#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fcv s GLN 2 N 0.00 3.09 -0.06 1.96 -0.21 -0.18 -4.88 119.66 119.38 3fcv s GLN 2 Ca 0.00 -0.97 0.05 0.00 0.02 0.00 0.00 55.36 54.46 3fcv s GLN 2 Cb 0.00 -2.68 -0.01 0.00 1.00 0.00 0.00 33.01 31.32 3fcv s GLN 2 CO 0.00 0.37 -0.22 1.03 -2.12 0.00 0.00 175.29 174.35 3fcv s ARG 3 N -3.92 2.37 0.09 2.91 0.52 -1.26 -2.05 118.95 117.60 3fcv s ARG 3 Ca 0.34 -0.80 0.06 0.00 -0.52 0.00 0.00 55.73 54.81 3fcv s ARG 3 Cb -0.08 -1.98 -0.03 0.00 0.52 0.00 0.00 34.95 33.38 3fcv s ARG 3 CO 0.27 0.31 -0.15 -0.08 0.02 0.00 0.00 175.30 175.66 3fcv s THR 4 N -0.02 1.24 -0.15 0.02 -1.32 -0.67 -4.76 115.64 109.98 3fcv s THR 4 Ca -0.06 -1.43 -0.14 0.00 -1.21 0.00 0.00 61.69 58.85 3fcv s THR 4 Cb -0.14 -1.24 -0.05 0.00 -1.51 0.00 0.00 72.50 69.57 3fcv s THR 4 CO 0.04 -0.24 0.31 -0.22 -2.21 0.00 0.00 174.62 172.30 3fcv s LEU 5 N -1.92 4.25 -0.03 9.08 1.98 -1.26 -1.76 118.68 129.02 3fcv s LEU 5 Ca 0.01 0.54 0.04 0.00 -2.89 0.00 0.00 54.13 51.84 3fcv s LEU 5 Cb -0.09 -2.40 -0.00 0.00 0.66 0.00 0.00 46.19 44.35 3fcv s LEU 5 CO 0.03 0.10 -0.14 -0.69 -1.89 0.00 0.00 176.35 173.75 3fcv s VAL 6 N 0.44 1.21 -0.15 1.68 1.01 0.76 -1.66 120.40 123.69 3fcv s VAL 6 Ca 0.17 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.57 3fcv s VAL 6 Cb -0.13 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.21 3fcv s VAL 6 CO 0.05 0.35 -0.19 -0.76 0.00 0.00 0.00 175.10 174.55 3fcv s LEU 7 N 0.05 2.28 -0.43 3.92 1.43 -0.85 -0.29 118.68 124.80 3fcv s LEU 7 Ca -0.03 -0.54 -0.24 0.00 -1.03 0.00 0.00 54.13 52.30 3fcv s LEU 7 Cb -0.10 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.64 3fcv s LEU 7 CO 0.01 0.08 0.82 -0.63 0.23 0.00 0.00 176.35 176.87 3fcv s ILE 8 N 0.80 4.63 0.70 -0.59 -1.09 0.37 -1.36 121.20 124.66 3fcv s ILE 8 Ca -0.07 0.62 -0.11 0.00 -2.23 0.00 0.00 60.65 58.86 3fcv s ILE 8 Cb -0.15 -4.32 0.01 0.00 -1.58 0.00 0.00 42.46 36.42 3fcv s ILE 8 CO -0.01 -0.67 1.09 -0.54 -1.23 0.00 0.00 174.94 173.58 3fcv s LYS 9 N 3.35 2.88 0.57 2.79 1.02 -0.57 -2.20 119.74 127.57 3fcv s LYS 9 Ca 0.32 0.53 0.27 0.00 0.02 0.00 0.00 55.97 57.11 3fcv s LYS 9 Cb -0.12 -2.02 1.53 0.00 -0.52 0.00 0.00 37.83 36.70 3fcv s LYS 9 CO 0.22 -1.04 2.02 -1.35 -0.92 0.00 0.00 175.35 174.29 3fcv h PRO 10 N -0.66 0.00 0.00 -1.68 0.11 -1.83 -0.95 132.00 126.99 3fcv h PRO 10 Ca -0.45 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 3fcv h PRO 10 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 3fcv h PRO 10 CO 0.63 0.00 -0.11 0.38 -0.21 0.00 0.00 178.00 178.69 3fcv h ASP 11 N 0.00 0.00 -0.28 -2.05 2.03 -1.90 -2.39 116.42 111.82 3fcv h ASP 11 Ca 0.16 0.00 -0.08 0.00 -0.73 0.00 0.00 57.03 56.38 3fcv h ASP 11 Cb 0.78 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.28 3fcv h ASP 11 CO -0.00 0.11 -0.14 0.00 -1.03 0.00 0.00 179.24 178.18 3fcv h ALA 12 N 1.89 0.40 -0.40 4.15 0.00 -1.44 -2.24 119.26 121.61 3fcv h ALA 12 Ca -0.00 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.46 3fcv h ALA 12 Cb 0.64 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3fcv h ALA 12 CO 0.01 0.28 -0.24 0.74 0.00 0.00 0.00 179.25 180.05 3fcv h PHE 13 N 0.34 1.00 -0.70 0.00 -1.00 -1.60 0.38 116.94 115.36 3fcv h PHE 13 Ca 0.06 -0.26 -0.03 0.00 2.81 0.00 0.00 57.97 60.55 3fcv h PHE 13 Cb 0.66 -0.23 -0.03 0.00 3.61 0.00 0.00 35.95 39.96 3fcv h PHE 13 CO 0.06 1.04 0.31 1.49 -1.61 0.00 0.00 178.31 179.61 3fcv h GLU 14 N 0.67 1.02 -0.03 1.51 4.57 -1.46 -2.77 114.58 118.09 3fcv h GLU 14 Ca 0.08 -0.15 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 3fcv h GLU 14 Cb 0.80 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 3fcv h GLU 14 CO 0.07 0.80 -0.01 0.54 -1.18 0.00 0.00 179.01 179.23 3fcv n ARG 15 N -4.32 2.19 -3.32 1.92 1.74 -0.85 -4.97 116.66 109.06 3fcv n ARG 15 Ca 0.07 -1.75 -0.17 0.00 -0.77 0.00 0.00 57.85 55.22 3fcv n ARG 15 Cb 0.15 -1.46 0.07 0.00 -1.02 0.00 0.00 32.46 30.20 3fcv n ARG 15 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3fcv n SER 16 N 1.12 -3.72 -0.63 0.55 7.64 0.58 -4.93 113.62 114.23 3fcv n SER 16 Ca 0.15 -0.50 0.06 0.00 1.01 0.00 0.00 58.87 59.59 3fcv n SER 16 Cb 0.56 -4.42 0.16 0.00 -1.01 0.00 0.00 64.21 59.50 3fcv n SER 16 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3fcv n LEU 17 N -3.98 3.04 0.19 -3.43 4.77 0.10 -4.74 117.00 112.95 3fcv n LEU 17 Ca -0.13 -2.24 -0.15 0.00 -0.03 0.00 0.00 56.01 53.46 3fcv n LEU 17 Cb 0.60 -0.28 -0.07 0.00 -2.33 0.00 0.00 43.42 41.34 3fcv n LEU 17 CO 0.54 0.70 0.63 0.58 -1.33 0.00 0.00 177.39 178.50 3fcv h VAL 18 N 1.77 0.26 -0.55 4.08 2.07 -1.92 -1.32 116.25 120.64 3fcv h VAL 18 Ca 0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 3fcv h VAL 18 Cb 0.87 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 3fcv h VAL 18 CO 0.05 0.00 0.12 0.00 0.02 0.00 0.00 177.57 177.76 3fcv h ALA 19 N -0.20 1.19 -0.18 1.67 0.00 -1.94 -2.13 119.26 117.67 3fcv h ALA 19 Ca -0.01 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.73 3fcv h ALA 19 Cb 0.65 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3fcv h ALA 19 CO -0.11 0.55 -0.08 1.49 0.00 0.00 0.00 179.25 181.11 3fcv h GLU 20 N 0.81 -0.06 -0.19 0.00 4.57 -1.78 0.18 114.58 118.11 3fcv h GLU 20 Ca 0.18 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.34 3fcv h GLU 20 Cb 0.31 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 3fcv h GLU 20 CO 0.00 -0.04 0.03 0.82 -1.18 0.00 0.00 179.01 178.64 3fcv h ILE 21 N -0.06 1.23 -0.06 2.32 2.04 -1.01 -2.55 117.51 119.41 3fcv h ILE 21 Ca 0.10 -0.74 -0.08 0.00 1.00 0.00 0.00 64.86 65.14 3fcv h ILE 21 Cb 0.20 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 3fcv h ILE 21 CO -0.22 0.23 -0.31 0.24 0.00 0.00 0.00 178.15 178.09 3fcv h MET 22 N 0.10 0.11 -0.15 2.37 2.86 -1.26 -2.82 114.93 116.14 3fcv h MET 22 Ca 0.06 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.53 3fcv h MET 22 Cb 0.32 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 3fcv h MET 22 CO 0.00 0.41 -0.47 0.78 1.06 0.00 0.00 176.91 178.70 3fcv h GLY 23 N 1.01 0.43 1.42 8.32 0.00 -0.50 0.26 103.07 114.01 3fcv h GLY 23 Ca 0.01 -0.45 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 3fcv h GLY 23 CO 0.04 0.40 -0.03 3.21 0.00 0.00 0.00 176.54 180.16 3fcv h ARG 24 N 0.32 0.71 0.08 4.80 3.08 -1.20 0.90 114.38 123.07 3fcv h ARG 24 Ca 0.02 -0.19 -0.29 0.00 0.07 0.00 0.00 59.98 59.59 3fcv h ARG 24 Cb 0.94 -0.08 0.02 0.00 0.08 0.00 0.00 29.97 30.94 3fcv h ARG 24 CO 0.08 0.75 -1.18 0.82 -1.07 0.00 0.00 179.97 179.37 3fcv h ILE 25 N 0.66 1.30 -0.51 2.04 2.04 -1.42 -2.99 117.51 118.63 3fcv h ILE 25 Ca 0.13 -2.45 -0.03 0.00 1.00 0.00 0.00 64.86 63.51 3fcv h ILE 25 Cb 0.46 2.61 -0.02 0.00 -0.74 0.00 0.00 36.82 39.13 3fcv h ILE 25 CO 0.02 0.74 0.19 -0.08 0.00 0.00 0.00 178.15 179.02 3fcv h GLU 26 N 0.29 0.77 0.00 2.37 4.81 -0.75 -2.42 114.58 119.64 3fcv h GLU 26 Ca -0.16 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 58.88 3fcv h GLU 26 Cb 1.85 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 31.10 3fcv h GLU 26 CO 0.22 0.69 -0.19 0.87 -0.73 0.00 0.00 179.01 179.88 3fcv h LYS 27 N 0.68 0.00 0.00 1.92 1.57 -0.90 0.47 116.57 120.31 3fcv h LYS 27 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3fcv h LYS 27 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3fcv h LYS 27 CO -0.01 0.19 0.00 1.17 -0.57 0.00 0.00 179.45 180.23 3fcv n LYS 28 N -4.05 0.02 -1.75 3.15 3.00 -0.93 -4.89 118.16 112.71 3fcv n LYS 28 Ca -0.02 0.21 0.00 0.00 -0.00 0.00 0.00 58.31 58.50 3fcv n LYS 28 Cb 0.26 -1.54 0.00 0.00 0.00 0.00 0.00 35.03 33.76 3fcv n LYS 28 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 3fcv n ASN 29 N -1.58 -1.08 -4.83 3.14 5.15 0.16 -5.07 115.26 111.14 3fcv n ASN 29 Ca 0.04 0.00 -0.38 0.00 -0.60 0.00 0.00 54.58 53.64 3fcv n ASN 29 Cb 0.22 -0.40 -0.06 0.00 -0.53 0.00 0.00 39.78 39.01 3fcv n ASN 29 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 3fcv s PHE 30 N -2.28 3.71 -0.17 1.20 0.40 -1.14 -5.00 117.98 114.70 3fcv s PHE 30 Ca 0.00 0.94 -0.09 0.00 -0.60 0.00 0.00 56.93 57.18 3fcv s PHE 30 Cb 0.00 -2.27 -0.05 0.00 0.51 0.00 0.00 43.02 41.21 3fcv s PHE 30 CO 0.00 0.63 0.14 0.15 0.70 0.00 0.00 175.22 176.84 3fcv s LYS 31 N -0.98 3.98 -0.07 0.44 -0.14 -1.07 -4.62 119.74 117.29 3fcv s LYS 31 Ca 0.23 -0.18 -0.30 0.00 -1.36 0.00 0.00 55.97 54.36 3fcv s LYS 31 Cb -0.16 -3.35 -0.04 0.00 -1.68 0.00 0.00 37.83 32.60 3fcv s LYS 31 CO 0.12 0.44 1.33 0.42 -0.76 0.00 0.00 175.35 176.90 3fcv s ILE 32 N -0.04 4.02 -0.26 2.17 1.01 -1.26 -1.10 121.20 125.74 3fcv s ILE 32 Ca 0.10 1.33 -0.08 0.00 0.00 0.00 0.00 60.65 62.00 3fcv s ILE 32 Cb -0.11 -3.86 -0.15 0.00 0.01 0.00 0.00 42.46 38.35 3fcv s ILE 32 CO 0.00 -0.05 -0.25 0.52 0.00 0.00 0.00 174.94 175.16 3fcv n VAL 33 N 4.94 1.53 -3.99 2.92 0.31 0.15 -4.97 118.33 119.22 3fcv n VAL 33 Ca 0.13 -0.45 -0.12 0.00 -0.01 0.00 0.00 64.34 63.90 3fcv n VAL 33 Cb 0.45 -1.71 -0.12 0.00 -0.91 0.00 0.00 33.84 31.55 3fcv n VAL 33 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3fcv s SER 34 N -7.08 0.34 -0.14 4.52 0.01 -1.21 -4.98 113.70 105.16 3fcv s SER 34 Ca -0.36 -0.32 -0.07 0.00 1.31 0.00 0.00 55.95 56.50 3fcv s SER 34 Cb 0.12 0.04 