#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1two n PRO 2 N 0.00 0.18 0.13 1.43 -0.04 -1.26 -4.66 135.00 130.78 1two n PRO 2 Ca 0.00 0.00 0.19 0.00 -0.04 0.00 0.00 63.50 63.65 1two n PRO 2 Cb 0.00 0.00 0.77 0.00 -0.04 0.00 0.00 33.50 34.23 1two n PRO 2 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1two h GLU 3 N 0.00 0.00 -0.90 0.54 3.07 -1.90 0.25 114.58 115.64 1two h GLU 3 Ca 0.00 0.00 0.09 0.00 -0.50 0.00 0.00 59.36 58.95 1two h GLU 3 Cb 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 27.85 1two h GLU 3 CO 0.00 0.00 0.58 0.82 -1.40 0.00 0.00 179.01 179.01 1two h ILE 4 N 0.00 1.00 -0.01 3.13 1.08 -1.89 -0.20 117.51 120.63 1two h ILE 4 Ca 0.16 -0.32 0.00 0.00 -0.39 0.00 0.00 64.86 64.30 1two h ILE 4 Cb 0.86 -0.03 0.00 0.00 -3.07 0.00 0.00 36.82 34.59 1two h ILE 4 CO -0.00 0.17 -0.55 0.80 -0.69 0.00 0.00 178.15 177.88 1two n MET 5 N -4.52 0.89 -4.00 2.37 1.56 0.75 -4.77 117.12 109.41 1two n MET 5 Ca 0.15 -0.71 -0.33 0.00 -0.27 0.00 0.00 57.70 56.54 1two n MET 5 Cb 0.27 -1.49 -0.14 0.00 2.15 0.00 0.00 33.22 34.01 1two n MET 5 CO 0.00 0.00 0.00 0.21 -0.73 0.00 0.00 175.97 175.45 1two s LYS 6 N -2.60 1.97 -0.03 2.12 2.47 -0.09 -4.87 119.74 118.72 1two s LYS 6 Ca 0.17 -1.57 0.07 0.00 -1.56 0.00 0.00 55.97 53.08 1two s LYS 6 Cb 0.18 -3.12 -0.02 0.00 -1.46 0.00 0.00 37.83 33.41 1two s LYS 6 CO 0.63 -0.76 -0.25 0.54 0.16 0.00 0.00 175.35 175.67 1two s ASN 7 N 1.13 3.11 0.73 1.43 4.22 -1.25 -4.52 114.94 119.78 1two s ASN 7 Ca 0.00 -0.47 0.00 0.00 -2.14 0.00 0.00 52.86 50.26 1two s ASN 7 Cb -0.20 -0.50 0.00 0.00 1.28 0.00 0.00 41.25 41.83 1two s ASN 7 CO -0.05 0.30 0.00 0.00 -2.04 0.00 0.00 177.10 175.31 1two n LEU 8 N 2.57 0.00 0.00 3.54 -0.00 -1.26 -4.98 117.00 116.88 1two n LEU 8 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.85 1two n LEU 8 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.93 1two n LEU 8 CO 0.24 -0.72 0.00 -0.24 -0.00 0.00 0.00 177.39 176.67 1two n SER 9 N -2.18 0.00 0.00 1.45 2.88 -1.26 -4.46 113.62 110.04 1two n SER 9 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1two n SER 9 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1two n SER 9 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1two n ASN 10 N 0.00 3.25 -0.17 -3.46 4.13 -1.26 -4.31 115.26 113.44 1two n ASN 10 Ca 0.00 0.00 0.16 0.00 1.68 0.00 0.00 54.58 56.42 1two n ASN 10 Cb 0.00 0.18 0.27 0.00 -1.54 0.00 0.00 39.78 38.70 1two n ASN 10 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1two n ASN 11 N -1.90 0.13 -0.02 6.41 3.02 -1.26 0.16 115.26 121.80 1two n ASN 11 Ca 0.00 0.68 -0.03 0.00 -0.03 0.00 0.00 54.58 55.20 1two n ASN 11 Cb 0.36 -0.33 -0.01 0.00 -0.61 0.00 0.00 39.78 39.19 1two n ASN 11 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1two n PHE 12 N -3.79 0.00 -0.36 3.10 7.35 -1.26 -3.97 117.46 118.52 1two n PHE 12 Ca 0.17 0.00 0.29 0.00 -0.76 0.00 0.00 57.45 57.15 1two n PHE 12 Cb 0.62 -0.17 0.55 0.00 0.35 0.00 0.00 39.48 40.82 1two n PHE 12 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 1two h GLY 13 N -0.34 1.77 0.38 7.13 0.00 -1.57 1.16 103.07 111.60 1two h GLY 13 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 1two h GLY 13 CO 0.00 -0.46 -0.03 1.70 0.00 0.00 0.00 176.54 177.75 1two h LYS 14 N 0.22 -0.07 -0.84 4.80 3.11 0.13 -0.72 116.57 123.19 1two h LYS 14 Ca 0.76 0.00 0.09 0.00 -2.81 0.00 0.00 60.65 58.69 1two h LYS 14 Cb 2.00 0.02 -0.07 0.00 -1.00 0.00 0.00 32.23 33.17 1two h LYS 14 CO -0.54 0.49 0.50 0.00 -2.81 0.00 0.00 179.45 177.09 1two h ALA 15 N 0.17 1.20 -0.07 5.00 0.00 -0.18 1.66 119.26 127.04 1two h ALA 15 Ca -0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1two h ALA 15 Cb 0.59 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1two h ALA 15 CO 0.01 0.15 0.02 0.52 0.00 0.00 0.00 179.25 179.95 1two h MET 16 N 0.84 0.11 -0.53 0.00 2.86 0.11 1.57 114.93 119.89 1two h MET 16 Ca 0.40 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.92 1two h MET 16 Cb 0.33 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 1two h MET 16 CO -0.23 0.28 -0.03 0.22 1.06 0.00 0.00 176.91 178.21 1two h ASP 17 N -0.09 0.94 -0.38 1.22 1.82 -0.34 -0.67 116.42 118.93 1two h ASP 17 Ca 0.02 -0.32 -0.14 0.00 -0.39 0.00 0.00 57.03 56.20 1two h ASP 17 Cb 0.22 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 39.97 1two h ASP 17 CO -0.00 1.04 -0.30 1.56 -1.61 0.00 0.00 179.24 179.93 1two h GLN 18 N 0.83 0.88 -0.77 0.28 4.20 0.26 -2.80 115.11 117.98 1two h GLN 18 Ca 0.15 -0.43 -0.00 0.00 0.06 0.00 0.00 58.65 58.42 1two h GLN 18 Cb 0.57 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.31 1two h GLN 18 CO 0.03 1.08 