#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 0.35 0.16 -1.46 -0.04 -1.26 -4.62 135.00 128.13 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 0.79 0.00 -0.04 0.00 0.00 33.50 34.25 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 -0.89 0.54 4.39 -1.90 0.27 114.58 116.99 1two h GLU 3 Ca 0.00 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.76 1two h GLU 3 Cb 0.00 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.59 1two h GLU 3 CO 0.00 0.00 0.58 0.82 -1.16 0.00 0.00 179.01 179.25 1two h ILE 4 N 0.00 1.08 -0.00 3.13 1.08 -1.89 -1.08 117.51 119.83 1two h ILE 4 Ca 0.14 -0.35 0.00 0.00 -0.39 0.00 0.00 64.86 64.25 1two h ILE 4 Cb 0.82 -0.03 0.00 0.00 -3.07 0.00 0.00 36.82 34.53 1two h ILE 4 CO -0.00 0.19 -0.81 0.80 -0.69 0.00 0.00 178.15 177.63 1two n MET 5 N -4.48 0.20 -3.74 2.37 1.56 0.80 -4.78 117.12 109.05 1two n MET 5 Ca 0.13 -0.15 -0.38 0.00 -0.27 0.00 0.00 57.70 57.03 1two n MET 5 Cb 0.18 -1.50 -0.12 0.00 2.15 0.00 0.00 33.22 33.93 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 -2.91 2.48 -0.03 2.12 2.20 -0.27 -4.87 119.74 118.46 1two s LYS 6 Ca 0.11 -1.39 0.07 0.00 -0.36 0.00 0.00 55.97 54.40 1two s LYS 6 Cb 0.17 -3.53 -0.02 0.00 -1.51 0.00 0.00 37.83 32.93 1two s LYS 6 CO 0.79 -0.81 -0.23 0.54 -0.36 0.00 0.00 175.35 175.27 1two s ASN 7 N 1.67 3.28 1.39 1.43 4.22 -1.26 -4.58 114.94 121.08 1two s ASN 7 Ca 0.01 -0.41 -0.22 0.00 -2.14 0.00 0.00 52.86 50.09 1two s ASN 7 Cb -0.21 -0.52 0.34 0.00 1.28 0.00 0.00 41.25 42.14 1two s ASN 7 CO 0.01 0.31 0.92 -0.11 -2.04 0.00 0.00 177.10 176.19 1two n LEU 8 N 2.48 0.00 0.00 3.54 0.00 -1.26 -4.82 117.00 116.94 1two n LEU 8 Ca -0.16 -0.95 0.00 0.00 0.00 0.00 0.00 56.01 54.90 1two n LEU 8 Cb 0.51 -0.96 0.00 0.00 0.00 0.00 0.00 43.42 42.97 1two n LEU 8 CO 0.24 -2.57 0.00 -0.24 0.00 0.00 0.00 177.39 174.82 1two n SER 9 N -5.42 0.00 -0.01 1.96 2.88 -1.26 -3.58 113.62 108.20 1two n SER 9 Ca 0.14 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.67 1two n SER 9 Cb 0.58 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.03 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 4.08 -0.27 -3.46 4.13 -1.26 -3.93 115.26 114.54 1two n ASN 10 Ca 0.00 -0.00 0.25 0.00 1.68 0.00 0.00 54.58 56.50 1two n ASN 10 Cb 0.00 0.08 0.43 0.00 -1.54 0.00 0.00 39.78 38.75 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 -2.44 0.18 0.00 6.41 4.13 -1.26 0.50 115.26 122.78 1two n ASN 11 Ca -0.02 1.01 -0.01 0.00 1.68 0.00 0.00 54.58 57.24 1two n ASN 11 Cb 0.52 -0.50 -0.00 0.00 -1.54 0.00 0.00 39.78 38.26 1two n ASN 11 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1two n PHE 12 N -4.24 0.00 -0.31 3.10 3.72 -1.26 -4.08 117.46 114.38 1two n PHE 12 Ca 0.26 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.84 1two n PHE 12 Cb 0.97 -0.08 0.36 0.00 -0.94 0.00 0.00 39.48 39.79 1two n PHE 12 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1two h GLY 13 N -0.16 1.64 0.38 1.37 0.00 -1.58 2.21 103.07 106.93 1two h GLY 13 Ca 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 1two h GLY 13 CO 0.00 -0.42 -0.03 1.70 0.00 0.00 0.00 176.54 177.79 1two h LYS 14 N 0.25 -0.08 -0.82 4.80 3.64 -0.09 0.72 116.57 124.98 1two h LYS 14 Ca 0.63 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 60.10 1two h LYS 14 Cb 1.34 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 33.11 1two h LYS 14 CO -0.65 0.47 0.48 0.00 -2.27 0.00 0.00 179.45 177.48 1two h ALA 15 N 0.14 1.17 -0.28 5.00 0.00 0.37 1.32 119.26 126.98 1two h ALA 15 Ca -0.01 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1two h ALA 15 Cb 0.59 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1two h ALA 15 CO 0.01 0.12 -0.06 1.98 0.00 0.00 0.00 179.25 181.30 1two h MET 16 N 0.81 0.54 -0.45 0.00 4.05 0.35 0.62 114.93 120.85 1two h MET 16 Ca 0.39 -0.20 -0.10 0.00 -0.28 0.00 0.00 59.70 59.52 1two h MET 16 Cb 0.33 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.08 1two h MET 16 CO -0.24 0.73 -0.11 0.22 0.23 0.00 0.00 176.91 177.75 1two h ASP 17 N 0.30 0.81 -0.23 1.39 1.82 0.12 0.11 116.42 120.73 1two h ASP 17 Ca 0.07 -0.25 -0.18 0.00 -0.39 0.00 0.00 57.03 56.28 1two h ASP 17 Cb 0.53 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 40.32 1two h ASP 17 CO 0.03 0.94 -0.56 1.56 -1.61 0.00 0.00 179.24 179.59 1two h GLN 18 N 0.74 0.80 -0.34 0.28 4.20 0.18 -2.98 115.11 118.00 1two h GLN 18 Ca 0.12 -0.54 -0.07 0.00 0.06 0.00 0.00 58.65 58.22 1two h GLN 18 Cb 0.60 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.44 