#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 -0.01 0.17 1.43 -0.04 -1.26 -4.76 135.00 130.53 1two n PRO 2 Ca 0.00 0.00 0.18 0.00 -0.04 0.00 0.00 63.50 63.64 1two n PRO 2 Cb 0.00 0.00 0.80 0.00 -0.04 0.00 0.00 33.50 34.26 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 -1.00 0.54 4.39 -1.92 0.09 114.58 116.68 1two h GLU 3 Ca 0.00 0.00 0.23 0.00 0.34 0.00 0.00 59.36 59.93 1two h GLU 3 Cb 0.00 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 28.55 1two h GLU 3 CO 0.00 0.00 0.63 0.82 -1.16 0.00 0.00 179.01 179.30 1two h ILE 4 N 0.00 0.62 0.00 3.13 1.08 -1.89 1.47 117.51 121.91 1two h ILE 4 Ca 0.12 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 64.40 1two h ILE 4 Cb 0.64 0.02 0.00 0.00 -3.07 0.00 0.00 36.82 34.42 1two h ILE 4 CO -0.00 0.10 0.00 -0.03 -0.69 0.00 0.00 178.15 177.53 1two h MET 5 N 0.55 0.00 -4.57 2.37 4.05 -1.27 -3.37 114.93 112.70 1two h MET 5 Ca 0.57 0.00 -0.70 0.00 -0.28 0.00 0.00 59.70 59.30 1two h MET 5 Cb 1.20 0.00 -0.32 0.00 -0.80 0.00 0.00 31.60 31.69 1two h MET 5 CO -0.33 0.00 -0.57 0.21 0.23 0.00 0.00 176.91 176.45 1two s LYS 6 N -3.80 2.34 -0.03 0.39 2.20 0.50 -5.07 119.74 116.27 1two s LYS 6 Ca -0.01 -1.51 0.07 0.00 -0.36 0.00 0.00 55.97 54.16 1two s LYS 6 Cb 0.10 -3.53 -0.02 0.00 -1.51 0.00 0.00 37.83 32.88 1two s LYS 6 CO 0.48 -0.88 -0.25 0.54 -0.36 0.00 0.00 175.35 174.87 1two s ASN 7 N 1.72 3.01 0.94 1.43 4.22 -1.26 -4.89 114.94 120.11 1two s ASN 7 Ca 0.02 -0.48 0.00 0.00 -2.14 0.00 0.00 52.86 50.27 1two s ASN 7 Cb -0.22 -0.49 0.00 0.00 1.28 0.00 0.00 41.25 41.82 1two s ASN 7 CO -0.01 0.29 0.00 0.00 -2.04 0.00 0.00 177.10 175.34 1two n LEU 8 N 2.61 0.00 0.00 3.54 -0.00 -1.26 -5.00 117.00 116.89 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 -0.90 0.00 -0.24 -0.00 0.00 0.00 177.39 176.48 1two n SER 9 N -2.81 0.00 0.00 1.45 2.88 -1.26 -4.52 113.62 109.36 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 3.65 -0.12 -3.46 3.02 -1.26 -4.33 115.26 112.76 1two n ASN 10 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.67 1two n ASN 10 Cb 0.00 0.28 0.23 0.00 -0.61 0.00 0.00 39.78 39.68 1two n ASN 10 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1two n ASN 11 N -1.83 0.14 -0.02 6.41 3.02 -1.26 0.16 115.26 121.88 1two n ASN 11 Ca 0.00 0.65 -0.03 0.00 -0.03 0.00 0.00 54.58 55.16 1two n ASN 11 Cb 0.39 -0.32 -0.01 0.00 -0.61 0.00 0.00 39.78 39.23 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 -3.88 0.00 -0.38 3.10 7.35 -1.26 -3.90 117.46 118.49 1two n PHE 12 Ca 0.15 0.00 0.30 0.00 -0.76 0.00 0.00 57.45 57.14 1two n PHE 12 Cb 0.50 -0.18 0.57 0.00 0.35 0.00 0.00 39.48 40.72 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 -0.36 1.68 0.28 7.13 0.00 -1.58 1.84 103.07 112.06 1two h GLY 13 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 1two h GLY 13 CO 0.00 -0.46 -0.04 1.70 0.00 0.00 0.00 176.54 177.74 1two h LYS 14 N 0.18 -0.12 -0.81 4.80 3.11 0.14 -0.27 116.57 123.60 1two h LYS 14 Ca 0.77 0.01 0.09 0.00 -2.81 0.00 0.00 60.65 58.71 1two h LYS 14 Cb 2.12 0.03 -0.06 0.00 -1.00 0.00 0.00 32.23 33.33 1two h LYS 14 CO -0.52 0.42 0.53 0.00 -2.81 0.00 0.00 179.45 177.07 1two h ALA 15 N -0.16 1.70 -0.09 5.00 0.00 -0.29 1.35 119.26 126.77 1two h ALA 15 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1two h ALA 15 Cb 0.59 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1two h ALA 15 CO 0.02 0.14 -0.07 1.98 0.00 0.00 0.00 179.25 181.32 1two h MET 16 N 0.80 0.21 -0.48 0.00 4.05 0.26 0.75 114.93 120.52 1two h MET 16 Ca 0.37 -0.10 -0.09 0.00 -0.28 0.00 0.00 59.70 59.60 1two h MET 16 Cb 0.38 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.17 1two h MET 16 CO -0.14 0.62 -0.04 0.22 0.23 0.00 0.00 176.91 177.80 1two h ASP 17 N -0.20 0.86 -0.38 1.39 3.58 -0.18 0.00 116.42 121.49 1two h ASP 17 Ca 0.02 -0.33 -0.13 0.00 0.42 0.00 0.00 57.03 57.01 1two h ASP 17 Cb 0.57 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 1two h ASP 17 CO 0.02 0.98 -0.27 1.56 -2.88 0.00 0.00 179.24 178.65 1two h GLN 18 N 0.72 0.85 -0.61 0.28 4.20 0.18 -2.78 115.11 117.95 1two h GLN 18 Ca 0.13 -0.41 -0.02 0.00 0.06 0.00 0.00 58.65 58.41 1two h GLN 18 Cb 0.56 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 1two h GLN 18 CO 0.03 1.05 0.30 0.00 -0.67 0.00 0.00 178.83 179.54 1two n LYS 20 N -4.35 0.15 -0.00 0.00 4.81 -0.03 -1.01 118.16 117.73 1two n LYS 20 Ca 0.06 0.18 -0.00 0.00 -0.87 0.00 0.00 58.31 57.68 1two n LYS 20 Cb 0.13 -1.50 -0.00 0.00 0.02 0.00 0.00 35.03 33.68 1two n LYS 20 