0.05 0.00 0.21 0.00 0.00 66.02 66.44 3fcv s SER 34 CO 0.55 -0.15 0.34 -0.32 0.41 0.00 0.00 173.24 174.07 3fcv s MET 35 N -0.91 0.31 -0.04 12.44 0.00 -1.26 -0.73 119.30 129.11 3fcv s MET 35 Ca -0.08 0.68 0.02 0.00 0.00 0.00 0.00 55.69 56.31 3fcv s MET 35 Cb -0.06 -0.06 0.01 0.00 0.00 0.00 0.00 34.83 34.71 3fcv s MET 35 CO -0.00 -0.16 -0.10 0.15 0.00 0.00 0.00 175.02 174.91 3fcv s LYS 36 N 1.36 1.21 -0.17 4.11 -0.14 0.20 -5.00 119.74 121.32 3fcv s LYS 36 Ca -0.09 -0.32 -0.08 0.00 -1.36 0.00 0.00 55.97 54.11 3fcv s LYS 36 Cb -0.09 -1.08 -0.04 0.00 -1.68 0.00 0.00 37.83 34.93 3fcv s LYS 36 CO -0.11 0.06 0.11 0.12 -0.76 0.00 0.00 175.35 174.78 3fcv s PHE 37 N 0.45 3.42 -0.17 3.18 5.36 -1.26 -0.71 117.98 128.25 3fcv s PHE 37 Ca -0.08 0.33 0.01 0.00 -0.96 0.00 0.00 56.93 56.23 3fcv s PHE 37 Cb -0.12 -2.06 0.02 0.00 -0.34 0.00 0.00 43.02 40.52 3fcv s PHE 37 CO 0.02 0.40 -0.19 -1.58 -1.46 0.00 0.00 175.22 172.41 3fcv s TRP 38 N -0.11 2.64 0.41 10.12 0.52 0.21 -4.97 118.94 127.76 3fcv s TRP 38 Ca 0.09 -1.52 0.10 0.00 0.02 0.00 0.00 56.10 54.80 3fcv s TRP 38 Cb -0.12 -1.84 0.85 0.00 -1.15 0.00 0.00 33.47 31.22 3fcv s TRP 38 CO 0.00 -0.75 1.95 0.66 0.02 0.00 0.00 176.95 178.83 3fcv h SER 39 N 7.86 0.20 -0.78 2.95 4.64 -1.91 -0.13 113.55 126.38 3fcv h SER 39 Ca -0.42 -0.03 0.15 0.00 -0.47 0.00 0.00 61.79 61.02 3fcv h SER 39 Cb 1.15 -0.05 -0.21 0.00 -0.31 0.00 0.00 62.40 62.97 3fcv h SER 39 CO 0.61 0.32 -0.07 -1.59 -0.87 0.00 0.00 176.83 175.23 3fcv s LYS 40 N -4.79 0.40 0.38 4.77 -2.85 -1.26 -3.38 119.74 113.01 3fcv s LYS 40 Ca -0.05 0.74 -0.28 0.00 -1.00 0.00 0.00 55.97 55.38 3fcv s LYS 40 Cb 0.16 0.42 -0.10 0.00 -2.06 0.00 0.00 37.83 36.24 3fcv s LYS 40 CO 0.72 -0.40 1.45 0.00 0.10 0.00 0.00 175.35 177.22 3fcv s ALA 41 N 2.87 3.51 0.31 0.59 0.00 -1.26 -4.95 121.76 122.82 3fcv s ALA 41 Ca 0.09 1.51 -0.29 0.00 0.00 0.00 0.00 51.96 53.27 3fcv s ALA 41 Cb -0.12 -3.59 -0.10 0.00 0.00 0.00 0.00 23.12 19.30 3fcv s ALA 41 CO -0.17 -1.02 1.42 -2.14 0.00 0.00 0.00 175.76 173.85 3fcv s PRO 42 N -2.12 4.25 0.34 0.00 0.02 -1.26 -4.77 135.00 131.46 3fcv s PRO 42 Ca 0.54 2.36 0.08 0.00 0.02 0.00 0.00 61.00 63.99 3fcv s PRO 42 Cb -0.45 -3.06 0.78 0.00 0.02 0.00 0.00 34.50 31.79 3fcv s PRO 42 CO 0.60 -0.39 1.84 -0.09 -0.33 0.00 0.00 177.00 178.64 3fcv h ARG 43 N 3.99 0.71 -0.65 5.54 2.43 -1.95 -1.36 114.38 123.10 3fcv h ARG 43 Ca -0.48 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.63 3fcv h ARG 43 Cb 1.23 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.58 3fcv h ARG 43 CO 0.71 0.47 0.36 -0.97 -1.51 0.00 0.00 179.97 179.02 3fcv h ASN 44 N 0.74 0.82 -0.95 -3.80 -0.73 -1.99 0.18 115.58 109.85 3fcv h ASN 44 Ca 0.49 -0.10 0.02 0.00 1.87 0.00 0.00 56.30 58.58 3fcv h ASN 44 Cb 0.77 -0.21 -0.05 0.00 0.27 0.00 0.00 38.32 39.11 3fcv h ASN 44 CO -0.25 0.68 0.62 0.25 -0.37 0.00 0.00 177.43 178.36 3fcv h LEU 45 N 0.89 1.07 -0.22 0.34 5.85 -1.64 -1.04 115.31 120.57 3fcv h LEU 45 Ca 0.23 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.88 3fcv h LEU 45 Cb 0.05 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 3fcv h LEU 45 CO -0.04 0.76 -0.06 0.40 -0.34 0.00 0.00 178.44 179.17 3fcv h ILE 46 N 1.25 1.29 -0.19 4.05 1.08 -0.97 -2.00 117.51 122.03 3fcv h ILE 46 Ca 0.36 -1.05 0.00 0.00 -0.39 0.00 0.00 64.86 63.77 3fcv h ILE 46 Cb -0.10 1.54 -0.01 0.00 -3.07 0.00 0.00 36.82 35.18 3fcv h ILE 46 CO -0.09 0.32 0.12 -0.33 -0.69 0.00 0.00 178.15 177.48 3fcv h GLU 47 N 0.14 0.25 -0.06 2.37 5.08 -0.20 -1.36 114.58 120.81 3fcv h GLU 47 Ca 0.05 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 3fcv h GLU 47 Cb 0.51 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3fcv h GLU 47 CO 0.02 0.17 -0.21 1.96 -1.00 0.00 0.00 179.01 179.95 3fcv h GLN 48 N 0.25 0.25 -0.76 2.33 1.08 -1.08 -0.89 115.11 116.29 3fcv h GLN 48 Ca 0.07 -0.19 0.13 0.00 -1.45 0.00 0.00 58.65 57.21 3fcv h GLN 48 Cb -0.02 0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.39 3fcv h GLN 48 CO -0.01 0.82 0.50 1.25 -0.95 0.00 0.00 178.83 180.44 3fcv h HIS 49 N -0.27 0.61 -0.42 2.96 2.76 -0.82 -2.14 115.15 117.83 3fcv h HIS 49 Ca -0.01 0.02 -0.22 0.00 -2.20 0.00 0.00 60.37 57.96 3fcv h HIS 49 Cb 0.85 -0.19 -0.13 0.00 1.55 0.00 0.00 27.41 29.48 3fcv h HIS 49 CO 0.13 0.25 -0.03 0.66 -1.30 0.00 0.00 177.93 177.64 3fcv n TYR 50 N -4.50 1.29 0.28 5.26 4.02 -0.56 -4.73 117.16 118.22 3fcv n TYR 50 Ca 0.14 -1.66 0.16 0.00 -0.01 0.00 0.00 57.90 56.53 3fcv n TYR 50 Cb 0.44 -0.54 0.93 0.00 -0.02 0.00 0.00 39.34 40.15 3fcv n TYR 50 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 