#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fbc s LEU 1 N 0.00 4.39 0.32 0.99 1.43 -1.26 -3.17 118.68 121.38 3fbc s LEU 1 Ca 0.00 2.64 0.08 0.00 -1.03 0.00 0.00 54.13 55.82 3fbc s LEU 1 Cb 0.00 -3.62 -0.06 0.00 0.03 0.00 0.00 46.19 42.54 3fbc s LEU 1 CO 0.00 -0.68 -0.08 -1.10 0.23 0.00 0.00 176.35 174.72 3fbc s GLN 2 N -0.37 1.72 0.11 1.70 -0.21 -1.03 -4.91 119.66 116.66 3fbc s GLN 2 Ca 0.59 -1.88 0.10 0.00 0.02 0.00 0.00 55.36 54.18 3fbc s GLN 2 Cb -0.41 -1.50 -0.04 0.00 1.00 0.00 0.00 33.01 32.06 3fbc s GLN 2 CO 0.43 0.10 -0.22 1.03 -2.12 0.00 0.00 175.29 174.51 3fbc s ARG 3 N -3.65 1.67 0.08 2.91 1.81 -1.26 -2.31 118.95 118.19 3fbc s ARG 3 Ca 0.31 -1.22 -0.02 0.00 -1.72 0.00 0.00 55.73 53.08 3fbc s ARG 3 Cb 0.03 -2.03 -0.03 0.00 -0.45 0.00 0.00 34.95 32.47 3fbc s ARG 3 CO 0.15 0.48 0.03 -0.08 -0.68 0.00 0.00 175.30 175.20 3fbc s THR 4 N -1.05 0.18 -0.15 0.02 -1.32 -0.36 -4.74 115.64 108.21 3fbc s THR 4 Ca 0.15 -1.72 -0.04 0.00 -1.21 0.00 0.00 61.69 58.87 3fbc s THR 4 Cb -0.10 -1.62 -0.03 0.00 -1.51 0.00 0.00 72.50 69.24 3fbc s THR 4 CO 0.07 -0.81 0.00 -0.22 -2.21 0.00 0.00 174.62 171.46 3fbc s LEU 5 N -2.94 3.50 0.03 9.08 2.96 -1.26 -1.28 118.68 128.77 3fbc s LEU 5 Ca 0.11 -0.00 0.09 0.00 -0.22 0.00 0.00 54.13 54.10 3fbc s LEU 5 Cb 0.07 -1.85 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 3fbc s LEU 5 CO -0.07 0.22 -0.26 -0.69 -1.32 0.00 0.00 176.35 174.22 3fbc s VAL 6 N 0.09 2.09 -0.13 1.68 1.01 0.24 -1.97 120.40 123.42 3fbc s VAL 6 Ca 0.02 -1.32 0.03 0.00 0.00 0.00 0.00 61.98 60.70 3fbc s VAL 6 Cb -0.13 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.48 3fbc s VAL 6 CO 0.02 0.40 -0.22 -0.76 0.00 0.00 0.00 175.10 174.54 3fbc s LEU 7 N -1.11 2.13 -0.33 3.92 1.43 0.63 -1.13 118.68 124.23 3fbc s LEU 7 Ca 0.11 -0.58 -0.23 0.00 -1.03 0.00 0.00 54.13 52.41 3fbc s LEU 7 Cb -0.10 -1.44 0.00 0.00 0.03 0.00 0.00 46.19 44.68 3fbc s LEU 7 CO 0.01 0.11 0.75 -0.63 0.23 0.00 0.00 176.35 176.82 3fbc s ILE 8 N 0.66 4.81 0.84 -0.59 -1.09 0.12 -0.32 121.20 125.63 3fbc s ILE 8 Ca -0.11 0.99 -0.12 0.00 -2.23 0.00 0.00 60.65 59.18 3fbc s ILE 8 Cb -0.16 -4.13 0.10 0.00 -1.58 0.00 0.00 42.46 36.68 3fbc s ILE 8 CO 0.02 -0.29 1.18 -0.54 -1.23 0.00 0.00 174.94 174.08 3fbc s LYS 9 N 2.92 1.72 0.34 2.79 1.02 0.17 -2.16 119.74 126.55 3fbc s LYS 9 Ca 0.30 0.11 0.08 0.00 0.02 0.00 0.00 55.97 56.48 3fbc s LYS 9 Cb -0.14 -1.92 0.62 0.00 -0.52 0.00 0.00 37.83 35.87 3fbc s LYS 9 CO 0.14 -1.76 1.81 -1.35 -0.92 0.00 0.00 175.35 173.27 3fbc h PRO 10 N -1.18 0.26 -0.61 -1.68 0.11 -1.85 -2.33 132.00 124.72 3fbc h PRO 10 Ca -0.47 -0.08 0.02 0.00 0.11 0.00 0.00 66.00 65.58 3fbc h PRO 10 Cb 1.32 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.38 3fbc h PRO 10 CO 0.63 0.50 0.40 0.38 -0.21 0.00 0.00 178.00 179.70 3fbc h ASP 11 N 0.23 0.64 -0.99 -2.05 2.03 -1.91 -1.02 116.42 113.36 3fbc h ASP 11 Ca 0.04 -0.01 0.01 0.00 -0.73 0.00 0.00 57.03 56.34 3fbc h ASP 11 Cb 0.57 -0.15 -0.05 0.00 -0.83 0.00 0.00 39.33 38.87 3fbc h ASP 11 CO 0.04 0.45 0.66 0.00 -1.03 0.00 0.00 179.24 179.36 3fbc h ALA 12 N 1.64 1.30 -0.26 4.15 0.00 -1.67 -0.09 119.26 124.32 3fbc h ALA 12 Ca 0.24 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 3fbc h ALA 12 Cb 0.02 -0.40 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 3fbc h ALA 12 CO -0.06 0.65 -0.56 0.74 0.00 0.00 0.00 179.25 180.02 3fbc h PHE 13 N 1.34 1.01 -0.13 0.00 -1.00 -1.32 0.91 116.94 117.75 3fbc h PHE 13 Ca 0.36 -0.36 -0.01 0.00 2.81 0.00 0.00 57.97 60.77 3fbc h PHE 13 Cb -0.15 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 39.22 3fbc h PHE 13 CO -0.00 1.18 0.05 1.49 -1.61 0.00 0.00 178.31 179.42 3fbc h GLU 14 N 0.61 0.19 -0.04 1.51 4.22 -0.87 -2.70 114.58 117.49 3fbc h GLU 14 Ca 0.01 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.42 3fbc h GLU 14 Cb 1.16 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3fbc h GLU 14 CO 0.12 0.28 0.00 0.54 -2.18 0.00 0.00 179.01 177.77 3fbc n ARG 15 N -4.90 1.26 -3.48 1.92 1.74 -0.08 -4.94 116.66 108.19 3fbc n ARG 15 Ca -0.05 -0.39 -0.21 0.00 -0.77 0.00 0.00 57.85 56.44 3fbc n ARG 15 Cb 0.11 -1.38 0.08 0.00 -1.02 0.00 0.00 32.46 30.25 3fbc n ARG 15 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3fbc n SER 16 N -0.44 -4.96 -0.44 0.55 7.64 -0.44 -4.91 113.62 110.62 3fbc n SER 16 Ca 0.17 -0.53 0.09 0.00 1.01 0.00 0.00 58.87 59.61 3fbc n SER 16 Cb 0.17 -4.78 0.19 0.00 -1.01 0.00 0.00 64.21 58.78 3fbc n SER 16 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3fbc