#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2odm h ALA 5 N 0.00 0.90 0.00 1.69 0.00 -2.04 -2.60 119.26 117.21 2odm h ALA 5 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2odm h ALA 5 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2odm h ALA 5 CO 0.00 0.65 0.00 0.25 0.00 0.00 0.00 179.25 180.15 2odm n THR 6 N -4.19 0.62 0.00 0.00 -2.24 -1.26 -2.28 114.28 104.94 2odm n THR 6 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2odm n THR 6 Cb 0.33 -0.81 0.00 0.00 -2.10 0.00 0.00 70.33 67.76 2odm n THR 6 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2odm n LYS 8 N 0.67 0.00 0.00 -0.78 5.02 -0.98 -2.27 118.16 119.82 2odm n LYS 8 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 2odm n LYS 8 Cb 0.32 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.22 2odm n LYS 8 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 2odm h ASN 9 N 0.00 0.53 0.19 4.39 -0.73 -1.73 -3.01 115.58 115.22 2odm h ASN 9 Ca 0.00 -0.75 -0.08 0.00 1.87 0.00 0.00 56.30 57.34 2odm h ASN 9 Cb 0.00 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 38.42 2odm h ASN 9 CO 0.00 1.21 -0.31 0.00 -0.37 0.00 0.00 177.43 177.96 2odm h ALA 10 N 0.33 1.30 -0.25 1.57 0.00 -1.73 -1.83 119.26 118.66 2odm h ALA 10 Ca -0.07 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.39 2odm h ALA 10 Cb 1.30 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 2odm h ALA 10 CO 0.12 0.49 -0.32 0.00 0.00 0.00 0.00 179.25 179.53 2odm h ALA 11 N 1.52 0.37 -0.27 0.00 0.00 -1.83 0.26 119.26 119.30 2odm h ALA 11 Ca 0.02 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 2odm h ALA 11 Cb 0.64 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2odm h ALA 11 CO 0.05 0.41 -0.08 1.25 0.00 0.00 0.00 179.25 180.88 2odm h LEU 12 N 0.37 0.41 -0.10 0.00 6.46 -1.42 -1.94 115.31 119.09 2odm h LEU 12 Ca 0.03 -0.09 -0.05 0.00 -0.12 0.00 0.00 57.88 57.65 2odm h LEU 12 Cb 0.90 -0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 40.73 2odm h LEU 12 CO 0.08 0.53 -0.15 0.50 -0.62 0.00 0.00 178.44 178.78 2odm h LYS 13 N 0.41 0.27 -0.33 1.25 3.64 -1.19 -2.17 116.57 118.45 2odm h LYS 13 Ca 0.08 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.26 2odm h LYS 13 Cb 0.40 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 2odm h LYS 13 CO 0.02 0.73 0.03 0.37 -2.27 0.00 0.00 179.45 178.33 2odm h GLN 14 N -0.17 0.49 -0.25 1.90 5.75 -0.89 -0.78 115.11 121.17 2odm h GLN 14 Ca 0.01 -0.09 -0.20 0.00 -0.15 0.00 0.00 58.65 58.22 2odm h GLN 14 Cb 0.70 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.18 2odm h GLN 14 CO 0.03 0.50 -0.62 1.25 -2.65 0.00 0.00 178.83 177.34 2odm h LEU 15 N 0.48 0.97 -0.25 -2.39 5.85 -1.34 -1.69 115.31 116.93 2odm h LEU 15 Ca 0.11 -0.56 -0.21 0.00 