1two h GLN 18 CO 0.04 1.17 -0.09 0.00 -0.67 0.00 0.00 178.83 179.28 1two n LYS 20 N -4.21 0.11 -0.00 0.00 4.81 0.37 -0.69 118.16 118.54 1two n LYS 20 Ca 0.01 0.23 -0.01 0.00 -0.87 0.00 0.00 58.31 57.67 1two n LYS 20 Cb 0.31 -1.50 -0.00 0.00 0.02 0.00 0.00 35.03 33.86 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 -1.36 0.29 -0.30 3.14 -0.08 0.12 -3.16 116.55 115.20 1two n ASP 21 Ca 0.04 0.04 0.11 0.00 -1.51 0.00 0.00 54.79 53.48 1two n ASP 21 Cb 0.10 -0.29 0.27 0.00 2.34 0.00 0.00 41.12 43.55 1two n ASP 21 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 1two h GLU 22 N -0.09 0.42 0.00 -0.67 4.11 -0.15 0.29 114.58 118.50 1two h GLU 22 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.40 1two h GLU 22 Cb 0.09 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1two h GLU 22 CO 0.00 0.28 -0.97 1.28 0.07 0.00 0.00 179.01 179.67 1two n LEU 23 N -5.02 0.84 -1.01 3.06 4.77 0.13 -4.93 117.00 114.84 1two n LEU 23 Ca 0.20 -0.36 -0.08 0.00 -0.03 0.00 0.00 56.01 55.74 1two n LEU 23 Cb 0.58 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.59 1two n LEU 23 CO 0.15 0.20 -0.08 -1.20 -1.33 0.00 0.00 177.39 175.13 1two n SER 24 N -1.57 -2.78 -4.92 -1.43 7.64 0.10 -4.89 113.62 105.77 1two n SER 24 Ca 0.04 0.20 -0.26 0.00 1.01 0.00 0.00 58.87 59.85 1two n SER 24 Cb 0.35 -2.51 0.05 0.00 -1.01 0.00 0.00 64.21 61.10 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 -2.63 2.97 -0.15 -3.43 -0.00 -1.23 -4.87 118.68 109.34 1two s LEU 25 Ca 0.00 0.61 -0.29 0.00 -0.00 0.00 0.00 54.13 54.45 1two s LEU 25 Cb 0.00 -3.33 -0.02 0.00 -0.00 0.00 0.00 46.19 42.84 1two s LEU 25 CO 0.00 -1.39 1.27 -2.16 -0.00 0.00 0.00 176.35 174.07 1two s PRO 26 N -5.17 4.24 0.00 1.48 0.04 -1.26 -4.16 135.00 130.17 1two s PRO 26 Ca 0.58 1.68 0.13 0.00 0.04 0.00 0.00 61.00 63.43 1two s PRO 26 Cb -0.11 -3.75 0.75 0.00 0.04 0.00 0.00 34.50 31.43 1two s PRO 26 CO 0.45 -0.69 1.25 -0.40 0.04 0.00 0.00 177.00 177.65 1two n ASP 27 N 6.51 0.00 0.11 6.66 5.75 -1.26 -1.89 116.55 132.43 1two n ASP 27 Ca 0.14 -0.28 -0.24 0.00 -0.01 0.00 0.00 54.79 54.40 1two n ASP 27 Cb 0.45 -0.07 -0.15 0.00 -1.03 0.00 0.00 41.12 40.31 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 0.74 -0.41 -1.12 4.64 -1.96 -1.52 113.55 113.91 1two h SER 28 Ca 0.00 -0.93 -0.06 0.00 -0.47 0.00 0.00 61.79 60.33 1two h SER 28 Cb 0.03 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.86 1two h SER 28 CO 0.00 1.75 0.04 -0.37 -0.87 0.00 0.00 176.83 177.38 1two h VAL 29 N 0.11 1.23 0.02 0.95 -1.51 -1.78 -0.92 116.25 114.35 1two h VAL 29 Ca -0.30 -0.92 -0.21 0.00 -1.23 0.00 0.00 66.70 64.04 1two h VAL 29 Cb 2.13 0.81 -0.01 0.00 -2.13 0.00 0.00 31.29 32.08 1two h VAL 29 CO 0.23 0.33 -0.95 1.62 -1.23 0.00 0.00 177.57 177.56 1two h VAL 30 N 0.74 1.55 0.00 7.19 3.04 -1.64 -2.93 116.25 124.20 1two h VAL 30 Ca 0.15 -2.86 0.00 0.00 -1.01 0.00 0.00 66.70 62.99 1two h VAL 30 Cb 0.39 2.62 0.00 0.00 -2.01 0.00 0.00 31.29 32.29 1two h VAL 30 CO 0.01 0.83 0.00 0.00 -1.01 0.00 0.00 177.57 177.40 1two h ALA 31 N 0.93 1.00 0.00 3.17 0.00 -0.68 -1.30 119.26 122.38 1two h ALA 31 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1two h ALA 31 Cb 1.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1two h ALA 31 CO 0.14 0.00 0.00 0.22 0.00 0.00 0.00 179.25 179.61 1two h ASP 32 N 0.00 0.00 0.05 0.00 3.58 -0.99 -3.17 116.42 115.90 1two h ASP 32 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1two h ASP 32 Cb 0.42 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.46 1two h ASP 32 CO 0.00 0.00 -0.05 -0.07 -2.88 0.00 0.00 179.24 176.24 1two h LEU 33 N 0.00 -0.13 -2.29 2.28 4.07 -1.32 -0.46 115.31 117.46 1two h LEU 33 Ca 0.00 0.01 0.02 0.00 0.08 0.00 0.00 57.88 57.99 1two h LEU 33 Cb 0.75 0.04 -0.00 0.00 1.08 0.00 0.00 40.66 42.53 1two h LEU 33 CO 0.00 -0.08 0.24 1.88 -1.08 0.00 0.00 178.44 179.40 1two h TYR 34 N -0.11 0.00 0.00 1.13 0.05 -1.69 -2.92 116.97 113.42 1two h TYR 34 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1two h TYR 34 Cb 0.11 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.85 1two h TYR 34 CO -0.10 0.00 0.00 0.09 -1.05 0.00 0.00 178.16 177.10 1two n ASN 35 N -3.16 0.00 0.00 3.88 3.02 -0.27 -4.89 115.26 113.85 1two n ASN 35 Ca -0.01 0.39 0.00 0.00 -0.03 0.00 0.00 54.58 54.93 1two n ASN 35 Cb 0.31 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 39.12 1two n ASN 35 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 1two n PHE 36 N -1.57 0.00 0.50 3.10 1.16 -0.70 -4.99 117.46 