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1two n ASP 21 N -1.29 0.13 -0.30 3.14 9.92 0.96 -3.19 116.55 125.92 1two n ASP 21 Ca 0.05 0.02 0.13 0.00 -0.53 0.00 0.00 54.79 54.46 1two n ASP 21 Cb 0.09 -0.22 0.30 0.00 -0.64 0.00 0.00 41.12 40.65 1two n ASP 21 CO 0.00 0.00 0.00 1.05 0.13 0.00 0.00 177.20 178.38 1two h GLU 22 N -0.03 0.27 0.00 -1.24 4.11 0.31 0.42 114.58 118.42 1two h GLU 22 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.41 1two h GLU 22 Cb 0.03 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1two h GLU 22 CO 0.00 0.18 -1.13 1.28 0.07 0.00 0.00 179.01 179.41 1two n LEU 23 N -5.15 0.79 -0.88 3.06 4.77 -0.18 -4.93 117.00 114.47 1two n LEU 23 Ca 0.22 -0.37 -0.08 0.00 -0.03 0.00 0.00 56.01 55.75 1two n LEU 23 Cb 0.68 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.71 1two n LEU 23 CO 0.09 0.19 -0.08 -1.20 -1.33 0.00 0.00 177.39 175.06 1two n SER 24 N -1.65 -3.52 -4.91 -1.43 7.64 0.15 -4.90 113.62 105.00 1two n SER 24 Ca 0.03 0.21 -0.27 0.00 1.01 0.00 0.00 58.87 59.84 1two n SER 24 Cb 0.37 -2.90 0.06 0.00 -1.01 0.00 0.00 64.21 60.74 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 -2.39 2.82 -0.12 -3.43 -0.00 -1.23 -4.85 118.68 109.48 1two s LEU 25 Ca 0.00 0.69 -0.29 0.00 -0.00 0.00 0.00 54.13 54.52 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 -1.54 1.26 -2.16 -0.00 0.00 0.00 176.35 173.90 1two s PRO 26 N -5.30 4.27 0.00 1.48 0.04 -1.26 -4.13 135.00 130.10 1two s PRO 26 Ca 0.59 1.69 0.14 0.00 0.04 0.00 0.00 61.00 63.46 1two s PRO 26 Cb -0.11 -3.70 0.77 0.00 0.04 0.00 0.00 34.50 31.50 1two s PRO 26 CO 0.47 -0.62 1.28 -0.40 0.04 0.00 0.00 177.00 177.76 1two n ASP 27 N 6.12 0.00 0.12 6.66 5.75 -1.26 -1.92 116.55 132.02 1two n ASP 27 Ca 0.13 -0.25 -0.24 0.00 -0.01 0.00 0.00 54.79 54.43 1two n ASP 27 Cb 0.45 -0.10 -0.16 0.00 -1.03 0.00 0.00 41.12 40.29 1two n ASP 27 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1two h SER 28 N 0.00 0.75 -0.42 -1.12 4.64 -1.96 -1.36 113.55 114.08 1two h SER 28 Ca 0.00 -0.89 -0.05 0.00 -0.47 0.00 0.00 61.79 60.38 1two h SER 28 Cb 0.04 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 61.86 1two h SER 28 CO 0.00 1.71 0.09 -0.37 -0.87 0.00 0.00 176.83 177.39 1two h VAL 29 N 0.13 1.22 0.04 0.95 -1.51 -1.79 0.12 116.25 115.41 1two h VAL 29 Ca -0.28 -0.83 -0.23 0.00 -1.23 0.00 0.00 66.70 64.13 1two h VAL 29 Cb 2.14 0.75 -0.01 0.00 -2.13 0.00 0.00 31.29 32.05 1two h VAL 29 CO 0.24 0.30 -1.02 1.62 -1.23 0.00 0.00 177.57 177.49 1two h VAL 30 N 0.73 1.52 0.00 7.19 3.04 -1.63 -2.98 116.25 124.13 1two h VAL 30 Ca 0.16 -2.87 0.00 0.00 -1.01 0.00 0.00 66.70 62.98 1two h VAL 30 Cb 0.32 2.67 0.00 0.00 -2.01 0.00 0.00 31.29 32.27 1two h VAL 30 CO 0.00 0.83 0.00 0.00 -1.01 0.00 0.00 177.57 177.40 1two h ALA 31 N 0.83 1.00 0.00 3.17 0.00 -0.61 -2.33 119.26 121.32 1two h ALA 31 Ca -0.07 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1two h ALA 31 Cb 1.70 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 1two h ALA 31 CO 0.16 0.00 -0.80 0.22 0.00 0.00 0.00 179.25 178.82 1two h ASP 32 N 0.00 0.00 -0.85 0.00 3.58 -0.63 -3.16 116.42 115.36 1two h ASP 32 Ca 0.00 0.00 0.17 0.00 0.42 0.00 0.00 57.03 57.62 1two h ASP 32 Cb 0.53 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 41.48 1two h ASP 32 CO 0.00 0.80 0.41 -0.07 -2.88 0.00 0.00 179.24 177.50 1two h LEU 33 N 0.00 0.44 -0.95 2.28 3.38 -1.41 0.88 115.31 119.92 1two h LEU 33 Ca -0.01 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1two h LEU 33 Cb 1.45 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.25 1two h LEU 33 CO 0.10 0.14 -0.03 0.22 0.09 0.00 0.00 178.44 178.97 1two h TYR 34 N 0.54 0.00 0.00 1.13 3.20 -1.68 -3.33 116.97 116.82 1two h TYR 34 Ca 0.49 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.36 1two h TYR 34 Cb 0.78 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.05 1two h TYR 34 CO -0.11 0.03 0.00 -1.71 -1.64 0.00 0.00 178.16 174.72 1two n ASN 35 N -3.12 0.00 0.00 -2.11 2.85 0.30 -4.94 115.26 108.24 1two n ASN 35 Ca 0.02 0.65 0.00 0.00 -0.11 0.00 0.00 54.58 55.14 1two n ASN 35 Cb 0.39 -0.33 0.00 0.00 1.24 0.00 0.00 39.78 41.08 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 -1.50 0.00 -0.67 1.20 3.72 -0.81 -5.01 117.46 114.39 1two n PHE 36 Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 1two n PHE 36 Cb 0.00 0.00 0.19 0.00 -0.94 0.00 0.00 39.48 38.73 1two n PHE 36 CO 0.00 0.00 0.00 -2.67 -0.05 0.00 0.00 176.76 174.04 1two n TRP 37 N 0.00 2.19 -0.22 1.38 4.27 -1.22 -4.57 117.44 119.27 1two n TRP 37 Ca 