.55 115.36 3isf h SER 126 Ca 0.17 -0.18 -0.10 0.00 -1.23 0.00 0.00 61.79 60.46 3isf h SER 126 Cb 0.19 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 3isf h SER 126 CO -0.22 0.85 -0.27 -0.33 -0.53 0.00 0.00 176.83 176.32 3isf h GLU 127 N 0.94 0.45 -0.51 2.24 4.39 0.18 -1.40 114.58 120.89 3isf h GLU 127 Ca 0.22 -0.18 -0.12 0.00 0.34 0.00 0.00 59.36 59.63 3isf h GLU 127 Cb 0.22 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 3isf h GLU 127 CO -0.02 0.69 -0.14 0.93 -1.16 0.00 0.00 179.01 179.31 3isf h GLU 128 N 0.40 0.97 -0.59 2.33 5.08 0.13 -0.65 114.58 122.25 3isf h GLU 128 Ca 0.06 -0.37 0.10 0.00 -1.00 0.00 0.00 59.36 58.14 3isf h GLU 128 Cb 0.69 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.81 3isf h GLU 128 CO 0.05 1.04 0.20 0.93 -1.00 0.00 0.00 179.01 180.23 3isf h GLU 129 N 0.86 0.35 -0.54 2.33 5.08 -0.69 -1.31 114.58 120.66 3isf h GLU 129 Ca 0.13 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 3isf h GLU 129 Cb 0.70 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 3isf h GLU 129 CO 0.05 0.23 0.35 1.25 -1.00 0.00 0.00 179.01 179.89 3isf h HIS 130 N 0.36 0.65 -0.54 4.33 2.76 -0.56 -1.61 115.15 120.54 3isf h HIS 130 Ca 0.30 0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.56 3isf h HIS 130 Cb 0.39 -0.22 -0.06 0.00 1.55 0.00 0.00 27.41 29.07 3isf h HIS 130 CO -0.19 0.40 0.21 0.82 -1.30 0.00 0.00 177.93 177.87 3isf h ILE 131 N 0.70 0.83 -0.73 6.26 2.04 -0.79 0.57 117.51 126.39 3isf h ILE 131 Ca 0.21 -0.14 0.04 0.00 1.00 0.00 0.00 64.86 65.97 3isf h ILE 131 Cb -0.04 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 36.38 3isf h ILE 131 CO -0.06 0.07 0.45 -0.78 0.00 0.00 0.00 178.15 177.83 3isf h ASP 132 N 0.40 0.72 -0.39 1.72 3.58 -0.69 0.77 116.42 122.53 3isf h ASP 132 Ca 0.26 0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.67 3isf h ASP 132 Cb 0.28 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 3isf h ASP 132 CO -0.25 0.49 0.06 0.22 -2.88 0.00 0.00 179.24 176.87 3isf h TYR 133 N 0.86 0.70 0.19 0.28 3.20 -0.62 -1.07 116.97 120.50 3isf h TYR 133 Ca 0.30 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 3isf h TYR 133 Cb 0.07 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.15 3isf h TYR 133 CO -0.05 0.69 -0.09 -0.07 -1.64 0.00 0.00 178.16 177.01 3isf h LEU 134 N 0.50 -0.22 -0.87 2.82 -0.00 -0.41 -1.26 115.31 115.87 3isf h LEU 134 Ca 0.12 -0.20 0.08 0.00 -0.00 0.00 0.00 57.88 57.87 3isf h LEU 134 Cb 0.38 0.06 -0.07 0.00 -0.00 0.00 0.00 40.66 41.03 3isf h LEU 134 CO 0.01 0.09 0.53 -0.33 -0.00 0.00 0.00 178.44 178.74 3isf h GLU 135 N -0.55 0.90 -0.76 1.13 5.08 -0.88 -2.17 114.58 117.33 3isf h GLU 135 Ca -0.03 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3isf h GLU 135 Cb 0.41 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 3isf h GLU 135 CO 0.04 0.59 0.47 1.15 -1.00 0.00 0.00 179.01 180.27 3isf h THR 136 N 0.92 1.21 -0.56 1.13 2.02 -1.09 -1.64 