114.97 1two n PHE 36 Ca 0.00 0.00 0.05 0.00 -1.87 0.00 0.00 57.45 55.63 1two n PHE 36 Cb 0.00 0.00 0.18 0.00 -1.61 0.00 0.00 39.48 38.05 1two n PHE 36 CO 0.00 0.00 0.00 -2.67 -1.87 0.00 0.00 176.76 172.22 1two n TRP 37 N 0.00 0.72 -0.26 2.97 -0.00 -1.11 -4.37 117.44 115.38 1two n TRP 37 Ca 0.00 -0.30 -0.06 0.00 -0.00 0.00 0.00 57.50 57.14 1two n TRP 37 Cb 0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 31.31 31.18 1two n TRP 37 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 177.69 178.56 1two h LYS 38 N 2.17 -0.14 -0.17 -2.67 1.57 -1.87 1.17 116.57 116.63 1two h LYS 38 Ca 0.00 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1two h LYS 38 Cb 0.79 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 1two h LYS 38 CO 0.09 -0.09 -0.09 0.38 -0.57 0.00 0.00 179.45 179.17 1two h ASP 39 N -0.14 0.25 0.00 0.86 3.04 -1.86 -3.24 116.42 115.32 1two h ASP 39 Ca 0.23 -0.05 -0.33 0.00 -3.24 0.00 0.00 57.03 53.64 1two h ASP 39 Cb 0.56 -0.06 0.01 0.00 -1.04 0.00 0.00 39.33 38.79 1two h ASP 39 CO -0.77 0.38 2.36 -0.67 -2.04 0.00 0.00 179.24 178.49 1two n ASP 40 N -4.30 4.39 -4.21 4.15 -0.08 0.40 -4.88 116.55 112.02 1two n ASP 40 Ca -0.00 -2.28 -0.29 0.00 -1.51 0.00 0.00 54.79 50.71 1two n ASP 40 Cb 0.25 -1.02 0.25 0.00 2.34 0.00 0.00 41.12 42.94 1two n ASP 40 CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 1two s TYR 41 N 3.50 0.91 0.45 -0.67 -0.85 -1.22 -4.47 117.35 114.99 1two s TYR 41 Ca 0.35 0.93 0.33 0.00 -0.52 0.00 0.00 57.07 58.16 1two s TYR 41 Cb 0.09 -3.10 1.48 0.00 0.38 0.00 0.00 41.96 40.81 1two s TYR 41 CO -0.03 -4.05 1.61 0.28 -1.52 0.00 0.00 175.55 171.83 1two h VAL 42 N -2.75 0.08 -1.47 -3.49 2.07 -1.89 0.63 116.25 109.42 1two h VAL 42 Ca -0.56 -0.02 0.43 0.00 0.82 0.00 0.00 66.70 67.37 1two h VAL 42 Cb 1.34 0.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.07 1two h VAL 42 CO 0.45 0.01 1.26 0.80 0.02 0.00 0.00 177.57 180.11 1two n MET 43 N -4.64 0.01 -0.07 1.57 0.00 -1.26 -1.04 117.12 111.68 1two n MET 43 Ca 0.39 0.99 -0.16 0.00 0.00 0.00 0.00 57.70 58.92 1two n MET 43 Cb 1.52 -2.37 -0.05 0.00 0.00 0.00 0.00 33.22 32.32 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 0.80 -3.69 1.12 -1.04 0.22 -4.94 114.28 103.26 1two n THR 44 Ca 0.33 -0.21 -0.30 0.00 -2.04 0.00 0.00 64.05 61.84 1two n THR 44 Cb 1.70 -1.68 -0.15 0.00 -1.82 0.00 0.00 70.33 68.38 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 -6.30 3.88 0.13 8.00 2.15 -0.21 -4.99 116.67 119.34 1two s ASP 45 Ca -0.20 -1.69 -0.14 0.00 0.43 0.00 0.00 52.55 50.95 1two s ASP 45 Cb 0.08 -0.77 -0.01 0.00 -0.30 0.00 0.00 42.92 41.91 1two s ASP 45 CO 0.26 -0.40 1.58 -0.09 -0.17 0.00 0.00 175.17 176.35 1two h ARG 46 N 7.98 0.74 -0.88 4.34 1.12 -1.75 -2.80 114.38 123.13 1two h ARG 46 Ca -0.13 -0.23 0.23 0.00 -1.11 0.00 0.00 59.98 58.74 1two h ARG 46 Cb 1.00 -0.07 -0.13 0.00 -0.01 0.00 0.00 29.97 30.76 1two h ARG 46 CO 0.46 0.81 0.32 -0.07 -3.11 0.00 0.00 179.97 178.39 1two h LEU 47 N 0.58 0.18 -1.71 3.80 -0.00 -1.94 1.69 115.31 117.92 1two h LEU 47 Ca 0.12 0.17 0.13 0.00 -0.00 0.00 0.00 57.88 58.31 1two h LEU 47 Cb 0.47 0.19 -0.04 0.00 -0.00 0.00 0.00 40.66 41.29 1two h LEU 47 CO 0.02 -0.08 0.44 0.00 -0.00 0.00 0.00 178.44 178.82 1two h ALA 48 N 1.74 2.18 -0.01 1.53 0.00 -1.82 2.06 119.26 124.94 1two h ALA 48 Ca 0.56 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 55.28 1two h ALA 48 Cb 1.10 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1two h ALA 48 CO -0.59 -0.34 -0.82 0.78 0.00 0.00 0.00 179.25 178.28 1two h GLY 49 N 0.31 0.17 0.84 0.00 0.00 0.24 -2.00 103.07 102.63 1two h GLY 49 Ca 0.31 -0.28 -0.27 0.00 0.00 0.00 0.00 47.33 47.09 1two h GLY 49 CO -0.08 0.25 -1.24 0.00 0.00 0.00 0.00 176.54 175.48 1two h ALA 51 N 0.08 0.30 -0.39 0.00 0.00 0.31 0.15 119.26 119.71 1two h ALA 51 Ca -0.23 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1two h ALA 51 Cb 1.87 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.74 1two h ALA 51 CO 0.17 -0.37 -0.05 0.97 0.00 0.00 0.00 179.25 179.96 1two h ILE 52 N 0.14 1.23 0.04 0.00 -0.00 -1.46 0.89 117.51 118.34 1two h ILE 52 Ca 0.14 -0.99 0.01 0.00 -0.00 0.00 0.00 64.86 64.02 1two h ILE 52 Cb 0.17 1.00 -0.01 0.00 -0.00 0.00 0.00 36.82 37.97 1two h ILE 52 CO -0.21 0.34 -0.08 -1.13 -0.00 0.00 0.00 178.15 177.07 1two h ASN 53 N 0.60 -0.22 0.61 2.19 -0.73 -0.56 -0.55 115.58 116.92 1two h ASN 53 Ca 0.12 0.03 -0.04 0.00 1.87 0.00 0.00 56.30 58.27 1two h ASN 53 Cb 0.46 0.09 -0.01 0.00 0.27 0.00 0.00 38.32 39.13 