0.00 -1.28 -0.08 0.00 -3.89 0.00 0.00 57.50 52.25 1two n TRP 37 Cb 0.00 -0.69 -0.04 0.00 -1.36 0.00 0.00 31.31 29.22 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 1.43 -0.21 -0.69 -2.67 1.57 -1.85 2.04 116.57 116.19 1two h LYS 38 Ca 0.36 0.01 0.20 0.00 -1.87 0.00 0.00 60.65 59.35 1two h LYS 38 Cb 2.24 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 34.57 1two h LYS 38 CO 0.73 -0.14 0.79 0.38 -0.57 0.00 0.00 179.45 180.65 1two h ASP 39 N -0.21 0.00 -1.97 0.86 3.04 -1.85 0.25 116.42 116.53 1two h ASP 39 Ca 0.18 0.00 -0.76 0.00 -3.24 0.00 0.00 57.03 53.21 1two h ASP 39 Cb 0.56 0.00 -0.25 0.00 -1.04 0.00 0.00 39.33 38.59 1two h ASP 39 CO -0.71 0.00 1.07 -0.67 -2.04 0.00 0.00 179.24 176.90 1two n ASP 40 N -3.49 7.42 -2.08 4.15 -0.08 0.69 -4.89 116.55 118.27 1two n ASP 40 Ca 0.14 -3.70 -0.01 0.00 -1.51 0.00 0.00 54.79 49.71 1two n ASP 40 Cb 1.03 -1.13 0.01 0.00 2.34 0.00 0.00 41.12 43.36 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 -0.15 -3.98 -0.35 -0.67 4.01 0.86 -4.47 117.16 112.41 1two n TYR 41 Ca 0.52 -0.05 0.30 0.00 -0.16 0.00 0.00 57.90 58.50 1two n TYR 41 Cb 0.27 -0.04 0.49 0.00 -0.31 0.00 0.00 39.34 39.75 1two n TYR 41 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 1two n VAL 42 N -2.05 -0.15 -0.07 -0.72 3.14 -1.23 0.25 118.33 117.49 1two n VAL 42 Ca 0.01 1.24 0.23 0.00 -2.96 0.00 0.00 64.34 62.86 1two n VAL 42 Cb 0.02 -2.03 0.48 0.00 -1.06 0.00 0.00 33.84 31.25 1two n VAL 42 CO 0.00 0.00 0.00 -0.03 -6.46 0.00 0.00 176.83 170.34 1two h MET 43 N 0.00 0.00 0.00 1.45 -1.53 -1.91 -2.44 114.93 110.50 1two h MET 43 Ca 0.62 0.00 -0.03 0.00 -3.44 0.00 0.00 59.70 56.86 1two h MET 43 Cb 2.08 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 33.13 1two h MET 43 CO -0.29 0.00 -1.10 2.41 0.14 0.00 0.00 176.91 178.08 1two n THR 44 N -3.26 0.09 -3.91 -0.77 -1.04 0.68 -4.96 114.28 101.11 1two n THR 44 Ca 0.16 -0.03 -0.30 0.00 -2.04 0.00 0.00 64.05 61.84 1two n THR 44 Cb 1.23 -1.44 -0.15 0.00 -1.82 0.00 0.00 70.33 68.15 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 -5.07 4.44 0.25 8.00 2.15 -0.93 -4.97 116.67 120.55 1two s ASP 45 Ca -0.02 -2.09 -0.05 0.00 0.43 0.00 0.00 52.55 50.82 1two s ASP 45 Cb 0.01 -1.36 0.32 0.00 -0.30 0.00 0.00 42.92 41.58 1two s ASP 45 CO 0.03 -0.37 1.90 -0.09 -0.17 0.00 0.00 175.17 176.47 1two h ARG 46 N 7.62 1.21 -0.89 4.34 2.43 -1.80 -1.56 114.38 125.74 1two h ARG 46 Ca -0.07 -0.07 0.23 0.00 -0.81 0.00 0.00 59.98 59.26 1two h ARG 46 Cb 1.00 -0.27 -0.13 0.00 -0.42 0.00 0.00 29.97 30.15 1two h ARG 46 CO 0.52 0.80 0.35 -0.07 -1.51 0.00 0.00 179.97 180.06 1two h LEU 47 N 1.25 0.23 -1.70 3.80 -0.00 -1.93 1.78 115.31 118.73 1two h LEU 47 Ca 0.39 0.17 0.10 0.00 -0.00 0.00 0.00 57.88 58.54 1two h LEU 47 Cb -0.01 0.18 -0.03 0.00 -0.00 0.00 0.00 40.66 40.80 1two h LEU 47 CO -0.12 -0.06 0.38 0.00 -0.00 0.00 0.00 178.44 178.64 1two h ALA 48 N 1.74 2.07 0.00 1.53 0.00 -1.60 1.61 119.26 124.61 1two h ALA 48 Ca 0.56 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 55.27 1two h ALA 48 Cb 1.10 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1two h ALA 48 CO -0.57 -0.20 -0.94 0.78 0.00 0.00 0.00 179.25 178.32 1two h GLY 49 N 0.34 0.00 0.68 0.00 0.00 0.25 -2.52 103.07 101.82 1two h GLY 49 Ca 0.26 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.41 1two h GLY 49 CO -0.06 0.00 -0.77 0.00 0.00 0.00 0.00 176.54 175.70 1two h ALA 51 N 0.10 0.43 -0.88 0.00 0.00 0.21 0.02 119.26 119.15 1two h ALA 51 Ca -0.13 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1two h ALA 51 Cb 1.59 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.28 1two h ALA 51 CO 0.15 -0.19 0.53 0.97 0.00 0.00 0.00 179.25 180.71 1two h ILE 52 N 0.37 1.24 -0.47 0.00 -0.00 -1.54 0.15 117.51 117.26 1two h ILE 52 Ca 0.15 -0.52 0.02 0.00 -0.00 0.00 0.00 64.86 64.50 1two h ILE 52 Cb 0.05 -0.00 -0.03 0.00 -0.00 0.00 0.00 36.82 36.84 1two h ILE 52 CO -0.10 0.25 0.28 0.78 -0.00 0.00 0.00 178.15 179.37 1two h ASN 53 N 1.21 0.46 0.56 2.19 4.21 -0.72 0.19 115.58 123.68 1two h ASN 53 Ca 0.32 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.77 1two h ASN 53 Cb -0.06 -0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 37.04 1two h ASN 53 CO -0.06 0.33 -0.28 0.00 -1.29 0.00 0.00 177.43 176.13 1two h LEU 55 N 0.00 0.43 -0.43 0.00 5.85 0.14 1.85 115.31 123.15 1two h LEU 55 Ca -0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1two h LEU 55 Cb 0.63 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1two h LEU 55 CO 0.04 0.19 0.00 0.00 -0.34 