#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rff n GLY 2 N 0.00 0.04 3.58 -0.02 0.00 -1.26 -5.17 105.19 102.36 2rff n GLY 2 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2rff n GLY 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rff s LYS 3 N 0.00 3.33 0.89 1.61 -0.14 -1.26 -5.12 119.74 119.05 2rff s LYS 3 Ca 0.00 -0.48 -0.10 0.00 -1.36 0.00 0.00 55.97 54.03 2rff s LYS 3 Cb 0.00 -2.84 0.19 0.00 -1.68 0.00 0.00 37.83 33.51 2rff s LYS 3 CO 0.00 0.46 1.22 0.20 -0.76 0.00 0.00 175.35 176.46 2rff s GLY 4 N -0.21 1.79 0.23 -3.33 0.00 -1.26 -4.84 107.32 99.70 2rff s GLY 4 Ca 0.04 -1.56 -0.07 0.00 0.00 0.00 0.00 44.72 43.13 2rff s GLY 4 CO 0.02 -0.82 1.87 1.70 0.00 0.00 0.00 173.10 175.88 2rff h LYS 5 N -1.28 1.02 -0.34 2.90 3.64 -1.99 -1.45 116.57 119.06 2rff h LYS 5 Ca -0.40 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 58.80 2rff h LYS 5 Cb 1.23 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 2rff h LYS 5 CO 0.34 0.67 -0.28 1.03 -2.27 0.00 0.00 179.45 178.94 2rff h SER 6 N 1.05 0.82 -0.27 4.20 0.87 -1.99 -0.79 113.55 117.44 2rff h SER 6 Ca 0.34 -0.45 -0.03 0.00 -1.23 0.00 0.00 61.79 60.42 2rff h SER 6 Cb 0.02 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.74 2rff h SER 6 CO -0.12 1.10 0.07 0.00 -0.53 0.00 0.00 176.83 177.35 2rff h ALA 7 N 0.75 0.36 -0.34 6.23 0.00 -1.85 -1.69 119.26 122.71 2rff h ALA 7 Ca 0.06 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2rff h ALA 7 Cb 0.85 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2rff h ALA 7 CO 0.07 0.02 0.18 0.82 0.00 0.00 0.00 179.25 180.34 2rff h ILE 8 N 0.27 1.15 -0.69 0.00 1.08 -1.19 -0.99 117.51 117.14 2rff h ILE 8 Ca 0.09 -0.41 0.08 0.00 -0.39 0.00 0.00 64.86 64.23 2rff h ILE 8 Cb 0.29 0.79 -0.07 0.00 -3.07 0.00 0.00 36.82 34.76 2rff h ILE 8 CO 0.00 0.16 0.35 -0.08 -0.69 0.00 0.00 178.15 177.89 2rff h GLU 9 N 0.43 0.59 -0.31 2.37 4.81 -1.07 -1.68 114.58 119.72 2rff h GLU 9 Ca 0.12 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.21 2rff h GLU 9 Cb 0.09 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 2rff h GLU 9 CO -0.02 0.39 -0.23 0.66 -0.73 0.00 0.00 179.01 179.09 2rff h SER 10 N 0.61 0.60 -0.36 1.04 4.64 -0.89 -0.97 113.55 118.22 2rff h SER 10 Ca 0.33 -0.20 -0.03 0.00 -0.47 0.00 0.00 61.79 61.42 2rff h SER 10 Cb 0.32 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 2rff h SER 10 CO -0.25 0.82 0.09 -0.61 -0.87 0.00 0.00 176.83 176.02 2rff h GLN 11 N 0.52 0.57 0.09 4.77 5.75 -0.45 -3.12 115.11 123.24 2rff h GLN 11 Ca 0.08 -0.13 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 2rff h GLN 11 Cb 0.68 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.15 2rff h GLN 11 CO 0.05 0.61 -0.04 0.82 -2.65 0.00 0.00 178.83 177.61 2rff h ILE 12 N 0.43 0.94 0.00 2.39 2.04 -1.17 -0.97 117.51 121.17 2rff h ILE 12 Ca 0.11 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.88 2rff h ILE 12 Cb 0.29 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 2rff h ILE 12 CO -0.00 0.02 0.00 -1.14 0.00 0.00 0.00 178.15 177.03 2rff n ARG 13 N -5.12 0.00 0.00 2.37 0.63 -0.38 -1.52 116.66 112.63 2rff n ARG 13 Ca -0.08 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.85 2rff n ARG 13 Cb 0.09 -1.07 0.00 0.00 0.45 0.00 0.00 32.46 31.93 2rff n ARG 13 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2rff n LEU 15 N 0.58 0.00 -0.18 6.15 4.77 -0.37 -1.51 117.00 126.44 2rff n LEU 15 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.90 2rff n LEU 15 Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 2rff n LEU 15 CO 0.00 0.00 1.02 0.11 -1.33 0.00 0.00 177.39 