0.84 0.00 0.00 57.88 58.06 2odm h LEU 15 Cb 0.26 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.01 2odm h LEU 15 CO 0.00 1.36 -0.79 0.71 -0.34 0.00 0.00 178.44 179.38 2odm h THR 16 N 0.64 1.33 -0.28 1.05 1.35 -1.21 -0.76 112.91 115.02 2odm h THR 16 Ca -0.01 -2.09 0.04 0.00 -0.55 0.00 0.00 66.41 63.80 2odm h THR 16 Cb 1.23 2.09 -0.04 0.00 -1.73 0.00 0.00 68.15 69.71 2odm h THR 16 CO 0.13 0.65 0.03 0.50 -0.25 0.00 0.00 175.52 176.58 2odm h LYS 17 N 0.40 0.13 -0.52 4.72 3.64 -1.15 0.54 116.57 124.32 2odm h LYS 17 Ca -0.05 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2odm h LYS 17 Cb 1.40 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.16 2odm h LYS 17 CO 0.15 0.08 0.34 -0.44 -2.27 0.00 0.00 179.45 177.31 2odm h ASP 18 N 0.13 0.60 -0.60 4.20 3.32 -1.23 -1.98 116.42 120.86 2odm h ASP 18 Ca 0.13 -0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.19 2odm h ASP 18 Cb 0.15 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 2odm h ASP 18 CO -0.19 0.44 0.36 0.00 -1.72 0.00 0.00 179.24 178.13 2odm h ALA 19 N 1.19 0.78 -0.63 3.45 0.00 -0.87 -2.81 119.26 120.36 2odm h ALA 19 Ca 0.19 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.15 2odm h ALA 19 Cb -0.07 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.50 2odm h ALA 19 CO -0.04 0.08 0.34 -0.44 0.00 0.00 0.00 179.25 179.20 2odm h ASP 20 N 0.70 0.50 -0.82 0.00 3.32 0.45 -0.42 116.42 120.16 2odm h ASP 20 Ca 0.25 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.32 2odm h ASP 20 Cb 0.05 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.49 2odm h ASP 20 CO -0.11 0.33 0.47 -0.33 -1.72 0.00 0.00 179.24 177.88 2odm h GLU 21 N 0.64 1.13 -0.04 3.56 5.08 -1.26 0.92 114.58 124.62 2odm h GLU 21 Ca 0.28 -0.11 -0.26 0.00 -1.00 0.00 0.00 59.36 58.27 2odm h GLU 21 Cb 0.18 -0.23 0.02 0.00 0.50 0.00 0.00 28.75 29.22 2odm h GLU 21 CO -0.18 0.81 -0.98 0.82 -1.00 0.00 0.00 179.01 178.48 2odm h ILE 22 N 1.14 1.28 -0.63 3.13 2.04 -1.20 -3.00 117.51 120.27 2odm h ILE 22 Ca 0.29 -2.18 -0.02 0.00 1.00 0.00 0.00 64.86 63.95 2odm h ILE 22 Cb -0.01 2.29 -0.03 0.00 -0.74 0.00 0.00 36.82 38.33 2odm h ILE 22 CO -0.05 0.68 0.30 0.25 0.00 0.00 0.00 178.15 179.33 2odm h LEU 23 N 0.42 0.81 -1.09 1.44 5.85 -0.90 -1.64 115.31 120.21 2odm h LEU 23 Ca -0.11 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.51 2odm h LEU 23 Cb 1.63 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.41 2odm h LEU 23 CO 0.19 0.69 0.39 -0.74 -0.34 0.00 0.00 178.44 178.63 2odm h HIS 24 N 0.90 1.01 -0.55 1.25 2.76 -0.79 -0.92 115.15 118.80 2odm h HIS 24 Ca 0.22 -0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.32 2odm h HIS 24 Cb 0.10 -0.32 -0.02 0.00 1.55 0.00 0.00 27.41 28.71 2odm h HIS 24 CO 0.01 0.71 