#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bay s LEU 2 N 0.00 4.04 0.30 4.03 1.43 -1.26 -4.57 118.68 122.65 2bay s LEU 2 Ca 0.00 0.69 -0.29 0.00 -1.03 0.00 0.00 54.13 53.49 2bay s LEU 2 Cb 0.00 -3.51 -0.11 0.00 0.03 0.00 0.00 46.19 42.60 2bay s LEU 2 CO 0.00 -0.22 1.51 0.00 0.23 0.00 0.00 176.35 177.88 2bay h ALA 4 N 4.42 1.07 0.00 0.00 0.00 -1.65 -0.80 119.26 122.30 2bay h ALA 4 Ca -0.48 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2bay h ALA 4 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2bay h ALA 4 CO 0.75 0.12 -0.46 -0.89 0.00 0.00 0.00 179.25 178.76 2bay n ILE 5 N -3.30 1.03 0.21 0.00 2.08 -1.26 -4.67 119.36 113.45 2bay n ILE 5 Ca -0.00 0.28 0.11 0.00 0.56 0.00 0.00 62.75 63.69 2bay n ILE 5 Cb 0.31 -2.13 0.27 0.00 -0.75 0.00 0.00 39.64 37.34 2bay n ILE 5 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 2bay h SER 6 N -0.71 0.00 -0.02 4.38 4.64 -1.97 -3.47 113.55 116.40 2bay h SER 6 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2bay h SER 6 Cb 0.46 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.55 2bay h SER 6 CO 0.00 0.14 -0.01 0.61 -0.87 0.00 0.00 176.83 176.70 2bay n GLY 7 N 0.81 0.40 3.65 -0.77 0.00 -0.31 -4.97 105.19 103.99 2bay n GLY 7 Ca 0.02 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 2bay n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bay s LYS 8 N -0.72 2.26 0.01 1.61 -0.14 -1.26 -4.74 119.74 116.75 2bay s LYS 8 Ca 0.00 -1.48 -0.30 0.00 -1.36 0.00 0.00 55.97 52.83 2bay s LYS 8 Cb 0.00 -2.12 -0.07 0.00 -1.68 0.00 0.00 37.83 33.95 2bay s LYS 8 CO 0.00 0.31 1.69 0.08 -0.76 0.00 0.00 175.35 176.68 2bay s VAL 9 N -2.36 3.30 0.39 3.17 1.01 -1.26 -0.93 120.40 123.72 2bay s VAL 9 Ca 0.32 0.53 -0.27 0.00 0.00 0.00 0.00 61.98 62.57 2bay s VAL 9 Cb -0.05 -3.34 -0.09 0.00 0.00 0.00 0.00 36.38 32.89 2bay s VAL 9 CO 0.20 -0.03 1.35 -2.84 0.00 0.00 0.00 175.10 173.78 2bay s PRO 10 N 3.54 4.04 0.20 2.72 0.02 -1.26 -4.92 135.00 139.34 2bay s PRO 10 Ca 0.76 2.28 -0.08 0.00 0.02 0.00 0.00 61.00 63.98 2bay s PRO 10 Cb -0.37 -2.85 0.12 0.00 0.02 0.00 0.00 34.50 31.42 2bay s PRO 10 CO 0.32 -0.48 1.66 -0.09 -0.33 0.00 0.00 177.00 178.09 2bay h ARG 11 N 2.84 1.02 -2.76 5.54 2.43 -1.95 -3.38 114.38 118.12 2bay h ARG 11 Ca -0.50 -0.32 -0.60 0.00 -0.81 0.00 0.00 59.98 57.75 2bay h ARG 11 Cb 1.24 -0.10 -0.40 0.00 -0.42 0.00 0.00 29.97 30.30 2bay h ARG 11 CO 0.63 1.00 -0.80 1.03 -1.51 0.00 0.00 179.97 180.33 2bay s