3fcv h LYS 51 N 1.03 0.00 0.00 -0.72 2.10 -0.45 0.16 116.57 118.69 3fcv h LYS 51 Ca 0.26 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.91 3fcv h LYS 51 Cb 1.75 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.08 3fcv h LYS 51 CO 0.46 0.00 0.00 0.93 -2.00 0.00 0.00 179.45 178.84 3fcv h GLU 52 N 0.00 0.00 -0.37 0.07 5.08 -1.84 -3.10 114.58 114.42 3fcv h GLU 52 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3fcv h GLU 52 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3fcv h GLU 52 CO -0.00 0.00 0.00 0.72 -1.00 0.00 0.00 179.01 178.73 3fcv n HIS 53 N -2.89 1.24 0.23 4.33 8.25 0.04 -4.64 115.22 121.78 3fcv n HIS 53 Ca 0.01 -0.80 0.07 0.00 -0.26 0.00 0.00 57.72 56.73 3fcv n HIS 53 Cb 0.29 -0.35 0.53 0.00 1.12 0.00 0.00 29.99 31.59 3fcv n HIS 53 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3fcv h SER 54 N 2.50 0.00 0.46 0.41 4.64 -1.60 -2.61 113.55 117.35 3fcv h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fcv h SER 54 Cb 1.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.64 3fcv h SER 54 CO 0.28 0.21 -0.73 -0.62 -0.87 0.00 0.00 176.83 175.11 3fcv n GLU 55 N -4.03 0.11 -1.57 4.77 -0.58 -1.26 -4.88 120.64 113.20 3fcv n GLU 55 Ca -0.02 0.01 -0.34 0.00 -0.42 0.00 0.00 57.16 56.39 3fcv n GLU 55 Cb 0.29 -1.55 0.07 0.00 -0.57 0.00 0.00 31.44 29.68 3fcv n GLU 55 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3fcv s GLN 56 N -3.07 2.42 0.27 3.49 -1.52 -0.98 -4.93 119.66 115.33 3fcv s GLN 56 Ca 0.08 1.59 0.26 0.00 -1.95 0.00 0.00 55.36 55.33 3fcv s GLN 56 Cb 0.16 -1.88 0.80 0.00 -0.22 0.00 0.00 33.01 31.87 3fcv s GLN 56 CO 0.75 -1.59 1.75 0.66 -0.25 0.00 0.00 175.29 176.62 3fcv h SER 57 N -0.17 0.00 0.16 5.90 4.64 -1.91 -3.12 113.55 119.05 3fcv h SER 57 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3fcv h SER 57 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3fcv h SER 57 CO 0.51 0.00 -0.44 0.00 -0.87 0.00 0.00 176.83 176.04 3fcv n TYR 58 N -2.43 0.00 -0.24 4.77 0.18 -1.26 -4.55 117.16 113.63 3fcv n TYR 58 Ca 0.04 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.83 3fcv n TYR 58 Cb 0.40 -0.08 0.07 0.00 -0.38 0.00 0.00 39.34 39.35 3fcv n TYR 58 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 3fcv h PHE 59 N 1.36 -0.41 -0.34 -3.48 3.04 -1.75 0.17 116.94 115.53 3fcv h PHE 59 Ca 0.00 0.06 -0.17 0.00 3.98 0.00 0.00 57.97 61.85 3fcv h PHE 59 Cb 0.59 0.29 -0.00 0.00 2.56 0.00 0.00 35.95 39.39 3fcv h PHE 59 CO 0.00 -0.31 -0.45 -0.97 -2.02 0.00 0.00 178.31 174.56 3fcv h ASN 60 N -0.01 0.96 -0.64 0.41 -0.00 -1.85 -0.83 115.58 113.61 3fcv h ASN 60 Ca 0.33 -0.47 -0.09 0.00 -0.00 0.00 0.00 56.30 56.07 3fcv h ASN 60 Cb 0.52 -0.27 -0.02 0.00 -0.00 0.00 0.00 38.32 38.54 3fcv h ASN 60 CO -0.73 1.26 0.06 0.44 -0.00 0.00 0.00 177.43 178.46 3fcv h ASP 61 N 0.71 1.07 -0.12 1.15 3.32 -1.70 -0.44 116.42 120.40 3fcv h ASP 61 Ca 0.04 -0.28 0.03 0.00 0.02 0.00 0.00 57.03 56.85 3fcv h ASP 61 Cb 1.04 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 40.27 3fcv h ASP 61 CO 0.10 1.08 -0.10 0.25 -1.72 0.00 0.00 179.24 178.86 3fcv h LEU 62 N 1.01 -0.32 -0.85 1.55 5.85 -0.44 0.27 115.31 122.38 3fcv h LEU 62 Ca 0.19 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.92 3fcv h LEU 62 Cb 0.50 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 3fcv h LEU 62 CO 0.02 -0.14 0.22 0.00 -0.34 0.00 0.00 178.44 178.21 3fcv h ASP 64 N 1.04 0.86 -0.25 0.00 3.32 -0.68 -2.79 116.42 117.93 3fcv h ASP 64 Ca 0.23 -0.11 -0.11 0.00 0.02 0.00 0.00 57.03 57.06 3fcv h ASP 64 Cb 0.29 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3fcv h ASP 64 CO -0.01 0.73 -0.22 0.15 -1.72 0.00 0.00 179.24 178.17 3fcv h PHE 65 N 0.93 0.81 0.00 4.55 3.04 -0.64 -2.87 116.94 122.76 3fcv h PHE 65 Ca 0.24 -0.18 0.00 0.00 3.98 0.00 0.00 57.97 62.00 3fcv h PHE 65 Cb 0.07 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 38.39 3fcv h PHE 65 CO -0.00 0.88 0.00 -1.33 -2.02 0.00 0.00 178.31 175.84 3fcv n MET 66 N -4.12 0.18 -0.14 1.11 2.81 -0.69 -2.25 117.12 114.03 3fcv n MET 66 Ca 0.00 0.31 0.04 0.00 -1.81 0.00 0.00 57.70 56.25 3fcv n MET 66 Cb 0.42 -1.79 0.12 0.00 -0.71 0.00 0.00 33.22 31.26 3fcv n MET 66 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 3fcv n VAL 67 N -2.13 0.99 1.20 2.03 0.24 -1.09 -4.57 118.33 115.00 3fcv n VAL 67 Ca 0.04 -0.99 0.14 0.00 -2.04 0.00 0.00 64.34 61.48 3fcv n VAL 67 Cb 0.29 0.51 0.55 0.00 -1.47 0.00 0.00 33.84 33.72 3fcv n VAL 67 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3fcv n SER 68 N 0.30 0.29 -2.62 -1.34 3.41 -0.95 -4.85 113.62 107.86 3fcv n SER 