0.17 1.25 -1.30 0.00 0.00 177.93 178.77 2odm h LEU 25 N 1.03 0.81 -0.39 0.26 5.85 -1.23 -2.18 115.31 119.46 2odm h LEU 25 Ca 0.26 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 2odm h LEU 25 Cb 0.05 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 2odm h LEU 25 CO -0.04 0.81 0.12 0.40 -0.34 0.00 0.00 178.44 179.40 2odm h ILE 26 N 0.77 1.21 -0.34 4.05 2.04 -0.92 -2.47 117.51 121.86 2odm h ILE 26 Ca 0.18 -0.70 -0.08 0.00 1.00 0.00 0.00 64.86 65.26 2odm h ILE 26 Cb 0.29 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 2odm h ILE 26 CO -0.00 0.25 -0.12 0.11 0.00 0.00 0.00 178.15 178.38 2odm h LYS 27 N 0.49 0.58 -0.68 2.37 1.57 -1.13 -0.65 116.57 119.12 2odm h LYS 27 Ca 0.13 -0.17 -0.06 0.00 -1.87 0.00 0.00 60.65 58.67 2odm h LYS 27 Cb 0.26 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 2odm h LYS 27 CO -0.00 0.69 0.17 0.28 -0.57 0.00 0.00 179.45 180.01 2odm h VAL 28 N 0.53 1.26 -0.04 0.50 2.07 -1.32 -0.52 116.25 118.73 2odm h VAL 28 Ca 0.10 -0.94 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 2odm h VAL 28 Cb 0.52 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2odm h VAL 28 CO 0.03 0.36 0.02 1.56 0.02 0.00 0.00 177.57 179.56 2odm h GLN 29 N 1.02 0.06 -0.86 1.57 1.08 -0.96 -2.16 115.11 114.85 2odm h GLN 29 Ca 0.21 -0.01 0.04 0.00 -1.45 0.00 0.00 58.65 57.44 2odm h GLN 29 Cb 0.35 -0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.72 2odm h GLN 29 CO 0.00 0.19 0.55 -0.07 -0.95 0.00 0.00 178.83 178.55 2odm h LEU 30 N -0.09 0.91 0.00 1.46 3.38 -0.95 -1.08 115.31 118.95 2odm h LEU 30 Ca 0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2odm h LEU 30 Cb 0.15 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2odm h LEU 30 CO -0.00 0.62 0.00 0.47 0.09 0.00 0.00 178.44 179.62 2odm n ASP 31 N -4.55 0.00 -1.64 -0.43 9.92 -0.22 -5.10 116.55 114.53 2odm n ASP 31 Ca 0.11 -0.22 0.00 0.00 -0.53 0.00 0.00 54.79 54.15 2odm n ASP 31 Cb 0.10 -0.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.34 2odm n ASP 31 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2odm n ASN 32 N -1.24 -7.41 0.00 -2.24 4.13 -0.41 -5.06 115.26 103.02 2odm n ASN 32 Ca 0.14 1.13 0.00 0.00 1.68 0.00 0.00 54.58 57.53 2odm n ASN 32 Cb 0.20 -4.53 0.00 0.00 -1.54 0.00 0.00 39.78 33.91 2odm n ASN 32 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2odm h PRO 39 N 0.00 0.00 -0.22 0.00 0.11 -2.06 -1.86 132.00 127.96 2odm h PRO 39 Ca 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.05 2odm h PRO 39 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 2odm h PRO 39 CO 0.00 0.00 -0.10 1.25 -0.21 0.00 0.00 178.00 178.94 2odm h LEU 40 N 0.00 0.47 -3.98 2.35 6.46 -2.06 -3.25 115.31 115.30 2odm h LEU 40 Ca -0.00 -0.41 -0.20 0.00 -0.12 