1two h ASN 53 CO 0.02 -0.12 -0.21 0.00 -0.37 0.00 0.00 177.43 176.75 1two h LEU 55 N 0.00 0.49 -0.19 0.00 5.85 0.85 2.30 115.31 124.61 1two h LEU 55 Ca -0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1two h LEU 55 Cb 0.57 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.57 1two h LEU 55 CO 0.03 0.17 0.00 0.00 -0.34 0.00 0.00 178.44 178.30 1two n ALA 56 N -2.47 1.94 0.00 1.25 0.00 -0.91 -4.23 120.51 116.08 1two n ALA 56 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1two n ALA 56 Cb 0.71 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 -1.85 0.00 -3.78 0.00 5.66 0.78 -2.00 114.28 113.09 1two n THR 57 Ca 0.04 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.68 1two n THR 57 Cb 0.28 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 68.94 1two n THR 57 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 1two s LYS 58 N -3.71 2.35 0.48 1.09 2.47 -1.26 -4.93 119.74 116.24 1two s LYS 58 Ca 0.00 -1.47 0.28 0.00 -1.56 0.00 0.00 55.97 53.21 1two s LYS 58 Cb 0.00 -3.48 1.02 0.00 -1.46 0.00 0.00 37.83 33.91 1two s LYS 58 CO 0.00 -0.84 1.86 -0.07 0.16 0.00 0.00 175.35 176.45 1two h LEU 59 N 8.13 0.00 -1.34 5.43 3.38 -1.75 -2.19 115.31 126.96 1two h LEU 59 Ca -0.19 0.00 -0.02 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 0.64 0.12 0.19 -0.78 0.09 0.00 0.00 178.44 178.70 1two h ASP 60 N 0.00 0.57 0.27 -0.43 3.58 -1.88 1.94 116.42 120.46 1two h ASP 60 Ca -0.00 -0.06 -0.34 0.00 0.42 0.00 0.00 57.03 57.05 1two h ASP 60 Cb 0.70 -0.15 0.01 0.00 1.72 0.00 0.00 39.33 41.61 1two h ASP 60 CO 0.02 0.52 -1.69 -0.37 -2.88 0.00 0.00 179.24 174.83 1two h VAL 61 N 0.63 1.00 -0.25 2.25 -1.51 -1.87 -3.28 116.25 113.23 1two h VAL 61 Ca 0.16 -2.60 -0.05 0.00 -1.23 0.00 0.00 66.70 62.98 1two h VAL 61 Cb 0.12 2.77 -0.01 0.00 -2.13 0.00 0.00 31.29 32.04 1two h VAL 61 CO -0.02 0.84 -0.05 0.58 -1.23 0.00 0.00 177.57 177.69 1two h VAL 62 N 0.10 1.28 -3.57 7.19 2.07 -0.97 -3.40 116.25 118.95 1two h VAL 62 Ca -0.31 -1.04 -0.62 0.00 0.82 0.00 0.00 66.70 65.54 1two h VAL 62 Cb 2.08 1.45 -0.39 0.00 -1.52 0.00 0.00 31.29 32.92 1two h VAL 62 CO 0.18 0.33 -0.77 1.51 0.02 0.00 0.00 177.57 178.84 1two s ASP 63 N -6.06 4.08 0.05 0.57 1.47 0.65 -4.75 116.67 112.67 1two s ASP 63 Ca -0.14 -1.46 -0.17 0.00 1.18 0.00 0.00 52.55 51.97 1two s ASP 63 Cb 0.07 -1.22 -0.21 0.00 -0.34 0.00 0.00 42.92 41.22 1two s ASP 63 CO 0.76 -0.30 1.18 1.55 0.68 0.00 0.00 175.17 179.05 1two h PRO 64 N 7.91 0.57 -0.16 2.11 0.13 -1.76 -3.31 132.00 137.48 1two h PRO 64 Ca -0.14 -0.55 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 1two h PRO 64 Cb 1.05 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1two h PRO 64 CO 0.44 1.17 0.00 -3.47 -0.23 0.00 0.00 178.00 175.92 1two n ASP 65 N -4.09 2.38 -0.08 1.44 -0.08 -1.26 -4.95 116.55 109.91 1two n ASP 65 Ca -0.10 -1.70 0.00 0.00 -1.51 0.00 0.00 54.79 51.48 1two n ASP 65 Cb 0.72 -0.10 0.00 0.00 2.34 0.00 0.00 41.12 44.08 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 0.59 0.61 0.37 0.27 0.00 -1.24 -4.98 105.19 100.81 1two n GLY 66 Ca 0.09 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.20 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 0.65 -0.98 1.61 -1.24 -1.85 -3.46 115.58 110.31 1two h ASN 67 Ca 0.00 0.06 0.10 0.00 0.71 0.00 0.00 56.30 57.17 1two h ASN 67 Cb 0.09 -0.06 -0.02 0.00 0.73 0.00 0.00 38.32 39.06 1two h ASN 67 CO 0.00 0.28 0.27 0.00 -1.29 0.00 0.00 177.43 176.69 1two n LEU 68 N -4.61 0.00 -3.67 0.34 -0.00 -1.26 -3.21 117.00 104.59 1two n LEU 68 Ca 0.20 -0.26 -0.15 0.00 -0.00 0.00 0.00 56.01 55.80 1two n LEU 68 Cb 0.56 0.75 -0.14 0.00 -0.00 0.00 0.00 43.42 44.59 1two n LEU 68 CO 0.27 -0.09 -0.18 -1.00 -0.00 0.00 0.00 177.39 176.39 1two s HIS 69 N -3.38 -0.31 0.31 1.47 3.76 -1.24 -4.74 115.29 111.16 1two s HIS 69 Ca 0.10 0.81 -0.27 0.00 -0.15 0.00 0.00 55.06 55.55 1two s HIS 69 Cb -0.01 -0.13 -0.14 0.00 1.11 0.00 0.00 32.58 33.41 1two s HIS 69 CO 0.00 -0.31 0.85 1.58 -0.85 0.00 0.00 174.74 176.02 1two n HIS 70 N 5.30 0.69 0.00 1.40 -0.00 -1.26 -0.90 115.22 120.46 1two n HIS 70 Ca -0.06 0.72 0.00 0.00 0.46 0.00 0.00 57.72 58.84 1two n HIS 70 Cb 0.50 -2.16 0.00 0.00 -0.12 0.00 0.00 29.99 28.21 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 1.43 1.35 2.68 1.57 0.00 -1.26 -4.68 105.19 106.29 1two n GLY 71 Ca 0.11 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 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 3.35 0.18 1.61 2.47 -0.08 -4.94 114.94 117.53 1two s ASN 72 Ca 