0.47 0.00 -0.67 0.00 0.00 178.83 179.74 1two n LYS 20 N -4.39 0.19 -0.00 0.00 4.81 -0.27 -1.21 118.16 117.29 1two n LYS 20 Ca 0.08 0.16 -0.00 0.00 -0.87 0.00 0.00 58.31 57.68 1two n LYS 20 Cb 0.06 -1.50 -0.00 0.00 0.02 0.00 0.00 35.03 33.61 1two n LYS 20 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1two n ASP 21 N -1.26 0.09 -0.30 3.14 2.03 0.14 -3.18 116.55 117.21 1two n ASP 21 Ca 0.06 0.01 0.13 0.00 0.52 0.00 0.00 54.79 55.51 1two n ASP 21 Cb 0.09 -0.22 0.29 0.00 -0.72 0.00 0.00 41.12 40.56 1two n ASP 21 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1two h GLU 22 N -0.02 0.18 0.00 -0.67 4.11 0.54 0.54 114.58 119.26 1two h GLU 22 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1two h GLU 22 Cb 0.02 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1two h GLU 22 CO 0.00 0.12 -1.09 1.28 0.07 0.00 0.00 179.01 179.39 1two n LEU 23 N -5.25 0.80 -1.08 3.06 4.77 -0.35 -4.93 117.00 114.01 1two n LEU 23 Ca 0.21 -0.35 -0.10 0.00 -0.03 0.00 0.00 56.01 55.74 1two n LEU 23 Cb 0.68 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.70 1two n LEU 23 CO 0.05 0.19 -0.09 -1.20 -1.33 0.00 0.00 177.39 175.01 1two n SER 24 N -1.64 -3.25 -4.92 -1.43 7.64 0.19 -4.90 113.62 105.32 1two n SER 24 Ca 0.03 0.24 -0.27 0.00 1.01 0.00 0.00 58.87 59.88 1two n SER 24 Cb 0.37 -2.87 0.06 0.00 -1.01 0.00 0.00 64.21 60.76 1two n SER 24 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1two s LEU 25 N -2.89 2.88 -0.16 -3.43 -0.00 -1.24 -4.86 118.68 108.99 1two s LEU 25 Ca 0.00 0.66 -0.29 0.00 -0.00 0.00 0.00 54.13 54.50 1two s LEU 25 Cb 0.00 -3.35 -0.02 0.00 -0.00 0.00 0.00 46.19 42.82 1two s LEU 25 CO 0.00 -1.48 1.27 -2.16 -0.00 0.00 0.00 176.35 173.98 1two s PRO 26 N -5.25 4.24 0.00 1.48 0.04 -1.26 -4.19 135.00 130.06 1two s PRO 26 Ca 0.59 1.68 0.11 0.00 0.04 0.00 0.00 61.00 63.41 1two s PRO 26 Cb -0.11 -3.76 0.63 0.00 0.04 0.00 0.00 34.50 31.30 1two s PRO 26 CO 0.46 -0.69 1.18 -3.47 0.04 0.00 0.00 177.00 174.52 1two n ASP 27 N 6.53 0.00 0.13 6.66 2.03 -1.26 -1.75 116.55 128.89 1two n ASP 27 Ca 0.14 -0.14 -0.24 0.00 0.52 0.00 0.00 54.79 55.07 1two n ASP 27 Cb 0.45 -0.13 -0.16 0.00 -0.72 0.00 0.00 41.12 40.56 1two n ASP 27 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1two h SER 28 N 0.00 0.79 -0.44 1.67 4.64 -1.97 -1.47 113.55 116.77 1two h SER 28 Ca 0.00 -0.92 -0.04 0.00 -0.47 0.00 0.00 61.79 60.37 1two h SER 28 Cb 0.05 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 61.86 1two h SER 28 CO 0.00 1.73 0.15 -0.37 -0.87 0.00 0.00 176.83 177.48 1two h VAL 29 N 0.14 1.20 0.03 0.95 -1.51 -1.75 -0.53 116.25 114.78 1two h VAL 29 Ca -0.28 -0.68 -0.22 0.00 -1.23 0.00 0.00 66.70 64.29 1two h VAL 29 Cb 2.15 0.66 -0.02 0.00 -2.13 0.00 0.00 31.29 31.95 1two h VAL 29 CO 0.25 0.26 -1.01 1.62 -1.23 0.00 0.00 177.57 177.46 1two h VAL 30 N 0.72 1.62 0.00 7.19 3.04 -1.62 -3.00 116.25 124.19 1two h VAL 30 Ca 0.17 -3.14 0.00 0.00 -1.01 0.00 0.00 66.70 62.72 1two h VAL 30 Cb 0.21 2.76 0.00 0.00 -2.01 0.00 0.00 31.29 32.26 1two h VAL 30 CO -0.01 0.90 0.00 0.00 -1.01 0.00 0.00 177.57 177.45 1two h ALA 31 N 0.93 1.00 0.02 3.17 0.00 -0.40 -2.06 119.26 121.92 1two h ALA 31 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.66 1two h ALA 31 Cb 1.72 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 1two h ALA 31 CO 0.14 0.00 -0.94 0.22 0.00 0.00 0.00 179.25 178.67 1two h ASP 32 N 0.00 0.26 -1.00 0.00 3.58 -0.98 -3.16 116.42 115.11 1two h ASP 32 Ca 0.00 -0.22 0.20 0.00 0.42 0.00 0.00 57.03 57.43 1two h ASP 32 Cb 0.42 -0.08 -0.11 0.00 1.72 0.00 0.00 39.33 41.29 1two h ASP 32 CO 0.00 1.06 0.61 -0.07 -2.88 0.00 0.00 179.24 177.97 1two h LEU 33 N 0.09 0.74 -0.80 2.28 3.38 -1.41 1.06 115.31 120.65 1two h LEU 33 Ca -0.05 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1two h LEU 33 Cb 1.60 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.32 1two h LEU 33 CO 0.14 0.24 -0.06 1.88 0.09 0.00 0.00 178.44 180.73 1two h TYR 34 N 0.70 0.00 0.00 1.13 0.05 -1.66 -3.34 116.97 113.86 1two h TYR 34 Ca 0.58 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.36 1two h TYR 34 Cb 0.99 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.73 1two h TYR 34 CO -0.00 0.06 0.00 -1.71 -1.05 0.00 0.00 178.16 175.46 1two n ASN 35 N -3.14 0.00 0.00 3.88 2.85 0.36 -4.88 115.26 114.33 1two n ASN 35 Ca 0.02 0.64 0.00 0.00 -0.11 0.00 0.00 54.58 55.13 1two n ASN 35 Cb 0.43 -0.33 0.00 0.00 1.24 0.00 0.00 39.78 41.12 1two n ASN 35 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1two n PHE 36 N -1.48 0.00 -0.62 1.20 3.01 -0.91 -5.00 117.46 113.65 1two n PHE 36 Ca 0.00 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.36 