0.00 0.00 57.88 57.15 2odm h LEU 40 Cb 0.16 -0.13 -0.07 0.00 -0.73 0.00 0.00 40.66 39.89 2odm h LEU 40 CO 0.00 0.77 -0.32 0.00 -0.62 0.00 0.00 178.44 178.27 2odm n TYR 41 N -4.54 0.10 0.00 1.25 9.36 -0.70 -1.75 117.16 120.88 2odm n TYR 41 Ca -0.05 -1.50 0.00 0.00 3.32 0.00 0.00 57.90 59.67 2odm n TYR 41 Cb 0.33 -1.53 0.00 0.00 -0.63 0.00 0.00 39.34 37.51 2odm n TYR 41 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 2odm n GLU 42 N 2.34 0.00 -0.11 2.98 2.13 -1.24 -4.75 120.64 122.00 2odm n GLU 42 Ca 0.41 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 58.13 2odm n GLU 42 Cb 0.88 -0.27 0.03 0.00 0.27 0.00 0.00 31.44 32.35 2odm n GLU 42 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2odm h GLU 43 N 0.00 0.87 -0.59 5.31 5.08 -1.52 -1.83 114.58 121.90 2odm h GLU 43 Ca 0.00 -0.40 0.09 0.00 -1.00 0.00 0.00 59.36 58.05 2odm h GLU 43 Cb 0.00 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.17 2odm h GLU 43 CO 0.00 1.04 0.23 0.28 -1.00 0.00 0.00 179.01 179.56 2odm h VAL 44 N 0.73 0.80 -0.45 3.13 2.07 -1.66 0.23 116.25 121.11 2odm h VAL 44 Ca 0.08 -0.15 -0.13 0.00 0.82 0.00 0.00 66.70 67.33 2odm h VAL 44 Cb 0.84 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2odm h VAL 44 CO 0.07 0.08 -0.23 -0.07 0.02 0.00 0.00 177.57 177.44 2odm h LEU 45 N 0.42 0.95 -0.66 2.57 3.38 -1.81 -1.07 115.31 119.08 2odm h LEU 45 Ca 0.29 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.92 2odm h LEU 45 Cb 0.34 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 2odm h LEU 45 CO -0.28 1.13 0.42 0.44 0.09 0.00 0.00 178.44 180.25 2odm h ASP 46 N 0.80 0.72 -0.51 -0.43 3.45 -0.80 -2.78 116.42 116.86 2odm h ASP 46 Ca 0.10 -0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.52 2odm h ASP 46 Cb 0.79 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 39.37 2odm h ASP 46 CO 0.07 0.51 0.20 0.74 -1.57 0.00 0.00 179.24 179.18 2odm h THR 47 N 0.85 1.22 0.00 0.35 2.02 -0.40 -1.42 112.91 115.53 2odm h THR 47 Ca 0.25 -0.68 0.00 0.00 0.77 0.00 0.00 66.41 66.75 2odm h THR 47 Cb -0.05 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 2odm h THR 47 CO -0.08 0.26 0.00 1.67 0.37 0.00 0.00 175.52 177.74 2odm n GLN 48 N -4.53 0.00 0.00 6.66 -0.06 -0.42 -1.18 117.38 117.85 2odm n GLN 48 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.02 2odm n GLN 48 Cb 0.16 -0.95 0.00 0.00 -4.06 0.00 0.00 30.24 25.39 2odm n GLN 48 CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 2odm n PHE 50 N 0.37 0.00 -0.21 3.69 7.35 -0.54 -1.44 117.46 126.68 2odm n PHE 50 Ca 0.00 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 56.62 2odm n PHE 50 Cb 0.00 0.00 0.03 0.00 0.35 0.00 0.00 39.48 39.86 2odm n PHE 50 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 