#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 2.04 -0.04 1.96 -0.21 0.44 -4.85 119.66 119.01 3fcv s GLN 2 Ca 0.00 -1.98 0.06 0.00 0.02 0.00 0.00 55.36 53.46 3fcv s GLN 2 Cb 0.00 -1.78 -0.01 0.00 1.00 0.00 0.00 33.01 32.22 3fcv s GLN 2 CO 0.00 -0.04 -0.22 1.03 -2.12 0.00 0.00 175.29 173.94 3fcv s ARG 3 N -3.76 2.10 0.16 2.91 0.52 -1.26 -1.81 118.95 117.81 3fcv s ARG 3 Ca 0.37 -0.79 0.07 0.00 -0.52 0.00 0.00 55.73 54.85 3fcv s ARG 3 Cb 0.06 -1.86 -0.04 0.00 0.52 0.00 0.00 34.95 33.63 3fcv s ARG 3 CO 0.19 0.38 -0.14 -0.08 0.02 0.00 0.00 175.30 175.67 3fcv s THR 4 N -0.23 1.54 -0.22 0.02 -1.32 -0.32 -4.82 115.64 110.29 3fcv s THR 4 Ca 0.00 -2.00 -0.09 0.00 -1.21 0.00 0.00 61.69 58.40 3fcv s THR 4 Cb -0.11 -1.83 -0.04 0.00 -1.51 0.00 0.00 72.50 69.00 3fcv s THR 4 CO 0.02 -0.52 0.10 -0.22 -2.21 0.00 0.00 174.62 171.79 3fcv s LEU 5 N -2.93 3.84 -0.07 9.08 1.98 -1.26 -1.36 118.68 127.96 3fcv s LEU 5 Ca 0.16 0.02 0.05 0.00 -2.89 0.00 0.00 54.13 51.48 3fcv s LEU 5 Cb -0.02 -2.01 -0.01 0.00 0.66 0.00 0.00 46.19 44.80 3fcv s LEU 5 CO 0.05 0.08 -0.22 -0.69 -1.89 0.00 0.00 176.35 173.68 3fcv s VAL 6 N 0.94 2.36 -0.16 1.68 1.01 0.80 -1.94 120.40 125.09 3fcv s VAL 6 Ca 0.05 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.07 3fcv s VAL 6 Cb -0.14 -1.89 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 3fcv s VAL 6 CO 0.03 0.57 -0.11 -0.76 0.00 0.00 0.00 175.10 174.83 3fcv s LEU 7 N -0.19 2.72 -0.49 3.92 1.43 -0.74 -0.56 118.68 124.77 3fcv s LEU 7 Ca -0.02 -0.38 -0.21 0.00 -1.03 0.00 0.00 54.13 52.49 3fcv s LEU 7 Cb -0.14 -1.64 0.04 0.00 0.03 0.00 0.00 46.19 44.49 3fcv s LEU 7 CO 0.03 0.09 0.71 -0.63 0.23 0.00 0.00 176.35 176.79 3fcv s ILE 8 N 0.80 4.74 0.72 -0.59 -1.09 0.19 -0.86 121.20 125.10 3fcv s ILE 8 Ca -0.04 -0.07 -0.11 0.00 -2.23 0.00 0.00 60.65 58.20 3fcv s ILE 8 Cb -0.15 -4.32 0.02 0.00 -1.58 0.00 0.00 42.46 36.43 3fcv s ILE 8 CO 0.01 -0.80 1.07 -0.54 -1.23 0.00 0.00 174.94 173.45 3fcv s LYS 9 N 3.02 2.76 0.49 2.79 1.02 0.32 -2.36 119.74 127.79 3fcv s LYS 9 Ca 0.22 0.87 0.22 0.00 0.02 0.00 0.00 55.97 57.30 3fcv s LYS 9 Cb -0.16 -1.98 1.27 0.00 -0.52 0.00 0.00 37.83 36.45 3fcv s LYS 9 CO 0.16 -1.20 1.95 -1.35 -0.92 0.00 0.00 175.35 173.99 3fcv h PRO 10 N -0.79 0.16 0.00 -1.68 0.11 -1.84 -0.61 132.00 127.35 3fcv h PRO 10 Ca -0.45 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 3fcv h PRO 10 Cb 1.22 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3fcv h PRO 10 CO 0.58 0.11 -0.17 0.38 -0.21 0.00 0.00 178.00 178.68 3fcv h ASP 11 N 0.17 0.00 -0.60 -2.05 2.03 -1.90 -1.04 116.42 113.03 3fcv h ASP 11 Ca 0.33 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.53 