ARG 12 N -5.00 1.23 0.27 0.20 0.52 -1.26 -5.08 118.95 109.83 2bay s ARG 12 Ca -0.11 -2.13 -0.29 0.00 -0.52 0.00 0.00 55.73 52.68 2bay s ARG 12 Cb 0.14 -2.07 -0.09 0.00 0.52 0.00 0.00 34.95 33.45 2bay s ARG 12 CO 0.85 -1.25 1.20 -1.25 0.02 0.00 0.00 175.30 174.87 2bay s PRO 13 N 0.11 4.50 0.12 3.54 0.04 -1.26 -1.13 135.00 140.93 2bay s PRO 13 Ca 0.23 1.97 0.01 0.00 0.04 0.00 0.00 61.00 63.25 2bay s PRO 13 Cb -0.13 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.20 2bay s PRO 13 CO -0.08 -0.01 -0.02 0.14 0.04 0.00 0.00 177.00 177.07 2bay s VAL 14 N -0.82 0.54 -0.04 -0.36 -7.23 -0.28 -2.06 120.40 110.16 2bay s VAL 14 Ca 0.49 -1.93 0.05 0.00 -1.81 0.00 0.00 61.98 58.78 2bay s VAL 14 Cb -0.35 -1.86 -0.01 0.00 0.56 0.00 0.00 36.38 34.72 2bay s VAL 14 CO 0.43 -0.70 -0.21 -0.22 -0.31 0.00 0.00 175.10 174.10 2bay s LEU 15 N -3.07 2.00 -0.12 1.32 0.20 0.26 -1.13 118.68 118.14 2bay s LEU 15 Ca 0.17 -0.43 -0.25 0.00 0.69 0.00 0.00 54.13 54.32 2bay s LEU 15 Cb 0.06 -1.16 -0.02 0.00 -0.43 0.00 0.00 46.19 44.64 2bay s LEU 15 CO -0.02 0.21 0.79 -0.55 -0.29 0.00 0.00 176.35 176.50 2bay s SER 16 N -0.14 6.99 0.29 3.68 0.15 -0.81 -1.20 113.70 122.67 2bay s SER 16 Ca -0.02 1.21 0.25 0.00 0.70 0.00 0.00 55.95 58.10 2bay s SER 16 Cb -0.12 -2.45 0.98 0.00 -1.71 0.00 0.00 66.02 62.72 2bay s SER 16 CO 0.02 -0.29 1.76 1.55 1.20 0.00 0.00 173.24 177.48 2bay h PRO 17 N 7.10 0.00 0.10 5.44 0.13 -1.90 0.58 132.00 143.44 2bay h PRO 17 Ca -0.34 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2bay h PRO 17 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2bay h PRO 17 CO 0.80 0.00 -0.05 0.87 -0.23 0.00 0.00 178.00 179.39 2bay h LYS 18 N 0.00 -0.12 -0.01 0.86 1.79 -1.93 -3.34 116.57 113.81 2bay h LYS 18 Ca 0.00 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2bay h LYS 18 Cb 0.48 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 2bay h LYS 18 CO 0.00 0.33 -0.26 -1.13 -1.08 0.00 0.00 179.45 177.30 2bay n SER 19 N -4.82 1.03 -3.98 0.86 3.41 -1.23 -4.95 113.62 103.94 2bay n SER 19 Ca -0.06 -0.89 -0.32 0.00 -0.26 0.00 0.00 58.87 57.34 2bay n SER 19 Cb 0.25 0.14 -0.01 0.00 -0.26 0.00 0.00 64.21 64.33 2bay n SER 19 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2bay n ARG 20 N -0.66 -3.76 -4.59 4.33 1.74 0.19 -4.94 116.66 108.97 2bay n ARG 20 Ca 0.12 0.44 -0.28 0.00 -0.77 0.00 0.00 57.85 57.36 2bay n ARG 20 Cb 0.35 -5.21 -0.14 0.00 -1.02 0.00 0.00 32.46 26.44 2bay n ARG 20 