2odm h GLY 51 N 0.00 0.93 0.93 7.13 0.00 -1.42 -1.67 103.07 108.98 2odm h GLY 51 Ca 0.00 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 46.82 2odm h GLY 51 CO 0.00 0.44 0.08 -2.00 0.00 0.00 0.00 176.54 175.06 2odm h LEU 52 N 0.82 0.62 -1.05 3.11 5.85 -1.51 -2.50 115.31 120.65 2odm h LEU 52 Ca 0.21 -0.25 0.10 0.00 0.84 0.00 0.00 57.88 58.78 2odm h LEU 52 Cb 0.12 -0.16 -0.08 0.00 0.37 0.00 0.00 40.66 40.91 2odm h LEU 52 CO -0.03 0.71 0.63 -0.61 -0.34 0.00 0.00 178.44 178.80 2odm h GLN 53 N 0.50 0.99 -0.53 1.25 5.75 -1.79 -0.98 115.11 120.30 2odm h GLN 53 Ca 0.12 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.52 2odm h GLN 53 Cb 0.35 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.65 2odm h GLN 53 CO 0.01 0.65 0.18 0.87 -2.65 0.00 0.00 178.83 177.89 2odm h LYS 54 N 1.02 0.82 -0.57 1.69 1.79 -1.02 -1.61 116.57 118.69 2odm h LYS 54 Ca 0.47 -0.17 -0.03 0.00 -2.18 0.00 0.00 60.65 58.74 2odm h LYS 54 Cb 0.40 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.90 2odm h LYS 54 CO -0.22 0.74 0.25 0.93 -1.08 0.00 0.00 179.45 180.07 2odm h GLU 55 N 0.73 0.84 0.63 3.15 5.08 -1.02 -1.96 114.58 122.03 2odm h GLU 55 Ca 0.17 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2odm h GLU 55 Cb 0.26 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2odm h GLU 55 CO -0.01 0.71 -0.32 0.28 -1.00 0.00 0.00 179.01 178.67 2odm h VAL 56 N 0.78 0.34 -0.49 3.13 2.07 -0.97 -1.15 116.25 119.97 2odm h VAL 56 Ca 0.19 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.79 2odm h VAL 56 Cb 0.17 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 30.21 2odm h VAL 56 CO -0.02 0.00 0.12 0.44 0.02 0.00 0.00 177.57 178.13 2odm h ASP 57 N -0.87 0.06 -0.31 0.57 3.32 -1.33 0.39 116.42 118.24 2odm h ASP 57 Ca -0.08 0.08 0.07 0.00 0.02 0.00 0.00 57.03 57.12 2odm h ASP 57 Cb 0.68 0.10 -0.08 0.00 0.22 0.00 0.00 39.33 40.25 2odm h ASP 57 CO 0.13 0.06 -0.22 0.15 -1.72 0.00 0.00 179.24 177.63 2odm h PHE 58 N 0.27 -0.58 -0.29 4.55 3.04 -1.25 0.12 116.94 122.80 2odm h PHE 58 Ca 0.24 0.04 -0.08 0.00 3.98 0.00 0.00 57.97 62.15 2odm h PHE 58 Cb 0.30 0.30 -0.02 0.00 2.56 0.00 0.00 35.95 39.10 2odm h PHE 58 CO -0.20 -0.30 -0.18 0.00 -2.02 0.00 0.00 178.31 175.61 2odm h ALA 59 N 0.95 1.16 -0.20 2.41 0.00 -0.59 -2.66 119.26 120.32 2odm h ALA 59 Ca 0.16 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 2odm h ALA 59 Cb 0.44 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2odm h ALA 59 CO -0.43 0.53 -0.15 0.28 0.00 0.00 0.00 179.25 179.48 2odm h VAL 60 N 0.47 1.32 -0.86 0.00 2.07 -0.41 -1.72 116.25 117.13 2odm h VAL 60 Ca 0.08 -1.28 0.07 0.00 0.82 0.00 0.00 66.70 66.40 2odm h VAL 60 Cb 0.58 1.72 -0.06 0.00 -1.52 0.00 0.00 31.29 32.01 2odm h VAL 60 CO 0.04 0.39 