1two n PHE 36 Cb 0.00 0.00 0.20 0.00 -0.01 0.00 0.00 39.48 39.67 1two n PHE 36 CO 0.00 0.00 0.00 -2.67 1.01 0.00 0.00 176.76 175.10 1two n TRP 37 N 0.00 2.10 -0.28 1.38 4.27 -1.23 -4.56 117.44 119.13 1two n TRP 37 Ca 0.00 -1.19 -0.02 0.00 -3.89 0.00 0.00 57.50 52.40 1two n TRP 37 Cb 0.00 -0.66 0.04 0.00 -1.36 0.00 0.00 31.31 29.33 1two n TRP 37 CO 0.00 0.00 0.00 0.87 -2.29 0.00 0.00 177.69 176.27 1two h LYS 38 N 1.58 -0.07 -1.13 -2.67 1.57 -1.85 1.74 116.57 115.74 1two h LYS 38 Ca 0.32 0.00 0.32 0.00 -1.87 0.00 0.00 60.65 59.42 1two h LYS 38 Cb 2.16 0.02 -0.10 0.00 0.08 0.00 0.00 32.23 34.39 1two h LYS 38 CO 0.69 -0.05 0.73 0.22 -0.57 0.00 0.00 179.45 180.47 1two h ASP 39 N -0.07 0.35 -1.85 0.86 3.58 -1.85 -2.72 116.42 114.73 1two h ASP 39 Ca 0.31 0.09 -0.74 0.00 0.42 0.00 0.00 57.03 57.11 1two h ASP 39 Cb 0.58 0.04 -0.16 0.00 1.72 0.00 0.00 39.33 41.51 1two h ASP 39 CO -0.82 0.01 1.62 -0.67 -2.88 0.00 0.00 179.24 176.50 1two n ASP 40 N -4.61 5.16 -1.84 2.28 -0.08 0.59 -4.94 116.55 113.11 1two n ASP 40 Ca 0.28 -3.01 0.00 0.00 -1.51 0.00 0.00 54.79 50.55 1two n ASP 40 Cb 1.06 -1.55 0.00 0.00 2.34 0.00 0.00 41.12 42.96 1two n ASP 40 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 1two n TYR 41 N 5.22 -2.83 -0.29 -0.67 4.01 -1.03 -4.73 117.16 116.84 1two n TYR 41 Ca 0.38 0.00 0.25 0.00 -0.16 0.00 0.00 57.90 58.38 1two n TYR 41 Cb 0.41 0.00 0.42 0.00 -0.31 0.00 0.00 39.34 39.86 1two n TYR 41 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 1two n VAL 42 N -1.02 -0.17 -0.43 -0.72 0.24 -1.21 0.20 118.33 115.22 1two n VAL 42 Ca 0.00 1.15 0.38 0.00 -2.04 0.00 0.00 64.34 63.83 1two n VAL 42 Cb 0.00 -1.88 0.59 0.00 -1.47 0.00 0.00 33.84 31.08 1two n VAL 42 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 1two n MET 43 N -3.97 0.01 -0.00 7.34 0.00 -1.26 -2.04 117.12 117.19 1two n MET 43 Ca 0.25 1.03 -0.00 0.00 0.00 0.00 0.00 57.70 58.98 1two n MET 43 Cb 0.98 -2.47 -0.00 0.00 0.00 0.00 0.00 33.22 31.73 1two n MET 43 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 1two n THR 44 N -3.50 0.02 -3.89 1.12 -1.04 0.52 -4.96 114.28 102.56 1two n THR 44 Ca 0.32 -0.01 -0.30 0.00 -2.04 0.00 0.00 64.05 62.02 1two n THR 44 Cb 1.72 -1.47 -0.15 0.00 -1.82 0.00 0.00 70.33 68.61 1two n THR 44 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1two s ASP 45 N -5.00 4.38 0.22 8.00 2.15 -0.87 -4.97 116.67 120.59 1two s ASP 45 Ca -0.01 -2.07 -0.08 0.00 0.43 0.00 0.00 52.55 50.82 1two s ASP 45 Cb 0.00 -1.31 0.19 0.00 -0.30 0.00 0.00 42.92 41.50 1two s ASP 45 CO 0.01 -0.37 1.83 -0.09 -0.17 0.00 0.00 175.17 176.38 1two h ARG 46 N 7.63 1.20 -0.87 4.34 1.12 -1.80 -2.26 114.38 123.75 1two h ARG 46 Ca -0.07 -0.16 0.22 0.00 -1.11 0.00 0.00 59.98 58.86 1two h ARG 46 Cb 1.00 -0.23 -0.13 0.00 -0.01 0.00 0.00 29.97 30.61 1two h ARG 46 CO 0.51 0.90 0.31 -0.07 -3.11 0.00 0.00 179.97 178.51 1two h LEU 47 N 1.20 0.17 -1.82 3.80 -0.00 -1.93 1.73 115.31 118.46 1two h LEU 47 Ca 0.30 0.17 0.12 0.00 -0.00 0.00 0.00 57.88 58.46 1two h LEU 47 Cb 0.07 0.19 -0.03 0.00 -0.00 0.00 0.00 40.66 40.89 1two h LEU 47 CO -0.04 -0.06 0.37 0.00 -0.00 0.00 0.00 178.44 178.70 1two h ALA 48 N 1.72 2.24 0.00 1.53 0.00 -1.72 1.73 119.26 124.76 1two h ALA 48 Ca 0.54 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 55.22 1two h ALA 48 Cb 1.03 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1two h ALA 48 CO -0.57 -0.38 -1.11 0.78 0.00 0.00 0.00 179.25 177.98 1two h GLY 49 N 0.20 0.00 0.61 0.00 0.00 0.24 -2.73 103.07 101.39 1two h GLY 49 Ca 0.25 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.43 1two h GLY 49 CO -0.04 0.00 -0.66 0.00 0.00 0.00 0.00 176.54 175.84 1two h ALA 51 N 0.11 0.42 -0.84 0.00 0.00 0.23 0.15 119.26 119.33 1two h ALA 51 Ca -0.11 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1two h ALA 51 Cb 1.49 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.27 1two h ALA 51 CO 0.12 -0.27 0.47 0.97 0.00 0.00 0.00 179.25 180.54 1two h ILE 52 N 0.27 1.24 -0.41 0.00 6.09 -1.57 -0.10 117.51 123.03 1two h ILE 52 Ca 0.17 -0.60 0.01 0.00 -1.37 0.00 0.00 64.86 63.07 1two h ILE 52 Cb 0.15 0.10 -0.02 0.00 0.47 0.00 0.00 36.82 37.52 1two h ILE 52 CO -0.18 0.27 0.26 0.78 -3.07 0.00 0.00 178.15 176.21 1two h ASN 53 N 1.18 0.44 0.71 2.19 4.21 -0.56 0.10 115.58 123.84 1two h ASN 53 Ca 0.30 -0.01 -0.00 0.00 1.21 0.00 0.00 56.30 57.80 1two h ASN 53 Cb 0.02 -0.10 -0.00 0.00 -1.12 0.00 0.00 38.32 37.12 1two h ASN 53 CO -0.05 0.32 -0.02 0.00 -1.29 0.00 0.00 177.43 176.39 1two h LEU 55 N 0.00 0.43 -0.22 0.00 7.12 0.11 1.68 115.31 124.43 1two h LEU 55 Ca -0.00 0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.04 