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2bay s THR 21 N -3.20 2.02 0.14 0.55 2.01 -1.21 -4.95 115.64 111.00 2bay s THR 21 Ca 0.66 -1.49 -0.23 0.00 0.31 0.00 0.00 61.69 60.93 2bay s THR 21 Cb -0.35 -1.77 -0.08 0.00 0.01 0.00 0.00 72.50 70.31 2bay s THR 21 CO 0.81 0.18 0.71 -0.63 -0.69 0.00 0.00 174.62 175.01 2bay s ILE 22 N -0.94 4.48 0.06 1.82 -1.09 -1.26 -1.92 121.20 122.35 2bay s ILE 22 Ca 0.11 1.55 0.00 0.00 -2.23 0.00 0.00 60.65 60.08 2bay s ILE 22 Cb -0.10 -4.06 -0.04 0.00 -1.58 0.00 0.00 42.46 36.68 2bay s ILE 22 CO 0.04 0.53 -0.04 -0.36 -1.23 0.00 0.00 174.94 173.87 2bay s PHE 23 N -1.14 0.61 0.18 3.97 0.08 -0.28 -1.60 117.98 119.80 2bay s PHE 23 Ca 0.34 -0.91 -0.31 0.00 0.12 0.00 0.00 56.93 56.17 2bay s PHE 23 Cb -0.22 -0.40 -0.10 0.00 -0.57 0.00 0.00 43.02 41.73 2bay s PHE 23 CO 0.24 -0.26 1.52 -2.00 -0.10 0.00 0.00 175.22 174.61 2bay s GLU 24 N -3.40 4.24 0.14 0.44 2.56 -1.26 -1.12 118.70 120.30 2bay s GLU 24 Ca 0.04 2.32 -0.26 0.00 0.00 0.00 0.00 54.97 57.07 2bay s GLU 24 Cb 0.03 -3.15 -0.01 0.00 2.00 0.00 0.00 34.13 33.01 2bay s GLU 24 CO -0.06 -0.54 1.59 -0.22 -0.56 0.00 0.00 175.26 175.46 2bay h LYS 25 N 6.30 -0.37 -0.26 4.30 3.64 -1.45 -1.49 116.57 127.23 2bay h LYS 25 Ca -0.43 0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 58.90 2bay h LYS 25 Cb 1.21 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 2bay h LYS 25 CO 0.87 -0.24 -0.12 0.77 -2.27 0.00 0.00 179.45 178.46 2bay h SER 26 N -0.38 0.42 -0.27 4.20 0.02 -1.93 -0.65 113.55 114.97 2bay h SER 26 Ca 0.12 -0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 60.89 2bay h SER 26 Cb 0.58 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 2bay h SER 26 CO -0.45 0.57 -0.12 -0.07 -1.14 0.00 0.00 176.83 175.62 2bay h LEU 27 N 0.41 0.56 -0.57 5.07 3.38 -1.72 -0.19 115.31 122.25 2bay h LEU 27 Ca 0.08 -0.40 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 2bay h LEU 27 Cb 0.46 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2bay h LEU 27 CO 0.03 0.84 0.13 0.25 0.09 0.00 0.00 178.44 179.78 2bay h LEU 28 N 0.29 0.87 -1.40 1.67 5.85 -1.07 -2.95 115.31 118.57 2bay h LEU 28 Ca 0.06 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 2bay h LEU 28 Cb 0.62 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2bay h LEU 28 CO 0.04 0.88 0.05 -0.33 -0.34 0.00 0.00 178.44 178.74 2bay h GLU 29 N 0.82 0.45 -0.02 1.25 5.08 -0.97 -0.93 114.58 120.26 2bay h GLU 29 Ca 0.18 