0.56 0.11 0.02 0.00 0.00 177.57 178.68 2odm h LYS 61 N 0.14 0.89 -0.00 1.57 1.57 -0.73 -2.00 116.57 117.99 2odm h LYS 61 Ca 0.04 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2odm h LYS 61 Cb 0.67 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2odm h LYS 61 CO 0.04 0.59 -0.04 1.28 -0.57 0.00 0.00 179.45 180.74 2odm n LEU 62 N -4.50 0.31 -0.44 2.94 4.77 -1.01 -4.90 117.00 114.17 2odm n LEU 62 Ca 0.13 0.03 -0.06 0.00 -0.03 0.00 0.00 56.01 56.08 2odm n LEU 62 Cb 0.24 -0.14 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2odm n LEU 62 CO 0.32 0.06 -0.05 0.61 -1.33 0.00 0.00 177.39 177.00 2odm n GLY 63 N 1.19 0.81 0.08 -0.72 0.00 -0.75 -4.90 105.19 100.90 2odm n GLY 63 Ca 0.18 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.52 2odm n GLY 63 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2odm h LEU 64 N 0.00 0.14 -8.11 0.99 3.38 -1.55 -3.46 115.31 106.70 2odm h LEU 64 Ca -0.12 -0.16 -0.43 0.00 0.09 0.00 0.00 57.88 57.26 2odm h LEU 64 Cb 0.45 -0.05 -0.29 0.00 0.09 0.00 0.00 40.66 40.87 2odm h LEU 64 CO 0.17 1.13 -0.79 -0.69 0.09 0.00 0.00 178.44 178.35 2odm s VAL 65 N -2.68 0.87 0.40 1.22 1.01 -1.07 -4.55 120.40 115.59 2odm s VAL 65 Ca -0.02 -0.50 -0.24 0.00 0.00 0.00 0.00 61.98 61.23 2odm s VAL 65 Cb 0.09 -0.73 -0.09 0.00 0.00 0.00 0.00 36.38 35.65 2odm s VAL 65 CO 0.84 0.23 1.05 -1.81 0.00 0.00 0.00 175.10 175.41 2odm s ASP 66 N -0.31 6.74 0.35 3.32 1.01 -1.26 -4.16 116.67 122.36 2odm s ASP 66 Ca 0.04 2.05 0.05 0.00 0.71 0.00 0.00 52.55 55.40 2odm s ASP 66 Cb -0.04 -2.59 0.70 0.00 1.01 0.00 0.00 42.92 42.00 2odm s ASP 66 CO -0.00 -0.50 1.94 -0.09 0.21 0.00 0.00 175.17 176.72 2odm h ARG 67 N 2.49 0.78 0.00 8.23 2.43 -1.98 -1.37 114.38 124.97 2odm h ARG 67 Ca -0.48 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 58.59 2odm h ARG 67 Cb 1.22 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.58 2odm h ARG 67 CO 0.62 0.52 -0.27 0.93 -1.51 0.00 0.00 179.97 180.26 2odm h GLU 68 N 0.81 0.00 -0.38 0.20 3.07 -1.98 -1.89 114.58 114.40 2odm h GLU 68 Ca 0.35 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 59.06 2odm h GLU 68 Cb 0.31 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 2odm h GLU 68 CO -0.13 0.23 -0.34 -0.44 -1.40 0.00 0.00 179.01 176.93 2odm h ASP 69 N 0.00 0.93 -0.51 1.42 3.45 -1.67 -2.05 116.42 118.00 2odm h ASP 69 Ca -0.01 -0.40 -0.10 0.00 0.43 0.00 0.00 57.03 56.95 2odm h ASP 69 Cb 1.18 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 39.67 2odm h ASP 69 CO 0.03 1.18 -0.07 1.23 -1.57 0.00 0.00 179.24 180.04 2odm h GLY 70 N 0.86 1.05 1.88 2.75 0.00 -1.27 -2.56 103.07 105.78 2odm h GLY 70 Ca 0.07 -0.80 -0.11 0.00 0.00 0.00 0.00 47.33 46.49 2odm h GLY 70 CO 0.08 0.74 -0.46 0.50 0.00 0.00 