0.00 0.00 178.44 178.32 1two n ALA 56 N -2.51 1.70 0.00 1.25 0.00 -0.88 -4.04 120.51 116.03 1two n ALA 56 Ca 0.18 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1two n ALA 56 Cb 0.64 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.75 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 -1.99 0.00 -3.74 0.00 5.66 0.63 -1.96 114.28 112.88 1two n THR 57 Ca 0.03 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.66 1two n THR 57 Cb 0.22 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 68.89 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 -4.68 2.25 0.41 1.09 -0.14 -1.26 -4.91 119.74 112.50 1two s LYS 58 Ca 0.00 -1.64 0.28 0.00 -1.36 0.00 0.00 55.97 53.25 1two s LYS 58 Cb 0.00 -3.59 1.06 0.00 -1.68 0.00 0.00 37.83 33.62 1two s LYS 58 CO 0.00 -0.98 1.83 -0.07 -0.76 0.00 0.00 175.35 175.37 1two h LEU 59 N 8.16 0.00 -1.13 3.17 4.07 -1.73 -2.34 115.31 125.50 1two h LEU 59 Ca -0.17 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.71 1two h LEU 59 Cb 1.06 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.79 1two h LEU 59 CO 0.70 0.00 -0.26 0.44 -1.08 0.00 0.00 178.44 178.24 1two h ASP 60 N 0.00 0.29 0.28 -0.43 3.32 -1.88 1.98 116.42 119.97 1two h ASP 60 Ca 0.00 -0.09 -0.34 0.00 0.02 0.00 0.00 57.03 56.62 1two h ASP 60 Cb 0.55 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.02 1two h ASP 60 CO 0.00 0.55 -1.72 -0.37 -1.72 0.00 0.00 179.24 175.98 1two h VAL 61 N 0.26 0.96 -0.20 -1.35 -1.51 -1.85 -3.24 116.25 109.32 1two h VAL 61 Ca 0.04 -2.59 -0.16 0.00 -1.23 0.00 0.00 66.70 62.77 1two h VAL 61 Cb 0.60 2.71 0.00 0.00 -2.13 0.00 0.00 31.29 32.48 1two h VAL 61 CO 0.04 0.83 -0.50 0.58 -1.23 0.00 0.00 177.57 177.30 1two h VAL 62 N 0.09 1.31 -3.28 7.19 2.07 -1.23 -3.41 116.25 118.99 1two h VAL 62 Ca -0.32 -1.73 -0.54 0.00 0.82 0.00 0.00 66.70 64.93 1two h VAL 62 Cb 2.06 1.88 -0.40 0.00 -1.52 0.00 0.00 31.29 33.32 1two h VAL 62 CO 0.16 0.54 -0.77 1.51 0.02 0.00 0.00 177.57 179.03 1two s ASP 63 N -6.76 3.20 0.05 0.57 -4.77 0.67 -4.72 116.67 104.90 1two s ASP 63 Ca -0.12 -1.00 -0.17 0.00 -3.30 0.00 0.00 52.55 47.97 1two s ASP 63 Cb 0.08 -0.69 -0.21 0.00 -1.09 0.00 0.00 42.92 41.00 1two s ASP 63 CO 0.85 -0.32 1.18 1.55 0.70 0.00 0.00 175.17 179.13 1two h PRO 64 N 8.19 0.58 -0.12 2.11 0.13 -1.73 -3.31 132.00 137.85 1two h PRO 64 Ca -0.16 -0.57 0.00 0.00 -0.87 0.00 0.00 66.00 64.40 1two h PRO 64 Cb 1.10 0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1two h PRO 64 CO 0.37 1.19 0.00 -3.47 -0.23 0.00 0.00 178.00 175.85 1two n ASP 65 N -4.07 2.22 -0.00 1.44 -0.08 -1.26 -4.95 116.55 109.84 1two n ASP 65 Ca -0.10 -1.63 0.00 0.00 -1.51 0.00 0.00 54.79 51.55 1two n ASP 65 Cb 0.73 -0.08 0.00 0.00 2.34 0.00 0.00 41.12 44.12 1two n ASP 65 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1two n GLY 66 N 0.53 0.66 0.38 0.27 0.00 -1.25 -4.99 105.19 100.79 1two n GLY 66 Ca 0.08 -0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.25 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 0.59 -1.43 1.61 -1.24 -1.84 -3.46 115.58 109.80 1two h ASN 67 Ca 0.00 0.05 0.14 0.00 0.71 0.00 0.00 56.30 57.21 1two h ASN 67 Cb 0.00 -0.06 -0.03 0.00 0.73 0.00 0.00 38.32 38.97 1two h ASN 67 CO 0.00 0.25 0.42 0.00 -1.29 0.00 0.00 177.43 176.81 1two n LEU 68 N -4.59 0.00 -3.61 0.34 -0.00 -1.26 -3.38 117.00 104.50 1two n LEU 68 Ca 0.20 -0.49 -0.14 0.00 -0.00 0.00 0.00 56.01 55.57 1two n LEU 68 Cb 0.59 1.26 -0.13 0.00 -0.00 0.00 0.00 43.42 45.14 1two n LEU 68 CO 0.28 -0.16 -0.14 -1.00 -0.00 0.00 0.00 177.39 176.36 1two s HIS 69 N -3.13 -0.42 0.22 1.47 3.76 -1.19 -4.72 115.29 111.28 1two s HIS 69 Ca 0.15 0.81 -0.26 0.00 -0.15 0.00 0.00 55.06 55.60 1two s HIS 69 Cb -0.01 -0.10 -0.16 0.00 1.11 0.00 0.00 32.58 33.42 1two s HIS 69 CO 0.01 -0.43 0.44 -2.39 -0.85 0.00 0.00 174.74 171.53 1two n HIS 70 N 5.35 -0.69 0.00 1.40 1.44 -1.26 0.23 115.22 121.69 1two n HIS 70 Ca -0.06 0.89 0.00 0.00 -2.01 0.00 0.00 57.72 56.54 1two n HIS 70 Cb 0.50 -1.87 0.00 0.00 0.12 0.00 0.00 29.99 28.74 1two n HIS 70 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1two n GLY 71 N 1.97 1.33 2.70 -1.39 0.00 -1.26 -4.69 105.19 103.85 1two n GLY 71 Ca 0.16 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1two n GLY 71 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1two s ASN 72 N 0.00 3.49 0.19 1.61 2.47 0.13 -4.74 114.94 118.10 1two s ASN 72 Ca 0.00 -3.38 -0.31 0.00 0.42 0.00 0.00 52.86 49.59 1two s ASN 72 Cb 0.00 -1.14 -0.10 0.00 -1.45 0.00 0.00 41.25 38.56 1two s ASN 72 CO 0.00 -0.15 1.56 0.00 -3.72 0.00 0.00 177.10 174.80 1two s ALA 73 N -0.64 3.76 1.22 1.71 0.00 -0.83 -3.16 121.76 123.83 1two s ALA 73 Ca 0.26 1.40 -0.14 0.00 0.00 0.00 0.00 51.96 53.48 1two s ALA 73 Cb -0.05 -3.62 0.31 0.00 0.00 0.00 0.00 23.12 19.76 1two s ALA 73 CO -0.15 -0.80 1.01 0.15 0.00 0.00 0.00 175.76 175.97 1two s LYS 74 N 0.76 -1.37 0.00 0.00 -0.14 -1.26 -4.81 119.74 112.91 1two s LYS 74 Ca 0.68 0.75 0.14 0.00 -1.36 0.00 0.00 55.97 56.19 1two s LYS 74 Cb -0.44 -1.51 0.86 0.00 -1.68 0.00 0.00 37.83 35.06 1two s LYS 74 CO 0.35 -4.00 1.30 -0.25 -0.76 0.00 0.00 175.35 171.98 1two n ASP 75 N -5.10 0.00 -0.06 2.83 9.92 -1.26 -2.62 116.55 120.26 1two n ASP 75 Ca 0.03 -0.72 -0.22 0.00 -0.53 0.00 0.00 54.79 53.36 1two n ASP 75 Cb 0.55 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.90 1two n ASP 75 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1two n PHE 76 N -0.89 1.12 0.46 1.24 3.72 -1.26 -3.84 117.46 118.01 1two n PHE 76 Ca 0.11 0.37 -0.19 0.00 -0.05 0.00 0.00 57.45 57.68 1two n PHE 76 Cb 0.05 -1.13 -0.09 0.00 -0.94 0.00 0.00 39.48 37.37 1two n PHE 76 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1two h ALA 77 N -0.27 -1.15 -0.01 4.37 0.00 -1.51 1.49 119.26 122.18 1two h ALA 77 Ca -0.38 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.24 1two h ALA 77 Cb 1.61 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 19.84 1two h ALA 77 CO -0.09 -1.13 -0.03 0.00 0.00 0.00 0.00 179.25 178.00 1two n MET 78 N -5.57 1.13 0.00 0.00 0.00 -1.21 -3.37 117.12 108.10 1two n MET 78 Ca -0.15 -0.15 0.00 0.00 0.00 0.00 0.00 57.70 57.40 1two n MET 78 Cb 0.46 -1.12 0.00 0.00 0.00 0.00 0.00 33.22 32.56 1two n MET 78 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1two n LYS 79 N 1.58 0.00 0.00 3.17 3.00 -0.99 -4.34 118.16 120.57 1two n LYS 79 Ca 0.05 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.40 1two n LYS 79 Cb 0.55 -0.02 0.17 0.00 0.00 0.00 0.00 35.03 35.73 1two n LYS 79 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 1two n HIS 80 N -2.35 0.00 -2.04 5.64 1.44 0.51 -2.33 115.22 116.08 1two n HIS 80 Ca 0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 1two n HIS 80 Cb 0.00 -0.35 -0.01 0.00 0.12 0.00 0.00 29.99 29.76 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 -0.70 0.79 2.99 -1.39 0.00 -1.22 -5.07 105.19 100.59 1two n GLY 81 Ca 0.03 -0.07 -0.18 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 0.66 0.57 4.61 0.00 -0.99 -5.00 121.76 121.61 1two s ALA 82 Ca 0.03 -0.30 -0.18 0.00 0.00 0.00 0.00 51.96 51.51 1two s ALA 82 Cb 0.03 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 1two s ALA 82 CO -0.01 0.14 1.13 -0.51 0.00 0.00 0.00 175.76 176.51 1two s ASP 83 N -0.02 5.55 0.46 0.00 1.01 -1.26 -4.42 116.67 117.98 1two s ASP 83 Ca 0.01 2.16 0.32 0.00 0.71 0.00 0.00 52.55 55.75 1two s ASP 83 Cb -0.05 -2.58 1.43 0.00 1.01 0.00 0.00 42.92 42.74 1two s ASP 83 CO -0.00 -1.34 1.67 -0.08 0.21 0.00 0.00 175.17 175.63 1two h GLU 84 N 0.93 0.11 0.18 8.23 4.81 -1.95 0.82 114.58 127.72 1two h GLU 84 Ca -0.49 -0.01 -0.25 0.00 -0.13 0.00 0.00 59.36 58.48 1two h GLU 84 Cb 1.26 -0.03 0.03 0.00 0.63 0.00 0.00 28.75 30.64 1two h GLU 84 CO 0.56 0.07 -1.12 0.00 -0.73 0.00 0.00 179.01 177.80 1two h THR 85 N 0.11 1.39 -0.78 0.32 1.03 -2.00 -3.32 112.91 109.67 1two h THR 85 Ca 0.76 -2.59 0.11 0.00 -0.01 0.00 0.00 66.41 64.68 1two h THR 85 Cb 2.52 3.11 -0.08 0.00 -1.07 0.00 0.00 68.15 72.63 1two h THR 85 CO -0.28 0.75 0.40 -0.03 -0.01 0.00 0.00 175.52 176.35 1two h MET 86 N -0.17 0.62 -0.55 0.00 1.85 0.22 0.70 114.93 117.62 1two h MET 86 Ca -0.20 -0.04 0.10 0.00 -0.61 0.00 0.00 59.70 58.96 1two h MET 86 Cb 1.86 -0.14 -0.08 0.00 0.43 0.00 0.00 31.60 33.66 1two h MET 86 CO 0.19 0.41 0.07 0.00 -0.40 0.00 0.00 176.91 177.18 1two h ALA 87 N 1.48 0.59 -0.12 0.39 0.00 -1.01 0.49 119.26 121.09 1two h ALA 87 Ca 0.40 0.14 -0.22 0.00 0.00 0.00 0.00 54.91 55.22 1two h ALA 87 Cb 0.46 0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.47 1two h ALA 87 CO -0.30 -0.34 -0.80 0.37 0.00 0.00 0.00 179.25 178.18 1two h GLN 88 N 0.19 0.71 -0.36 0.00 -0.00 -1.25 -3.26 115.11 111.14 1two h GLN 88 Ca 0.28 -0.60 0.08 0.00 -0.00 0.00 0.00 58.65 58.41 1two h GLN 88 Cb 0.42 0.13 -0.08 0.00 0.00 0.00 0.00 27.48 27.95 1two h GLN 88 CO -0.41 1.21 -0.25 1.96 0.00 0.00 0.00 178.83 181.34 1two h GLN 89 N 0.48 -0.20 -0.70 1.69 4.20 0.18 0.24 115.11 121.00 1two h GLN 89 Ca -0.06 0.01 0.15 0.00 0.06 0.00 0.00 58.65 58.82 1two h GLN 89 Cb 1.42 0.05 -0.12 0.00 0.30 0.00 0.00 