177.19 2rff h LYS 16 N 0.00 0.73 -0.38 3.23 1.57 -1.52 -0.20 116.57 120.00 2rff h LYS 16 Ca 0.00 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 2rff h LYS 16 Cb 0.00 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 2rff h LYS 16 CO 0.00 0.58 0.15 1.25 -0.57 0.00 0.00 179.45 180.85 2rff h LEU 17 N 0.69 0.52 -0.83 2.94 5.85 -1.54 -2.06 115.31 120.88 2rff h LEU 17 Ca 0.18 -0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.76 2rff h LEU 17 Cb 0.07 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 2rff h LEU 17 CO -0.03 0.56 0.53 0.00 -0.34 0.00 0.00 178.44 179.16 2rff h ALA 18 N 0.99 1.10 -0.21 1.25 0.00 -1.79 -1.56 119.26 119.05 2rff h ALA 18 Ca 0.12 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.03 2rff h ALA 18 Cb 0.20 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2rff h ALA 18 CO -0.01 0.34 0.05 -0.22 0.00 0.00 0.00 179.25 179.41 2rff h LYS 19 N 1.02 0.13 -0.49 0.00 3.64 -0.80 0.57 116.57 120.64 2rff h LYS 19 Ca 0.34 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.75 2rff h LYS 19 Cb 0.04 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 2rff h LYS 19 CO -0.13 0.09 0.26 0.93 -2.27 0.00 0.00 179.45 178.33 2rff h GLU 20 N 0.13 0.49 -0.33 1.90 5.08 -0.89 0.30 114.58 121.27 2rff h GLU 20 Ca 0.09 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2rff h GLU 20 Cb 0.08 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2rff h GLU 20 CO -0.12 0.33 0.16 0.82 -1.00 0.00 0.00 179.01 179.20 2rff h ILE 21 N 0.51 1.16 -0.76 3.13 2.04 -1.00 -2.69 117.51 119.90 2rff h ILE 21 Ca 0.21 -0.45 -0.06 0.00 1.00 0.00 0.00 64.86 65.56 2rff h ILE 21 Cb 0.09 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 2rff h ILE 21 CO -0.13 0.17 0.24 0.58 0.00 0.00 0.00 178.15 179.01 2rff h VAL 22 N 0.40 1.26 -0.80 1.67 2.07 -0.53 -1.49 116.25 118.84 2rff h VAL 22 Ca 0.11 -0.91 0.09 0.00 0.82 0.00 0.00 66.70 66.82 2rff h VAL 22 Cb 0.12 0.42 -0.07 0.00 -1.52 0.00 0.00 31.29 30.23 2rff h VAL 22 CO -0.01 0.36 0.46 -0.33 0.02 0.00 0.00 177.57 178.06 2rff h GLU 23 N 1.13 0.76 -0.01 1.57 5.08 -0.78 0.29 114.58 122.62 2rff h GLU 23 Ca 0.25 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 2rff h GLU 23 Cb 0.30 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 2rff h GLU 23 CO -0.01 0.50 -0.02 0.93 -1.00 0.00 0.00 179.01 179.42 2rff h GLU 24 N 0.78 0.03 -0.42 2.33 5.08 -1.13 -2.34 114.58 118.91 2rff h GLU 24 Ca 0.38 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 2rff h GLU 24 Cb 0.33 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2rff h GLU 24 CO -0.24 0.53 0.28 0.28 -1.00 0.00 0.00 179.01 178.86 2rff h VAL 25 N -0.46 1.12 -0.39 3.13 2.07 -1.06 -2.46 116.25 118.19 2rff h VAL 25 Ca 0.00 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 2rff h VAL 25 Cb 0.52 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2rff h VAL 25 CO 0.00 0.11 0.11 0.00 0.02 0.00 0.00 177.57 177.82 2rff h ALA 26 N 1.15 1.46 0.00 1.67 0.00 -0.46 -1.28 119.26 121.80 2rff h ALA 26 Ca 0.15 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2rff h ALA 26 Cb -0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2rff h ALA 26 CO -0.03 0.40 -0.27 1.03 0.00 0.00 0.00 179.25 180.38 2rff h SER 27 N 0.57 0.00 0.61 0.00 0.87 -1.23 -3.30 113.55 111.06 2rff h SER 27 Ca 0.13 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.50 2rff h SER 27 Cb 0.19 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.12 2rff h SER 27 CO -0.01 0.27 -1.53 -1.20 -0.53 0.00 0.00 176.83 173.83 2rff n SER 28 N -3.37 0.79 -3.79 6.23 7.64 -0.57 -4.82 113.62 115.73 2rff n SER 28 Ca 0.00 0.35 -0.29 0.00 1.01 0.00 0.00 58.87 59.94 2rff n SER 28 Cb 0.48 0.22 -0.15 0.00 -1.01 0.00 0.00 64.21 63.75 2rff n SER 28 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2rff s PHE 29 N -2.87 1.81 0.56 1.43 0.08 -0.71 -5.00 117.98 113.29 2rff s PHE 29 Ca -0.04 -1.62 0.26 0.00 0.12 0.00 0.00 56.93 55.66 2rff s PHE 29 Cb 0.09 -1.61 1.49 0.00 -0.57 0.00 0.00 43.02 42.42 2rff s PHE 29 CO 0.82 -0.80 2.04 -1.35 -0.10 0.00 0.00 175.22 175.82 2rff h PRO 30 N 8.07 0.00 -0.00 0.24 0.11 -1.88 -1.92 132.00 136.62 2rff h PRO 30 Ca -0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.97 2rff h PRO 30 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2rff h PRO 30 CO 0.43 0.00 -0.04 0.27 -0.21 0.00 0.00 178.00 178.45 2rff n ASN 31 N -4.10 0.25 -4.68 -2.05 6.94 -1.26 -4.80 115.26 105.56 2rff n ASN 31 Ca 0.05 -0.60 -0.42 0.00 -0.02 0.00 0.00 54.58 53.59 2rff n ASN 31 Cb 0.46 -0.12 -0.03 0.00 -2.36 0.00 0.00 39.78 37.74 2rff n ASN 31 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2rff s LEU 32 N -2.35 4.35 -0.10 -4.53 2.96 -0.72 -0.17 118.68 118.10 2rff s LEU 32 Ca 0.34 2.36 -0.00 0.00 -0.22 0.00 0.00 54.13 56.61 2rff s LEU 32 Cb 0.21 -3.56 -0.06 0.00 0.50 0.00 0.00 46.19 43.28 2rff s LEU 32 CO 0.43 -0.85 -0.10 1.21 -1.32 0.00 0.00 176.35 175.72 2rff n GLU 33 N 5.81 0.25 -3.86 1.98 4.07 -0.05 -4.70 120.64 124.15 2rff n GLU 33 Ca 0.15 0.07 -0.11 0.00 -0.06 0.00 0.00 57.16 57.21 2rff n GLU 33 Cb 0.42 -1.16 -0.09 0.00 -0.06 0.00 0.00 31.44 30.55 2rff n GLU 33 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2rff s GLU 34 N -2.20 0.58 -0.02 5.31 2.02 -0.99 -1.06 118.70 122.33 2rff s GLU 34 Ca -0.14 -0.48 0.03 0.00 0.02 0.00 0.00 54.97 54.40 2rff s GLU 34 Cb 0.04 0.24 -0.00 0.00 0.10 0.00 0.00 34.13 34.51 2rff s GLU 34 CO 0.23 -0.15 -0.10 0.08 0.02 0.00 0.00 175.26 175.34 2rff s VAL 35 N -1.84 0.84 0.16 2.63 1.01 0.12 -0.66 120.40 122.66 2rff s VAL 35 Ca -0.11 -0.42 0.11 0.00 0.00 0.00 0.00 61.98 61.56 2rff s VAL 35 Cb -0.05 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 2rff s VAL 35 CO -0.00 0.25 -0.25 -0.31 0.00 0.00 0.00 175.10 174.79 2rff s TYR 36 N -0.02 2.23 -0.16 5.22 1.51 -0.23 -0.68 117.35 125.23 2rff s TYR 36 Ca 0.00 -0.38 -0.15 0.00 -1.01 0.00 0.00 57.07 55.54 2rff s TYR 36 Cb -0.07 -1.15 -0.05 0.00 -0.11 0.00 0.00 41.96 40.59 2rff s TYR 36 CO 0.00 0.40 0.33 0.42 -1.11 0.00 0.00 175.55 175.59 2rff s ILE 37 N -1.42 5.28 0.39 2.71 -1.09 -0.13 -0.43 121.20 126.53 2rff s ILE 37 Ca 0.17 0.62 0.01 0.00 -2.23 0.00 0.00 60.65 59.21 2rff s ILE 37 Cb -0.09 -3.67 -0.00 0.00 -1.58 0.00 0.00 42.46 37.12 2rff s ILE 37 CO 0.08 0.37 0.03 2.22 -1.23 0.00 0.00 174.94 176.40 2rff n PHE 38 N 3.68 0.74 -4.16 3.97 -1.74 -0.45 -0.52 117.46 118.99 2rff n PHE 38 Ca -0.11 -2.06 0.00 0.00 -0.56 0.00 0.00 57.45 54.72 2rff n PHE 38 Cb 0.52 -0.20 0.00 0.00 1.52 0.00 0.00 39.48 41.31 2rff n PHE 38 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2rff n GLY 39 N -0.00 -1.24 0.25 4.97 0.00 -1.26 -3.90 105.19 104.00 2rff n GLY 39 Ca -0.14 -1.25 0.04 0.00 0.00 0.00 0.00 46.02 44.66 2rff n GLY 39 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2rff h SER 40 N 0.00 0.20 1.21 1.61 4.64 -1.91 -1.08 113.55 118.22 2rff h SER 40 Ca 0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2rff h SER 40 Cb 0.00 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 2rff h SER 40 CO 0.00 0.31 0.00 0.03 -0.87 0.00 0.00 176.83 176.30 2rff h ARG 41 N 0.21 0.00 0.17 4.77 3.08 -1.84 0.64 114.38 121.41 2rff h ARG 41 Ca 0.05 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.77 2rff h ARG 41 Cb 