n LEU 17 N -4.50 3.01 0.05 -3.43 4.77 0.19 -4.70 117.00 112.38 3fbc n LEU 17 Ca -0.07 -2.98 -0.12 0.00 -0.03 0.00 0.00 56.01 52.81 3fbc n LEU 17 Cb 0.59 -0.45 -0.08 0.00 -2.33 0.00 0.00 43.42 41.15 3fbc n LEU 17 CO 0.60 0.69 0.81 0.58 -1.33 0.00 0.00 177.39 178.74 3fbc h VAL 18 N 0.84 1.03 -0.44 4.08 2.07 -1.91 -1.47 116.25 120.46 3fbc h VAL 18 Ca 0.00 -0.20 -0.09 0.00 0.82 0.00 0.00 66.70 67.22 3fbc h VAL 18 Cb 1.16 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.08 3fbc h VAL 18 CO 0.10 0.05 -0.10 0.00 0.02 0.00 0.00 177.57 177.63 3fbc h ALA 19 N 0.82 1.00 -0.38 1.67 0.00 -1.94 -2.03 119.26 118.40 3fbc h ALA 19 Ca -0.01 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.63 3fbc h ALA 19 Cb 0.12 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 3fbc h ALA 19 CO 0.01 0.60 0.17 1.49 0.00 0.00 0.00 179.25 181.52 3fbc h GLU 20 N 0.71 0.34 0.36 0.00 4.57 -1.83 0.61 114.58 119.34 3fbc h GLU 20 Ca 0.12 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.26 3fbc h GLU 20 Cb 0.58 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.10 3fbc h GLU 20 CO 0.04 0.23 -0.17 0.82 -1.18 0.00 0.00 179.01 178.74 3fbc h ILE 21 N 0.35 0.54 -0.36 2.32 2.04 -1.06 -2.79 117.51 118.54 3fbc h ILE 21 Ca 0.17 -0.62 0.10 0.00 1.00 0.00 0.00 64.86 65.51 3fbc h ILE 21 Cb 0.10 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 3fbc h ILE 21 CO -0.14 0.10 0.32 0.24 0.00 0.00 0.00 178.15 178.68 3fbc h MET 22 N -0.89 0.00 -0.27 2.37 2.86 -1.34 -2.26 114.93 115.40 3fbc h MET 22 Ca -0.05 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 3fbc h MET 22 Cb 0.54 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 3fbc h MET 22 CO 0.08 0.00 -0.12 0.78 1.06 0.00 0.00 176.91 178.71 3fbc h GLY 23 N 0.00 0.61 1.43 8.32 0.00 -0.62 -0.12 103.07 112.68 3fbc h GLY 23 Ca 0.17 -0.54 -0.03 0.00 0.00 0.00 0.00 47.33 46.94 3fbc h GLY 23 CO -0.00 0.49 0.21 3.21 0.00 0.00 0.00 176.54 180.45 3fbc h ARG 24 N 0.30 0.74 -0.09 4.80 3.08 -1.15 0.27 114.38 122.32 3fbc h ARG 24 Ca 0.06 -0.10 -0.23 0.00 0.07 0.00 0.00 59.98 59.78 3fbc h ARG 24 Cb 0.63 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.55 3fbc h ARG 24 CO 0.04 0.60 -0.85 0.82 -1.07 0.00 0.00 179.97 179.52 3fbc h ILE 25 N 0.73 1.31 -0.43 2.04 2.04 -1.47 -2.62 117.51 119.11 3fbc h ILE 25 Ca 0.18 -2.11 -0.01 0.00 1.00 0.00 0.00 64.86 63.92 3fbc h ILE 25 Cb 0.14 2.13 -0.02 0.00 -0.74 0.00 0.00 36.82 38.33 3fbc h ILE 25 CO -0.02 0.66 0.23 -0.08 0.00 0.00 0.00 178.15 178.93 3fbc h GLU 26 N 0.43 0.60 0.00 2.37 4.81 -0.36 -2.66 114.58 119.78 3fbc h GLU 26 Ca -0.07 -0.08 -0.02 0.00 -0.13 0.00 0.00 59.36 59.07 3fbc h GLU 26 Cb 1.47 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.73 3fbc h GLU 26 CO 0.16 0.50 -0.07 0.87 -0.73 0.00 0.00 179.01 179.74 3fbc h LYS 27 N 0.55 0.00 -0.16 1.92 1.57 -0.46 -0.81 116.57 119.19 3fbc h LYS 27 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3fbc h LYS 27 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3fbc h LYS 27 CO -0.02 0.07 0.00 1.17 -0.57 0.00 0.00 179.45 180.10 3fbc n LYS 28 N -3.26 1.36 -2.00 3.15 4.81 -0.99 -4.90 118.16 116.33 3fbc n LYS 28 Ca -0.00 -0.56 -0.05 0.00 -0.87 0.00 0.00 58.31 56.83 3fbc n LYS 28 Cb 0.29 -1.12 -0.00 0.00 0.02 0.00 0.00 35.03 34.22 3fbc n LYS 28 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 3fbc n ASN 29 N -0.05 -2.30 -4.85 3.14 4.05 -0.31 -5.05 115.26 109.90 3fbc n ASN 29 Ca 0.05 0.01 -0.37 0.00 0.45 0.00 0.00 54.58 54.72 3fbc n ASN 29 Cb 0.13 -1.54 -0.06 0.00 1.23 0.00 0.00 39.78 39.55 3fbc n ASN 29 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 3fbc s PHE 30 N -2.24 3.67 0.04 1.20 0.40 -1.07 -4.89 117.98 115.09 3fbc s PHE 30 Ca 0.00 0.82 0.01 0.00 -0.60 0.00 0.00 56.93 57.16 3fbc s PHE 30 Cb 0.00 -2.16 -0.04 0.00 0.51 0.00 0.00 43.02 41.33 3fbc s PHE 30 CO 0.00 0.67 0.09 0.15 0.70 0.00 0.00 175.22 176.82 3fbc s LYS 31 N -1.15 3.00 -0.12 0.44 -0.14 -0.36 -4.51 119.74 116.90 3fbc s LYS 31 Ca 0.22 -0.58 -0.29 0.00 -1.36 0.00 0.00 55.97 53.97 3fbc s LYS 31 Cb -0.15 -2.81 -0.01 0.00 -1.68 0.00 0.00 37.83 33.18 3fbc s LYS 31 CO 0.11 0.61 0.97 0.42 -0.76 0.00 0.00 175.35 176.70 3fbc s ILE 32 N -1.30 4.80 -0.23 2.17 1.01 -1.26 -0.12 121.20 126.28 3fbc s ILE 32 Ca 0.26 1.96 -0.09 0.00 0.00 0.00 0.00 60.65 62.79 3fbc s ILE 32 Cb -0.12 -4.28 -0.11 0.00 0.01 0.00 0.00 42.46 37.96 3fbc s ILE 32 CO 0.18 0.01 -0.28 0.52 0.00 0.00 0.00 174.94 175.37 3fbc n VAL 33 N 4.57 1.29 -4.19 2.92 0.31 0.00 -4.94 118.33 118.30 3fbc n VAL 33 Ca 0.08 -0.36 -0.18 0.00 -0.01 0.00 0.00 64.34 63.87 3fbc n VAL 33 Cb 0.49 -1.72 -0.12 0.00 -0.91 0.00 0.00 33.84 31.59 3fbc n VAL 33 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3fbc s SER 34 N -6.94 1.75 -0.23 4.52 0.01 -1.18 -4.97 113.70 106.68 3fbc s SER 34 Ca -0.32 -0.70 -0.17 0.00 1.31 0.00 0.00 55.95 56.07 3fbc s SER 34 Cb 0.12 -0.05 0.07 0.00 0.21 0.00 0.00 66.02 66.36 3fbc s SER 34 CO 0.43 -0.12 0.59 -0.32 0.41 0.00 0.00 173.24 174.23 3fbc s MET 35 N -2.14 0.63 -0.02 12.44 0.00 -1.26 -0.72 119.30 128.23 3fbc s MET 35 Ca 0.02 0.96 0.03 0.00 0.00 0.00 0.00 55.69 56.69 3fbc s MET 35 Cb -0.08 0.19 0.00 0.00 0.00 0.00 0.00 34.83 34.95 3fbc s MET 35 CO 0.02 -0.12 -0.09 0.15 0.00 0.00 0.00 175.02 174.98 3fbc s LYS 36 N 1.01 0.98 -0.23 4.11 1.02 0.54 -5.00 119.74 122.17 3fbc s LYS 36 Ca -0.06 -0.32 -0.11 0.00 0.02 0.00 0.00 55.97 55.51 3fbc s LYS 36 Cb -0.05 -0.92 -0.05 0.00 -0.52 0.00 0.00 37.83 36.29 3fbc s LYS 36 CO -0.09 0.13 0.16 0.12 -0.92 0.00 0.00 175.35 174.75 3fbc s PHE 37 N 0.14 3.34 -0.24 3.18 5.36 -1.26 -1.15 117.98 127.35 3fbc s PHE 37 Ca -0.02 0.27 -0.01 0.00 -0.96 0.00 0.00 56.93 56.21 3fbc s PHE 37 Cb -0.08 -2.25 0.02 0.00 -0.34 0.00 0.00 43.02 40.37 3fbc s PHE 37 CO 0.00 0.12 -0.08 -1.58 -1.46 0.00 0.00 175.22 172.23 3fbc s TRP 38 N 0.88 3.04 0.31 10.12 0.52 -0.30 -4.98 118.94 128.52 3fbc s TRP 38 Ca 0.08 -1.56 0.00 0.00 0.02 0.00 0.00 56.10 54.64 3fbc s TRP 38 Cb -0.13 -2.04 0.50 0.00 -1.15 0.00 0.00 33.47 30.65 3fbc s TRP 38 CO 0.03 -0.73 1.92 0.66 0.02 0.00 0.00 176.95 178.84 3fbc h SER 39 N 8.00 0.77 -2.73 2.95 4.64 -1.92 -0.91 113.55 124.35 3fbc h SER 39 Ca -0.34 -0.08 -0.27 0.00 -0.47 0.00 0.00 61.79 60.63 3fbc h SER 39 Cb 1.11 -0.20 -0.35 0.00 -0.31 0.00 0.00 62.40 62.66 3fbc h SER 39 CO 0.58 0.66 -0.59 -0.75 -0.87 0.00 0.00 176.83 175.85 3fbc s LYS 40 N -5.50 0.15 0.19 4.77 2.20 -1.26 -2.86 119.74 117.43 3fbc s LYS 40 Ca -0.10 0.47 -0.30 0.00 -0.36 0.00 0.00 55.97 55.68 3fbc s LYS 40 Cb 0.17 -0.60 -0.08 0.00 -1.51 0.00 0.00 37.83 35.80 3fbc s LYS 40 CO 0.78 -0.46 1.27 0.00 -0.36 0.00 0.00 175.35 176.58 3fbc s ALA 41 N 2.36 3.49 0.42 3.13 0.00 -1.26 -4.96 121.76 124.94 3fbc s ALA 41 Ca 0.04 1.05 -0.25 0.00 0.00 0.00 0.00 51.96 52.80 3fbc s ALA 41 Cb -0.14 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.43 3fbc s ALA 41 CO -0.10 -0.48 1.24 -2.30 0.00 0.00 0.00 175.76 174.12 3fbc n PRO 42 N 2.60 1.85 0.20 0.00 -0.02 -1.26 -4.86 135.00 133.52 3fbc n PRO 42 Ca 0.05 0.66 0.05 0.00 -2.02 0.00 0.00 63.50 62.25 3fbc n PRO 42 Cb 0.43 -2.33 0.42 0.00 -0.02 0.00 0.00 33.50 32.00 3fbc n PRO 42 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3fbc h ARG 43 N 2.02 0.00 0.00 -0.52 2.43 -1.98 -2.74 114.38 113.59 3fbc h ARG 43 Ca -0.47 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 58.53 3fbc h ARG 43 Cb 1.30 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.83 3fbc h ARG 43 CO 0.60 0.33 -0.81 -2.95 -1.51 0.00 0.00 179.97 175.63 3fbc h ASN 44 N 0.00 0.03 -0.15 -3.80 -1.07 -1.98 -0.36 115.58 108.25 3fbc h ASN 44 Ca -0.00 -0.02 -0.00 0.00 0.07 0.00 0.00 56.30 56.34 3fbc h ASN 44 Cb 0.68 -0.01 -0.01 0.00 -2.07 0.00 0.00 38.32 36.92 3fbc h ASN 44 CO 0.04 0.82 0.08 -0.07 0.07 0.00 0.00 177.43 178.38 3fbc h LEU 45 N 0.01 0.18 -0.50 6.14 4.07 -1.87 0.17 115.31 123.52 3fbc h LEU 45 Ca -0.01 -0.07 0.02 0.00 0.08 0.00 0.00 57.88 57.90 3fbc h LEU 45 Cb 1.42 -0.05 -0.03 0.00 1.08 0.00 0.00 40.66 43.08 3fbc h LEU 45 CO 0.11 0.19 0.30 0.40 -1.08 0.00 0.00 178.44 178.36 3fbc h ILE 46 N 0.15 1.07 -0.33 1.22 1.08 -1.34 0.10 117.51 119.45 3fbc h ILE 46 Ca 0.05 -0.21 -0.11 0.00 -0.39 0.00 0.00 64.86 64.20 3fbc h ILE 46 Cb 0.05 0.41 -0.01 0.00 -3.07 0.00 0.00 36.82 34.20 3fbc h ILE 46 CO -0.01 0.11 -0.27 -0.33 -0.69 0.00 0.00 178.15 176.96 3fbc h GLU 47 N 0.61 0.66 -0.12 2.37 5.08 -0.84 -1.68 114.58 120.66 3fbc h GLU 47 Ca 0.20 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3fbc h GLU 47 Cb -0.00 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3fbc h GLU 47 CO -0.08 0.86 0.05 1.96 -1.00 0.00 0.00 179.01 180.80 3fbc h GLN 48 N 0.57 0.18 -0.47 2.33 4.20 -0.49 -2.26 115.11 119.18 3fbc h GLN 48 Ca 0.07 -0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.81 3fbc h GLN 48 Cb 0.76 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.48 3fbc h GLN 48 CO 0.06 0.28 0.32 1.25 -0.67 0.00 0.00 178.83 180.07 3fbc h HIS 49 N 0.04 0.40 -0.33 2.96 2.76 -0.61 -1.70 115.15 