68 Ca 0.09 -0.14 -0.05 0.00 -0.26 0.00 0.00 58.87 58.51 3fcv n SER 68 Cb 0.39 -0.16 0.02 0.00 -0.26 0.00 0.00 64.21 64.20 3fcv n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fcv n GLY 69 N 1.39 0.98 3.71 5.00 0.00 -1.26 -5.07 105.19 109.94 3fcv n GLY 69 Ca 0.10 -1.16 -0.32 0.00 0.00 0.00 0.00 46.02 44.64 3fcv n GLY 69 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3fcv s PRO 70 N -2.06 1.66 -0.01 1.61 0.02 -1.22 -4.52 135.00 130.49 3fcv s PRO 70 Ca 0.15 1.48 -0.01 0.00 0.02 0.00 0.00 61.00 62.64 3fcv s PRO 70 Cb -0.03 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.68 3fcv s PRO 70 CO 0.07 -2.14 0.02 0.42 -0.33 0.00 0.00 177.00 175.05 3fcv s ILE 71 N -2.57 0.01 -0.24 2.83 1.01 -0.06 -3.30 121.20 118.87 3fcv s ILE 71 Ca 0.67 -0.08 -0.04 0.00 0.00 0.00 0.00 60.65 61.20 3fcv s ILE 71 Cb -0.22 -0.07 0.00 0.00 0.01 0.00 0.00 42.46 42.18 3fcv s ILE 71 CO 0.54 -0.04 -0.02 -0.63 0.00 0.00 0.00 174.94 174.78 3fcv s ILE 72 N -0.12 3.38 -0.14 2.92 1.01 -0.94 -0.62 121.20 126.69 3fcv s ILE 72 Ca -0.01 -0.65 -0.15 0.00 0.00 0.00 0.00 60.65 59.84 3fcv s ILE 72 Cb -0.01 -2.62 -0.05 0.00 0.01 0.00 0.00 42.46 39.80 3fcv s ILE 72 CO -0.00 0.31 0.34 -0.94 0.00 0.00 0.00 174.94 174.65 3fcv s SER 73 N 1.45 6.52 -0.01 3.58 1.04 0.11 -0.48 113.70 125.90 3fcv s SER 73 Ca 0.04 0.61 0.01 0.00 0.48 0.00 0.00 55.95 57.09 3fcv s SER 73 Cb -0.15 -2.21 0.01 0.00 0.10 0.00 0.00 66.02 63.76 3fcv s SER 73 CO -0.02 0.09 -0.03 -0.63 0.98 0.00 0.00 173.24 173.63 3fcv s ILE 74 N 0.40 0.31 -0.36 -1.02 1.01 0.61 -0.63 121.20 121.51 3fcv s ILE 74 Ca 0.19 -0.10 -0.12 0.00 0.00 0.00 0.00 60.65 60.62 3fcv s ILE 74 Cb -0.14 -0.30 0.01 0.00 0.01 0.00 0.00 42.46 42.04 3fcv s ILE 74 CO 0.06 0.12 0.23 -0.69 0.00 0.00 0.00 174.94 174.65 3fcv s VAL 75 N 0.28 4.90 0.09 2.92 1.01 0.09 -0.17 120.40 129.52 3fcv s VAL 75 Ca -0.03 -0.59 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 3fcv s VAL 75 Cb -0.06 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.62 3fcv s VAL 75 CO -0.00 -0.15 0.36 -0.31 0.00 0.00 0.00 175.10 175.00 3fcv s TYR 76 N 1.63 3.54 -0.02 5.22 1.51 -0.72 -0.67 117.35 127.84 3fcv s TYR 76 Ca 0.04 0.65 0.04 0.00 -1.01 0.00 0.00 57.07 56.79 3fcv s TYR 76 Cb -0.18 -2.06 -0.00 0.00 -0.11 0.00 0.00 41.96 39.60 3fcv s TYR 76 CO 0.08 0.50 -0.13 -2.00 -1.11 0.00 0.00 175.55 172.89 3fcv s GLU 77 N -2.19 1.25 0.00 -0.62 2.12 -0.26 -1.68 118.70 117.33 3fcv s GLU 77 Ca 0.35 -0.47 0.00 0.00 0.36 0.00 0.00 54.97 55.21 3fcv s GLU 77 Cb -0.13 -1.16 0.00 0.00 0.26 0.00 0.00 34.13 33.10 3fcv s GLU 77 CO 0.20 0.23 0.00 0.41 -0.54 0.00 0.00 175.26 175.57 3fcv n GLY 78 N 3.00 1.33 3.66 -1.50 0.00 -0.87 -2.60 105.19 108.22 3fcv n GLY 78 Ca -0.16 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 3fcv n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fcv s THR 79 N -2.00 3.42 -1.59 2.61 2.01 -1.26 -1.02 115.64 117.81 3fcv s THR 79 Ca 0.00 0.50 -0.01 0.00 0.31 0.00 0.00 61.69 62.50 3fcv s THR 79 Cb 0.00 -3.34 0.00 0.00 0.01 0.00 0.00 72.50 69.17 3fcv s THR 79 CO 0.00 -0.06 0.09 0.47 -0.69 0.00 0.00 174.62 174.43 3fcv n ASP 80 N 7.49 -5.51 -0.31 3.53 10.43 -1.26 -4.88 116.55 126.04 3fcv n ASP 80 Ca 0.18 -0.06 0.16 0.00 2.57 0.00 0.00 54.79 57.65 3fcv n ASP 80 Cb 0.43 -4.52 0.40 0.00 1.84 0.00 0.00 41.12 39.27 3fcv n ASP 80 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3fcv h ALA 81 N 0.90 1.91 0.22 2.24 0.00 -1.68 -2.49 119.26 120.37 3fcv h ALA 81 Ca -0.46 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 3fcv h ALA 81 Cb 1.33 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3fcv h ALA 81 CO 0.53 -0.25 -0.11 0.82 0.00 0.00 0.00 179.25 180.24 3fcv h ILE 82 N 0.62 0.82 -0.08 0.00 2.04 -1.88 -1.92 117.51 117.11 3fcv h ILE 82 Ca 0.54 -0.22 -0.22 0.00 1.00 0.00 0.00 64.86 65.96 3fcv h ILE 82 Cb 1.03 0.95 0.01 0.00 -0.74 0.00 0.00 36.82 38.07 3fcv h ILE 82 CO -0.29 0.05 -0.84 0.77 0.00 0.00 0.00 178.15 177.83 3fcv h SER 83 N -0.41 0.73 -0.00 1.72 4.64 -1.84 -2.97 113.55 115.42 3fcv h SER 83 Ca -0.03 -0.51 -0.00 0.00 -0.47 0.00 0.00 61.79 60.78 3fcv h SER 83 Cb 0.31 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3fcv h SER 83 CO 0.05 1.30 0.00 0.11 -0.87 0.00 0.00 176.83 177.42 3fcv h LYS 84 N 0.38 0.00 0.00 4.77 1.57 -1.45 -2.27 116.57 119.57 3fcv h LYS 84 Ca -0.06 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 3fcv h LYS 84 Cb 1.46 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.76 3fcv h LYS 84 CO 0.16 0.15 -0.26 0.82 -0.57 0.00 0.00 179.45 179.75 3fcv h ILE 85 N -0.14 1.09 -0.66 1.86 2.04 -1.44 -1.46 117.51 118.79 3fcv h ILE 85 Ca 0.00 -0.91 -0.03 0.00 1.00 0.00 0.00 64.86 64.92 3fcv h ILE 85 Cb 0.15 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 3fcv h ILE 85 CO -0.00 0.25 0.31 0.03 0.00 0.00 0.00 178.15 178.74 3fcv h ARG 86 N 0.00 0.96 -0.17 2.37 2.47 -1.33 -0.26 114.38 118.43 3fcv h ARG 86 Ca -0.00 -0.15 -0.12 0.00 -1.26 0.00 0.00 59.98 58.45 3fcv h ARG 86 Cb 0.48 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.62 3fcv h ARG 86 CO 0.03 0.77 -0.43 0.00 0.56 0.00 0.00 179.97 180.90 3fcv h ARG 87 N 0.92 0.40 -0.52 0.04 3.08 -0.71 -2.30 114.38 115.28 3fcv h ARG 87 Ca 0.23 -0.21 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 3fcv h ARG 87 Cb 0.13 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3fcv h ARG 87 CO -0.03 0.76 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.51 3fcv h LEU 88 N 0.33 0.92 0.21 3.04 3.38 -1.15 -3.26 115.31 118.78 3fcv h LEU 88 Ca 0.03 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.72 3fcv h LEU 88 Cb 0.90 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 3fcv h LEU 88 CO 0.08 1.01 -0.19 -0.61 0.09 0.00 0.00 178.44 178.82 3fcv h GLN 89 N 0.85 -0.40 0.00 1.13 4.15 -0.56 0.12 115.11 120.40 3fcv h GLN 89 Ca 0.15 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.59 3fcv h GLN 89 Cb 0.58 0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.37 3fcv h GLN 89 CO 0.04 -0.27 0.00 0.41 -1.93 0.00 0.00 178.83 177.08 3fcv n GLY 90 N -1.31 1.26 3.65 2.39 0.00 -0.91 -0.94 105.19 109.33 3fcv n GLY 90 Ca -0.08 -1.84 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 3fcv n GLY 90 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3fcv n ASN 91 N -0.37 0.74 0.02 1.61 2.85 -1.26 -4.86 115.26 114.00 3fcv n ASN 91 Ca 0.00 0.63 -0.02 0.00 -0.11 0.00 0.00 54.58 55.08 3fcv n ASN 91 Cb 0.00 -1.46 0.24 0.00 1.24 0.00 0.00 39.78 39.80 3fcv n ASN 91 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 3fcv h THR 92 N -0.53 1.24 -3.37 -0.44 2.02 -1.95 -3.40 112.91 106.48 3fcv h THR 92 Ca -0.47 -1.12 -0.56 0.00 0.77 0.00 0.00 66.41 65.04 3fcv h THR 92 Cb 1.32 1.25 -0.05 0.00 -1.74 0.00 0.00 68.15 68.92 3fcv h THR 92 CO 0.46 0.36 0.12 0.21 0.37 0.00 0.00 175.52 177.04 3fcv s ASN 93 N -6.80 7.04 0.35 4.18 3.84 -1.26 -4.43 114.94 117.85 3fcv s ASN 93 Ca -0.07 1.25 0.26 0.00 0.21 0.00 0.00 52.86 54.51 3fcv s ASN 93 Cb 0.14 -2.43 1.21 0.00 -0.55 0.00 0.00 41.25 39.62 3fcv s ASN 93 CO 0.78 -0.12 1.78 -0.65 -2.79 0.00 0.00 177.10 176.10 3fcv h PRO 94 N 6.67 0.00 -0.00 0.43 0.11 -1.84 0.73 132.00 138.09 3fcv h PRO 94 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3fcv h PRO 94 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3fcv h PRO 94 CO 0.75 0.00 -0.14 1.28 -0.21 0.00 0.00 178.00 179.68 3fcv n LEU 95 N -2.41 0.60 0.00 2.35 4.77 -1.26 -4.38 117.00 116.67 3fcv n LEU 95 Ca 0.00 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 3fcv n LEU 95 Cb 0.16 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3fcv n LEU 95 CO 0.17 0.11 -0.29 0.00 -1.33 0.00 0.00 177.39 176.06 3fcv n ALA 96 N -0.87 1.85 -1.68 -1.18 0.00 -0.55 -5.04 120.51 113.04 3fcv n ALA 96 Ca 0.14 0.00 -0.50 0.00 0.00 0.00 0.00 53.44 53.08 3fcv n ALA 96 Cb 0.29 0.24 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 3fcv n ALA 96 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3fcv n SER 97 N -1.83 3.15 -4.78 0.00 3.41 0.14 -4.80 113.62 108.91 3fcv n SER 97 Ca 0.00 1.01 -0.37 0.00 -0.26 0.00 0.00 58.87 59.25 3fcv n SER 97 Cb 0.29 -1.33 -0.06 0.00 -0.26 0.00 0.00 64.21 62.85 3fcv n SER 97 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fcv s ALA 98 N 3.43 3.21 0.32 7.33 0.00 -1.26 -4.37 121.76 130.42 3fcv s ALA 98 Ca 0.92 0.55 -0.29 0.00 0.00 0.00 0.00 51.96 53.14 3fcv s ALA 98 Cb -0.77 -3.20 -0.12 0.00 0.00 0.00 0.00 23.12 19.04 3fcv s ALA 98 CO 0.52 0.13 1.48 -2.30 0.00 0.00 0.00 175.76 175.59 3fcv n PRO 99 N 0.54 2.50 0.00 0.00 -0.02 -1.26 -2.05 135.00 134.70 3fcv n PRO 99 Ca 0.02 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 3fcv n PRO 99 Cb 0.50 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 3fcv n PRO 99 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fcv n GLY 100 N 1.37 2.88 3.95 -1.23 0.00 -1.26 -4.96 105.19 105.94 3fcv n GLY 100 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 3fcv n GLY 100 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fcv s THR 101 N -2.59 3.25 0.05 2.61 -4.23 -0.87 -4.95 115.64 108.91 3fcv s THR 101 Ca 0.00 -0.48 -0.28 0.00 -1.18 0.00 0.00 61.69 59.75 3fcv s THR 101 Cb 0.00 -3.24 -0.17 0.00 1.34 0.00 0.00 