3fcv h ASP 11 Cb 1.05 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.53 3fcv h ASP 11 CO -0.05 0.17 -0.01 0.00 -1.03 0.00 0.00 179.24 178.32 3fcv h ALA 12 N 1.83 0.81 -0.22 4.15 0.00 -1.36 -2.00 119.26 122.47 3fcv h ALA 12 Ca -0.00 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 3fcv h ALA 12 Cb 0.68 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3fcv h ALA 12 CO 0.02 0.66 -0.28 0.74 0.00 0.00 0.00 179.25 180.40 3fcv h PHE 13 N 0.96 0.70 -0.43 0.00 -1.00 -1.43 0.48 116.94 116.22 3fcv h PHE 13 Ca 0.17 -0.23 -0.01 0.00 2.81 0.00 0.00 57.97 60.72 3fcv h PHE 13 Cb 0.58 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 39.97 3fcv h PHE 13 CO 0.04 0.94 0.24 1.49 -1.61 0.00 0.00 178.31 179.41 3fcv h GLU 14 N 0.26 0.59 -0.63 1.51 4.57 -1.18 -2.37 114.58 117.34 3fcv h GLU 14 Ca 0.03 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 3fcv h GLU 14 Cb 0.85 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 3fcv h GLU 14 CO 0.07 0.43 0.00 0.54 -1.18 0.00 0.00 179.01 178.87 3fcv n ARG 15 N -4.43 2.68 -3.79 1.92 1.74 -0.76 -4.97 116.66 109.07 3fcv n ARG 15 Ca 0.03 -2.53 -0.25 0.00 -0.77 0.00 0.00 57.85 54.34 3fcv n ARG 15 Cb 0.10 -1.53 0.03 0.00 -1.02 0.00 0.00 32.46 30.04 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 1.51 -2.69 -0.64 0.55 7.64 -0.67 -4.89 113.62 114.42 3fcv n SER 16 Ca 0.22 -0.80 0.07 0.00 1.01 0.00 0.00 58.87 59.37 3fcv n SER 16 Cb 0.60 -3.99 0.19 0.00 -1.01 0.00 0.00 64.21 60.00 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 -4.46 3.24 0.29 -3.43 4.77 0.16 -4.75 117.00 112.82 3fcv n LEU 17 Ca -0.16 -2.59 -0.16 0.00 -0.03 0.00 0.00 56.01 53.07 3fcv n LEU 17 Cb 0.62 -0.38 -0.08 0.00 -2.33 0.00 0.00 43.42 41.24 3fcv n LEU 17 CO 0.71 0.68 0.66 0.58 -1.33 0.00 0.00 177.39 178.69 3fcv h VAL 18 N 1.54 0.48 -0.51 4.08 2.07 -1.90 -2.08 116.25 119.92 3fcv h VAL 18 Ca 0.00 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 3fcv h VAL 18 Cb 1.08 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 3fcv h VAL 18 CO 0.11 0.02 0.28 0.00 0.02 0.00 0.00 177.57 177.99 3fcv h ALA 19 N -0.30 0.65 -0.49 1.67 0.00 -1.94 -2.16 119.26 116.68 3fcv h ALA 19 Ca -0.07 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.85 3fcv h ALA 19 Cb 0.56 -0.20 -0.10 0.00 0.00 0.00 0.00 17.79 18.05 3fcv h ALA 19 CO 0.12 0.17 -0.15 1.49 0.00 0.00 0.00 179.25 180.88 3fcv h GLU 20 N 0.68 -0.03 0.60 0.00 4.57 -1.86 0.47 114.58 119.01 3fcv h GLU 20 Ca 0.18 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.33 3fcv h GLU 20 Cb 0.05 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 28.65 3fcv h GLU 20 CO -0.03 -0.02 -0.29 0.82 -1.18 0.00 0.00 179.01 