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2bay h GLU 29 Cb 0.35 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 2bay h GLU 29 CO 0.00 0.44 0.02 0.37 -1.00 0.00 0.00 179.01 178.84 2bay h GLN 30 N 0.44 0.03 -0.48 2.33 4.15 -0.88 0.57 115.11 121.27 2bay h GLN 30 Ca 0.10 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.52 2bay h GLN 30 Cb 0.21 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.87 2bay h GLN 30 CO -0.00 0.02 0.30 1.88 -1.93 0.00 0.00 178.83 179.11 2bay h TYR 31 N 0.03 0.61 -0.51 3.99 0.05 -1.29 -2.00 116.97 117.85 2bay h TYR 31 Ca 0.01 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.75 2bay h TYR 31 Cb -0.00 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.51 2bay h TYR 31 CO -0.08 0.40 0.13 0.28 -1.05 0.00 0.00 178.16 177.84 2bay h VAL 32 N 0.64 1.24 -0.73 -2.88 2.07 -0.83 0.18 116.25 115.93 2bay h VAL 32 Ca 0.17 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.81 2bay h VAL 32 Cb -0.05 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 2bay h VAL 32 CO -0.04 0.30 0.28 0.11 0.02 0.00 0.00 177.57 178.25 2bay h LYS 33 N 0.70 1.09 0.18 1.57 1.57 -0.81 0.32 116.57 121.19 2bay h LYS 33 Ca 0.16 -0.20 -0.31 0.00 -1.87 0.00 0.00 60.65 58.43 2bay h LYS 33 Cb 0.32 -0.18 0.03 0.00 0.08 0.00 0.00 32.23 32.48 2bay h LYS 33 CO 0.00 0.89 -1.35 0.22 -0.57 0.00 0.00 179.45 178.65 2bay h ASP 34 N 1.07 0.82 0.00 0.86 3.58 -1.06 -3.40 116.42 118.28 2bay h ASP 34 Ca 0.24 -0.81 -0.00 0.00 0.42 0.00 0.00 57.03 56.88 2bay h ASP 34 Cb 0.22 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 2bay h ASP 34 CO -0.02 1.62 -1.06 0.35 -2.88 0.00 0.00 179.24 177.26 2bay n THR 35 N -3.73 0.00 -1.24 2.25 -2.24 0.02 -5.02 114.28 104.32 2bay n THR 35 Ca -0.14 -0.03 -0.08 0.00 -2.27 0.00 0.00 64.05 61.52 2bay n THR 35 Cb 1.04 0.46 -0.04 0.00 -2.10 0.00 0.00 70.33 69.70 2bay n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bay n GLY 36 N 2.43 0.98 3.15 3.38 0.00 0.10 -5.00 105.19 110.22 2bay n GLY 36 Ca -0.00 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.51 2bay n GLY 36 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bay s ASN 37 N -2.62 1.43 0.16 1.61 0.01 -1.26 -0.73 114.94 113.54 2bay s ASN 37 Ca 0.00 -0.64 -0.31 0.00 -0.71 0.00 0.00 52.86 51.19 2bay s ASN 37 Cb 0.00 -0.02 -0.09 0.00 0.41 0.00 0.00 41.25 41.55 2bay s ASN 37 CO 0.00 -0.15 1.49 -0.62 -1.51 0.00 0.00 177.10 176.31 2bay s ASP 38 N -1.86 6.67 0.15 -1.22 2.15 0.80 -4.35 116.67 119.02 2bay s ASP 38 Ca -0.02 2.53 0.25 0.00 0.43 0.00 0.00 52.55 55.74 2bay s ASP 38 Cb -0.08 -2.60 0.92 0.00 -0.30 0.00 0.00 42.92 40.86 2bay s ASP 38 CO 0.01 -0.75 1.76 -0.81 -0.17 0.00 0.00 175.17 175.21 2bay n PRO 39 N 3.71 0.16 -0.04 4.34 -0.04 -1.26 -0.80 135.00 141.07 2bay n PRO 39 Ca 0.12 0.22 -0.21 0.00 -0.04 0.00 0.00 63.50 63.59 2bay n PRO 39 Cb 0.40 -1.72 -0.13 0.00 -0.04 0.00 0.00 33.50 32.01 2bay n PRO 39 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2bay h ILE 40 N 0.00 0.89 0.00 0.52 1.08 -1.98 -3.41 117.51 114.61 2bay h ILE 40 Ca 0.00 -2.29 0.00 0.00 -0.39 0.00 0.00 64.86 62.18 2bay h ILE 40 Cb 0.54 2.47 0.00 0.00 -3.07 0.00 0.00 36.82 36.77 2bay h ILE 40 CO 0.00 0.60 -0.80 0.35 -0.69 0.00 0.00 178.15 177.61 2bay n THR 41 N -4.03 0.00 -1.15 -0.27 -2.24 -1.23 -4.98 114.28 100.38 2bay n THR 41 Ca -0.29 -0.12 -0.05 0.00 -2.27 0.00 0.00 64.05 61.32 2bay n THR 41 Cb 0.84 0.98 -0.02 0.00 -2.10 0.00 0.00 70.33 70.03 2bay n THR 41 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2bay n ASN 42 N -1.40 -5.63 -4.79 3.42 5.15 0.02 -5.00 115.26 107.03 2bay n ASN 42 Ca 0.03 0.13 -0.34 0.00 -0.60 0.00 0.00 54.58 53.80 2bay n ASN 42 Cb 0.26 -3.59 -0.02 0.00 -0.53 0.00 0.00 39.78 35.90 2bay n ASN 42 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2bay s GLU 43 N -2.32 3.68 0.43 1.20 2.02 -1.26 -4.68 118.70 117.78 2bay s GLU 43 Ca 0.00 1.42 -0.25 0.00 0.02 0.00 0.00 54.97 56.16 2bay s GLU 43 Cb 0.00 -2.07 -0.09 0.00 0.10 0.00 0.00 34.13 32.07 2bay s GLU 43 CO 0.00 -0.55 1.31 -2.30 0.02 0.00 0.00 175.26 173.74 2bay n PRO 44 N -1.07 2.00 -3.70 0.39 -0.02 -1.26 -0.14 135.00 131.20 2bay n PRO 44 Ca 0.10 0.71 -0.11 0.00 -2.02 0.00 0.00 63.50 62.18 2bay n PRO 44 Cb 0.52 -2.45 -0.11 0.00 -0.02 0.00 0.00 33.50 31.44 2bay n PRO 44 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2bay s LEU 45 N -1.95 -0.01 0.26 2.45 2.96 0.09 -4.65 118.68 117.83 2bay s LEU 45 Ca 0.61 0.80 0.06 0.00 -0.22 0.00 0.00 54.13 55.38 2bay s LEU 45 Cb -0.49 1.17 -0.03 0.00 0.50 0.00 0.00 46.19 47.34 2bay s LEU 45 CO 0.58 -0.19 0.33 -0.94 -1.32 0.00 0.00 176.35 174.80 2bay s SER 46 N 1.47 6.01 0.28 3.68 1.04 -1.26 -4.09 113.70 120.83 2bay s SER 46 Ca -0.09 -0.08 -0.03 0.00 0.48 0.00 0.00 55.95 56.23 2bay s SER 46 Cb -0.09 -1.62 0.38 0.00 0.10 0.00 0.00 66.02 64.79 2bay s SER 46 CO -0.12 -0.12 1.94 0.40 0.98 0.00 0.00 173.24 176.32 2bay h ILE 47 N 1.23 1.20 0.00 -1.02 