72.50 70.43 3fcv s THR 101 CO 0.00 -0.18 1.47 0.40 -0.54 0.00 0.00 174.62 175.77 3fcv h ILE 102 N 0.10 0.60 -0.54 2.99 2.04 -0.71 -0.87 117.51 121.12 3fcv h ILE 102 Ca -0.44 -0.26 -0.11 0.00 1.00 0.00 0.00 64.86 65.05 3fcv h ILE 102 Cb 1.28 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 3fcv h ILE 102 CO 0.56 0.05 -0.09 0.03 0.00 0.00 0.00 178.15 178.69 3fcv h ARG 103 N -0.70 1.02 -0.11 2.37 3.08 -1.27 0.38 114.38 119.16 3fcv h ARG 103 Ca -0.06 -0.37 -0.00 0.00 0.07 0.00 0.00 59.98 59.62 3fcv h ARG 103 Cb 0.50 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 3fcv h ARG 103 CO 0.09 1.06 0.06 0.78 -1.07 0.00 0.00 179.97 180.89 3fcv h GLY 104 N 0.90 0.16 0.49 0.04 0.00 -1.64 -0.17 103.07 102.85 3fcv h GLY 104 Ca 0.14 -0.06 -0.34 0.00 0.00 0.00 0.00 47.33 47.07 3fcv h GLY 104 CO 0.05 0.06 -2.06 1.22 0.00 0.00 0.00 176.54 175.81 3fcv n ASP 105 N -4.50 0.75 0.00 0.19 8.00 -0.34 -4.36 116.55 116.30 3fcv n ASP 105 Ca -0.01 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.68 3fcv n ASP 105 Cb 0.10 0.24 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 3fcv n ASP 105 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3fcv n LEU 106 N -2.99 0.00 -4.82 0.64 4.77 0.11 -5.04 117.00 109.66 3fcv n LEU 106 Ca -0.27 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.33 3fcv n LEU 106 Cb 1.09 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 42.12 3fcv n LEU 106 CO 0.42 0.00 0.21 0.00 -1.33 0.00 0.00 177.39 176.69 3fcv s ALA 107 N -1.75 3.63 0.00 -1.18 0.00 -0.09 -4.97 121.76 117.41 3fcv s ALA 107 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 51.88 3fcv s ALA 107 Cb 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 23.12 20.59 3fcv s ALA 107 CO 0.00 0.44 0.61 -1.71 0.00 0.00 0.00 175.76 175.10 3fcv n ASN 108 N 1.61 0.70 -4.08 0.00 5.15 -1.26 -4.69 115.26 112.69 3fcv n ASN 108 Ca -0.11 -1.32 -0.13 0.00 -0.60 0.00 0.00 54.58 52.43 3fcv n ASN 108 Cb 0.51 0.00 -0.11 0.00 -0.53 0.00 0.00 39.78 39.65 3fcv n ASN 108 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3fcv s ASP 109 N -0.32 0.92 0.34 1.20 -1.08 -1.26 -4.90 116.67 111.57 3fcv s ASP 109 Ca 0.00 -0.63 0.18 0.00 -0.52 0.00 0.00 52.55 51.58 3fcv s ASP 109 Cb 0.00 0.04 0.16 0.00 -1.46 0.00 0.00 42.92 41.67 3fcv s ASP 109 CO 0.00 -0.25 1.49 -0.29 0.52 0.00 0.00 175.17 176.65 3fcv h ILE 110 N 4.23 0.52 0.00 4.11 2.10 -1.98 -3.36 117.51 123.14 3fcv h ILE 110 Ca -0.36 -1.74 -0.04 0.00 1.08 0.00 0.00 64.86 63.80 3fcv h ILE 110 Cb 1.20 2.25 -0.01 0.00 -1.09 0.00 0.00 36.82 39.17 3fcv h ILE 110 CO 0.45 0.30 -0.50 1.23 -1.08 0.00 0.00 178.15 178.54 3fcv h GLY 111 N 3.70 0.00 -7.38 8.18 0.00 -1.97 -3.42 103.07 102.18 3fcv h GLY 111 Ca -0.01 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.67 3fcv h GLY 111 CO 0.04 0.00 1.36 -0.54 0.00 0.00 0.00 176.54 177.40 3fcv s GLU 112 N -2.11 3.70 -0.17 4.80 2.02 -1.26 -4.77 118.70 120.91 3fcv s GLU 112 Ca -0.14 -1.60 0.16 0.00 0.02 0.00 0.00 54.97 53.41 3fcv s GLU 112 Cb 0.02 -5.21 0.37 0.00 0.10 0.00 0.00 34.13 29.41 3fcv s GLU 112 CO 0.27 -2.03 1.24 0.27 0.02 0.00 0.00 175.26 175.03 3fcv n ASN 113 N 7.73 2.49 0.00 -0.19 0.23 -1.26 -3.98 115.26 120.28 3fcv n ASN 113 Ca 0.33 -3.30 0.00 0.00 -0.53 0.00 0.00 54.58 51.08 3fcv n ASN 113 Cb 0.49 -0.49 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 3fcv n ASN 113 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3fcv n LEU 114 N -1.20 0.00 -3.82 -4.53 4.77 -1.26 -4.81 117.00 106.15 3fcv n LEU 114 Ca 0.19 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 56.05 3fcv n LEU 114 Cb 0.72 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.69 3fcv n LEU 114 CO 0.04 0.00 -0.21 -0.51 -1.33 0.00 0.00 177.39 175.38 3fcv s ILE 115 N 0.00 0.00 0.09 -0.08 2.07 -1.26 -1.52 121.20 120.50 3fcv s ILE 115 Ca 0.00 -0.01 0.05 0.00 -1.41 0.00 0.00 60.65 59.28 3fcv s ILE 115 Cb 0.00 -0.20 -0.04 0.00 0.13 0.00 0.00 42.46 42.35 3fcv s ILE 115 CO 0.00 -0.00 -0.00 -2.28 -1.91 0.00 0.00 174.94 170.75 3fcv s HIS 116 N 0.06 2.99 -0.17 3.50 5.65 -0.46 -4.97 115.29 121.89 3fcv s HIS 116 Ca -0.00 -0.03 -0.09 0.00 0.25 0.00 0.00 55.06 55.19 3fcv s HIS 116 Cb -0.01 -1.54 0.06 0.00 -1.18 0.00 0.00 32.58 29.91 3fcv s HIS 116 CO 0.00 0.48 0.40 0.00 -0.65 0.00 0.00 174.74 174.98 3fcv s ALA 117 N -1.31 -1.03 0.34 1.58 0.00 -1.26 -2.01 121.76 118.07 3fcv s ALA 117 Ca 0.26 1.50 -0.26 0.00 0.00 0.00 0.00 51.96 53.46 3fcv s ALA 117 Cb -0.12 -0.94 -0.13 0.00 0.00 0.00 0.00 23.12 21.94 3fcv s ALA 117 CO 0.18 -0.29 0.89 0.43 0.00 0.00 0.00 175.76 176.97 3fcv n SER 118 N 4.33 