27.48 29.13 1two h GLN 89 CO 0.16 -0.13 -0.01 -0.07 -0.67 0.00 0.00 178.83 178.10 1two h LEU 90 N -0.21 -0.35 -1.72 1.46 3.38 -1.01 2.18 115.31 119.05 1two h LEU 90 Ca 0.17 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1two h LEU 90 Cb 0.48 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1two h LEU 90 CO -0.48 -0.16 0.29 0.58 0.09 0.00 0.00 178.44 178.77 1two h VAL 91 N 0.10 0.00 0.05 1.22 2.07 -1.01 1.56 116.25 120.24 1two h VAL 91 Ca 0.37 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.89 1two h VAL 91 Cb 0.63 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1two h VAL 91 CO -0.62 0.00 -0.02 0.44 0.02 0.00 0.00 177.57 177.39 1two h ASP 92 N 0.00 -0.06 -0.19 0.57 5.19 0.39 -2.73 116.42 119.60 1two h ASP 92 Ca 0.00 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.38 1two h ASP 92 Cb 0.59 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 1two h ASP 92 CO 0.00 0.03 0.01 0.16 -3.12 0.00 0.00 179.24 176.32 1two h ILE 93 N -0.21 1.24 -0.40 0.35 -2.65 -1.17 -1.99 117.51 112.69 1two h ILE 93 Ca -0.01 -0.82 0.12 0.00 1.03 0.00 0.00 64.86 65.18 1two h ILE 93 Cb 0.05 1.41 -0.02 0.00 -2.05 0.00 0.00 36.82 36.21 1two h ILE 93 CO 0.01 0.25 0.49 0.40 0.03 0.00 0.00 178.15 179.33 1two h ILE 94 N 0.10 0.30 0.00 0.16 2.04 0.21 1.61 117.51 121.92 1two h ILE 94 Ca 0.06 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.75 1two h ILE 94 Cb 0.36 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1two h ILE 94 CO 0.01 0.00 -0.80 0.45 0.00 0.00 0.00 178.15 177.80 1two h HIS 95 N 0.00 0.00 0.00 1.37 3.86 -1.03 0.60 115.15 119.95 1two h HIS 95 Ca 0.19 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.26 1two h HIS 95 Cb 1.16 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.61 1two h HIS 95 CO 0.00 0.80 -1.24 0.78 0.86 0.00 0.00 177.93 179.13 1two h GLY 96 N 2.50 0.00 0.00 2.45 0.00 0.22 -3.20 103.07 105.04 1two h GLY 96 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1two h GLY 96 CO 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 176.54 176.21 1two h GLU 98 N -0.83 0.11 -0.01 0.00 4.81 0.01 3.10 114.58 121.76 1two h GLU 98 Ca 0.00 -0.01 -0.16 0.00 -0.13 0.00 0.00 59.36 59.06 1two h GLU 98 Cb 0.44 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 1two h GLU 98 CO 0.00 0.07 -0.74 1.57 -0.73 0.00 0.00 179.01 179.18 1two h LYS 99 N 0.11 0.05 -0.01 1.92 5.09 -1.67 -2.93 116.57 119.15 1two h LYS 99 Ca 0.68 -0.05 0.00 0.00 0.09 0.00 0.00 60.65 61.38 1two h LYS 99 Cb 2.37 0.01 0.00 0.00 0.10 0.00 0.00 32.23 34.72 1two h LYS 99 CO -0.17 0.77 -0.54 0.45 -2.09 0.00 0.00 179.45 177.87 1two n SER 100 N -3.69 1.11 -3.99 7.07 2.88 0.87 -4.54 113.62 113.34 1two n SER 100 Ca -0.01 -0.89 -0.32 0.00 -1.33 0.00 0.00 58.87 56.32 1two n SER 100 Cb 0.72 0.44 -0.10 0.00 -0.75 0.00 0.00 64.21 64.52 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 -2.74 3.99 0.94 -1.46 0.00 0.69 -5.04 121.76 118.14 1two s ALA 101 Ca 0.16 -3.82 -0.13 0.00 0.00 0.00 0.00 51.96 48.16 1two s ALA 101 Cb 0.18 -2.46 0.16 0.00 0.00 0.00 0.00 23.12 21.00 1two s ALA 101 CO 0.66 -2.12 1.15 -1.25 0.00 0.00 0.00 175.76 174.21 1two s PRO 102 N -1.36 0.88 0.00 0.00 0.04 -1.26 -4.61 135.00 128.68 1two s PRO 102 Ca 0.26 0.18 -0.01 0.00 0.04 0.00 0.00 61.00 61.47 1two s PRO 102 Cb -0.06 -1.82 -0.06 0.00 0.04 0.00 0.00 34.50 32.59 1two s PRO 102 CO -0.14 -2.36 1.93 -0.35 0.04 0.00 0.00 177.00 176.12 1two n PRO 103 N -3.86 0.99 -1.79 0.56 -0.04 -1.26 -4.24 135.00 125.36 1two n PRO 103 Ca 0.08 -0.24 -0.36 0.00 -0.04 0.00 0.00 63.50 62.94 1two n PRO 103 Cb 0.59 -1.36 0.06 0.00 -0.04 0.00 0.00 33.50 32.75 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 2.08 4.74 0.60 3.54 3.84 -1.26 -4.83 114.94 123.64 1two s ASN 104 Ca 0.16 2.53 0.29 0.00 0.21 0.00 0.00 52.86 56.04 1two s ASN 104 Cb 0.08 -2.61 1.48 0.00 -0.55 0.00 0.00 41.25 39.65 1two s ASN 104 CO 0.00 -1.91 1.89 0.44 -2.79 0.00 0.00 177.10 174.73 1two h ASP 105 N 0.56 0.00 -0.21 -4.21 3.32 -2.05 0.71 116.42 114.54 1two h ASP 105 Ca -0.50 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.45 1two h ASP 105 Cb 1.32 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.81 1two h ASP 105 CO 0.53 0.00 0.13 0.47 -1.72 0.00 0.00 179.24 178.65 1two n ASP 106 N -3.60 3.03 -0.66 6.45 8.00 -1.26 -4.42 116.55 124.09 1two n ASP 106 Ca 0.07 -2.33 0.51 0.00 0.71 0.00 0.00 54.79 53.75 1two n ASP 106 Cb 0.64 -0.57 0.79 0.00 -0.02 0.00 0.00 41.12 41.96 1two n ASP 106 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 1two h LYS 107 N 