118.67 3fbc h HIS 49 Ca 0.04 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 3fbc h HIS 49 Cb 0.17 -0.13 0.00 0.00 1.55 0.00 0.00 27.41 28.99 3fbc h HIS 49 CO -0.02 0.22 0.00 0.66 -1.30 0.00 0.00 177.93 177.49 3fbc n TYR 50 N -4.48 1.09 -0.21 5.26 4.02 -0.66 -4.76 117.16 117.41 3fbc n TYR 50 Ca 0.06 -0.81 0.19 0.00 -0.01 0.00 0.00 57.90 57.33 3fbc n TYR 50 Cb 0.24 -0.31 0.53 0.00 -0.02 0.00 0.00 39.34 39.78 3fbc n TYR 50 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 3fbc h LYS 51 N 2.24 0.35 0.00 -0.72 2.10 -0.68 0.72 116.57 120.59 3fbc h LYS 51 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 3fbc h LYS 51 Cb 1.46 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.71 3fbc h LYS 51 CO 0.24 0.23 0.00 0.39 -2.00 0.00 0.00 179.45 178.32 3fbc n GLU 52 N -4.48 0.13 0.00 0.07 1.02 -1.26 -1.82 120.64 114.30 3fbc n GLU 52 Ca 0.18 0.57 0.11 0.00 -0.02 0.00 0.00 57.16 58.00 3fbc n GLU 52 Cb 0.68 -1.89 0.05 0.00 -0.02 0.00 0.00 31.44 30.26 3fbc n GLU 52 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3fbc n HIS 53 N -2.16 0.00 0.31 -0.32 8.25 0.25 -4.68 115.22 116.86 3fbc n HIS 53 Ca -0.00 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 57.63 3fbc n HIS 53 Cb 0.07 0.00 0.89 0.00 1.12 0.00 0.00 29.99 32.07 3fbc n HIS 53 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3fbc h SER 54 N 3.55 0.00 0.19 0.41 4.64 -1.37 -1.81 113.55 119.16 3fbc h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fbc h SER 54 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 3fbc h SER 54 CO 0.00 0.00 -0.90 -0.62 -0.87 0.00 0.00 176.83 174.44 3fbc n GLU 55 N -3.05 0.06 -2.20 4.77 -0.58 -1.26 -4.92 120.64 113.45 3fbc n GLU 55 Ca -0.01 -0.01 -0.33 0.00 -0.42 0.00 0.00 57.16 56.39 3fbc n GLU 55 Cb 0.34 -1.51 -0.00 0.00 -0.57 0.00 0.00 31.44 29.69 3fbc n GLU 55 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3fbc s GLN 56 N -3.04 3.50 0.17 3.49 -1.52 -0.68 -4.95 119.66 116.62 3fbc s GLN 56 Ca 0.08 1.21 -0.15 0.00 -1.95 0.00 0.00 55.36 54.54 3fbc s GLN 56 Cb 0.16 -2.06 0.12 0.00 -0.22 0.00 0.00 33.01 31.01 3fbc s GLN 56 CO 0.81 -0.66 1.71 0.66 -0.25 0.00 0.00 175.29 177.56 3fbc h SER 57 N 0.74 -0.11 0.44 5.90 4.64 -1.93 -2.48 113.55 120.75 3fbc h SER 57 Ca -0.47 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 3fbc h SER 57 Cb 1.22 0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 3fbc h SER 57 CO 0.58 -0.02 0.00 0.00 -0.87 0.00 0.00 176.83 176.52 3fbc n TYR 58 N -5.16 0.00 -0.23 4.77 0.18 -1.26 -4.16 117.16 111.29 3fbc n TYR 58 Ca 0.03 0.00 0.04 0.00 1.88 0.00 0.00 57.90 59.85 3fbc n TYR 58 Cb 0.21 -0.45 0.15 0.00 -0.38 0.00 0.00 39.34 38.86 3fbc n TYR 58 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 3fbc h PHE 59 N 0.00 0.13 -0.25 -3.48 3.04 -1.69 -1.17 116.94 113.53 3fbc h PHE 59 Ca 0.00 0.04 -0.17 0.00 3.98 0.00 0.00 57.97 61.82 3fbc h PHE 59 Cb 0.22 0.05 -0.00 0.00 2.56 0.00 0.00 35.95 38.77 3fbc h PHE 59 CO 0.00 -0.13 -0.53 -0.91 -2.02 0.00 0.00 178.31 174.72 3fbc h ASN 60 N 0.20 0.80 -0.33 0.41 2.35 -1.83 -2.53 115.58 114.65 3fbc h ASN 60 Ca 0.38 -0.42 -0.13 0.00 -0.55 0.00 0.00 56.30 55.57 3fbc h ASN 60 Cb 0.64 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 3fbc h ASN 60 CO -0.53 1.18 -0.29 0.44 -1.65 0.00 0.00 177.43 176.58 3fbc h ASP 61 N 0.56 0.88 -0.16 5.81 3.32 -1.67 -1.21 116.42 123.95 3fbc h ASP 61 Ca 0.02 -0.35 0.03 0.00 0.02 0.00 0.00 57.03 56.74 3fbc h ASP 61 Cb 1.10 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.38 3fbc h ASP 61 CO 0.11 1.11 -0.02 0.25 -1.72 0.00 0.00 179.24 178.96 3fbc h LEU 62 N 0.72 -0.11 -0.68 1.55 5.85 -1.21 0.60 115.31 122.04 3fbc h LEU 62 Ca 0.08 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 3fbc h LEU 62 Cb 0.84 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 3fbc h LEU 62 CO 0.07 -0.03 -0.12 0.00 -0.34 0.00 0.00 178.44 178.01 3fbc h ASP 64 N 0.80 1.10 -0.13 0.00 3.32 -0.93 -2.36 116.42 118.23 3fbc h ASP 64 Ca 0.13 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3fbc h ASP 64 Cb 0.65 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 3fbc h ASP 64 CO 0.05 0.98 0.07 0.15 -1.72 0.00 0.00 179.24 178.76 3fbc h PHE 65 N 1.15 0.18 0.00 4.55 3.04 -0.51 -2.23 116.94 123.11 3fbc h PHE 65 Ca 0.26 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.20 3fbc h PHE 65 Cb 0.24 -0.06 0.00 0.00 2.56 0.00 0.00 35.95 38.69 3fbc h PHE 65 CO 0.02 0.21 0.00 -1.33 -2.02 0.00 0.00 178.31 175.19 3fbc n MET 66 N -4.94 0.08 0.00 1.11 2.81 -0.15 -0.82 