112.91 114.91 3isf h THR 136 Ca 0.40 -0.43 -0.11 0.00 0.77 0.00 0.00 66.41 67.04 3isf h THR 136 Cb 0.26 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 3isf h THR 136 CO -0.20 0.21 -0.07 1.56 0.37 0.00 0.00 175.52 177.39 3isf h GLN 137 N 1.03 1.03 -0.63 6.66 1.08 -0.64 -0.87 115.11 122.77 3isf h GLN 137 Ca 0.27 -0.36 -0.03 0.00 -1.45 0.00 0.00 58.65 57.08 3isf h GLN 137 Cb -0.06 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.26 3isf h GLN 137 CO -0.05 1.05 0.26 -0.07 -0.95 0.00 0.00 178.83 179.07 3isf h LEU 138 N 0.91 0.83 -0.75 1.46 -0.00 -1.28 -0.67 115.31 115.81 3isf h LEU 138 Ca 0.15 -0.11 -0.13 0.00 -0.00 0.00 0.00 57.88 57.79 3isf h LEU 138 Cb 0.63 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 41.06 3isf h LEU 138 CO 0.04 0.74 -0.61 1.23 -0.00 0.00 0.00 178.44 179.84 3isf h GLY 139 N 1.00 0.06 1.30 0.83 0.00 -0.98 -2.96 103.07 102.32 3isf h GLY 139 Ca 0.21 -0.08 -0.27 0.00 0.00 0.00 0.00 47.33 47.20 3isf h GLY 139 CO -0.02 0.07 -1.08 1.41 0.00 0.00 0.00 176.54 176.92 3isf h LEU 140 N 0.04 0.82 -0.93 3.11 3.38 -0.60 -1.80 115.31 119.33 3isf h LEU 140 Ca -0.01 -0.69 0.18 0.00 0.09 0.00 0.00 57.88 57.45 3isf h LEU 140 Cb 1.09 -0.25 -0.10 0.00 0.09 0.00 0.00 40.66 41.48 3isf h LEU 140 CO 0.08 1.49 0.52 0.40 0.09 0.00 0.00 178.44 181.02 3isf h ILE 141 N 0.33 0.69 -0.43 1.22 2.04 -1.08 -0.06 117.51 120.21 3isf h ILE 141 Ca -0.13 -0.23 -0.07 0.00 1.00 0.00 0.00 64.86 65.42 3isf h ILE 141 Cb 1.74 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 3isf h ILE 141 CO 0.21 0.12 -0.02 1.56 0.00 0.00 0.00 178.15 180.02 3isf h GLN 142 N 0.67 0.77 0.04 2.37 1.08 -1.35 -2.00 115.11 116.69 3isf h GLN 142 Ca 0.53 -0.26 -0.22 0.00 -1.45 0.00 0.00 58.65 57.25 3isf h GLN 142 Cb 0.82 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 28.17 3isf h GLN 142 CO -0.39 0.85 -1.01 0.87 -0.95 0.00 0.00 178.83 178.20 3isf h LYS 143 N 0.61 0.14 -0.01 1.46 1.57 -0.66 -3.35 116.57 116.33 3isf h LYS 143 Ca 0.12 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3isf h LYS 143 Cb 0.52 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.90 3isf h LYS 143 CO 0.03 1.03 -0.29 1.33 -0.57 0.00 0.00 179.45 180.97 3isf n VAL 144 N -3.52 0.00 0.00 0.50 0.24 -0.10 -5.09 118.33 110.37 3isf n VAL 144 Ca -0.04 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 3isf n VAL 144 Cb 0.91 1.10 0.00 0.00 -1.47 0.00 0.00 33.84 34.38 3isf n VAL 144 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3isf n GLY 145 N 1.01 -1.98 0.17 7.63 0.00 -0.75 -4.33 105.19 106.94 3isf n GLY 145 Ca 0.04 -1.38 -0.08 0.00 0.00 0.00 0.00 46.02 44.61 3isf n GLY 145 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3isf h LEU 146 N 0.00 0.41 -0.14 0.99 5.85 -1.90 -2.27 115.31 118.25 3isf h LEU 146 Ca 0.00 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.75 3isf h LEU 146 Cb 0.00 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 3isf h LEU 146 