0.30 0.00 -0.29 -1.24 2.10 0.13 2.24 116.57 119.81 1two h LYS 107 Ca 0.12 0.00 0.06 0.00 -2.00 0.00 0.00 60.65 58.83 1two h LYS 107 Cb 1.34 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.62 1two h LYS 107 CO 0.23 0.00 -0.06 0.00 -2.00 0.00 0.00 179.45 177.61 1two n MET 109 N -5.23 1.49 0.00 0.00 0.00 0.64 -3.97 117.12 110.05 1two n MET 109 Ca -0.00 -0.98 0.00 0.00 0.00 0.00 0.00 57.70 56.72 1two n MET 109 Cb 0.16 -1.38 0.00 0.00 0.00 0.00 0.00 33.22 32.01 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 0.04 0.00 -0.27 3.17 3.00 0.48 -3.74 118.16 120.85 1two n LYS 110 Ca 0.08 0.02 0.08 0.00 -0.00 0.00 0.00 58.31 58.49 1two n LYS 110 Cb 0.41 -0.30 0.22 0.00 0.00 0.00 0.00 35.03 35.36 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 0.50 -0.69 3.15 2.02 -1.24 0.20 112.91 116.84 1two h THR 111 Ca 0.00 -0.11 0.15 0.00 0.77 0.00 0.00 66.41 67.22 1two h THR 111 Cb 0.00 0.16 -0.12 0.00 -1.74 0.00 0.00 68.15 66.45 1two h THR 111 CO 0.00 0.06 0.03 -0.29 0.37 0.00 0.00 175.52 175.68 1two h ILE 112 N 0.32 0.43 -0.95 3.11 -0.00 -1.63 1.40 117.51 120.18 1two h ILE 112 Ca 0.46 -0.04 0.12 0.00 -0.00 0.00 0.00 64.86 65.40 1two h ILE 112 Cb 0.81 0.29 -0.14 0.00 -0.00 0.00 0.00 36.82 37.78 1two h ILE 112 CO -0.52 0.02 -0.44 -0.67 -0.00 0.00 0.00 178.15 176.54 1two n ASP 113 N -5.29 -0.77 -0.02 2.19 2.03 0.69 0.21 116.55 115.59 1two n ASP 113 Ca 0.12 1.66 -0.16 0.00 0.52 0.00 0.00 54.79 56.93 1two n ASP 113 Cb 0.42 -0.32 -0.13 0.00 -0.72 0.00 0.00 41.12 40.38 1two n ASP 113 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 1two h VAL 114 N 0.00 1.62 -0.71 5.18 3.04 -1.03 -0.20 116.25 124.15 1two h VAL 114 Ca 0.26 -2.19 0.21 0.00 -1.01 0.00 0.00 66.70 63.96 1two h VAL 114 Cb 0.50 3.05 -0.03 0.00 -2.01 0.00 0.00 31.29 32.80 1two h VAL 114 CO -0.92 0.59 0.82 0.00 -1.01 0.00 0.00 177.57 177.06 1two h ALA 115 N 0.14 2.52 0.00 3.17 0.00 0.35 0.86 119.26 126.30 1two h ALA 115 Ca -0.04 -0.02 -0.37 0.00 0.00 0.00 0.00 54.91 54.47 1two h ALA 115 Cb 1.14 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.91 1two h ALA 115 CO 0.06 -1.19 -2.37 -0.12 0.00 0.00 0.00 179.25 175.63 1two n MET 116 N -3.46 0.68 -0.35 0.00 0.00 0.57 -4.15 117.12 110.42 1two n MET 116 Ca 0.15 0.02 0.08 0.00 0.00 0.00 0.00 57.70 57.95 1two n MET 116 Cb 1.06 -1.53 0.18 0.00 0.00 0.00 0.00 33.22 32.92 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 0.00 0.68 -0.13 0.00 3.57 -1.72 -2.60 116.94 116.74 1two h PHE 118 Ca 0.50 -0.14 0.03 0.00 3.53 0.00 0.00 57.97 61.89 1two h PHE 118 Cb 0.85 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.42 1two h PHE 118 CO -0.69 0.78 0.09 0.87 -2.23 0.00 0.00 178.31 177.13 1two h LYS 119 N 0.39 0.05 0.00 1.11 1.57 0.76 0.29 116.57 120.73 1two h LYS 119 Ca 0.08 -0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1two h LYS 119 Cb 0.55 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 1two h LYS 119 CO 0.03 0.04 -0.19 0.87 -0.57 0.00 0.00 179.45 179.63 1two h LYS 120 N 0.06 0.00 -0.58 3.15 1.57 0.16 -1.94 116.57 118.99 1two h LYS 120 Ca 0.06 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.91 1two h LYS 120 Cb 0.17 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 1two h LYS 120 CO -0.01 0.19 0.39 0.93 -0.57 0.00 0.00 179.45 180.38 1two h GLU 121 N 0.00 0.47 -0.51 3.15 4.39 -0.34 -0.05 114.58 121.68 1two h GLU 121 Ca -0.00 -0.03 -0.12 0.00 0.34 0.00 0.00 59.36 59.55 1two h GLU 121 Cb 0.41 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 1two h GLU 121 CO 0.02 0.31 -0.16 0.82 -1.16 0.00 0.00 179.01 178.84 1two h ILE 122 N 0.49 1.27 0.00 3.13 1.08 -1.43 -2.14 117.51 119.91 1two h ILE 122 Ca 0.26 -1.33 0.00 0.00 -0.39 0.00 0.00 64.86 63.40 1two h ILE 122 Cb 0.39 1.04 0.00 0.00 -3.07 0.00 0.00 36.82 35.18 1two h ILE 122 CO -0.07 0.46 0.41 -0.74 -0.69 0.00 0.00 178.15 177.52 1two h HIS 123 N 0.89 0.00 -0.60 1.37 -0.00 -1.04 2.02 115.15 117.79 1two h HIS 123 Ca 0.13 0.00 -0.17 0.00 -0.00 0.00 0.00 60.37 60.32 1two h HIS 123 Cb 0.74 0.00 -0.10 0.00 -0.00 0.00 0.00 27.41 28.05 1two h HIS 123 CO 0.05 0.00 0.22 1.63 -0.00 0.00 0.00 177.93 179.83 1two n LYS 124 N -2.22 3.24 0.00 5.26 5.02 -0.80 -4.54 118.16 124.12 1two n LYS 124 Ca -0.01 -2.46 0.00 0.00 -2.02 0.00 0.00 58.31 53.82 1two n LYS 124 Cb 0.43 -2.04 0.00 0.00 -0.02 0.00 0.00 35.03 33.40 1two n LYS 124 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 1two n LEU 125 N -0.04 0.00 -0.29 -0.35 -0.00 0.68 -4.31 117.00 112.69 1two n LEU 125 Ca 0.33 0.00 0.06 0.00 -0.00 0.00 0.00 56.01 