117.12 115.21 3fbc n MET 66 Ca -0.05 0.25 0.04 0.00 -1.81 0.00 0.00 57.70 56.13 3fbc n MET 66 Cb 0.08 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.12 3fbc n MET 66 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 3fbc n VAL 67 N -1.38 0.00 1.75 2.03 3.14 -0.92 -4.61 118.33 118.34 3fbc n VAL 67 Ca 0.04 -0.50 0.15 0.00 -2.96 0.00 0.00 64.34 61.07 3fbc n VAL 67 Cb 0.10 1.16 0.86 0.00 -1.06 0.00 0.00 33.84 34.89 3fbc n VAL 67 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3fbc n SER 68 N 0.42 0.00 -2.72 6.55 3.41 -0.00 -4.82 113.62 116.46 3fbc n SER 68 Ca 0.04 -0.68 0.00 0.00 -0.26 0.00 0.00 58.87 57.97 3fbc n SER 68 Cb 0.19 -0.10 0.01 0.00 -0.26 0.00 0.00 64.21 64.06 3fbc n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fbc n GLY 69 N 1.02 0.56 3.73 5.00 0.00 -1.26 -5.07 105.19 109.17 3fbc n GLY 69 Ca 0.20 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.90 3fbc n GLY 69 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3fbc s PRO 70 N -2.02 1.68 0.03 1.61 0.02 -1.14 -4.55 135.00 130.63 3fbc s PRO 70 Ca 0.18 1.28 -0.02 0.00 0.02 0.00 0.00 61.00 62.46 3fbc s PRO 70 Cb -0.01 -1.82 -0.02 0.00 0.02 0.00 0.00 34.50 32.66 3fbc s PRO 70 CO 0.01 -2.08 0.00 0.96 -0.33 0.00 0.00 177.00 175.56 3fbc s ILE 71 N -2.81 0.15 -0.11 2.83 -5.25 -0.35 -3.36 121.20 112.31 3fbc s ILE 71 Ca 0.63 -1.25 0.02 0.00 -0.99 0.00 0.00 60.65 59.07 3fbc s ILE 71 Cb -0.19 -0.83 -0.01 0.00 2.95 0.00 0.00 42.46 44.38 3fbc s ILE 71 CO 0.57 -0.69 -0.18 -0.63 -1.79 0.00 0.00 174.94 172.22 3fbc s ILE 72 N -2.54 2.65 -0.09 8.37 1.01 -0.92 -1.15 121.20 128.53 3fbc s ILE 72 Ca -0.06 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 59.77 3fbc s ILE 72 Cb -0.02 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.36 3fbc s ILE 72 CO -0.05 0.55 -0.05 -0.94 0.00 0.00 0.00 174.94 174.45 3fbc s SER 73 N 0.18 4.81 -0.02 3.58 1.04 -0.30 -0.70 113.70 122.29 3fbc s SER 73 Ca -0.10 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.32 3fbc s SER 73 Cb -0.16 -1.40 0.02 0.00 0.10 0.00 0.00 66.02 64.58 3fbc s SER 73 CO 0.06 0.32 -0.00 -0.63 0.98 0.00 0.00 173.24 173.96 3fbc s ILE 74 N -0.52 0.13 -0.29 -1.02 1.01 -0.28 -0.34 121.20 119.89 3fbc s ILE 74 Ca 0.08 0.04 -0.12 0.00 0.00 0.00 0.00 60.65 60.65 3fbc s ILE 74 Cb -0.12 -0.18 -0.04 0.00 0.01 0.00 0.00 42.46 42.12 3fbc s ILE 74 CO 0.02 0.09 0.21 -0.69 0.00 0.00 0.00 174.94 174.57 3fbc s VAL 75 N 0.58 5.30 -0.03 2.92 1.01 0.10 -0.60 120.40 129.69 3fbc s VAL 75 Ca -0.05 0.13 -0.02 0.00 0.00 0.00 0.00 61.98 62.03 3fbc s VAL 75 Cb -0.08 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 3fbc s VAL 75 CO -0.01 0.20 0.13 -0.31 0.00 0.00 0.00 175.10 175.11 3fbc s TYR 76 N 1.77 3.44 -0.11 5.22 1.51 -0.40 -0.82 117.35 127.96 3fbc s TYR 76 Ca 0.07 0.32 0.03 0.00 -1.01 0.00 0.00 57.07 56.48 3fbc s TYR 76 Cb -0.16 -1.81 0.00 0.00 -0.11 0.00 0.00 41.96 39.89 3fbc s TYR 76 CO 0.11 0.62 -0.21 -2.00 -1.11 0.00 0.00 175.55 172.95 3fbc s GLU 77 N -1.69 2.82 -0.16 -0.62 2.12 0.84 -1.23 118.70 120.78 3fbc s GLU 77 Ca 0.23 -0.79 -0.35 0.00 0.36 0.00 0.00 54.97 54.42 3fbc s GLU 77 Cb -0.12 -2.19 0.14 0.00 0.26 0.00 0.00 34.13 32.22 3fbc s GLU 77 CO 0.14 0.10 1.35 0.20 -0.54 0.00 0.00 175.26 176.51 3fbc s GLY 78 N 0.53 -0.35 0.04 -1.50 0.00 -0.98 -1.23 107.32 103.84 3fbc s GLY 78 Ca -0.15 1.32 -0.30 0.00 0.00 0.00 0.00 44.72 45.59 3fbc s GLY 78 CO 0.05 0.37 1.90 -1.59 0.00 0.00 0.00 173.10 173.83 3fbc s THR 79 N -2.17 2.99 -1.46 0.90 2.01 -1.26 -1.43 115.64 115.21 3fbc s THR 79 Ca 0.13 0.12 -0.01 0.00 0.31 0.00 0.00 61.69 62.23 3fbc s THR 79 Cb 0.03 -3.08 0.00 0.00 0.01 0.00 0.00 72.50 69.46 3fbc s THR 79 CO -0.04 -0.01 0.17 -0.67 -0.69 0.00 0.00 174.62 173.38 3fbc n ASP 80 N 7.09 -5.30 -0.28 3.53 4.64 -1.19 -4.87 116.55 120.17 3fbc n ASP 80 Ca 0.19 -0.09 0.04 0.00 -1.38 0.00 0.00 54.79 53.55 3fbc n ASP 80 Cb 0.41 -4.30 0.18 0.00 -1.04 0.00 0.00 41.12 36.37 3fbc n ASP 80 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3fbc h ALA 81 N 0.85 1.14 0.36 -1.67 0.00 -1.50 -0.61 119.26 117.82 3fbc h ALA 81 Ca -0.43 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3fbc h ALA 81 Cb 1.31 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 3fbc h ALA 81 CO 0.50 -0.03 -0.19 0.82 0.00 0.00 0.00 179.25 180.35 3fbc h ILE 82 N 0.66 0.60 -0.18 0.00 2.04 -1.86 -0.19 117.51 118.58 3fbc h ILE 82 Ca 0.41 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 66.07 3fbc h ILE 82 Cb 0.48 0.60 