1.08 -1.97 -2.09 117.51 115.93 2bay h ILE 47 Ca -0.50 -0.42 -0.02 0.00 -0.39 0.00 0.00 64.86 63.54 2bay h ILE 47 Cb 1.24 -0.12 -0.00 0.00 -3.07 0.00 0.00 36.82 34.86 2bay h ILE 47 CO 0.60 0.22 -0.07 -0.33 -0.69 0.00 0.00 178.15 177.88 2bay h GLU 48 N 1.22 0.00 0.00 2.37 3.07 -2.05 -2.61 114.58 116.58 2bay h GLU 48 Ca 0.35 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 2bay h GLU 48 Cb -0.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.84 2bay h GLU 48 CO -0.09 0.07 -0.23 0.93 -1.40 0.00 0.00 179.01 178.29 2bay h GLU 49 N 0.00 0.00 -6.92 2.33 5.08 -1.78 -3.46 114.58 109.83 2bay h GLU 49 Ca -0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 2bay h GLU 49 Cb 0.45 0.00 0.09 0.00 0.50 0.00 0.00 28.75 29.80 2bay h GLU 49 CO 0.01 0.00 0.75 0.42 -1.00 0.00 0.00 179.01 179.19 2bay s ILE 50 N -3.22 2.23 -0.40 3.13 1.01 -0.98 -4.48 121.20 118.48 2bay s ILE 50 Ca 0.06 0.23 -0.12 0.00 0.00 0.00 0.00 60.65 60.82 2bay s ILE 50 Cb 0.08 -3.15 0.04 0.00 0.01 0.00 0.00 42.46 39.44 2bay s ILE 50 CO 0.68 0.05 0.26 -0.69 0.00 0.00 0.00 174.94 175.25 2bay s VAL 51 N -1.08 4.72 0.19 2.92 1.01 -0.34 -4.97 120.40 122.85 2bay s VAL 51 Ca 0.52 -0.97 -0.30 0.00 0.00 0.00 0.00 61.98 61.23 2bay s VAL 51 Cb -0.45 -3.71 -0.08 0.00 0.00 0.00 0.00 36.38 32.14 2bay s VAL 51 CO 0.60 -0.36 1.04 -1.61 0.00 0.00 0.00 175.10 174.78 2bay s GLU 52 N 1.56 4.67 -0.19 2.72 2.02 -1.26 -0.57 118.70 127.65 2bay s GLU 52 Ca 0.03 1.63 -0.12 0.00 0.02 0.00 0.00 54.97 56.53 2bay s GLU 52 Cb -0.21 -3.29 -0.05 0.00 0.10 0.00 0.00 34.13 30.69 2bay s GLU 52 CO 0.06 0.19 0.21 0.42 0.02 0.00 0.00 175.26 176.17 2bay s ILE 53 N -0.45 5.35 -0.01 -1.63 1.01 -0.87 -4.94 121.20 119.66 2bay s ILE 53 Ca 0.47 0.35 -0.30 0.00 0.00 0.00 0.00 60.65 61.17 2bay s ILE 53 Cb -0.28 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 2bay s ILE 53 CO 0.34 0.40 1.23 -0.69 0.00 0.00 0.00 174.94 176.22 2bay s VAL 54 N 0.55 4.12 0.90 2.92 1.01 -1.26 -4.72 120.40 123.91 2bay s VAL 54 Ca 0.12 1.48 -0.10 0.00 0.00 0.00 0.00 61.98 63.47 2bay s VAL 54 Cb -0.12 -3.95 0.13 0.00 0.00 0.00 0.00 36.38 32.44 2bay s VAL 54 CO 0.01 0.03 1.13 -2.84 0.00 0.00 0.00 175.10 173.43 2bay s PRO 55 N 1.92 1.18 0.00 2.72 0.02 -1.26 -5.13 135.00 134.45 2bay s PRO 55 Ca 0.58 1.41 0.12 0.00 0.02 0.00 0.00 61.00 63.13 2bay s PRO 55 Cb -0.27 -1.76 0.72 0.00 0.02 0.00 0.00 34.50 33.22 2bay s PRO 55 CO 0.25 -2.47 1.16 0.43 -0.33 0.00 0.00 177.00 176.03