0.00 -3.43 -0.32 0.00 0.42 0.00 0.00 52.86 49.53 1two s ASN 72 Cb 0.00 -1.10 -0.11 0.00 -1.45 0.00 0.00 41.25 38.59 1two s ASN 72 CO 0.00 -0.13 1.66 0.00 -3.72 0.00 0.00 177.10 174.90 1two s ALA 73 N -0.69 3.85 1.25 1.71 0.00 -0.36 -3.60 121.76 123.93 1two s ALA 73 Ca 0.27 1.47 -0.16 0.00 0.00 0.00 0.00 51.96 53.54 1two s ALA 73 Cb -0.03 -3.67 0.31 0.00 0.00 0.00 0.00 23.12 19.74 1two s ALA 73 CO -0.16 -0.89 1.00 0.15 0.00 0.00 0.00 175.76 175.85 1two s LYS 74 N 1.33 -1.62 0.00 0.00 -0.14 -1.26 -4.81 119.74 113.24 1two s LYS 74 Ca 0.73 0.57 0.04 0.00 -1.36 0.00 0.00 55.97 55.95 1two s LYS 74 Cb -0.46 -1.49 0.24 0.00 -1.68 0.00 0.00 37.83 34.43 1two s LYS 74 CO 0.32 -4.12 0.82 -0.25 -0.76 0.00 0.00 175.35 171.36 1two n ASP 75 N -5.16 0.00 -0.07 2.83 9.92 -1.26 -1.98 116.55 120.83 1two n ASP 75 Ca 0.06 -1.13 -0.06 0.00 -0.53 0.00 0.00 54.79 53.13 1two n ASP 75 Cb 0.56 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.92 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 -0.60 0.00 0.00 1.24 3.01 -1.26 -4.35 117.46 115.50 1two n PHE 76 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 1two n PHE 76 Cb 0.01 -0.72 0.00 0.00 -0.01 0.00 0.00 39.48 38.77 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 -2.52 -0.11 -0.47 4.37 0.00 -0.84 -1.31 120.51 119.63 1two n ALA 77 Ca -0.23 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.19 1two n ALA 77 Cb 0.94 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.35 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 -1.04 0.94 0.02 0.00 0.00 -1.24 -2.92 117.12 112.88 1two n MET 78 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 57.70 57.48 1two n MET 78 Cb 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 33.22 31.85 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 1.95 0.00 0.00 3.17 3.00 -1.23 -4.43 118.16 120.62 1two n LYS 79 Ca 0.10 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.46 1two n LYS 79 Cb 0.45 0.00 0.29 0.00 0.00 0.00 0.00 35.03 35.77 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 -2.64 0.00 -2.12 5.64 1.44 -0.43 -2.27 115.22 114.84 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 -0.33 -0.00 0.00 0.12 0.00 0.00 29.99 29.78 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 -0.29 0.71 3.24 -1.39 0.00 -1.22 -5.10 105.19 101.14 1two n GLY 81 Ca 0.05 -0.20 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 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 1.39 0.14 4.61 0.00 -0.96 -4.99 121.76 121.94 1two s ALA 82 Ca 0.08 -1.49 -0.05 0.00 0.00 0.00 0.00 51.96 50.51 1two s ALA 82 Cb 0.09 0.11 -0.05 0.00 0.00 0.00 0.00 23.12 23.27 1two s ALA 82 CO -0.04 -0.14 0.36 0.16 0.00 0.00 0.00 175.76 176.11 1two s ASP 83 N -3.15 6.48 0.51 0.00 1.47 -1.26 -4.69 116.67 116.03 1two s ASP 83 Ca 0.17 0.57 0.45 0.00 1.18 0.00 0.00 52.55 54.92 1two s ASP 83 Cb 0.03 -2.08 1.60 0.00 -0.34 0.00 0.00 42.92 42.13 1two s ASP 83 CO 0.00 0.06 1.47 -0.62 0.68 0.00 0.00 175.17 176.77 1two n GLU 84 N 0.12 -0.01 -0.17 2.11 1.02 -1.26 0.33 120.64 122.78 1two n GLU 84 Ca -0.03 1.05 -0.10 0.00 -0.02 0.00 0.00 57.16 58.06 1two n GLU 84 Cb 0.52 -2.35 0.00 0.00 -0.02 0.00 0.00 31.44 29.59 1two n GLU 84 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1two h THR 85 N 0.00 1.26 -1.06 2.62 1.03 -2.00 -2.86 112.91 111.91 1two h THR 85 Ca 0.88 -1.10 0.33 0.00 -0.01 0.00 0.00 66.41 66.50 1two h THR 85 Cb 3.44 0.98 -0.14 0.00 -1.07 0.00 0.00 68.15 71.36 1two h THR 85 CO -0.08 0.39 0.64 0.00 -0.01 0.00 0.00 175.52 176.46 1two h MET 86 N 0.75 0.30 -0.61 0.00 -0.00 0.51 2.72 114.93 118.61 1two h MET 86 Ca 0.14 -0.02 0.12 0.00 -0.00 0.00 0.00 59.70 59.95 1two h MET 86 Cb 0.54 -0.07 -0.11 0.00 -0.00 0.00 0.00 31.60 31.96 1two h MET 86 CO 0.03 0.20 -0.09 0.00 -0.00 0.00 0.00 176.91 177.05 1two h ALA 87 N 1.76 0.48 0.04 -3.00 0.00 -1.52 0.19 119.26 117.20 1two h ALA 87 Ca 0.72 0.22 -0.35 0.00 0.00 0.00 0.00 54.91 55.50 1two h ALA 87 Cb 1.77 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 19.92 1two h ALA 87 CO -0.52 -0.42 -1.99 0.94 0.00 0.00 0.00 179.25 177.27 1two n GLN 88 N -5.36 0.64 -0.23 0.00 0.00 0.15 -4.14 117.38 108.43 1two n GLN 88 Ca 0.08 0.34 -0.08 0.00 -0.00 0.00 0.00 57.00 57.33 1two n GLN 88 Cb 0.33 -1.64 -0.04 0.00 0.00 0.00 0.00 30.24 28.90 1two n GLN 88 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.06 179.02 1two h GLN 89 N -0.52 -0.19 -0.67 3.69 4.20 0.46 0.29 115.11 122.38 1two h GLN 89 Ca -0.50 0.01 0.14 0.00 0.06 0.00 0.00 58.65 58.37 