0.00 176.54 177.40 2odm h LYS 71 N 0.88 0.13 -0.06 4.80 1.57 -1.30 -3.06 116.57 119.53 2odm h LYS 71 Ca 0.15 -0.07 -0.21 0.00 -1.87 0.00 0.00 60.65 58.65 2odm h LYS 71 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.92 2odm h LYS 71 CO 0.04 0.57 -0.82 1.96 -0.57 0.00 0.00 179.45 180.63 2odm h GLN 72 N 0.11 0.49 0.00 3.15 1.08 -1.36 -1.69 115.11 116.88 2odm h GLN 72 Ca 0.01 -0.44 0.00 0.00 -1.45 0.00 0.00 58.65 56.76 2odm h GLN 72 Cb 0.86 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 2odm h GLN 72 CO 0.07 1.08 0.00 -0.89 -0.95 0.00 0.00 178.83 178.14 2odm n ILE 73 N -3.83 0.00 0.00 2.54 5.41 -0.97 -1.95 119.36 120.57 2odm n ILE 73 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.69 2odm n ILE 73 Cb 0.76 -0.28 0.00 0.00 -0.71 0.00 0.00 39.64 39.41 2odm n ILE 73 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 2odm n LEU 75 N -0.07 0.00 -0.20 1.39 0.00 -0.64 -3.34 117.00 114.15 2odm n LEU 75 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 56.01 56.02 2odm n LEU 75 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 43.42 43.53 2odm n LEU 75 CO 0.00 0.00 0.91 -0.09 0.00 0.00 0.00 177.39 178.21 2odm h ARG 76 N 0.00 0.24 -0.08 1.96 2.43 -1.66 -0.07 114.38 117.21 2odm h ARG 76 Ca 0.00 -0.01 -0.23 0.00 -0.81 0.00 0.00 59.98 58.92 2odm h ARG 76 Cb 0.00 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.51 2odm h ARG 76 CO 0.00 0.16 -0.87 -0.07 -1.51 0.00 0.00 179.97 177.67 2odm h LEU 77 N 0.24 0.82 -1.32 3.80 4.07 -1.84 -3.17 115.31 117.92 2odm h LEU 77 Ca 0.32 -0.59 -0.01 0.00 0.08 0.00 0.00 57.88 57.68 2odm h LEU 77 Cb 0.48 -0.25 -0.03 0.00 1.08 0.00 0.00 40.66 41.94 2odm h LEU 77 CO -0.42 1.38 0.34 -0.33 -1.08 0.00 0.00 178.44 178.34 2odm h GLU 78 N 0.42 0.81 -0.22 1.13 5.08 -1.73 1.00 114.58 121.06 2odm h GLU 78 Ca -0.08 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2odm h GLU 78 Cb 1.50 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.57 2odm h GLU 78 CO 0.17 0.58 0.12 -0.22 -1.00 0.00 0.00 179.01 178.66 2odm h LYS 79 N 0.82 0.31 -0.42 2.33 3.64 -1.06 -0.87 116.57 121.33 2odm h LYS 79 Ca 0.21 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 2odm h LYS 79 Cb -0.01 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2odm h LYS 79 CO -0.04 0.29 -0.13 1.49 -2.27 0.00 0.00 179.45 178.79 2odm h GLU 80 N 0.25 0.82 -0.46 1.90 4.57 -1.41 -2.55 114.58 117.71 2odm h GLU 80 Ca 0.08 -0.33 -0.05 0.00 -1.18 0.00 0.00 59.36 57.88 2odm h GLU 80 Cb 0.07 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 2odm h GLU 80 CO -0.01 0.96 0.07 1.25 -1.18 0.00 0.00 179.01 180.10 2odm h LEU 81 N 0.64 0.66 -0.47 1.64 5.85 -0.75 -1.90 115.31 120.98 2odm h LEU 81 Ca 0.10 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2odm