0.28 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.33 2rff h ARG 41 CO 0.01 0.00 -1.61 0.00 -1.07 0.00 0.00 179.97 177.30 2rff h ALA 42 N 2.05 0.14 -0.12 0.04 0.00 -1.36 -3.40 119.26 116.61 2rff h ALA 42 Ca 0.00 -1.10 -0.23 0.00 0.00 0.00 0.00 54.91 53.58 2rff h ALA 42 Cb 0.60 0.44 0.01 0.00 0.00 0.00 0.00 17.79 18.85 2rff h ALA 42 CO 0.00 0.93 -0.83 0.00 0.00 0.00 0.00 179.25 179.35 2rff h ARG 43 N -0.03 0.76 0.00 0.00 3.08 -1.13 -3.47 114.38 113.59 2rff h ARG 43 Ca -0.32 -0.67 0.00 0.00 0.07 0.00 0.00 59.98 59.06 2rff h ARG 43 Cb 1.98 0.15 0.00 0.00 0.08 0.00 0.00 29.97 32.19 2rff h ARG 43 CO 0.14 1.27 0.00 0.41 -1.07 0.00 0.00 179.97 180.72 2rff n GLY 44 N 0.80 1.66 1.70 0.04 0.00 0.20 -5.02 105.19 104.57 2rff n GLY 44 Ca -0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 2rff n GLY 44 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2rff n ASP 45 N 0.00 5.11 -4.94 1.61 5.75 -1.09 -4.93 116.55 118.07 2rff n ASP 45 Ca 0.00 -2.84 -0.25 0.00 -0.01 0.00 0.00 54.79 51.69 2rff n ASP 45 Cb 0.00 -0.90 -0.01 0.00 -1.03 0.00 0.00 41.12 39.18 2rff n ASP 45 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 2rff s TYR 46 N -1.46 3.51 0.36 2.11 -0.85 -1.23 -4.91 117.35 114.88 2rff s TYR 46 Ca 0.25 0.42 0.08 0.00 -0.52 0.00 0.00 57.07 57.30 2rff s TYR 46 Cb 0.20 -1.95 -0.03 0.00 0.38 0.00 0.00 41.96 40.56 2rff s TYR 46 CO 0.02 0.09 0.26 -0.51 -1.52 0.00 0.00 175.55 173.89 2rff s LEU 47 N -4.29 3.42 0.55 -3.49 1.43 -1.26 -5.01 118.68 110.04 2rff s LEU 47 Ca 0.41 -0.67 0.23 0.00 -1.03 0.00 0.00 54.13 53.07 2rff s LEU 47 Cb -0.10 -1.99 1.55 0.00 0.03 0.00 0.00 46.19 45.69 2rff s LEU 47 CO 0.36 -0.42 2.20 -2.24 0.23 0.00 0.00 176.35 176.48 2rff h ASP 48 N 1.29 0.00 0.14 2.29 2.03 -1.86 -2.05 116.42 118.25 2rff h ASP 48 Ca -0.43 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.87 2rff h ASP 48 Cb 1.26 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.76 2rff h ASP 48 CO 0.60 0.01 -0.11 0.35 -1.03 0.00 0.00 179.24 179.06 2rff n THR 49 N -4.16 0.00 -2.00 1.15 -2.24 -1.26 -4.82 114.28 100.95 2rff n THR 49 Ca -0.03 -0.16 -0.38 0.00 -2.27 0.00 0.00 64.05 61.21 2rff n THR 49 Cb 0.09 0.32 0.02 0.00 -2.10 0.00 0.00 70.33 68.66 2rff n THR 49 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2rff s SER 50 N -2.26 5.68 1.15 3.42 0.01 -0.77 -5.02 113.70 115.92 2rff s SER 50 Ca 0.32 2.56 -0.13 0.00 1.31 0.00 0.00 55.95 60.01 2rff s SER 50 Cb 0.20 -2.62 0.27 0.00 0.21 0.00 0.00 66.02 64.08 2rff s SER 50 CO 0.43 -1.27 1.04 -1.81 0.41 0.00 0.00 173.24 172.03 2rff s ASP 51 N -1.13 1.15 -0.08 2.44 1.01 -1.26 -4.97 116.67 113.83 2rff s ASP 51 Ca 0.68 1.34 0.03 0.00 0.71 0.00 0.00 52.55 55.31 2rff s ASP 51 Cb -0.35 -2.08 -0.02 0.00 1.01 0.00 0.00 42.92 41.48 2rff s ASP 51 CO 0.42 -4.07 -0.18 -0.51 0.21 0.00 0.00 175.17 171.04 2rff s ILE 52 N -2.59 2.70 -0.21 0.77 2.07 -0.65 -4.69 121.20 118.60 2rff s ILE 52 Ca 0.68 -0.83 -0.06 0.00 -1.41 0.00 0.00 60.65 59.03 2rff s ILE 52 Cb -0.23 -2.06 -0.03 0.00 0.13 0.00 0.00 42.46 40.28 2rff s ILE 52 CO 0.63 0.56 0.03 -1.81 -1.91 0.00 0.00 174.94 172.44 2rff s ASP 53 N -0.19 5.06 -0.15 4.50 1.01 -1.26 -1.56 116.67 124.08 2rff s ASP 53 Ca -0.01 -0.14 0.01 0.00 0.71 0.00 0.00 52.55 53.11 2rff s ASP 53 Cb -0.13 -1.87 0.00 0.00 1.01 0.00 0.00 42.92 41.92 2rff s ASP 53 CO 0.03 0.07 -0.17 -0.63 0.21 0.00 0.00 175.17 174.68 2rff s ILE 54 N 1.00 2.47 -0.32 0.77 1.01 -0.29 -1.34 121.20 124.50 2rff s ILE 54 Ca 0.03 -0.83 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 2rff s ILE 54 Cb -0.14 -2.03 -0.01 0.00 0.01 0.00 0.00 42.46 40.28 