178.31 3fcv h ILE 21 N -0.04 0.25 -0.37 2.32 2.04 -1.11 -2.39 117.51 118.22 3fcv h ILE 21 Ca 0.24 -0.32 0.11 0.00 1.00 0.00 0.00 64.86 65.88 3fcv h ILE 21 Cb 0.40 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 3fcv h ILE 21 CO -0.53 0.03 0.32 0.24 0.00 0.00 0.00 178.15 178.21 3fcv h MET 22 N -1.06 0.00 -0.43 2.37 2.86 -1.25 -1.53 114.93 115.89 3fcv h MET 22 Ca -0.08 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.41 3fcv h MET 22 Cb 0.67 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 3fcv h MET 22 CO 0.14 0.00 -0.31 0.78 1.06 0.00 0.00 176.91 178.58 3fcv h GLY 23 N 0.00 1.04 1.90 8.32 0.00 0.25 -1.32 103.07 113.26 3fcv h GLY 23 Ca 0.18 -1.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.44 3fcv h GLY 23 CO -0.00 0.91 -0.24 3.21 0.00 0.00 0.00 176.54 180.42 3fcv h ARG 24 N 0.80 0.12 0.16 4.80 3.08 -0.77 -1.01 114.38 121.56 3fcv h ARG 24 Ca 0.08 -0.04 -0.29 0.00 0.07 0.00 0.00 59.98 59.80 3fcv h ARG 24 Cb 0.90 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.95 3fcv h ARG 24 CO 0.08 0.36 -1.34 0.82 -1.07 0.00 0.00 179.97 178.82 3fcv h ILE 25 N 0.11 1.40 -0.39 2.04 2.04 -1.45 -3.20 117.51 118.06 3fcv h ILE 25 Ca 0.02 -2.94 -0.07 0.00 1.00 0.00 0.00 64.86 62.87 3fcv h ILE 25 Cb 0.49 2.95 -0.02 0.00 -0.74 0.00 0.00 36.82 39.50 3fcv h ILE 25 CO 0.03 0.87 -0.03 -0.08 0.00 0.00 0.00 178.15 178.94 3fcv h GLU 26 N 0.09 0.64 0.00 2.37 4.81 -0.93 -2.59 114.58 118.98 3fcv h GLU 26 Ca -0.18 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 58.88 3fcv h GLU 26 Cb 2.03 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 31.33 3fcv h GLU 26 CO 0.22 0.69 -0.03 0.87 -0.73 0.00 0.00 179.01 180.02 3fcv h LYS 27 N 0.61 0.00 -0.01 1.92 1.57 -1.26 -2.38 116.57 117.02 3fcv h LYS 27 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3fcv h LYS 27 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3fcv h LYS 27 CO 0.02 0.03 0.00 1.17 -0.57 0.00 0.00 179.45 180.10 3fcv n LYS 28 N -3.12 1.32 -0.83 3.15 3.00 -0.99 -4.91 118.16 115.77 3fcv n LYS 28 Ca 0.02 -0.46 0.00 0.00 -0.00 0.00 0.00 58.31 57.86 3fcv n LYS 28 Cb 0.39 -1.48 0.00 0.00 0.00 0.00 0.00 35.03 33.95 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 -0.43 -2.34 -4.76 3.14 4.05 -0.89 -5.05 115.26 108.99 3fcv n ASN 29 Ca 0.21 0.00 -0.39 0.00 0.45 0.00 0.00 54.58 54.85 3fcv n ASN 29 Cb 0.22 -0.40 -0.05 0.00 1.23 0.00 0.00 39.78 40.78 3fcv n ASN 29 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 3fcv s PHE 30 N -2.00 3.68 -0.12 1.20 0.40 -1.16 -4.95 117.98 115.02 3fcv s PHE 30 Ca 0.00 1.23 -0.06 0.00 -0.60 0.00 0.00 56.93 57.49 3fcv s PHE 30 Cb 0.00 -2.64 -0.04 0.00 0.51 0.00 0.00 43.02 