1two h GLN 89 Cb 1.69 0.04 -0.12 0.00 0.30 0.00 0.00 27.48 29.39 1two h GLN 89 CO -0.16 -0.13 -0.11 -0.07 -0.67 0.00 0.00 178.83 177.70 1two h LEU 90 N -0.20 -0.52 -0.97 1.46 4.07 -0.80 2.46 115.31 120.81 1two h LEU 90 Ca 0.19 0.19 0.00 0.00 0.08 0.00 0.00 57.88 58.34 1two h LEU 90 Cb 0.56 0.38 0.00 0.00 1.08 0.00 0.00 40.66 42.68 1two h LEU 90 CO -0.73 -0.20 0.19 0.52 -1.08 0.00 0.00 178.44 177.14 1two n VAL 91 N -5.41 0.82 0.00 1.22 0.31 0.98 0.19 118.33 116.44 1two n VAL 91 Ca 0.09 0.72 0.00 0.00 -0.01 0.00 0.00 64.34 65.14 1two n VAL 91 Cb 0.37 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 1two n VAL 91 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1two n ASP 92 N -2.06 0.00 -0.05 4.52 2.03 0.83 -3.01 116.55 118.80 1two n ASP 92 Ca -0.01 0.42 -0.11 0.00 0.52 0.00 0.00 54.79 55.61 1two n ASP 92 Cb 0.21 -0.41 -0.06 0.00 -0.72 0.00 0.00 41.12 40.14 1two n ASP 92 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 1two h ILE 93 N 0.00 1.23 -0.39 5.18 -2.65 -1.18 -1.91 117.51 117.80 1two h ILE 93 Ca 0.00 -0.74 0.11 0.00 1.03 0.00 0.00 64.86 65.26 1two h ILE 93 Cb 0.00 1.40 -0.02 0.00 -2.05 0.00 0.00 36.82 36.15 1two h ILE 93 CO 0.00 0.22 0.50 0.40 0.03 0.00 0.00 178.15 179.30 1two h ILE 94 N 0.06 0.27 0.00 0.16 2.04 0.18 1.59 117.51 121.81 1two h ILE 94 Ca 0.05 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.74 1two h ILE 94 Cb 0.32 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 1two h ILE 94 CO 0.00 0.00 -0.82 0.45 0.00 0.00 0.00 178.15 177.78 1two h HIS 95 N 0.00 0.04 0.00 1.37 3.86 -1.25 0.56 115.15 119.73 1two h HIS 95 Ca 0.18 -0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.27 1two h HIS 95 Cb 1.18 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.63 1two h HIS 95 CO 0.00 0.83 -1.05 0.78 0.86 0.00 0.00 177.93 179.35 1two h GLY 96 N 2.35 0.00 0.00 2.45 0.00 0.22 -3.18 103.07 104.91 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 0.11 0.00 -0.47 0.00 0.00 0.00 0.00 176.54 176.18 1two h GLU 98 N -0.88 0.10 -0.00 0.00 4.22 -0.06 3.48 114.58 121.43 1two h GLU 98 Ca 0.00 -0.01 -0.16 0.00 0.08 0.00 0.00 59.36 59.27 1two h GLU 98 Cb 0.47 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1two h GLU 98 CO 0.00 0.06 -0.76 1.57 -2.18 0.00 0.00 179.01 177.70 1two h LYS 99 N 0.10 0.05 -0.00 1.92 5.09 -1.68 -2.99 116.57 119.05 1two h LYS 99 Ca 0.69 -0.05 0.00 0.00 0.09 0.00 0.00 60.65 61.38 1two h LYS 99 Cb 2.45 0.01 0.00 0.00 0.10 0.00 0.00 32.23 34.79 1two h LYS 99 CO -0.15 0.79 -0.67 0.45 -2.09 0.00 0.00 179.45 177.77 1two n SER 100 N -3.67 1.09 -3.97 7.07 2.88 0.92 -4.56 113.62 113.38 1two n SER 100 Ca -0.01 -0.91 -0.31 0.00 -1.33 0.00 0.00 58.87 56.31 1two n SER 100 Cb 0.73 0.60 -0.10 0.00 -0.75 0.00 0.00 64.21 64.69 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 -2.83 3.94 0.96 -1.46 0.00 0.95 -5.04 121.76 118.27 1two s ALA 101 Ca 0.13 -3.81 -0.14 0.00 0.00 0.00 0.00 51.96 48.14 1two s ALA 101 Cb 0.17 -2.39 0.17 0.00 0.00 0.00 0.00 23.12 21.07 1two s ALA 101 CO 0.72 -2.11 1.16 -1.25 0.00 0.00 0.00 175.76 174.28 1two s PRO 102 N -1.36 0.74 0.00 0.00 0.04 -1.26 -4.66 135.00 128.50 1two s PRO 102 Ca 0.25 0.13 -0.02 0.00 0.04 0.00 0.00 61.00 61.40 1two s PRO 102 Cb -0.07 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.60 1two s PRO 102 CO -0.14 -2.44 1.98 -0.35 0.04 0.00 0.00 177.00 176.09 1two n PRO 103 N -3.90 1.02 -1.84 0.56 -0.04 -1.26 -4.47 135.00 125.07 1two n PRO 103 Ca 0.09 -0.27 -0.37 0.00 -0.04 0.00 0.00 63.50 62.91 1two n PRO 103 Cb 0.59 -1.39 0.05 0.00 -0.04 0.00 0.00 33.50 32.71 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 2.09 5.00 0.62 3.54 3.84 -1.26 -4.84 114.94 123.94 1two s ASN 104 Ca 0.18 2.61 0.31 0.00 0.21 0.00 0.00 52.86 56.17 1two s ASN 104 Cb 0.09 -2.62 1.71 0.00 -0.55 0.00 0.00 41.25 39.88 1two s ASN 104 CO 0.00 -1.74 2.04 0.44 -2.79 0.00 0.00 177.10 175.05 1two h ASP 105 N 0.97 0.00 -0.18 -4.21 5.19 -2.05 0.26 116.42 116.39 1two h ASP 105 Ca -0.51 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 55.81 1two h ASP 105 Cb 1.31 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 40.77 1two h ASP 105 CO 0.55 0.00 0.12 -0.67 -3.12 0.00 0.00 179.24 176.12 1two n ASP 106 N -3.40 3.19 -0.70 6.45 2.03 -1.26 -4.43 116.55 118.43 1two n ASP 106 Ca 0.01 -2.30 0.53 0.00 0.52 0.00 0.00 54.79 53.55 1two n ASP 106 Cb 0.37 -0.57 0.82 0.00 -0.72 0.00 0.00 41.12 41.02 1two n ASP 106 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1two h LYS 107 N 0.20 0.00 -0.34 -0.67 1.57 -0.81 2.48 116.57 119.01 1two h LYS 107 Ca 0.12 -0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.96 1two h LYS 107 Cb 1.34 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.59 1two h LYS 107 CO 0.21 0.00 0.01 0.00 -0.57 0.00 0.00 179.45 179.10 1two n MET 109 N -5.16 0.97 0.00 0.00 0.00 0.72 -4.00 117.12 109.65 1two n MET 109 Ca 0.01 -0.60 0.00 0.00 -0.00 0.00 0.00 57.70 57.11 1two n MET 109 Cb 0.17 -1.44 0.00 0.00 0.00 0.00 0.00 33.22 31.95 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 -0.57 0.00 -0.32 2.12 3.00 0.48 -4.04 118.16 118.83 1two n LYS 110 Ca 0.07 0.02 0.20 0.00 -0.00 0.00 0.00 58.31 58.60 1two n LYS 110 Cb 0.39 -0.30 0.41 0.00 0.00 0.00 0.00 35.03 35.52 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 0.22 -0.86 3.15 2.02 -1.07 0.73 112.91 117.11 1two h THR 111 Ca 0.00 -0.07 0.22 0.00 0.77 0.00 0.00 66.41 67.33 1two h THR 111 Cb 0.00 0.01 -0.15 0.00 -1.74 0.00 0.00 68.15 66.27 1two h THR 111 CO 0.00 0.03 0.09 -0.29 0.37 0.00 0.00 175.52 175.72 1two h ILE 112 N 0.19 0.25 -0.97 3.11 -0.00 -1.66 1.03 117.51 119.46 1two h ILE 112 Ca 0.67 -0.04 0.32 0.00 -0.00 0.00 0.00 64.86 65.81 1two h ILE 112 Cb 1.52 0.12 -0.16 0.00 -0.00 0.00 0.00 36.82 38.30 1two h ILE 112 CO -0.69 0.02 0.37 -0.78 -0.00 0.00 0.00 178.15 177.07 1two h ASP 113 N 0.12 0.13 0.02 2.19 3.58 0.35 1.21 116.42 124.02 1two h ASP 113 Ca 0.51 0.23 -0.07 0.00 0.42 0.00 0.00 57.03 58.12 1two h ASP 113 Cb 0.98 0.28 -0.00 0.00 1.72 0.00 0.00 39.33 42.31 1two h ASP 113 CO -0.73 -0.28 -0.34 0.58 -2.88 0.00 0.00 179.24 175.59 1two h VAL 114 N 0.13 1.61 -0.19 2.25 2.07 0.85 0.83 116.25 123.80 1two h VAL 114 Ca 0.70 -2.35 0.05 0.00 0.82 0.00 0.00 66.70 65.92 1two h VAL 114 Cb 1.63 3.18 -0.01 0.00 -1.52 0.00 0.00 31.29 34.57 1two h VAL 114 CO -0.73 0.58 0.50 0.00 0.02 0.00 0.00 177.57 177.94 1two h ALA 115 N -0.06 1.75 0.00 1.67 0.00 0.24 0.47 119.26 123.33 1two h ALA 115 Ca -0.08 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.53 1two h ALA 115 Cb 1.15 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 1two h ALA 115 CO -0.01 -0.60 -2.17 0.00 0.00 0.00 0.00 179.25 176.47 1two n MET 116 N -3.11 1.10 -0.15 0.00 3.85 0.38 -4.05 117.12 115.14 1two n MET 116 Ca 0.03 -0.02 -0.03 0.00 -1.00 0.00 0.00 57.70 56.68 1two n MET 116 Cb 0.60 -1.45 0.06 0.00 -1.05 0.00 0.00 33.22 31.38 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 0.24 0.46 -0.05 0.00 3.57 -1.55 -2.37 116.94 117.24 1two h PHE 118 Ca 0.24 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 1two h PHE 118 Cb 0.31 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1two h PHE 118 CO -0.22 0.48 -0.17 -0.22 -2.23 0.00 0.00 178.31 175.95 1two h LYS 119 N 0.31 0.08 -0.30 1.11 3.64 -1.44 -1.08 116.57 118.90 1two h LYS 119 Ca 0.09 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.54 1two h LYS 119 Cb 0.23 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1two h LYS 119 CO -0.00 0.26 0.22 0.87 -2.27 0.00 0.00 179.45 178.53 1two h LYS 120 N 0.08 0.00 -0.60 1.90 1.57 0.21 0.15 116.57 119.88 1two h LYS 120 Ca 0.01 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1two h LYS 120 Cb 0.36 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.64 1two h LYS 120 CO 0.02 0.00 0.40 0.93 -0.57 0.00 0.00 179.45 180.23 1two h GLU 121 N 0.00 0.71 -0.01 3.15 5.08 -1.11 -1.33 114.58 121.07 1two h GLU 121 Ca 0.14 -0.04 -0.24 0.00 -1.00 0.00 0.00 59.36 58.22 1two h GLU 121 Cb 0.59 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.69 1two h GLU 121 CO -0.00 0.47 -0.97 0.82 -1.00 0.00 0.00 179.01 178.33 1two h ILE 122 N 0.73 1.35 0.00 3.13 1.08 -0.84 -3.03 117.51 119.94 1two h ILE 122 Ca 0.24 -2.36 0.00 0.00 -0.39 0.00 0.00 64.86 62.35 1two h ILE 122 Cb 0.05 2.38 0.00 0.00 -3.07 0.00 0.00 36.82 36.18 1two h ILE 122 CO -0.06 0.71 0.63 -0.74 -0.69 0.00 0.00 178.15 178.00 1two h HIS 123 N 0.30 0.00 -0.65 1.37 -0.00 -0.80 2.81 115.15 118.18 1two h HIS 123 Ca -0.09 0.00 -0.25 0.00 -0.00 0.00 0.00 60.37 60.03 1two h HIS 123 Cb 1.61 0.00 -0.15 0.00 -0.00 0.00 0.00 27.41 28.87 1two h HIS 123 CO 0.07 0.00 0.32 1.63 -0.00 0.00 0.00 177.93 179.95 1two n LYS 124 N -2.59 2.78 0.00 5.26 5.02 -1.14 -4.56 118.16 122.93 1two n LYS 124 Ca -0.01 -2.39 0.00 0.00 -2.02 0.00 0.00 58.31 53.89 1two n LYS 124 Cb 0.65 -1.99 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 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 -0.29 0.00 0.02 -0.35 -0.00 0.94 -4.32 117.00 112.99 1two n LEU 125 Ca 0.37 