0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3fbc h ILE 82 CO -0.30 0.00 -0.65 -1.28 0.00 0.00 0.00 178.15 175.91 3fbc h SER 83 N -0.51 0.89 -0.35 1.72 0.87 -1.80 -1.92 113.55 112.46 3fbc h SER 83 Ca -0.04 -0.60 -0.01 0.00 -1.23 0.00 0.00 61.79 59.91 3fbc h SER 83 Cb 0.41 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 3fbc h SER 83 CO 0.06 1.34 0.19 0.11 -0.53 0.00 0.00 176.83 178.01 3fbc h LYS 84 N 0.50 0.50 -0.04 2.24 1.79 -1.05 -1.95 116.57 118.54 3fbc h LYS 84 Ca -0.03 -0.06 -0.12 0.00 -2.18 0.00 0.00 60.65 58.26 3fbc h LYS 84 Cb 1.28 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 31.82 3fbc h LYS 84 CO 0.14 0.41 -0.53 0.82 -1.08 0.00 0.00 179.45 179.21 3fbc h ILE 85 N 0.45 1.37 -1.00 1.86 2.04 -1.07 -1.89 117.51 119.26 3fbc h ILE 85 Ca 0.12 -1.81 0.05 0.00 1.00 0.00 0.00 64.86 64.22 3fbc h ILE 85 Cb 0.07 1.93 -0.06 0.00 -0.74 0.00 0.00 36.82 38.01 3fbc h ILE 85 CO -0.02 0.53 0.65 0.03 0.00 0.00 0.00 178.15 179.34 3fbc h ARG 86 N 0.10 1.19 0.00 2.37 2.47 -1.12 -1.94 114.38 117.45 3fbc h ARG 86 Ca -0.00 -0.07 -0.15 0.00 -1.26 0.00 0.00 59.98 58.50 3fbc h ARG 86 Cb 0.97 -0.27 -0.02 0.00 -1.65 0.00 0.00 29.97 29.00 3fbc h ARG 86 CO 0.08 0.78 -0.71 0.00 0.56 0.00 0.00 179.97 180.68 3fbc h ARG 87 N 1.22 0.00 -0.10 0.04 3.08 -0.97 -2.10 114.38 115.55 3fbc h ARG 87 Ca 0.41 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.43 3fbc h ARG 87 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.13 3fbc h ARG 87 CO -0.15 0.71 -0.06 1.25 -1.07 0.00 0.00 179.97 180.65 3fbc h LEU 88 N 0.00 0.22 -0.79 3.04 5.85 -1.01 -2.89 115.31 119.73 3fbc h LEU 88 Ca -0.01 -0.43 0.14 0.00 0.84 0.00 0.00 57.88 58.42 3fbc h LEU 88 Cb 1.27 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 42.15 3fbc h LEU 88 CO 0.09 0.60 0.37 -0.61 -0.34 0.00 0.00 178.44 178.55 3fbc h GLN 89 N -0.16 0.53 0.00 1.25 4.15 -1.28 0.22 115.11 119.82 3fbc h GLN 89 Ca 0.02 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.41 3fbc h GLN 89 Cb 0.52 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.09 3fbc h GLN 89 CO 0.02 0.35 0.00 0.41 -1.93 0.00 0.00 178.83 177.68 3fbc n GLY 90 N -1.32 1.52 3.42 2.39 0.00 -0.80 -1.19 105.19 109.21 3fbc n GLY 90 Ca 0.15 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 3fbc n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fbc s ASN 91 N -4.00 0.64 0.00 1.61 2.20 -1.26 -4.75 114.94 109.38 3fbc s ASN 91 Ca 0.00 -1.38 0.06 0.00 -0.94 0.00 0.00 52.86 50.59 3fbc s ASN 91 Cb 0.00 0.57 0.34 0.00 -2.00 0.00 0.00 41.25 40.16 3fbc s ASN 91 CO 0.00 -1.13 0.99 2.30 -2.94 0.00 0.00 177.10 176.32 3fbc n ILE 92 N -0.47 0.00 0.51 0.54 -5.35 -1.26 -1.64 119.36 111.69 3fbc n ILE 92 Ca 0.02 0.00 0.06 0.00 -0.27 0.00 0.00 62.75 62.55 3fbc n ILE 92 Cb 0.63 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.28 3fbc n ILE 92 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3fbc n LEU 93 N -0.62 1.39 -4.04 7.28 4.77 -1.26 -4.73 117.00 119.79 3fbc n LEU 93 Ca 0.04 -0.79 -0.33 0.00 -0.03 0.00 0.00 56.01 54.90 3fbc n LEU 93 Cb 0.02 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.99 3fbc n LEU 93 CO 0.03 0.27 -0.14 -0.89 -1.33 0.00 0.00 177.39 175.34 3fbc s THR 94 N -1.44 3.03 0.45 -5.08 2.01 -0.87 -5.04 115.64 108.71 3fbc s THR 94 Ca 0.10 -2.78 -0.24 0.00 0.31 0.00 0.00 61.69 59.08 3fbc s THR 94 Cb 0.09 -3.07 -0.09 0.00 0.01 0.00 0.00 72.50 69.44 3fbc s THR 94 CO 0.27 -0.77 1.22 -2.65 -0.69 0.00 0.00 174.62 172.01 3fbc n PRO 95 N 3.73 1.74 0.00 4.92 -0.02 -1.26 -2.67 135.00 141.44 3fbc n PRO 95 Ca 0.04 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3fbc n PRO 95 Cb 0.38 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 3fbc n PRO 95 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fbc n GLY 96 N 0.90 2.97 3.89 -1.23 0.00 -1.26 -4.97 105.19 105.49 3fbc n GLY 96 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 3fbc n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fbc s THR 97 N -2.61 2.88 0.11 2.61 -4.23 -1.09 -4.95 115.64 108.37 3fbc s THR 97 Ca 0.00 -1.31 -0.21 0.00 -1.18 0.00 0.00 61.69 58.99 3fbc s THR 97 Cb 0.00 -3.04 -0.07 0.00 1.34 0.00 0.00 72.50 70.73 3fbc s THR 97 CO 0.00 -0.04 1.72 0.40 -0.54 0.00 0.00 174.62 176.16 3fbc h ILE 98 N 1.02 0.87 0.00 2.99 2.04 -0.63 -0.16 117.51 123.65 3fbc h ILE 98 Ca -0.42 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.33 3fbc h ILE 98 Cb 1.27 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 3fbc h ILE 98 CO 0.56 0.00 -0.52 0.03 0.00 0.00 0.00 178.15 178.22 3fbc