56.40 1two n LEU 125 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.61 1two n LEU 125 CO 0.35 0.00 0.24 0.59 -0.00 0.00 0.00 177.39 178.57 1two n ASN 126 N 0.00 1.41 -4.92 1.45 3.02 -1.26 -4.98 115.26 109.98 1two n ASN 126 Ca 0.00 -1.21 -0.27 0.00 -0.03 0.00 0.00 54.58 53.08 1two n ASN 126 Cb 0.00 0.45 -0.02 0.00 -0.61 0.00 0.00 39.78 39.60 1two n ASN 126 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1two s TRP 127 N -1.57 3.50 -0.31 3.10 0.51 -1.26 -5.07 118.94 117.85 1two s TRP 127 Ca 0.11 0.57 -0.12 0.00 -2.12 0.00 0.00 56.10 54.54 1two s TRP 127 Cb 0.10 -2.07 -0.03 0.00 -0.81 0.00 0.00 33.47 30.66 1two s TRP 127 CO 0.31 0.07 0.21 0.14 -0.51 0.00 0.00 176.95 177.17 1two s VAL 128 N -2.28 5.22 -0.16 4.03 -7.23 -1.26 -4.57 120.40 114.15 1two s VAL 128 Ca 0.43 -0.05 -0.05 0.00 -1.81 0.00 0.00 61.98 60.51 1two s VAL 128 Cb -0.10 -3.58 -0.19 0.00 0.56 0.00 0.00 36.38 33.07 1two s VAL 128 CO 0.35 0.13 2.81 -0.81 -0.31 0.00 0.00 175.10 177.26 1two n PRO 129 N 5.07 1.68 -0.69 4.82 -0.04 -1.26 -4.58 135.00 140.00 1two n PRO 129 Ca -0.13 -0.89 0.52 0.00 -0.04 0.00 0.00 63.50 62.95 1two n PRO 129 Cb 0.51 -1.97 0.80 0.00 -0.04 0.00 0.00 33.50 32.79 1two n PRO 129 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1two n ASN 130 N 2.80 0.01 -4.30 3.54 0.23 -1.26 -3.11 115.26 113.17 1two n ASN 130 Ca 0.36 1.00 -0.45 0.00 -0.53 0.00 0.00 54.58 54.96 1two n ASN 130 Cb 0.62 -0.50 -0.06 0.00 -2.08 0.00 0.00 39.78 37.76 1two n ASN 130 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 1two s MET 131 N -4.84 2.89 -0.38 -3.83 -1.94 -1.26 -4.93 119.30 105.01 1two s MET 131 Ca -0.05 -1.67 0.02 0.00 -1.71 0.00 0.00 55.69 52.28 1two s MET 131 Cb 0.27 -4.20 0.11 0.00 2.01 0.00 0.00 34.83 33.02 1two s MET 131 CO 0.87 -1.26 0.14 -0.51 -0.01 0.00 0.00 175.02 174.25 1two s ASP 132 N 3.28 4.18 -0.30 3.03 1.11 -1.05 -5.02 116.67 121.91 1two s ASP 132 Ca 0.04 -2.21 -0.14 0.00 0.18 0.00 0.00 52.55 50.41 1two s ASP 132 Cb -0.28 -1.23 0.18 0.00 1.07 0.00 0.00 42.92 42.66 1two s ASP 132 CO 0.03 -0.34 1.12 -1.48 1.18 0.00 0.00 175.17 175.67 1two s LEU 133 N 0.85 -0.29 -0.00 1.23 -0.00 -1.26 -1.77 118.68 117.44 1two s LEU 133 Ca 0.13 0.11 0.04 0.00 -0.00 0.00 0.00 54.13 54.41 1two s LEU 133 Cb -0.21 1.21 -0.05 0.00 -0.00 0.00 0.00 46.19 47.14 1two s LEU 133 CO -0.11 -0.05 0.13 1.33 -0.00 0.00 0.00 176.35 177.65 1two n VAL 134 N 5.30 0.00 -0.01 1.48 0.24 -1.26 -4.57 118.33 119.51 1two n VAL 134 Ca -0.00 -0.27 0.06 0.00 -2.04 0.00 0.00 64.34 62.09 1two n VAL 134 Cb 0.56 0.73 -0.11 0.00 -1.47 0.00 0.00 33.84 33.56 1two n VAL 134 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 1two n ILE 135 N -1.34 0.07 -1.61 1.34 -0.00 -1.26 -4.99 119.36 111.57 1two n ILE 135 Ca 0.00 -0.33 -0.12 0.00 -0.00 0.00 0.00 62.75 62.30 1two n ILE 135 Cb 0.08 0.12 -0.04 0.00 -0.00 0.00 0.00 39.64 39.80 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 1.76 0.85 3.49 3.28 0.00 -1.26 -4.99 105.19 108.30 1two n GLY 136 Ca -0.04 -0.46 -0.24 0.00 0.00 0.00 0.00 46.02 45.28 1two n GLY 136 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1two s GLU 137 N -3.48 1.81 -0.50 1.61 2.12 -1.26 -5.07 118.70 113.93 1two s GLU 137 Ca 0.00 -2.07 -0.27 0.00 0.36 0.00 0.00 54.97 53.00 1two s GLU 137 Cb 0.00 -0.70 -0.04 0.00 0.26 0.00 0.00 34.13 33.65 1two s GLU 137 CO 0.00 -0.36 2.08 0.14 -0.54 0.00 0.00 175.26 176.57 1two s VAL 138 N -3.27 3.22 0.02 3.70 -7.23 -1.26 -3.79 120.40 111.79 1two s VAL 138 Ca 0.29 0.16 0.00 0.00 -1.81 0.00 0.00 61.98 60.61 1two s VAL 138 Cb 0.05 -3.50 0.00 0.00 0.56 0.00 0.00 36.38 33.49 1two s VAL 138 CO 0.14 -0.45 0.00 -0.11 -0.31 0.00 0.00 175.10 174.37 1two n LEU 139 N 13.48 -0.19 -4.78 1.32 -0.00 -1.26 -5.14 117.00 120.42 1two n LEU 139 Ca 0.27 0.30 -0.29 0.00 -0.00 0.00 0.00 56.01 56.29 1two n LEU 139 Cb 0.52 0.45 0.12 0.00 -0.00 0.00 0.00 43.42 44.51 1two n LEU 139 CO 0.70 -0.00 0.71 0.00 -0.00 0.00 0.00 177.39 178.80 1two s ALA 140 N -1.56 1.93 -1.09 1.96 0.00 -1.25 -4.90 121.76 116.86 1two s ALA 140 Ca 0.00 -0.34 -0.22 0.00 0.00 0.00 0.00 51.96 51.40 1two s ALA 140 Cb 0.00 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 20.02 1two s ALA 140 CO 0.00 -2.06 1.81 -1.21 0.00 0.00 0.00 175.76 174.30 1two s GLU 141 N -5.18 3.00 0.00 0.00 0.41 -0.73 -4.86 118.70 111.34 1two s GLU 141 Ca 0.62 -1.04 0.26 0.00 -0.41 0.00 0.00 54.97 54.41 1two s GLU 141 Cb -0.15 -5.26 0.62 0.00 -1.78 0.00 0.00 34.13 27.55 1two s GLU 141 CO 0.54 -3.13 1.50 1.55 -0.49 0.00 0.00 175.26 175.23