2rff s ILE 54 CO 0.02 0.52 0.19 -0.22 0.00 0.00 0.00 174.94 175.46 2rff s LEU 55 N 0.87 4.30 -0.16 2.97 2.96 0.43 -1.39 118.68 128.66 2rff s LEU 55 Ca -0.05 -0.45 -0.14 0.00 -0.22 0.00 0.00 54.13 53.27 2rff s LEU 55 Cb -0.15 -2.07 -0.05 0.00 0.50 0.00 0.00 46.19 44.42 2rff s LEU 55 CO -0.02 -0.21 0.30 -0.36 -1.32 0.00 0.00 176.35 174.75 2rff s PHE 56 N 1.67 3.46 -0.22 5.38 0.08 0.09 -1.06 117.98 127.37 2rff s PHE 56 Ca 0.05 0.61 0.02 0.00 0.12 0.00 0.00 56.93 57.73 2rff s PHE 56 Cb -0.17 -2.36 0.04 0.00 -0.57 0.00 0.00 43.02 39.96 2rff s PHE 56 CO 0.08 0.23 -0.15 0.08 -0.10 0.00 0.00 175.22 175.36 2rff s VAL 57 N 0.50 2.12 0.09 -0.44 1.01 0.17 -1.15 120.40 122.69 2rff s VAL 57 Ca 0.17 -1.31 0.06 0.00 0.00 0.00 0.00 61.98 60.90 2rff s VAL 57 Cb -0.13 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 2rff s VAL 57 CO 0.04 0.24 -0.09 -0.36 0.00 0.00 0.00 175.10 174.93 2rff s PHE 58 N 1.19 2.77 0.24 5.22 0.40 -0.49 -0.87 117.98 126.45 2rff s PHE 58 Ca -0.02 -0.14 -0.21 0.00 -0.60 0.00 0.00 56.93 55.96 2rff s PHE 58 Cb -0.17 -1.47 -0.09 0.00 0.51 0.00 0.00 43.02 41.81 2rff s PHE 58 CO -0.09 0.42 0.78 0.15 0.70 0.00 0.00 175.22 177.18 2rff s LYS 59 N -2.08 4.35 -0.96 0.44 1.02 0.76 -1.52 119.74 121.76 2rff s LYS 59 Ca 0.21 1.00 0.00 0.00 0.02 0.00 0.00 55.97 57.19 2rff s LYS 59 Cb -0.11 -2.88 0.00 0.00 -0.52 0.00 0.00 37.83 34.32 2rff s LYS 59 CO 0.13 0.38 0.00 0.41 -0.92 0.00 0.00 175.35 175.34 2rff n GLY 60 N 0.73 0.03 0.39 -3.33 0.00 -1.26 -4.88 105.19 96.87 2rff n GLY 60 Ca -0.01 -0.44 0.07 0.00 0.00 0.00 0.00 46.02 45.64 2rff n GLY 60 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2rff n ILE 61 N -3.89 1.76 -0.34 -0.61 -5.35 -1.26 -4.78 119.36 104.88 2rff n ILE 61 Ca -0.13 -1.78 0.17 0.00 -0.27 0.00 0.00 62.75 60.75 2rff n ILE 61 Cb 0.58 -0.03 0.40 0.00 -1.74 0.00 0.00 39.64 38.85 2rff n ILE 61 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2rff h LYS 62 N 0.83 0.58 -5.04 6.28 1.63 -1.91 -3.45 116.57 115.48 2rff h LYS 62 Ca 0.00 -0.03 -0.70 0.00 -0.85 0.00 0.00 60.65 59.06 2rff h LYS 62 Cb 1.02 -0.13 -0.17 0.00 -0.60 0.00 0.00 32.23 32.36 2rff h LYS 62 CO 0.07 0.38 1.15 -1.21 -3.45 0.00 0.00 179.45 176.39 2rff s GLU 63 N -5.72 3.81 0.26 1.90 2.02 -1.26 -5.06 118.70 114.64 2rff s GLU 63 Ca -0.10 -2.05 0.04 0.00 0.02 0.00 0.00 54.97 52.88 2rff s GLU 63 Cb 0.26 -5.04 -0.06 0.00 0.10 0.00 0.00 34.13 29.40 2rff s GLU 63 CO 0.80 -1.83 -0.00 0.54 0.02 0.00 0.00 175.26 174.79 2rff s ASN 65 N 3.45 2.12 0.48 -0.19 2.20 -1.26 -5.15 114.94 116.59 2rff s ASN 65 Ca 0.39 -1.24 0.15 0.00 -0.94 0.00 0.00 52.86 51.21 2rff s ASN 65 Cb -0.03 -0.04 1.14 0.00 -2.00 0.00 0.00 41.25 40.31 2rff s ASN 65 CO -0.05 -0.49 2.08 1.62 -2.94 0.00 0.00 177.10 177.32 2rff h VAL 66 N 2.37 0.97 -0.03 3.54 3.04 -1.99 -0.65 116.25 123.51 2rff h VAL 66 Ca -0.39 -0.07 -0.15 0.00 -1.01 0.00 0.00 66.70 65.07 2rff h VAL 66 Cb 1.23 0.74 0.01 0.00 -2.01 0.00 0.00 31.29 31.26 2rff h VAL 66 CO 0.66 0.04 -0.58 -0.26 -1.01 0.00 0.00 177.57 176.42 2rff h PHE 67 N 0.22 0.64 -0.89 3.17 0.04 -2.03 -3.14 116.94 114.95 2rff h PHE 67 Ca 0.12 -0.33 -0.02 0.00 2.80 0.00 0.00 57.97 60.55 2rff h PHE 67 Cb 0.22 -0.08 -0.04 0.00 2.20 0.00 0.00 35.95 38.25 2rff h PHE 67 CO -0.00 1.13 0.48 -0.44 -0.60 0.00 0.00 178.31 178.89 2rff h ASP 68 N -0.04 1.12 0.00 2.17 3.32 -1.92 -1.74 116.42 119.32 2rff h ASP 68 Ca -0.06 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.88 2rff h ASP 68 Cb 1.27 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.54 2rff h ASP 68 CO 0.12 0.90 0.00 0.54 -1.72 0.00 0.00 179.24 179.07 