0.00 0.11 0.00 -0.00 0.00 0.00 56.01 56.49 1two n LEU 125 Cb 1.26 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 44.55 1two n LEU 125 CO 0.39 0.00 -0.58 -3.20 -0.00 0.00 0.00 177.39 174.00 1two n ASN 126 N 0.00 0.20 -4.80 1.45 5.15 -1.26 -4.90 115.26 111.10 1two n ASN 126 Ca 0.00 0.08 -0.38 0.00 -0.60 0.00 0.00 54.58 53.67 1two n ASN 126 Cb 0.00 1.63 -0.06 0.00 -0.53 0.00 0.00 39.78 40.82 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 -3.47 3.76 -0.20 1.20 0.51 -1.26 -5.06 118.94 114.41 1two s TRP 127 Ca -0.06 1.18 0.01 0.00 -2.12 0.00 0.00 56.10 55.11 1two s TRP 127 Cb 0.13 -2.47 0.03 0.00 -0.81 0.00 0.00 33.47 30.35 1two s TRP 127 CO 0.88 0.55 -0.16 0.14 -0.51 0.00 0.00 176.95 177.84 1two s VAL 128 N -0.89 2.18 -0.03 4.03 -7.23 -1.26 -4.21 120.40 112.99 1two s VAL 128 Ca 0.28 -1.10 -0.05 0.00 -1.81 0.00 0.00 61.98 59.31 1two s VAL 128 Cb -0.18 -2.02 -0.20 0.00 0.56 0.00 0.00 36.38 34.54 1two s VAL 128 CO 0.17 0.38 2.85 -0.81 -0.31 0.00 0.00 175.10 177.38 1two n PRO 129 N 4.58 1.54 -0.70 4.82 -0.04 -1.26 -4.57 135.00 139.38 1two n PRO 129 Ca -0.19 -0.78 0.53 0.00 -0.04 0.00 0.00 63.50 63.02 1two n PRO 129 Cb 0.48 -1.89 0.82 0.00 -0.04 0.00 0.00 33.50 32.86 1two n PRO 129 CO 0.00 0.00 0.00 -2.95 -0.04 0.00 0.00 175.50 172.51 1two h ASN 130 N 3.79 0.00 -3.59 3.54 -1.07 -1.96 -3.15 115.58 113.15 1two h ASN 130 Ca 0.16 0.00 -0.70 0.00 0.07 0.00 0.00 56.30 55.83 1two h ASN 130 Cb 1.12 0.00 -0.32 0.00 -2.07 0.00 0.00 38.32 37.05 1two h ASN 130 CO 0.33 0.00 -0.58 -0.32 0.07 0.00 0.00 177.43 176.92 1two s MET 131 N -4.85 2.32 -0.10 4.14 1.75 -1.26 -4.84 119.30 116.47 1two s MET 131 Ca -0.05 -1.51 0.00 0.00 -1.25 0.00 0.00 55.69 52.89 1two s MET 131 Cb 0.27 -3.49 0.02 0.00 2.84 0.00 0.00 34.83 34.47 1two s MET 131 CO 0.89 -0.87 -0.08 -0.51 -0.65 0.00 0.00 175.02 173.80 1two s ASP 132 N 1.66 1.99 -0.29 1.11 1.01 -1.10 -4.96 116.67 116.09 1two s ASP 132 Ca 0.02 -0.29 -0.13 0.00 0.71 0.00 0.00 52.55 52.86 1two s ASP 132 Cb -0.21 -0.81 0.12 0.00 1.01 0.00 0.00 42.92 43.03 1two s ASP 132 CO -0.01 -0.08 0.73 -1.48 0.21 0.00 0.00 175.17 174.54 1two s LEU 133 N 1.39 -0.97 0.03 1.23 -0.00 -1.26 -0.63 118.68 118.47 1two s LEU 133 Ca -0.01 1.41 -0.04 0.00 -0.00 0.00 0.00 54.13 55.49 1two s LEU 133 Cb -0.13 2.22 -0.02 0.00 -0.00 0.00 0.00 46.19 48.26 1two s LEU 133 CO -0.05 -0.21 -0.08 0.52 -0.00 0.00 0.00 176.35 176.53 1two n VAL 134 N 4.88 1.25 0.37 1.48 0.31 -1.26 -4.81 118.33 120.55 1two n VAL 134 Ca -0.15 0.32 0.08 0.00 -0.01 0.00 0.00 64.34 64.58 1two n VAL 134 Cb 0.53 -1.76 -0.10 0.00 -0.91 0.00 0.00 33.84 31.60 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 -3.71 0.00 -1.16 2.52 -0.00 -1.26 -4.98 119.36 110.77 1two n ILE 135 Ca -0.04 -0.24 0.00 0.00 -0.00 0.00 0.00 62.75 62.47 1two n ILE 135 Cb 0.15 0.59 0.00 0.00 -0.00 0.00 0.00 39.64 40.38 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 1.48 0.55 3.93 3.28 0.00 -1.26 -5.06 105.19 108.10 1two n GLY 136 Ca 0.00 -0.84 -0.22 0.00 0.00 0.00 0.00 46.02 44.96 1two n GLY 136 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1two s GLU 137 N -2.39 2.43 -0.56 1.61 2.02 -1.26 -5.01 118.70 115.53 1two s GLU 137 Ca 0.00 -1.67 -0.26 0.00 0.02 0.00 0.00 54.97 53.05 1two s GLU 137 Cb 0.00 -2.38 -0.04 0.00 0.10 0.00 0.00 34.13 31.81 1two s GLU 137 CO 0.00 -0.46 2.09 0.14 0.02 0.00 0.00 175.26 177.05 1two s VAL 138 N -2.59 3.21 0.00 2.63 -7.23 -1.26 -3.33 120.40 111.83 1two s VAL 138 Ca 0.47 0.12 0.00 0.00 -1.81 0.00 0.00 61.98 60.76 1two s VAL 138 Cb -0.04 -3.56 0.00 0.00 0.56 0.00 0.00 36.38 33.34 1two s VAL 138 CO 0.29 -0.54 0.00 -0.11 -0.31 0.00 0.00 175.10 174.43 1two n LEU 139 N 14.07 0.00 -4.94 1.32 -0.00 -1.26 -5.14 117.00 121.05 1two n LEU 139 Ca 0.27 0.00 -0.24 0.00 -0.00 0.00 0.00 56.01 56.04 1two n LEU 139 Cb 0.53 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.97 1two n LEU 139 CO 0.71 0.00 0.39 0.00 -0.00 0.00 0.00 177.39 178.49 1two s ALA 140 N 0.00 3.57 -1.08 1.96 0.00 -1.21 -4.96 121.76 120.03 1two s ALA 140 Ca 0.00 -0.92 -0.23 0.00 0.00 0.00 0.00 51.96 50.81 1two s ALA 140 Cb 0.00 -2.33 -0.03 0.00 0.00 0.00 0.00 23.12 20.76 1two s ALA 140 CO 0.00 -0.58 1.84 -2.00 0.00 0.00 0.00 175.76 175.02 1two s GLU 141 N -4.75 2.88 0.00 0.00 -6.30 0.19 -4.90 118.70 105.83 1two s GLU 141 Ca 0.51 -0.98 0.29 0.00 -2.50 0.00 0.00 54.97 52.30 1two s GLU 141 Cb -0.10 -5.24 1.36 0.00 0.00 0.00 0.00 34.13 30.14 1two s GLU 141 CO 0.41 -3.28 1.92 0.28 0.02 0.00 0.00 175.26 174.60