1two h LEU 55 Cb 0.37 -0.05 0.00 0.00 -0.53 0.00 0.00 40.66 40.45 1two h LEU 55 CO 0.00 0.21 0.00 0.00 -0.13 0.00 0.00 178.44 178.52 1two n ALA 56 N -2.51 1.84 0.00 1.25 0.00 -0.84 -4.22 120.51 116.04 1two n ALA 56 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1two n ALA 56 Cb 0.57 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.68 1two n ALA 56 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1two n THR 57 N -1.82 0.00 -3.76 0.00 5.66 0.57 -1.90 114.28 113.03 1two n THR 57 Ca 0.04 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.67 1two n THR 57 Cb 0.25 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 68.91 1two n THR 57 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1two s LYS 58 N -3.48 2.34 0.46 1.09 -0.14 -1.26 -4.93 119.74 113.82 1two s LYS 58 Ca 0.00 -1.51 0.26 0.00 -1.36 0.00 0.00 55.97 53.36 1two s LYS 58 Cb 0.00 -3.52 0.99 0.00 -1.68 0.00 0.00 37.83 33.62 1two s LYS 58 CO 0.00 -0.88 1.85 -0.07 -0.76 0.00 0.00 175.35 175.49 1two h LEU 59 N 8.15 0.00 -1.37 3.17 3.38 -1.73 -1.03 115.31 125.88 1two h LEU 59 Ca -0.19 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 1two h LEU 59 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1two h LEU 59 CO 0.66 0.18 0.12 0.44 0.09 0.00 0.00 178.44 179.93 1two h ASP 60 N 0.00 0.50 0.17 -0.43 5.19 -1.88 1.66 116.42 121.63 1two h ASP 60 Ca -0.00 -0.06 -0.36 0.00 -0.62 0.00 0.00 57.03 55.99 1two h ASP 60 Cb 0.71 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 40.08 1two h ASP 60 CO 0.02 0.48 -1.90 -0.37 -3.12 0.00 0.00 179.24 174.35 1two h VAL 61 N 0.54 0.74 -0.39 -1.35 -1.51 -1.85 -3.29 116.25 109.14 1two h VAL 61 Ca 0.13 -2.42 -0.05 0.00 -1.23 0.00 0.00 66.70 63.13 1two h VAL 61 Cb 0.16 2.59 -0.02 0.00 -2.13 0.00 0.00 31.29 31.89 1two h VAL 61 CO -0.01 0.87 0.05 0.58 -1.23 0.00 0.00 177.57 177.83 1two h VAL 62 N 0.08 1.25 -3.40 7.19 2.07 -0.90 -3.39 116.25 119.14 1two h VAL 62 Ca -0.39 -0.90 -0.59 0.00 0.82 0.00 0.00 66.70 65.64 1two h VAL 62 Cb 2.05 1.06 -0.39 0.00 -1.52 0.00 0.00 31.29 32.49 1two h VAL 62 CO 0.12 0.31 -0.76 1.51 0.02 0.00 0.00 177.57 178.76 1two s ASP 63 N -6.10 3.94 0.05 0.57 1.47 0.56 -4.74 116.67 112.42 1two s ASP 63 Ca -0.13 -1.47 -0.17 0.00 1.18 0.00 0.00 52.55 51.97 1two s ASP 63 Cb 0.10 -1.04 -0.21 0.00 -0.34 0.00 0.00 42.92 41.42 1two s ASP 63 CO 0.78 -0.34 1.18 1.55 0.68 0.00 0.00 175.17 179.02 1two h PRO 64 N 7.99 0.58 -0.16 2.11 0.13 -1.75 -3.30 132.00 137.60 1two h PRO 64 Ca -0.14 -0.56 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 1two h PRO 64 Cb 1.05 0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1two h PRO 64 CO 0.44 1.18 0.00 -0.25 -0.23 0.00 0.00 178.00 179.15 1two n ASP 65 N -4.07 2.40 -0.08 1.44 9.92 -1.26 -4.95 116.55 119.95 1two n ASP 65 Ca -0.10 -1.70 0.00 0.00 -0.53 0.00 0.00 54.79 52.46 1two n ASP 65 Cb 0.73 -0.10 0.00 0.00 -0.64 0.00 0.00 41.12 41.11 1two n ASP 65 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1two n GLY 66 N 0.64 0.71 0.33 0.44 0.00 -1.24 -4.99 105.19 101.08 1two n GLY 66 Ca 0.09 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.17 1two n GLY 66 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1two h ASN 67 N 0.00 0.63 -1.29 1.61 -1.24 -1.85 -3.46 115.58 109.98 1two h ASN 67 Ca 0.00 0.10 0.09 0.00 0.71 0.00 0.00 56.30 57.21 1two h ASN 67 Cb 0.10 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.14 1two h ASN 67 CO 0.00 0.21 0.29 0.00 -1.29 0.00 0.00 177.43 176.65 1two n LEU 68 N -4.84 0.00 -3.67 0.34 -0.00 -1.26 -3.48 117.00 104.08 1two n LEU 68 Ca 0.21 -0.49 -0.14 0.00 -0.00 0.00 0.00 56.01 55.59 1two n LEU 68 Cb 0.54 1.08 -0.13 0.00 -0.00 0.00 0.00 43.42 44.91 1two n LEU 68 CO 0.20 -0.16 -0.14 -1.00 -0.00 0.00 0.00 177.39 176.28 1two s HIS 69 N -3.84 -0.39 0.24 1.47 3.76 -1.22 -4.72 115.29 110.60 1two s HIS 69 Ca 0.11 0.92 -0.28 0.00 -0.15 0.00 0.00 55.06 55.65 1two s HIS 69 Cb -0.01 -0.05 -0.16 0.00 1.11 0.00 0.00 32.58 33.47 1two s HIS 69 CO 0.02 -0.33 0.77 1.58 -0.85 0.00 0.00 174.74 175.92 1two n HIS 70 N 5.24 0.38 0.00 1.40 -0.00 -1.26 -0.41 115.22 120.57 1two n HIS 70 Ca -0.08 0.84 0.00 0.00 0.46 0.00 0.00 57.72 58.94 1two n HIS 70 Cb 0.50 -2.10 0.00 0.00 -0.12 0.00 0.00 29.99 28.27 1two n HIS 70 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1two n GLY 71 N 1.63 1.35 2.66 1.57 0.00 -1.26 -4.68 105.19 106.46 1two n GLY 71 Ca 0.14 -0.03 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 1two n GLY 71 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1two n ASN 72 N 2.54 2.36 -4.73 1.61 2.85 0.45 -4.96 115.26 115.38 1two n ASN 72 Ca 0.00 -3.08 -0.42 0.00 -0.11 0.00 0.00 54.58 50.97 1two n ASN 72 Cb 0.00 -0.69 -0.03 0.00 1.24 0.00 0.00 39.78 40.30 1two n ASN 72 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1two s ALA 73 N -1.40 3.80 1.25 5.20 0.00 -0.48 -3.38 121.76 126.75 1two s ALA 73 Ca 0.30 1.47 -0.15 0.00 0.00 0.00 0.00 51.96 53.58 1two s ALA 73 Cb 0.03 -3.64 0.32 0.00 0.00 0.00 0.00 23.12 19.82 1two s ALA 73 CO -0.14 -0.86 0.99 0.21 0.00 0.00 0.00 175.76 175.97 1two s LYS 74 N 0.66 -1.59 0.00 0.00 2.36 -1.26 -4.81 119.74 115.10 1two s LYS 74 Ca 0.69 0.66 0.16 0.00 -2.55 0.00 0.00 55.97 54.93 1two s LYS 74 Cb -0.46 -1.49 0.94 0.00 -1.05 0.00 0.00 37.83 35.78 1two s LYS 74 CO 0.36 -4.12 1.37 -0.25 1.55 0.00 0.00 175.35 174.26 1two n ASP 75 N -5.18 0.00 -0.08 1.43 8.00 -1.26 -1.98 116.55 117.49 1two n ASP 75 Ca 0.04 -0.68 -0.08 0.00 0.71 0.00 0.00 54.79 54.79 1two n ASP 75 Cb 0.56 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.52 1two n ASP 75 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1two n PHE 76 N -0.92 0.00 0.00 1.24 3.01 -1.26 -4.38 117.46 115.15 1two n PHE 76 Ca 0.12 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.58 1two n PHE 76 Cb 0.05 -0.84 0.00 0.00 -0.01 0.00 0.00 39.48 38.68 1two n PHE 76 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1two n ALA 77 N -2.62 -0.10 -0.45 4.37 0.00 -0.84 -0.03 120.51 120.84 1two n ALA 77 Ca -0.27 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.15 1two n ALA 77 Cb 1.04 0.06 -0.03 0.00 0.00 0.00 0.00 19.45 20.52 1two n ALA 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1two n MET 78 N -1.00 0.90 0.00 0.00 0.00 -1.25 -2.88 117.12 112.89 1two n MET 78 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 57.70 57.52 1two n MET 78 Cb 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 33.22 31.90 1two n MET 78 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1two n LYS 79 N 1.89 0.00 0.00 3.17 5.02 -1.04 -4.35 118.16 122.84 1two n LYS 79 Ca 0.08 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.44 1two n LYS 79 Cb 0.44 0.00 0.36 0.00 -0.02 0.00 0.00 35.03 35.80 1two n LYS 79 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1two n HIS 80 N -2.51 0.00 -2.09 2.13 1.44 0.96 -2.49 115.22 112.66 1two n HIS 80 Ca 0.00 0.00 -0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1two n HIS 80 Cb 0.00 -0.27 -0.00 0.00 0.12 0.00 0.00 29.99 29.84 1two n HIS 80 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1two n GLY 81 N -0.10 0.72 3.19 -1.39 0.00 -1.22 -5.10 105.19 101.30 1two n GLY 81 Ca 0.07 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 1two n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1two s ALA 82 N 0.00 1.16 0.22 4.61 0.00 -1.04 -4.99 121.76 121.72 1two s ALA 82 Ca 0.06 -1.32 -0.11 0.00 0.00 0.00 0.00 51.96 50.60 1two s ALA 82 Cb 0.07 0.07 -0.07 0.00 0.00 0.00 0.00 23.12 23.19 1two s ALA 82 CO -0.03 -0.11 0.56 -0.51 0.00 0.00 0.00 175.76 175.67 1two s ASP 83 N -2.81 6.68 0.56 0.00 1.01 -1.26 -4.64 116.67 116.20 1two s ASP 83 Ca 0.10 0.97 0.45 0.00 0.71 0.00 0.00 52.55 54.78 1two s ASP 83 Cb 0.01 -2.25 1.64 0.00 1.01 0.00 0.00 42.92 43.33 1two s ASP 83 CO -0.01 -0.04 1.64 -0.33 0.21 0.00 0.00 175.17 176.63 1two h GLU 84 N 2.75 0.00 -0.41 8.23 5.08 -1.95 2.32 114.58 130.60 1two h GLU 84 Ca -0.47 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.77 1two h GLU 84 Cb 1.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 1two h GLU 84 CO 0.68 0.00 -0.20 0.00 -1.00 0.00 0.00 179.01 178.49 1two h THR 85 N 0.00 1.27 -1.02 1.13 1.03 -2.00 -2.88 112.91 110.45 1two h THR 85 Ca 0.79 -1.31 0.24 0.00 -0.01 0.00 0.00 66.41 66.12 1two h THR 85 Cb 3.23 1.16 -0.11 0.00 -1.07 0.00 0.00 68.15 71.36 1two h THR 85 CO -0.01 0.44 0.63 0.00 -0.01 0.00 0.00 175.52 176.57 1two h MET 86 N 0.71 0.52 -0.73 0.00 -0.00 0.36 1.74 114.93 117.53 1two h MET 86 Ca 0.10 -0.03 0.16 0.00 -0.00 0.00 0.00 59.70 59.93 1two h MET 86 Cb 0.72 -0.12 -0.12 0.00 -0.00 0.00 0.00 31.60 32.08 1two h MET 86 CO 0.06 0.34 0.05 0.00 -0.00 0.00 0.00 176.91 177.36 1two h ALA 87 N 1.67 0.80 0.00 -3.00 0.00 -1.52 0.15 119.26 117.36 1two h ALA 87 Ca 0.61 0.22 -0.26 0.00 0.00 0.00 0.00 54.91 55.47 1two h ALA 87 Cb 1.28 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 19.39 1two h ALA 87 CO -0.38 -0.40 -1.55 0.94 0.00 0.00 0.00 179.25 177.86 1two n GLN 88 N -5.29 0.56 -0.38 0.00 0.00 0.57 -4.13 117.38 108.71 1two n GLN 88 Ca 0.13 0.45 -0.05 0.00 -0.00 0.00 0.00 57.00 57.53 1two n GLN 88 Cb 0.46 -1.64 -0.01 0.00 0.00 0.00 0.00 30.24 29.05 1two n GLN 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1two n GLN 89 N -4.40 -0.30 -0.23 