h LEU 81 Cb 0.67 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 2odm h LEU 81 CO 0.05 0.68 0.23 0.28 -0.34 0.00 0.00 178.44 179.33 2odm h SER 82 N 0.68 0.61 -0.50 1.25 0.02 -0.98 0.26 113.55 114.88 2odm h SER 82 Ca 0.15 -0.13 0.10 0.00 -0.84 0.00 0.00 61.79 61.07 2odm h SER 82 Cb 0.31 -0.16 -0.09 0.00 0.14 0.00 0.00 62.40 62.60 2odm h SER 82 CO 0.00 0.56 -0.12 0.11 -1.14 0.00 0.00 176.83 176.24 2odm h LYS 83 N 0.61 -0.00 -0.33 3.45 1.57 -1.19 -0.27 116.57 120.41 2odm h LYS 83 Ca 0.16 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 2odm h LYS 83 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2odm h LYS 83 CO -0.02 -0.00 0.13 1.25 -0.57 0.00 0.00 179.45 180.24 2odm h LEU 84 N -0.00 0.46 -0.45 2.94 5.85 -0.95 0.66 115.31 123.82 2odm h LEU 84 Ca 0.24 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.82 2odm h LEU 84 Cb 0.36 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 2odm h LEU 84 CO -0.51 0.51 0.23 0.45 -0.34 0.00 0.00 178.44 178.78 2odm h HIS 85 N 0.39 0.43 -0.53 1.25 3.86 -0.69 0.19 115.15 120.05 2odm h HIS 85 Ca 0.11 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.35 2odm h HIS 85 Cb 0.19 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.50 2odm h HIS 85 CO -0.00 0.23 0.34 1.49 0.86 0.00 0.00 177.93 180.84 2odm h GLU 86 N 0.47 0.66 -0.76 2.45 4.81 -0.87 -2.55 114.58 118.79 2odm h GLU 86 Ca 0.19 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.41 2odm h GLU 86 Cb 0.08 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.26 2odm h GLU 86 CO -0.12 0.43 0.48 0.00 -0.73 0.00 0.00 179.01 179.07 2odm h ALA 87 N 1.22 1.00 -0.72 2.92 0.00 -0.28 -2.75 119.26 120.64 2odm h ALA 87 Ca 0.21 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.20 2odm h ALA 87 Cb -0.02 -0.25 -0.08 0.00 0.00 0.00 0.00 17.79 17.44 2odm h ALA 87 CO -0.07 0.28 0.34 0.74 0.00 0.00 0.00 179.25 180.53 2odm h PHE 88 N 0.93 0.60 -0.14 0.00 0.05 -0.25 -1.91 116.94 116.22 2odm h PHE 88 Ca 0.30 0.03 0.04 0.00 3.82 0.00 0.00 57.97 62.17 2odm h PHE 88 Cb 0.02 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 37.81 2odm h PHE 88 CO -0.03 0.18 0.16 1.15 -0.18 0.00 0.00 178.31 179.58 2odm h THR 89 N 0.56 0.49 0.00 -1.55 2.02 -1.16 -2.98 112.91 110.29 2odm h THR 89 Ca 0.37 0.00 -0.27 0.00 0.77 0.00 0.00 66.41 67.28 2odm h THR 89 Cb 0.44 0.87 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 2odm h THR 89 CO -0.30 0.00 -2.10 0.18 0.37 0.00 0.00 175.52 173.66 2odm n LEU 90 N -3.83 0.22 0.00 2.58 4.77 -0.75 -5.14 117.00 114.86 2odm n LEU 90 Ca 0.01 0.10 0.14 0.00 -0.03 0.00 0.00 56.01 56.22 2odm n LEU 90 Cb 0.27 0.31 0.80 0.00 -2.33 0.00 0.00 43.42 42.48 2odm n LEU 90 CO 0.28 0.35 0.98 0.55 -1.33 0.00 0.00 177.39 178.21