2rff n ARG 69 N -4.34 0.09 -3.22 3.56 1.74 -0.29 -4.84 116.66 109.37 2rff n ARG 69 Ca 0.09 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.98 2rff n ARG 69 Cb 0.10 -1.17 -0.05 0.00 -1.02 0.00 0.00 32.46 30.33 2rff n ARG 69 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 2rff n TYR 71 N 0.60 -0.62 0.00 -1.55 9.36 -0.66 -4.79 117.16 119.50 2rff n TYR 71 Ca 0.00 0.34 0.00 0.00 3.32 0.00 0.00 57.90 61.56 2rff n TYR 71 Cb 0.03 -1.15 0.00 0.00 -0.63 0.00 0.00 39.34 37.59 2rff n TYR 71 CO 0.00 0.00 0.00 1.33 0.22 0.00 0.00 176.86 178.41 2rff n VAL 73 N -2.54 0.00 -0.33 2.97 0.24 -1.26 -4.60 118.33 112.80 2rff n VAL 73 Ca -0.03 0.00 0.02 0.00 -2.04 0.00 0.00 64.34 62.29 2rff n VAL 73 Cb 0.28 0.00 0.08 0.00 -1.47 0.00 0.00 33.84 32.74 2rff n VAL 73 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 2rff h SER 74 N 0.00 -1.08 0.58 -1.34 0.87 -1.97 -0.54 113.55 110.07 2rff h SER 74 Ca 0.00 0.28 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 2rff h SER 74 Cb 0.00 0.63 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 2rff h SER 74 CO 0.00 -0.30 0.00 0.08 -0.53 0.00 0.00 176.83 176.08 2rff h ARG 75 N -0.02 0.00 0.00 2.24 0.11 -2.02 -2.27 114.38 112.42 2rff h ARG 75 Ca 0.39 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.47 2rff h ARG 75 Cb 0.64 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.72 2rff h ARG 75 CO -0.93 0.00 -0.48 1.19 0.10 0.00 0.00 179.97 179.85 2rff n PHE 76 N -2.44 0.35 -2.93 4.08 3.72 -0.21 -4.90 117.46 115.13 2rff n PHE 76 Ca 0.01 0.10 -0.40 0.00 -0.05 0.00 0.00 57.45 57.10 2rff n PHE 76 Cb 0.19 -0.53 -0.04 0.00 -0.94 0.00 0.00 39.48 38.16 2rff n PHE 76 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2rff s ILE 77 N -3.09 4.93 0.19 4.37 -1.09 -0.86 -4.85 121.20 120.80 2rff s ILE 77 Ca 0.09 1.68 -0.17 0.00 -2.23 0.00 0.00 60.65 60.02 2rff s ILE 77 Cb 0.15 -4.14 0.02 0.00 -1.58 0.00 0.00 42.46 36.91 2rff s ILE 77 CO 0.69 0.24 0.49 0.00 -1.23 0.00 0.00 174.94 175.13 2rff s ARG 78 N 0.72 1.34 1.60 2.79 3.03 -1.26 -5.06 118.95 122.11 2rff s ARG 78 Ca 0.42 -0.89 0.00 0.00 2.03 0.00 0.00 55.73 57.30 2rff s ARG 78 Cb -0.19 0.50 0.00 0.00 -1.03 0.00 0.00 34.95 34.23 2rff s ARG 78 CO 0.22 -0.56 0.00 0.41 -1.13 0.00 0.00 175.30 174.24 2rff n GLY 79 N -0.32 -1.54 3.02 3.88 0.00 -1.26 -4.35 105.19 104.61 2rff n GLY 79 Ca -0.10 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.20 2rff n GLY 79 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rff n ASN 80 N -0.07 4.97 -4.03 1.61 5.15 -1.26 -4.89 115.26 116.74 2rff n ASN 80 Ca 0.00 -3.04 -0.20 0.00 -0.60 0.00 0.00 54.58 50.74 2rff n ASN 80 Cb 0.00 -1.53 -0.15 0.00 -0.53 0.00 0.00 39.78 37.57 2rff n ASN 80 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2rff s VAL 81 N 1.14 0.81 0.22 3.44 1.01 -1.26 -1.64 120.40 124.12 2rff s VAL 81 Ca 0.42 -0.41 0.06 0.00 0.00 0.00 0.00 61.98 62.05 2rff s VAL 81 Cb 0.07 -0.70 -0.05 0.00 0.00 0.00 0.00 36.38 35.71 2rff s VAL 81 CO -0.00 0.24 -0.10 -0.62 0.00 0.00 0.00 175.10 174.62 2rff s ASP 82 N -0.06 2.37 0.19 3.32 2.15 -0.60 -4.94 116.67 119.10 2rff s ASP 82 Ca 0.01 -1.09 -0.12 0.00 0.43 0.00 0.00 52.55 51.78 2rff s ASP 82 Cb -0.06 -0.10 0.00 0.00 -0.30 0.00 0.00 42.92 42.46 2rff s ASP 82 CO -0.00 -0.29 0.38 -0.72 -0.17 0.00 0.00 175.17 174.37 2rff s TYR 83 N -3.11 0.26 0.02 -5.34 1.13 -1.26 -1.14 117.35 107.90 2rff s TYR 83 Ca 0.24 -0.61 0.02 0.00 -1.41 0.00 0.00 57.07 55.30 2rff s TYR 83 Cb 0.02 0.10 -0.01 0.00 -1.10 0.00 0.00 41.96 40.97 2rff s TYR 83 CO 0.07 -0.82 -0.06 0.42 -2.51 0.00 0.00 175.55 172.65 2rff s ILE 84 N -3.95 