3.69 6.02 0.56 0.14 117.38 122.85 1two n GLN 89 Ca -0.35 1.46 0.02 0.00 -0.01 0.00 0.00 57.00 58.13 1two n GLN 89 Cb 0.68 -2.16 0.12 0.00 1.02 0.00 0.00 30.24 29.90 1two n GLN 89 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1two h LEU 90 N 0.00 -0.38 -0.97 1.08 4.07 -0.88 2.23 115.31 120.46 1two h LEU 90 Ca 0.26 0.18 0.00 0.00 0.08 0.00 0.00 57.88 58.40 1two h LEU 90 Cb 0.50 0.33 0.00 0.00 1.08 0.00 0.00 40.66 42.58 1two h LEU 90 CO -0.93 -0.17 0.25 0.52 -1.08 0.00 0.00 178.44 177.03 1two n VAL 91 N -5.35 0.68 -0.00 1.22 0.31 0.36 0.21 118.33 115.77 1two n VAL 91 Ca 0.11 0.74 -0.00 0.00 -0.01 0.00 0.00 64.34 65.18 1two n VAL 91 Cb 0.40 -1.74 -0.00 0.00 -0.91 0.00 0.00 33.84 31.59 1two n VAL 91 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1two h ASP 92 N 0.00 -0.00 -0.14 4.52 3.58 0.42 -3.07 116.42 121.74 1two h ASP 92 Ca 0.00 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 1two h ASP 92 Cb 0.50 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.54 1two h ASP 92 CO 0.00 0.02 -0.03 0.16 -2.88 0.00 0.00 179.24 176.51 1two h ILE 93 N -0.03 1.28 -0.39 2.25 -2.65 -1.19 -2.25 117.51 114.53 1two h ILE 93 Ca -0.00 -0.95 0.11 0.00 1.03 0.00 0.00 64.86 65.05 1two h ILE 93 Cb 0.00 1.64 -0.02 0.00 -2.05 0.00 0.00 36.82 36.40 1two h ILE 93 CO 0.00 0.28 0.50 0.40 0.03 0.00 0.00 178.15 179.36 1two h ILE 94 N -0.04 0.27 0.01 0.16 2.04 0.23 1.58 117.51 121.76 1two h ILE 94 Ca 0.04 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.70 1two h ILE 94 Cb 0.44 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1two h ILE 94 CO 0.01 0.00 -0.88 0.45 0.00 0.00 0.00 178.15 177.73 1two h HIS 95 N 0.00 0.25 0.00 1.37 3.86 -1.30 0.41 115.15 119.74 1two h HIS 95 Ca 0.19 -0.14 -0.12 0.00 -1.16 0.00 0.00 60.37 59.13 1two h HIS 95 Cb 1.18 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 29.61 1two h HIS 95 CO 0.00 0.96 -1.30 0.41 0.86 0.00 0.00 177.93 178.87 1two n GLY 96 N 0.90 -1.27 0.05 2.45 0.00 0.45 -3.37 105.19 104.39 1two n GLY 96 Ca -0.03 -0.15 -0.03 0.00 0.00 0.00 0.00 46.02 45.81 1two n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1two h GLU 98 N -0.69 0.16 -0.00 0.00 4.81 -0.36 3.79 114.58 122.29 1two h GLU 98 Ca 0.00 -0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 59.07 1two h GLU 98 Cb 0.29 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1two h GLU 98 CO 0.00 0.11 -0.69 1.57 -0.73 0.00 0.00 179.01 179.27 1two h LYS 99 N 0.17 0.01 -0.01 1.92 2.10 -1.67 -2.90 116.57 116.20 1two h LYS 99 Ca 0.72 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.36 1two h LYS 99 Cb 2.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.59 1two h LYS 99 CO -0.29 0.70 -0.65 0.45 -2.00 0.00 0.00 179.45 177.66 1two n SER 100 N -3.72 1.17 -3.97 7.07 2.88 0.93 -4.57 113.62 113.40 1two n SER 100 Ca -0.01 -0.96 -0.31 0.00 -1.33 0.00 0.00 58.87 56.26 1two n SER 100 Cb 0.68 0.58 -0.10 0.00 -0.75 0.00 0.00 64.21 64.62 1two n SER 100 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1two s ALA 101 N -2.79 3.93 1.00 -1.46 0.00 1.05 -5.03 121.76 118.46 1two s ALA 101 Ca 0.14 -3.81 -0.15 0.00 0.00 0.00 0.00 51.96 48.14 1two s ALA 101 Cb 0.17 -2.39 0.19 0.00 0.00 0.00 0.00 23.12 21.10 1two s ALA 101 CO 0.71 -2.11 1.18 -1.25 0.00 0.00 0.00 175.76 174.28 1two s PRO 102 N -1.35 0.41 0.00 0.00 0.04 -1.26 -4.67 135.00 128.17 1two s PRO 102 Ca 0.25 0.02 -0.00 0.00 0.04 0.00 0.00 61.00 61.30 1two s PRO 102 Cb -0.07 -1.78 -0.02 0.00 0.04 0.00 0.00 34.50 32.67 1two s PRO 102 CO -0.14 -2.64 1.64 -0.35 0.04 0.00 0.00 177.00 175.55 1two n PRO 103 N -4.02 0.83 -1.87 0.56 -0.04 -1.26 -4.50 135.00 124.70 1two n PRO 103 Ca 0.10 -0.08 -0.38 0.00 -0.04 0.00 0.00 63.50 63.11 1two n PRO 103 Cb 0.59 -1.20 0.03 0.00 -0.04 0.00 0.00 33.50 32.89 1two n PRO 103 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1two s ASN 104 N 2.02 5.39 0.64 3.54 3.84 -1.26 -4.84 114.94 124.28 1two s ASN 104 Ca 0.05 2.67 0.33 0.00 0.21 0.00 0.00 52.86 56.12 1two s ASN 104 Cb 0.02 -2.63 1.81 0.00 -0.55 0.00 0.00 41.25 39.90 1two s ASN 104 CO 0.00 -1.48 2.06 0.44 -2.79 0.00 0.00 177.10 175.33 1two h ASP 105 N 1.50 0.00 -0.19 -4.21 3.32 -2.05 0.24 116.42 115.03 1two h ASP 105 Ca -0.51 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.44 1two h ASP 105 Cb 1.29 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.78 1two h ASP 105 CO 0.57 0.00 0.13 -0.67 -1.72 0.00 0.00 179.24 177.55 1two n ASP 106 N -3.20 3.14 -0.64 6.45 -0.08 -1.26 -4.42 116.55 116.53 1two n ASP 106 Ca -0.01 -2.31 0.50 0.00 -1.51 0.00 0.00 54.79 51.46 1two n ASP 106 Cb 0.32 -0.57 0.78 0.00 2.34 0.00 0.00 41.12 44.00 1two n ASP 106 