CO 0.00 0.30 -0.07 -0.33 -0.34 0.00 0.00 178.44 178.00 3isf h GLU 147 N 0.50 -0.05 -0.24 1.25 5.08 -1.93 0.19 114.58 119.38 3isf h GLU 147 Ca 0.15 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.56 3isf h GLU 147 Cb -0.02 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 3isf h GLU 147 CO -0.06 -0.04 0.01 -0.91 -1.00 0.00 0.00 179.01 177.01 3isf h ASN 148 N -0.06 -0.08 -0.60 1.42 2.35 -1.74 -0.05 115.58 116.82 3isf h ASN 148 Ca 0.08 0.05 0.07 0.00 -0.55 0.00 0.00 56.30 55.94 3isf h ASN 148 Cb 0.17 0.09 -0.06 0.00 0.05 0.00 0.00 38.32 38.57 3isf h ASN 148 CO -0.18 -0.01 0.29 0.22 -1.65 0.00 0.00 177.43 176.11 3isf h TYR 149 N 0.08 0.53 -0.40 1.19 3.20 -1.08 0.20 116.97 120.69 3isf h TYR 149 Ca 0.11 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.87 3isf h TYR 149 Cb 0.14 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 3isf h TYR 149 CO -0.19 0.23 -0.31 -0.07 -1.64 0.00 0.00 178.16 176.18 3isf h LEU 150 N 0.54 0.93 -0.66 2.82 3.38 -0.75 -3.01 115.31 118.55 3isf h LEU 150 Ca 0.28 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 3isf h LEU 150 Cb 0.23 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3isf h LEU 150 CO -0.21 1.15 0.21 -0.61 0.09 0.00 0.00 178.44 179.07 3isf h GLN 151 N 0.74 1.02 0.00 1.13 4.15 0.19 -2.27 115.11 120.08 3isf h GLN 151 Ca 0.08 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 59.28 3isf h GLN 151 Cb 0.87 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.42 3isf h GLN 151 CO 0.08 0.89 0.00 0.43 -1.93 0.00 0.00 178.83 178.30 3isf n SER 152 N -4.34 0.06 -0.12 -0.69 7.64 0.58 -2.47 113.62 114.28 3isf n SER 152 Ca 0.04 0.52 0.01 0.00 1.01 0.00 0.00 58.87 60.46 3isf n SER 152 Cb 0.22 -0.53 0.03 0.00 -1.01 0.00 0.00 64.21 62.92 3isf n SER 152 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3isf n HIS 153 N -1.57 0.08 0.04 1.43 8.25 -0.87 -4.70 115.22 117.88 3isf n HIS 153 Ca 0.00 -0.52 -0.13 0.00 -0.26 0.00 0.00 57.72 56.82 3isf n HIS 153 Cb 0.03 -0.05 -0.09 0.00 1.12 0.00 0.00 29.99 31.00 3isf n HIS 153 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 3isf h MET 154 N 0.35 -0.12 -5.72 -0.41 2.07 -1.36 -1.60 114.93 108.14 3isf h MET 154 Ca 0.00 0.01 -0.63 0.00 -2.07 0.00 0.00 59.70 57.01 3isf h MET 154 Cb 0.56 0.03 -0.07 0.00 -1.87 0.00 0.00 31.60 30.25 3isf h MET 154 CO 0.00 0.26 -0.36 -1.01 1.07 0.00 0.00 176.91 176.87 3isf s HIS 155 N -4.58 3.61 0.68 -0.22 3.76 -1.26 -1.83 115.29 115.46 3isf s HIS 155 Ca -0.15 0.69 -0.11 0.00 -0.15 0.00 0.00 55.06 55.33 3isf s HIS 155 Cb 0.02 -2.14 0.00 0.00 1.11 0.00 0.00 32.58 31.58 3isf s HIS 155 CO 0.63 0.60 1.06 -1.21 -0.85 0.00 0.00 174.74 174.97 3isf s GLU 156 N -0.73 2.95 0.00 1.40 2.02 -1.26 -4.23 118.70 118.85 3isf s GLU 156 Ca 0.18 1.00 0.00 0.00 0.02 0.00 0.00 54.97 56.17 3isf s GLU 156 Cb -0.14 -1.99 0.00 0.00 0.10 0.00 0.00 34.13 32.10 3isf s GLU 156 CO 0.07 -1.09 0.00 -0.25 0.02 0.00 0.00 175.26 174.01