0.43 -0.14 -3.49 1.01 -0.48 -4.93 121.20 109.64 2rff s ILE 84 Ca 0.16 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.21 2rff s ILE 84 Cb 0.02 -0.44 0.00 0.00 0.01 0.00 0.00 42.46 42.05 2rff s ILE 84 CO 0.01 -0.13 -0.18 -0.69 0.00 0.00 0.00 174.94 173.95 2rff s VAL 85 N -0.72 2.46 0.08 2.92 1.01 -1.26 -0.73 120.40 124.15 2rff s VAL 85 Ca -0.04 -0.84 0.03 0.00 0.00 0.00 0.00 61.98 61.12 2rff s VAL 85 Cb -0.06 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.27 2rff s VAL 85 CO 0.00 0.53 -0.08 -0.76 0.00 0.00 0.00 175.10 174.79 2rff s LEU 86 N 0.75 2.38 0.56 3.92 1.43 -0.30 -4.99 118.68 122.43 2rff s LEU 86 Ca -0.07 -0.78 -0.15 0.00 -1.03 0.00 0.00 54.13 52.10 2rff s LEU 86 Cb -0.16 -0.18 -0.06 0.00 0.03 0.00 0.00 46.19 45.82 2rff s LEU 86 CO 0.00 -0.30 1.01 -0.62 0.23 0.00 0.00 176.35 176.67 2rff s ASP 87 N -2.31 6.31 0.37 2.29 2.15 -1.26 -1.39 116.67 122.83 2rff s ASP 87 Ca 0.02 1.60 0.15 0.00 0.43 0.00 0.00 52.55 54.75 2rff s ASP 87 Cb -0.03 -2.51 1.02 0.00 -0.30 0.00 0.00 42.92 41.10 2rff s ASP 87 CO -0.01 -0.80 1.76 -0.33 -0.17 0.00 0.00 175.17 175.61 2rff h GLU 88 N 0.53 0.46 0.00 4.34 4.39 -1.61 -0.13 114.58 122.56 2rff h GLU 88 Ca -0.46 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.21 2rff h GLU 88 Cb 1.19 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 2rff h GLU 88 CO 0.60 0.30 0.00 0.41 -1.16 0.00 0.00 179.01 179.17 2rff n GLY 89 N -1.41 -1.12 0.25 -3.84 0.00 -1.26 -3.50 105.19 94.30 2rff n GLY 89 Ca 0.26 -0.09 0.04 0.00 0.00 0.00 0.00 46.02 46.23 2rff n GLY 89 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2rff n GLU 90 N -1.38 1.59 0.28 1.61 1.02 -0.07 -4.75 120.64 118.93 2rff n GLU 90 Ca 0.08 -0.72 0.17 0.00 -0.02 0.00 0.00 57.16 56.68 2rff n GLU 90 Cb 0.21 -1.09 0.93 0.00 -0.02 0.00 0.00 31.44 31.48 2rff n GLU 90 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 2rff h LYS 91 N 1.25 0.00 0.00 3.49 2.10 -1.57 -1.37 116.57 120.47 2rff h LYS 91 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2rff h LYS 91 Cb 0.33 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.66 2rff h LYS 91 CO 0.00 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.05 2rff n ASP 92 N -3.65 0.50 0.28 7.07 5.75 -1.26 -2.70 116.55 122.53 2rff n ASP 92 Ca -0.01 0.67 0.15 0.00 -0.01 0.00 0.00 54.79 55.59 2rff n ASP 92 Cb 0.18 -0.76 0.81 0.00 -1.03 0.00 0.00 41.12 40.32 2rff n ASP 92 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2rff h ARG 93 N 0.00 0.00 -4.78 0.11 3.08 -1.63 -3.37 114.38 107.79 2rff h ARG 93 Ca 0.00 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.37 2rff h ARG 93 Cb 0.17 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 29.98 2rff h ARG 93 CO 0.00 0.08 -0.58 0.08 -1.07 0.00 0.00 179.97 178.47 2rff s VAL 94 N -4.19 4.29 -0.14 2.04 1.01 -1.10 -5.03 120.40 117.28 2rff s VAL 94 Ca -0.03 -0.59 -0.11 0.00 0.00 0.00 0.00 61.98 61.25 2rff s VAL 94 Cb 0.13 -3.22 -0.08 0.00 0.00 0.00 0.00 36.38 33.21 2rff s VAL 94 CO 0.55 0.05 0.07 0.11 0.00 0.00 0.00 175.10 175.88 2rff h LYS 95 N 8.30 0.00 -3.93 2.72 1.79 -1.86 -3.43 116.57 120.16 2rff h LYS 95 Ca -0.31 0.00 -0.77 0.00 -2.18 0.00 0.00 60.65 57.39 2rff h LYS 95 Cb 1.13 0.00 -0.22 0.00 -1.58 0.00 0.00 32.23 31.57 2rff h LYS 95 CO 0.61 0.30 1.16 -0.25 -1.08 0.00 0.00 179.45 180.19 2rff n ASP 96 N -4.64 5.45 -4.30 0.86 8.00 -1.26 -4.96 116.55 115.70 2rff n ASP 96 Ca -0.09 -3.08 -0.18 0.00 0.71 0.00 0.00 54.79 52.15 2rff n ASP 96 Cb 0.28 -1.46 -0.10 0.00 -0.02 0.00 0.00 41.12 39.81 2rff n ASP 96 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2rff s LYS 97 N -0.05 1.20 -0.12 -1.24 -2.85 -1.26 -4.27 119.74 111.15 2rff s LYS 97 Ca 0.37 -1.48 0.02 0.00 -1.00 0.00 0.00 55.97 53.89 2rff s LYS 97 Cb -0.01 -0.98 -0.00 0.00 -2.06 0.00 0.00 37.83 34.77 2rff s LYS 97 CO -0.01 0.16 -0.20 0.08 0.10 0.00 0.00 175.35 175.49 2rff s VAL 98 N -2.82 2.37 -0.00 1.79 1.01 0.32 -4.97 120.40 118.10 2rff s VAL 98 Ca 0.18 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.96 2rff s VAL 98 Cb -0.01 -1.95 -0.06 0.00 0.00 0.00 0.00 36.38 34.36 2rff s VAL 98 CO 0.05 0.54 1.55 -0.22 0.00 0.00 0.00 175.10 177.02 2rff s LEU 99 N 0.50 4.33 -0.19 3.92 2.96 -1.26 -0.95 118.68 127.98 2rff s LEU 99 Ca -0.13 2.26 0.01 0.00 -0.22 0.00 0.00 54.13 56.04 2rff s LEU 99 Cb -0.17 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 42.85 2rff s LEU 99 CO 0.05 -0.84 -0.17 0.33 -1.32 0.00 0.00 176.35 174.40 2rff n PHE 100 N 6.03 0.00 -3.66 5.38 7.35 0.15 -4.71 117.46 127.99 2rff n PHE 100 Ca 0.15 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.69 2rff n PHE 100 Cb 0.42 -0.72 -0.08 0.00 0.35 0.00 0.00 39.48 39.45 2rff n PHE 100 CO 0.00 0.00 0.00 -0.46 -0.76 0.00 0.00 176.76 175.54 2rff s TRP 101 N -2.38 -0.43 -0.08 -5.13 -0.00 -0.89 -1.24 118.94 108.79 2rff s TRP 101 Ca -0.25 0.80 -0.07 0.00 -0.00 0.00 0.00 56.10 56.57 2rff s TRP 101 Cb 0.07 0.23 0.02 0.00 -0.00 0.00 0.00 33.47 33.79 2rff s TRP 101 CO 0.43 -0.45 0.22 0.21 -0.00 0.00 0.00 176.95 177.36 2rff s LYS 102 N -0.99 0.25 0.25 5.86 2.20 -0.93 -0.70 119.74 125.67 2rff s LYS 102 Ca -0.10 0.32 -0.05 0.00 -0.36 0.00 0.00 55.97 55.78 2rff s LYS 102 Cb -0.03 0.10 0.47 0.00 -1.51 0.00 0.00 37.83 36.86 2rff s LYS 102 CO 0.06 -0.04 1.67 -0.09 -0.36 0.00 0.00 175.35 176.59 2rff h ARG 103 N 5.92 0.22 -0.00 4.03 9.65 -1.38 0.23 114.38 133.04 2rff h ARG 103 Ca -0.27 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.60 2rff h ARG 103 Cb 1.19 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.72 2rff h ARG 103 CO 0.37 0.14 -0.02 0.39 2.80 0.00 0.00 179.97 183.65 2rff n GLU 104 N -5.20 0.66 -0.00 0.20 4.71 -1.26 -3.67 120.64 116.08 2rff n GLU 104 Ca 0.14 -0.07 0.00 0.00 -0.01 0.00 0.00 57.16 57.23 2rff n GLU 104 Cb 0.48 -1.50 -0.00 0.00 -1.01 0.00 0.00 31.44 29.41 2rff n GLU 104 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2rff n LYS 105 N -1.11 3.55 0.00 3.49 5.02 -0.18 -5.13 118.16 123.80 2rff n LYS 105 Ca 0.17 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 2rff n LYS 105 Cb 0.22 -0.76 0.00 0.00 -0.02 0.00 0.00 35.03 34.47 2rff n LYS 105 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rff n GLY 106 N 1.72 0.54 3.76 0.72 0.00 0.62 -4.73 105.19 107.82 2rff n GLY 106 Ca 0.00 -0.81 -0.39 0.00 0.00 0.00 0.00 46.02 44.82 2rff n GLY 106 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2rff s PHE 107 N 0.00 3.74 -0.09 1.61 0.08 -1.26 -2.20 117.98 119.86 2rff s PHE 107 Ca 0.00 1.80 -0.23 0.00 0.12 0.00 0.00 56.93 58.63 2rff s PHE 107 Cb 0.00 -3.06 -0.03 0.00 -0.57 0.00 0.00 43.02 39.36 2rff s PHE 107 CO 0.00 0.03 0.67 0.08 -0.10 0.00 0.00 175.22 175.90 2rff s VAL 108 N -1.33 5.05 0.00 -0.44 1.01 -0.37 -4.06 120.40 120.26 2rff s VAL 108 Ca 0.46 1.36 0.00 0.00 0.00 0.00 0.00 61.98 63.80 2rff s VAL 108 Cb -0.25 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.12 2rff s VAL 108 CO 0.32 0.23 0.00 0.18 0.00 0.00 0.00 175.10 175.83 2rff n LEU 109 N 3.98 0.97 0.00 3.92 7.99 -1.26 -4.94 117.00 127.66 2rff n LEU 109 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.98 2rff n LEU 109 Cb 0.51 -2.08 0.00 0.00 -0.11 0.00 0.00 43.42 41.74 2rff n LEU 109 CO 0.46 -0.79 0.10 0.18 -1.51 0.00 0.00 177.39 175.83