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 1two h LYS 107 N 0.20 0.00 -0.55 -0.67 2.10 -0.85 1.95 116.57 118.75 1two h LYS 107 Ca 0.12 0.00 0.11 0.00 -2.00 0.00 0.00 60.65 58.88 1two h LYS 107 Cb 1.36 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 32.60 1two h LYS 107 CO 0.21 0.00 0.05 0.00 -2.00 0.00 0.00 179.45 177.72 1two n MET 109 N -5.20 1.13 0.00 0.00 0.00 0.61 -3.99 117.12 109.68 1two n MET 109 Ca 0.07 -0.53 0.00 0.00 0.00 0.00 0.00 57.70 57.24 1two n MET 109 Cb 0.30 -1.40 0.00 0.00 0.00 0.00 0.00 33.22 32.13 1two n MET 109 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1two n LYS 110 N -0.65 0.00 -0.30 3.17 3.00 0.17 -3.87 118.16 119.69 1two n LYS 110 Ca 0.06 0.01 0.13 0.00 -0.00 0.00 0.00 58.31 58.51 1two n LYS 110 Cb 0.37 -0.27 0.28 0.00 0.00 0.00 0.00 35.03 35.41 1two n LYS 110 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1two h THR 111 N 0.00 0.30 -0.84 3.15 2.02 -0.92 0.67 112.91 117.30 1two h THR 111 Ca 0.00 -0.07 0.20 0.00 0.77 0.00 0.00 66.41 67.32 1two h THR 111 Cb 0.00 0.09 -0.13 0.00 -1.74 0.00 0.00 68.15 66.38 1two h THR 111 CO 0.00 0.04 0.26 -0.29 0.37 0.00 0.00 175.52 175.89 1two h ILE 112 N 0.20 0.42 -0.78 3.11 -0.00 -1.62 0.55 117.51 119.39 1two h ILE 112 Ca 0.55 -0.10 0.18 0.00 -0.00 0.00 0.00 64.86 65.49 1two h ILE 112 Cb 1.10 0.12 -0.14 0.00 -0.00 0.00 0.00 36.82 37.90 1two h ILE 112 CO -0.66 0.05 -0.01 -0.78 -0.00 0.00 0.00 178.15 176.75 1two h ASP 113 N 0.28 -0.39 0.17 2.19 3.58 0.26 1.40 116.42 123.91 1two h ASP 113 Ca 0.51 0.21 -0.01 0.00 0.42 0.00 0.00 57.03 58.16 1two h ASP 113 Cb 0.96 0.37 0.00 0.00 1.72 0.00 0.00 39.33 42.38 1two h ASP 113 CO -0.57 -0.20 -0.08 0.58 -2.88 0.00 0.00 179.24 176.09 1two h VAL 114 N 0.09 0.54 -0.18 2.25 2.07 -0.16 1.07 116.25 121.92 1two h VAL 114 Ca 0.43 -1.10 0.05 0.00 0.82 0.00 0.00 66.70 66.90 1two h VAL 114 Cb 0.75 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1two h VAL 114 CO -0.70 0.16 0.66 0.00 0.02 0.00 0.00 177.57 177.70 1two h ALA 115 N -0.64 1.85 0.00 1.67 0.00 0.53 0.54 119.26 123.21 1two h ALA 115 Ca -0.02 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.54 1two h ALA 115 Cb 0.43 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1two h ALA 115 CO 0.04 -0.75 -2.29 -0.12 0.00 0.00 0.00 179.25 176.13 1two n MET 116 N -2.93 0.77 -0.21 0.00 0.00 0.47 -3.97 117.12 111.26 1two n MET 116 Ca 0.03 0.07 -0.06 0.00 0.00 0.00 0.00 57.70 57.74 1two n MET 116 Cb 0.74 -1.46 -0.01 0.00 0.00 0.00 0.00 33.22 32.49 1two n MET 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1two h PHE 118 N -0.18 0.73 -0.03 0.00 3.57 -1.64 -1.75 116.94 117.64 1two h PHE 118 Ca 0.22 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 1two h PHE 118 Cb 0.56 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.08 1two h PHE 118 CO -0.67 0.67 -0.09 -0.22 -2.23 0.00 0.00 178.31 175.78 1two h LYS 119 N 0.67 0.04 0.00 1.11 3.64 -0.20 0.42 116.57 122.24 1two h LYS 119 Ca 0.14 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1two h LYS 119 Cb 0.36 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1two h LYS 119 CO 0.01 0.13 -0.12 0.87 -2.27 0.00 0.00 179.45 178.07 1two h LYS 120 N 0.04 0.00 -0.14 1.90 1.57 0.11 -0.90 116.57 119.15 1two h LYS 120 Ca 0.01 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1two h LYS 120 Cb 0.18 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1two h LYS 120 CO 0.01 0.12 0.12 0.93 -0.57 0.00 0.00 179.45 180.06 1two h GLU 121 N 0.00 0.00 0.21 3.15 4.39 -0.91 -0.92 114.58 120.50 1two h GLU 121 Ca -0.00 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.42 1two h GLU 121 Cb 0.24 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 28.92 1two h GLU 121 CO 0.02 0.00 -1.25 0.82 -1.16 0.00 0.00 179.01 177.44 1two h ILE 122 N 0.00 1.35 -0.31 3.13 1.08 -1.27 -3.21 117.51 118.28 1two h ILE 122 Ca 0.07 -2.62 0.09 0.00 -0.39 0.00 0.00 64.86 62.00 1two h ILE 122 Cb 0.31 3.09 -0.01 0.00 -3.07 0.00 0.00 36.82 37.13 1two h ILE 122 CO -0.00 0.77 0.71 -0.74 -0.69 0.00 0.00 178.15 178.21 1two h HIS 123 N -0.06 0.00 -0.82 1.37 -0.00 -1.07 2.72 115.15 117.29 1two h HIS 123 Ca -0.22 0.00 -0.40 0.00 -0.00 0.00 0.00 60.37 59.75 1two h HIS 123 Cb 1.96 0.00 -0.24 0.00 -0.00 0.00 0.00 27.41 29.13 1two h HIS 123 CO 0.15 0.00 0.51 0.36 -0.00 0.00 0.00 177.93 178.95 1two n LYS 124 N -3.05 2.32 0.00 5.26 2.85 -1.14 -4.62 118.16 119.78 1two n LYS 124 Ca 0.06 -2.60 0.00 0.00 -1.05 0.00 0.00 58.31 54.72 1two n LYS 124 Cb 0.83 -2.03 0.00 0.00 -0.65 0.00 0.00 35.03 33.18 1two n LYS 124 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 1two n LEU 125 N -0.76 0.00 -0.23 -5.58 -0.00 0.91 -4.32 117.00 107.02 1two n LEU 125 Ca 0.49 0.00 0.04 0.00 -0.00 0.00 0.00 56.01 56.54 1two n LEU 125 Cb 1.47 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 44.89 1two n LEU 125 CO 0.50 0.00 0.24 -3.20 -0.00 0.00 0.00 177.39 174.92 1two n ASN 126 N 0.00 1.23 -4.89 1.45 5.15 -1.26 -4.99 115.26 111.95 1two n ASN 126 Ca 0.00 -1.12 -0.30 0.00 -0.60 0.00 0.00 54.58 52.56 1two n ASN 126 Cb 0.00 0.38 -0.04 0.00 -0.53 0.00 0.00 39.78 39.60 1two n ASN 126 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1two s TRP 127 N -1.15 3.46 -0.30 1.20 0.51 -1.26 -5.05 118.94 116.36 1two s TRP 127 Ca 0.08 0.78 -0.19 0.00 -2.12 0.00 0.00 56.10 54.65 1two s TRP 127 Cb 0.07 -2.21 -0.02 0.00 -0.81 0.00 0.00 33.47 30.51 1two s TRP 127 CO 0.20 0.15 0.56 0.54 -0.51 0.00 0.00 176.95 177.89 1two s VAL 128 N -2.06 5.01 -0.04 4.03 0.11 -1.26 -4.61 120.40 121.58 1two s VAL 128 Ca 0.46 0.75 -0.05 0.00 -2.93 0.00 0.00 61.98 60.22 1two s VAL 128 Cb -0.11 -3.92 -0.20 0.00 -1.53 0.00 0.00 36.38 30.62 1two s VAL 128 CO 0.28 -0.07 2.85 -0.81 -3.33 0.00 0.00 175.10 174.02 1two n PRO 129 N 5.72 1.55 -0.59 1.54 -0.04 -1.26 -4.57 135.00 137.35 1two n PRO 129 Ca -0.03 -0.79 0.47 0.00 -0.04 0.00 0.00 63.50 63.11 1two n PRO 129 Cb 0.49 -1.90 0.76 0.00 -0.04 0.00 0.00 33.50 32.81 1two n PRO 129 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1two h ASN 130 N 3.80 0.09 -3.08 3.54 4.21 -1.93 -3.17 115.58 119.03 1two h ASN 130 Ca 0.16 0.06 -0.73 0.00 1.21 0.00 0.00 56.30 57.01 1two h ASN 130 Cb 1.12 0.06 -0.21 0.00 -1.12 0.00 0.00 38.32 38.17 1two h ASN 130 CO 0.34 -0.10 -0.08 -0.32 -1.29 0.00 0.00 177.43 175.97 1two s MET 131 N -5.04 3.03 -0.39 0.81 1.75 -1.26 -4.99 119.30 113.21 1two s MET 131 Ca -0.06 -1.40 0.02 0.00 -1.25 0.00 0.00 55.69 53.00 1two s MET 131 Cb 0.28 -4.23 0.12 0.00 2.84 0.00 0.00 34.83 33.84 1two s MET 131 CO 0.86 -1.34 0.15 -0.51 -0.65 0.00 0.00 175.02 173.54 1two s ASP 132 N 3.32 4.11 -0.29 1.11 1.01 -1.20 -5.00 116.67 119.72 1two s ASP 132 Ca 0.08 -2.26 -0.19 0.00 0.71 0.00 0.00 52.55 50.88 1two s ASP 132 Cb -0.26 -1.20 0.18 0.00 1.01 0.00 0.00 42.92 42.66 1two s ASP 132 CO 0.06 -0.33 1.20 -1.48 0.21 0.00 0.00 175.17 174.83 1two s LEU 133 N 0.79 -0.22 0.02 1.23 -0.00 -1.26 -4.42 118.68 114.82 1two s LEU 133 Ca 0.14 0.38 -0.04 0.00 -0.00 0.00 0.00 54.13 54.60 1two s LEU 133 Cb -0.21 1.36 -0.02 0.00 -0.00 0.00 0.00 46.19 47.32 1two s LEU 133 CO -0.09 -0.06 -0.08 0.52 -0.00 0.00 0.00 176.35 176.63 1two n VAL 134 N 2.80 1.13 0.69 1.48 0.31 -1.26 -4.78 118.33 118.70 1two n VAL 134 Ca -0.15 0.27 0.08 0.00 -0.01 0.00 0.00 64.34 64.52 1two n VAL 134 Cb 0.57 -1.73 -0.01 0.00 -0.91 0.00 0.00 33.84 31.75 1two n VAL 134 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1two n ILE 135 N -3.65 0.00 -1.49 2.52 -0.00 -1.26 -4.97 119.36 110.52 1two n ILE 135 Ca -0.05 -0.31 0.00 0.00 -0.00 0.00 0.00 62.75 62.39 1two n ILE 135 Cb 0.20 1.16 0.00 0.00 -0.00 0.00 0.00 39.64 41.00 1two n ILE 135 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1two n GLY 136 N 1.16 0.83 3.58 3.28 0.00 -1.26 -5.07 105.19 107.71 1two n GLY 136 Ca 0.06 -0.63 -0.27 0.00 0.00 0.00 0.00 46.02 45.18 1two n GLY 136 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1two s GLU 137 N -3.22 1.94 -0.27 1.61 -1.05 -1.26 -5.08 118.70 111.37 1two s GLU 137 Ca 0.00 -2.17 -0.29 0.00 -0.15 0.00 0.00 54.97 52.37 1two s GLU 137 Cb 0.00 -1.04 -0.02 0.00 -0.44 0.00 0.00 34.13 32.63 1two s GLU 137 CO 0.00 -0.33 1.74 0.54 0.95 0.00 0.00 175.26 178.16 1two s VAL 138 N -3.08 3.54 0.00 1.83 0.11 -1.26 -4.12 120.40 117.42 1two s VAL 138 Ca 0.23 0.57 0.00 0.00 -2.93 0.00 0.00 61.98 59.86 1two s VAL 138 Cb 0.05 -3.63 0.00 0.00 -1.53 0.00 0.00 36.38 31.26 1two s VAL 138 CO 0.12 -0.34 0.00 -0.11 -3.33 0.00 0.00 175.10 171.44 1two n LEU 139 N 9.48 -0.04 -4.87 2.54 0.00 -1.26 -5.12 117.00 117.73 1two n LEU 139 Ca 0.21 0.03 -0.30 0.00 0.00 0.00 0.00 56.01 55.95 1two n LEU 139 Cb 0.46 0.14 0.06 0.00 0.00 0.00 0.00 43.42 44.07 1two n LEU 139 CO 0.67 -0.07 0.75 0.00 0.00 0.00 0.00 177.39 178.73 1two s ALA 140 N -2.00 2.74 -1.07 1.96 0.00 -1.26 -4.91 121.76 117.23 1two s ALA 140 Ca 0.00 -0.34 -0.23 0.00 0.00 0.00 0.00 51.96 51.38 1two s ALA 140 Cb 0.00 -3.04 -0.07 0.00 0.00 0.00 0.00 23.12 20.01 1two s ALA 140 CO 0.00 -1.31 1.94 -1.21 0.00 0.00 0.00 175.76 175.18 1two s GLU 141 N -5.34 2.53 0.00 0.00 2.02 -1.26 -4.92 118.70 111.73 1two s GLU 141 Ca 0.59 -0.80 0.11 0.00 0.02 0.00 0.00 54.97 54.89 1two s GLU 141 Cb -0.12 -5.17 0.09 0.00 0.10 0.00 0.00 34.13 29.03 1two s GLU 141 CO 0.52 -3.72 0.85 1.55 0.02 0.00 0.00 175.26 174.48