h ARG 99 N -0.01 0.00 -0.29 2.37 3.08 -1.37 -2.26 114.38 115.90 3fbc h ARG 99 Ca 0.06 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.98 3fbc h ARG 99 Cb 0.10 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3fbc h ARG 99 CO -0.13 0.52 -0.37 0.78 -1.07 0.00 0.00 179.97 179.71 3fbc h GLY 100 N 2.32 0.71 0.82 0.04 0.00 -0.88 -2.51 103.07 103.58 3fbc h GLY 100 Ca -0.01 -0.69 -0.32 0.00 0.00 0.00 0.00 47.33 46.31 3fbc h GLY 100 CO 0.07 0.62 -1.83 1.22 0.00 0.00 0.00 176.54 176.61 3fbc n ASP 101 N -4.05 1.41 -0.00 0.19 8.00 -0.11 -4.48 116.55 117.51 3fbc n ASP 101 Ca -0.01 0.33 0.03 0.00 0.71 0.00 0.00 54.79 55.85 3fbc n ASP 101 Cb 0.50 -0.41 -0.04 0.00 -0.02 0.00 0.00 41.12 41.15 3fbc n ASP 101 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3fbc n LEU 102 N -3.23 0.23 -4.36 0.64 4.77 -0.85 -5.04 117.00 109.15 3fbc n LEU 102 Ca -0.23 -0.35 -0.28 0.00 -0.03 0.00 0.00 56.01 55.12 3fbc n LEU 102 Cb 1.05 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 42.01 3fbc n LEU 102 CO 0.44 0.06 -0.56 0.00 -1.33 0.00 0.00 177.39 176.00 3fbc s ALA 103 N -1.91 2.23 0.00 -1.18 0.00 -0.94 -5.03 121.76 114.92 3fbc s ALA 103 Ca 0.01 -1.38 0.17 0.00 0.00 0.00 0.00 51.96 50.75 3fbc s ALA 103 Cb 0.05 -0.36 0.28 0.00 0.00 0.00 0.00 23.12 23.08 3fbc s ALA 103 CO 0.29 0.50 1.09 -1.71 0.00 0.00 0.00 175.76 175.93 3fbc n ASN 104 N 1.09 0.51 -3.88 0.00 5.15 -1.26 -4.72 115.26 112.15 3fbc n ASN 104 Ca -0.18 -1.96 -0.11 0.00 -0.60 0.00 0.00 54.58 51.73 3fbc n ASN 104 Cb 0.53 -0.19 -0.11 0.00 -0.53 0.00 0.00 39.78 39.48 3fbc n ASN 104 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3fbc s ASP 105 N -1.60 0.01 0.19 1.20 -1.08 -1.26 -5.05 116.67 109.08 3fbc s ASP 105 Ca 0.22 -0.13 -0.02 0.00 -0.52 0.00 0.00 52.55 52.10 3fbc s ASP 105 Cb 0.25 0.21 0.12 0.00 -1.46 0.00 0.00 42.92 42.04 3fbc s ASP 105 CO -0.11 -0.27 1.50 -0.29 0.52 0.00 0.00 175.17 176.52 3fbc h ILE 106 N 4.50 1.33 0.03 4.11 6.09 -2.02 -3.36 117.51 128.19 3fbc h ILE 106 Ca -0.29 -1.86 -0.32 0.00 -1.37 0.00 0.00 64.86 61.01 3fbc h ILE 106 Cb 1.20 1.84 -0.04 0.00 0.47 0.00 0.00 36.82 40.29 3fbc h ILE 106 CO 0.41 0.57 -1.80 0.61 -3.07 0.00 0.00 178.15 174.87 3fbc n GLY 107 N 0.30 -0.66 3.54 8.18 0.00 -1.26 -4.65 105.19 110.64 3fbc n GLY 107 Ca -0.03 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 3fbc n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fbc s GLU 108 N -2.45 3.96 -0.15 1.61 2.02 -1.26 -4.69 118.70 117.74 3fbc s GLU 108 Ca -0.30 -2.05 0.15 0.00 0.02 0.00 0.00 54.97 52.79 3fbc s GLU 108 Cb 0.08 -5.38 0.43 0.00 0.10 0.00 0.00 34.13 29.36 3fbc s GLU 108 CO 0.62 -2.11 1.20 0.27 0.02 0.00 0.00 175.26 175.25 3fbc n ASN 109 N 7.69 1.63 0.00 -0.19 0.23 -1.26 -4.16 115.26 119.20 3fbc n ASN 109 Ca 0.43 -3.33 0.00 0.00 -0.53 0.00 0.00 54.58 51.15 3fbc n ASN 109 Cb 0.46 -0.46 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 3fbc n ASN 109 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3fbc n LEU 110 N -0.64 0.00 -3.77 -4.53 4.77 -1.26 -4.78 117.00 106.80 3fbc n LEU 110 Ca 0.16 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 56.01 3fbc n LEU 110 Cb 0.83 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.82 3fbc n LEU 110 CO -0.02 0.00 -0.02 -0.51 -1.33 0.00 0.00 177.39 175.51 3fbc s ILE 111 N 0.00 0.01 -0.04 -0.08 2.07 -1.26 -0.65 121.20 121.25 3fbc s ILE 111 Ca 0.00 -0.07 0.04 0.00 -1.41 0.00 0.00 60.65 59.21 3fbc s ILE 111 Cb 0.00 -0.46 -0.03 0.00 0.13 0.00 0.00 42.46 42.10 3fbc s ILE 111 CO 0.00 -0.04 -0.14 -2.28 -1.91 0.00 0.00 174.94 170.58 3fbc s HIS 112 N -0.04 2.72 0.03 3.50 5.65 0.56 -4.96 115.29 122.75 3fbc s HIS 112 Ca -0.02 -0.15 0.03 0.00 0.25 0.00 0.00 55.06 55.17 3fbc s HIS 112 Cb -0.03 -1.61 -0.02 0.00 -1.18 0.00 0.00 32.58 29.74 3fbc s HIS 112 CO 0.01 0.22 -0.09 0.00 -0.65 0.00 0.00 174.74 174.23 3fbc s ALA 113 N -0.78 0.73 0.31 1.58 0.00 -1.26 -0.27 121.76 122.07 3fbc s ALA 113 Ca 0.12 -0.61 -0.29 0.00 0.00 0.00 0.00 51.96 51.18 3fbc s ALA 113 Cb -0.11 -0.08 -0.12 0.00 0.00 0.00 0.00 23.12 22.81 3fbc s ALA 113 CO 0.02 0.10 1.43 0.43 0.00 0.00 0.00 175.76 177.73 3fbc n SER 114 N 2.09 3.21 -1.14 0.00 7.64 -0.83 -4.93 113.62 119.65 3fbc n SER 114 Ca -0.18 1.18 0.10 0.00 1.01 0.00 0.00 58.87 60.98 3fbc n SER 114 Cb 0.56 -1.52 0.27 0.00 -1.01 0.00 0.00 64.21 62.51 3fbc n SER 114 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3fbc n ASP 115 N 1.35 3.65 -3.58 6.43 5.68 -1.26 -4.71 116.55 124.11 3fbc n ASP 115 Ca 0.06 -2.00 -0.07 