0.70 -0.25 0.00 7.64 -0.66 -4.90 113.62 120.47 3fcv n SER 118 Ca -0.23 1.08 0.10 0.00 1.01 0.00 0.00 58.87 60.84 3fcv n SER 118 Cb 0.55 -1.25 -0.06 0.00 -1.01 0.00 0.00 64.21 62.44 3fcv n SER 118 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3fcv n ASP 119 N 1.09 1.51 -3.79 6.43 5.68 -1.26 -4.81 116.55 121.40 3fcv n ASP 119 Ca 0.10 -1.25 -0.06 0.00 -0.50 0.00 0.00 54.79 53.08 3fcv n ASP 119 Cb 0.35 0.73 -0.02 0.00 -1.14 0.00 0.00 41.12 41.05 3fcv n ASP 119 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 3fcv s SER 120 N -2.70 -0.22 0.13 -1.12 1.04 -1.26 -4.91 113.70 104.66 3fcv s SER 120 Ca 0.13 -0.58 -0.19 0.00 0.48 0.00 0.00 55.95 55.79 3fcv s SER 120 Cb 0.17 0.67 -0.05 0.00 0.10 0.00 0.00 66.02 66.91 3fcv s SER 120 CO 0.70 -1.25 1.76 -0.33 0.98 0.00 0.00 173.24 175.11 3fcv h GLU 121 N 2.00 0.20 -0.00 4.02 5.08 -1.95 -0.38 114.58 123.55 3fcv h GLU 121 Ca -0.21 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.15 3fcv h GLU 121 Cb 1.24 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 3fcv h GLU 121 CO 0.24 0.13 -0.07 -0.44 -1.00 0.00 0.00 179.01 177.88 3fcv h ASP 122 N 0.21 -0.20 0.82 1.42 3.45 -2.00 -2.02 116.42 118.11 3fcv h ASP 122 Ca 0.09 0.03 -0.07 0.00 0.43 0.00 0.00 57.03 57.51 3fcv h ASP 122 Cb 0.03 0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 38.88 3fcv h ASP 122 CO -0.07 -0.10 -0.34 0.77 -1.57 0.00 0.00 179.24 177.93 3fcv h SER 123 N -0.12 0.00 0.27 6.45 4.64 -1.95 -2.30 113.55 120.55 3fcv h SER 123 Ca 0.03 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.34 3fcv h SER 123 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3fcv h SER 123 CO -0.07 0.34 -0.13 0.00 -0.87 0.00 0.00 176.83 176.10 3fcv h ALA 124 N 1.66 -0.37 -0.98 5.18 0.00 -0.76 0.16 119.26 124.15 3fcv h ALA 124 Ca -0.00 -0.17 0.15 0.00 0.00 0.00 0.00 54.91 54.88 3fcv h ALA 124 Cb 0.85 0.14 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 3fcv h ALA 124 CO 0.04 -0.56 0.61 0.28 0.00 0.00 0.00 179.25 179.62 3fcv h VAL 125 N -0.66 0.84 -0.23 0.00 2.07 -1.31 0.11 116.25 117.07 3fcv h VAL 125 Ca -0.04 -0.29 -0.15 0.00 0.82 0.00 0.00 66.70 67.04 3fcv h VAL 125 Cb 0.46 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 3fcv h VAL 125 CO 0.06 0.16 -0.43 -0.78 0.02 0.00 0.00 177.57 176.60 3fcv h ASP 126 N 0.85 0.78 1.13 0.57 3.58 -1.19 -2.88 116.42 119.27 3fcv h ASP 126 Ca 0.51 -0.54 -0.18 0.00 0.42 0.00 0.00 57.03 57.24 3fcv h ASP 126 Cb 0.67 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.47 3fcv h ASP 126 CO -0.28 1.17 -0.85 -0.33 -2.88 0.00 0.00 179.24 176.08 3fcv h GLU 127 N 0.42 0.00 -0.33 0.28 5.08 -0.14 -3.00 114.58 116.89 3fcv h GLU 127 Ca 0.01 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.28 3fcv h GLU 127 Cb 1.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 3fcv h GLU 127 CO 0.10 0.85 -0.16 0.82 -1.00 0.00 0.00 179.01 179.61 3fcv h ILE 128 N 0.00 1.25 0.00 3.13 2.04 -0.85 -2.59 117.51 120.49 3fcv h ILE 128 Ca -0.01 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.69 3fcv h ILE 128 Cb 1.64 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 3fcv h ILE 128 CO 0.11 0.38 0.00 -1.54 0.00 0.00 0.00 178.15 177.10 3fcv n SER 129 N -4.16 0.53 0.07 1.72 3.41 -1.09 -0.45 113.62 113.65 3fcv n SER 129 Ca 0.01 0.56 -0.23 0.00 -0.26 0.00 0.00 58.87 58.95 3fcv n SER 129 Cb 0.37 -0.70 -0.15 0.00 -0.26 0.00 0.00 64.21 63.47 3fcv n SER 129 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3fcv h ILE 130 N 0.00 1.08 0.00 -1.33 2.04 -1.33 -3.21 117.51 114.76 3fcv h ILE 130 Ca 0.00 -2.52 -0.08 0.00 1.00 0.00 0.00 64.86 63.26 3fcv h ILE 130 Cb 0.62 2.85 -0.02 0.00 -0.74 0.00 0.00 36.82 39.53 3fcv h ILE 130 CO 0.00 0.80 -1.53 0.79 0.00 0.00 0.00 178.15 178.21 3fcv n TRP 131 N -3.75 0.61 -3.17 1.37 7.02 -1.02 -4.48 117.44 114.03 3fcv n TRP 131 Ca -0.22 0.19 -0.23 0.00 -1.02 0.00 0.00 57.50 56.22 3fcv n TRP 131 Cb 1.01 -0.87 -0.05 0.00 -2.42 0.00 0.00 31.31 28.98 3fcv n TRP 131 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 3fcv n PHE 132 N -2.63 1.37 0.20 -5.99 3.72 0.40 -4.96 117.46 109.57 3fcv n PHE 132 Ca -0.07 -3.84 0.18 0.00 -0.05 0.00 0.00 57.45 53.67 3fcv n PHE 132 Cb 0.70 -0.44 0.83 0.00 -0.94 0.00 0.00 39.48 39.63 3fcv n PHE 132 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3fcv h PRO 133 N 3.41 0.00 0.00 -1.08 0.13 -1.72 -3.41 132.00 129.33 3fcv h PRO 133 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3fcv h PRO 133 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 3fcv h PRO 133 CO 0.61 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.77