0.00 -0.50 0.00 0.00 54.79 52.28 3fbc n ASP 115 Cb 0.36 -0.41 -0.02 0.00 -1.14 0.00 0.00 41.12 39.91 3fbc n ASP 115 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 3fbc s SER 116 N -1.01 -0.33 0.14 -1.12 1.04 -1.26 -5.01 113.70 106.14 3fbc s SER 116 Ca 0.41 -0.14 -0.19 0.00 0.48 0.00 0.00 55.95 56.51 3fbc s SER 116 Cb 0.22 0.45 -0.00 0.00 0.10 0.00 0.00 66.02 66.78 3fbc s SER 116 CO 0.28 -0.76 1.70 -0.33 0.98 0.00 0.00 173.24 175.10 3fbc h GLU 117 N 2.00 -0.00 0.08 4.02 5.08 -1.98 0.33 114.58 124.11 3fbc h GLU 117 Ca -0.24 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.12 3fbc h GLU 117 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3fbc h GLU 117 CO 0.30 -0.00 -0.04 -0.44 -1.00 0.00 0.00 179.01 177.83 3fbc h ASP 118 N -0.00 -0.10 -0.87 1.42 3.32 -1.99 -1.78 116.42 116.41 3fbc h ASP 118 Ca 0.11 -0.40 0.16 0.00 0.02 0.00 0.00 57.03 56.93 3fbc h ASP 118 Cb 0.18 0.02 -0.07 0.00 0.22 0.00 0.00 39.33 39.68 3fbc h ASP 118 CO -0.25 0.37 0.57 0.77 -1.72 0.00 0.00 179.24 178.98 3fbc h SER 119 N -0.59 0.56 0.05 6.45 4.64 -1.95 0.26 113.55 122.98 3fbc h SER 119 Ca -0.01 0.04 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3fbc h SER 119 Cb 0.49 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3fbc h SER 119 CO 0.02 0.27 -0.03 0.00 -0.87 0.00 0.00 176.83 176.22 3fbc h ALA 120 N 1.61 -0.07 -0.59 5.18 0.00 -0.77 0.15 119.26 124.76 3fbc h ALA 120 Ca 0.44 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.25 3fbc h ALA 120 Cb 0.84 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 3fbc h ALA 120 CO -0.19 -0.51 0.15 0.28 0.00 0.00 0.00 179.25 178.98 3fbc h VAL 121 N -0.14 1.25 0.55 0.00 2.07 -0.24 -2.04 116.25 117.70 3fbc h VAL 121 Ca -0.01 -0.89 -0.03 0.00 0.82 0.00 0.00 66.70 66.60 3fbc h VAL 121 Cb 0.12 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3fbc h VAL 121 CO 0.01 0.33 -0.31 -0.78 0.02 0.00 0.00 177.57 176.84 3fbc h ASP 122 N 0.85 -0.77 -1.02 0.57 3.58 -0.51 -2.98 116.42 116.14 3fbc h ASP 122 Ca 0.19 0.04 0.26 0.00 0.42 0.00 0.00 57.03 57.93 3fbc h ASP 122 Cb 0.34 0.21 -0.12 0.00 1.72 0.00 0.00 39.33 41.49 3fbc h ASP 122 CO 0.00 -0.49 0.62 -0.33 -2.88 0.00 0.00 179.24 176.16 3fbc h GLU 123 N -0.80 0.49 -0.40 0.28 5.08 -0.68 0.58 114.58 119.13 3fbc h GLU 123 Ca -0.07 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 3fbc h GLU 123 Cb 0.63 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 3fbc h GLU 123 CO 0.09 0.32 0.17 0.82 -1.00 0.00 0.00 179.01 179.41 3fbc h ILE 124 N 0.50 1.15 0.01 3.13 2.04 -1.33 -2.88 117.51 120.12 3fbc h ILE 124 Ca 0.64 -0.45 -0.19 0.00 1.00 0.00 0.00 64.86 65.86 3fbc h ILE 124 Cb 1.37 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 3fbc h ILE 124 CO -0.43 0.18 -0.88 0.77 0.00 0.00 0.00 178.15 177.78 3fbc h SER 125 N 0.56 0.09 0.08 1.72 4.64 -0.73 0.10 113.55 120.01 3fbc h SER 125 Ca 0.14 -0.08 0.02 0.00 -0.47 0.00 0.00 61.79 61.40 3fbc h SER 125 Cb 0.10 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.14 3fbc h SER 125 CO -0.02 0.92 -0.19 0.40 -0.87 0.00 0.00 176.83 177.08 3fbc h ILE 126 N 0.03 0.57 0.00 0.95 2.04 -1.33 -1.56 117.51 118.20 3fbc h ILE 126 Ca -0.02 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 3fbc h ILE 126 Cb 1.54 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 3fbc h ILE 126 CO 0.12 0.00 -0.91 -0.50 0.00 0.00 0.00 178.15 176.86 3fbc h TRP 127 N -0.35 0.00 -2.07 1.37 4.06 -1.51 -3.38 115.95 114.07 3fbc h TRP 127 Ca 0.03 0.00 -0.54 0.00 2.06 0.00 0.00 58.89 60.44 3fbc h TRP 127 Cb 0.38 0.00 -0.40 0.00 -1.00 0.00 0.00 29.16 28.14 3fbc h TRP 127 CO -0.20 0.12 -1.00 1.19 -3.56 0.00 0.00 178.44 174.99 3fbc n PHE 128 N -2.80 1.13 0.17 0.49 3.72 0.35 -4.94 117.46 115.60 3fbc n PHE 128 Ca -0.01 -3.82 0.02 0.00 -0.05 0.00 0.00 57.45 53.59 3fbc n PHE 128 Cb 0.60 -0.43 0.36 0.00 -0.94 0.00 0.00 39.48 39.08 3fbc n PHE 128 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3fbc h PRO 129 N 3.43 0.04 -2.91 -1.08 0.13 -1.45 -3.14 132.00 127.03 3fbc h PRO 129 Ca 0.11 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 65.20 3fbc h PRO 129 Cb 0.82 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 3fbc h PRO 129 CO 0.59 0.38 0.42 0.39 -0.23 0.00 0.00 178.00 179.55 3fbc n GLU 130 N -4.13 0.27 0.00 0.86 4.71 -1.26 -5.03 120.64 116.06 3fbc n GLU 130 Ca -0.02 -0.15 0.00 0.00 -0.01 0.00 0.00 57.16 56.98 3fbc n GLU 130 Cb 0.39 -1.58 0.00 0.00 -1.01 0.00 0.00 31.44 29.23 3fbc n GLU 130 CO 0.00 0.00 0.00 -2.37 0.09 0.00 0.00 177.13 174.85