40.85 3fcv s PHE 30 CO 0.00 0.32 0.12 0.15 0.70 0.00 0.00 175.22 176.51 3fcv s LYS 31 N -0.09 3.41 0.27 0.44 -0.14 -0.87 -4.55 119.74 118.21 3fcv s LYS 31 Ca 0.32 -0.18 -0.29 0.00 -1.36 0.00 0.00 55.97 54.46 3fcv s LYS 31 Cb -0.18 -3.14 -0.09 0.00 -1.68 0.00 0.00 37.83 32.73 3fcv s LYS 31 CO 0.18 0.74 1.11 0.42 -0.76 0.00 0.00 175.35 177.03 3fcv s ILE 32 N -0.92 3.50 0.00 2.17 1.01 -1.26 -0.52 121.20 125.17 3fcv s ILE 32 Ca 0.14 1.48 0.00 0.00 0.00 0.00 0.00 60.65 62.27 3fcv s ILE 32 Cb -0.12 -3.94 0.00 0.00 0.01 0.00 0.00 42.46 38.41 3fcv s ILE 32 CO 0.03 0.34 0.00 1.33 0.00 0.00 0.00 174.94 176.65 3fcv n VAL 33 N 1.32 0.00 -3.73 2.92 0.24 -0.34 -4.90 118.33 113.84 3fcv n VAL 33 Ca -0.01 -0.08 -0.13 0.00 -2.04 0.00 0.00 64.34 62.08 3fcv n VAL 33 Cb 0.45 0.53 -0.10 0.00 -1.47 0.00 0.00 33.84 33.25 3fcv n VAL 33 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3fcv s SER 34 N -1.52 -0.44 -0.19 -1.34 0.01 -1.22 -4.98 113.70 104.02 3fcv s SER 34 Ca 0.00 0.84 -0.15 0.00 1.31 0.00 0.00 55.95 57.95 3fcv s SER 34 Cb 0.00 0.85 0.05 0.00 0.21 0.00 0.00 66.02 67.14 3fcv s SER 34 CO 0.00 -0.16 0.49 -0.32 0.41 0.00 0.00 173.24 173.66 3fcv s MET 35 N 0.17 0.53 -0.05 12.44 0.00 -1.26 -1.17 119.30 129.97 3fcv s MET 35 Ca -0.00 0.77 -0.02 0.00 0.00 0.00 0.00 55.69 56.44 3fcv s MET 35 Cb -0.03 0.17 0.03 0.00 0.00 0.00 0.00 34.83 35.00 3fcv s MET 35 CO 0.01 -0.10 0.11 0.21 0.00 0.00 0.00 175.02 175.24 3fcv s LYS 36 N 0.75 0.06 -0.19 4.11 2.20 -0.71 -5.02 119.74 120.94 3fcv s LYS 36 Ca -0.04 0.28 -0.12 0.00 -0.36 0.00 0.00 55.97 55.73 3fcv s LYS 36 Cb -0.05 -0.15 -0.05 0.00 -1.51 0.00 0.00 37.83 36.07 3fcv s LYS 36 CO -0.06 -0.14 0.22 0.12 -0.36 0.00 0.00 175.35 175.14 3fcv s PHE 37 N 0.92 3.41 -0.30 4.03 5.36 -1.26 -1.81 117.98 128.33 3fcv s PHE 37 Ca -0.07 0.43 -0.02 0.00 -0.96 0.00 0.00 56.93 56.31 3fcv s PHE 37 Cb -0.10 -2.28 0.05 0.00 -0.34 0.00 0.00 43.02 40.35 3fcv s PHE 37 CO -0.04 0.20 -0.01 -1.58 -1.46 0.00 0.00 175.22 172.33 3fcv s TRP 38 N 0.62 3.25 0.51 10.12 0.52 -0.11 -4.95 118.94 128.91 3fcv s TRP 38 Ca 0.12 -1.86 0.16 0.00 0.02 0.00 0.00 56.10 54.54 3fcv s TRP 38 Cb -0.12 -2.10 1.26 0.00 -1.15 0.00 0.00 33.47 31.36 3fcv s TRP 38 CO 0.02 -0.80 2.14 0.66 0.02 0.00 0.00 176.95 178.99 3fcv h SER 39 N 7.99 0.00 -0.87 2.95 4.64 -1.91 -0.07 113.55 126.27 3fcv h SER 39 Ca -0.22 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.21 3fcv h SER 39 Cb 1.06 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 62.94 3fcv h SER 39 CO 0.53 0.02 -0.22 -0.75 -0.87 0.00 0.00 176.83 175.54 3fcv s LYS 40 N -5.02 0.50 0.37 4.77 2.20 -1.26 -3.33 119.74 117.96 3fcv s LYS 40 Ca -0.05 0.79 -0.28 0.00 -0.36 0.00 0.00 55.97 56.07 3fcv s LYS 40 Cb 0.17 0.43 -0.11 0.00 -1.51 0.00 0.00 37.83 36.81 3fcv s LYS 40 CO 0.67 -0.63 1.42 0.00 -0.36 0.00 0.00 175.35 176.45 3fcv s ALA 41 N 2.87 3.52 0.26 3.13 0.00 -1.26 -4.94 121.76 125.34 3fcv s ALA 41 Ca 0.16 1.46 -0.31 0.00 0.00 0.00 0.00 51.96 53.27 3fcv s ALA 41 Cb -0.13 -3.56 -0.11 0.00 0.00 0.00 0.00 23.12 19.32 3fcv s ALA 41 CO -0.21 -0.93 1.61 -2.14 0.00 0.00 0.00 175.76 174.09 3fcv s PRO 42 N -2.03 4.15 0.32 0.00 0.02 -1.26 -4.81 135.00 131.39 3fcv s PRO 42 Ca 0.52 2.54 0.10 0.00 0.02 0.00 0.00 61.00 64.18 3fcv s PRO 42 Cb -0.44 -3.06 0.92 0.00 0.02 0.00 0.00 34.50 31.95 3fcv s PRO 42 CO 0.59 -0.64 1.71 -0.09 -0.33 0.00 0.00 177.00 178.24 3fcv h ARG 43 N 5.52 0.47 -0.02 5.54 9.65 -1.98 -1.35 114.38 132.20 3fcv h ARG 43 Ca -0.46 -0.03 -0.13 0.00 -1.10 0.00 0.00 59.98 58.27 3fcv h ARG 43 Cb 1.21 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 29.67 3fcv h ARG 43 CO 0.84 0.31 -0.57 -2.95 2.80 0.00 0.00 179.97 180.40 3fcv h ASN 44 N 0.48 0.09 -0.53 -3.80 -1.07 -1.99 -1.42 115.58 107.34 3fcv h ASN 44 Ca 0.66 -0.05 -0.06 0.00 0.07 0.00 0.00 56.30 56.92 3fcv h ASN 44 Cb 1.33 -0.02 -0.02 0.00 -2.07 0.00 0.00 38.32 37.53 3fcv h ASN 44 CO -0.52 0.64 0.10 -0.07 0.07 0.00 0.00 177.43 177.65 3fcv h LEU 45 N 0.06 0.83 -0.18 6.14 3.38 -1.63 -1.67 115.31 122.25 3fcv h LEU 45 Ca -0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 3fcv h LEU 45 Cb 1.03 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 3fcv h LEU 45 CO 0.08 0.87 0.09 0.40 0.09 0.00 0.00 178.44 179.97 3fcv h ILE 46 N 0.76 1.13 -0.12 1.22 1.08 -1.28 0.13 117.51 120.43 3fcv h ILE 46 Ca 0.16 -0.37 -0.05 0.00 -0.39 0.00 0.00 64.86 64.21 3fcv h ILE 46 Cb 0.38 1.05 -0.01 0.00 -3.07 0.00 0.00 36.82 35.18 3fcv h ILE 46 CO 0.01 0.12 -0.16 -0.33 -0.69 0.00 0.00 178.15 177.10 3fcv h GLU 47 N 0.16 0.19 0.16 2.37 5.08 -1.19 -1.19 114.58 120.16 3fcv h GLU 47 Ca 0.06 -0.04 -0.31 0.00 -1.00 0.00 0.00 59.36 58.07 3fcv h GLU 47 Cb 0.12 -0.03 0.03 0.00 0.50 0.00 0.00 28.75 29.37 3fcv h GLU 47 CO -0.01 0.35 -1.31 0.37 -1.00 0.00 0.00 179.01 177.41 3fcv h GLN 48 N 0.18 0.54 -0.70 2.33 4.15 -1.10 -2.07 115.11 118.44 3fcv h GLN 48 Ca 0.04 -0.80 0.09 0.00 0.77 0.00 0.00 58.65 58.75 3fcv h GLN 48 Cb 0.39 0.28 -0.07 0.00 0.21 0.00 0.00 27.48 28.29 3fcv h GLN 48 CO 0.02 1.37 0.35 1.25 -1.93 0.00 0.00 178.83 179.89 3fcv h HIS 49 N 0.20 0.63 -0.90 3.99 2.76 -0.35 -2.16 115.15 119.31 3fcv h HIS 49 Ca -0.20 0.03 -0.57 0.00 -2.20 0.00 0.00 60.37 57.43 3fcv h HIS 49 Cb 2.00 -0.18 -0.29 0.00 1.55 0.00 0.00 27.41 30.49 3fcv h HIS 49 CO 0.11 0.23 0.52 0.66 -1.30 0.00 0.00 177.93 178.15 3fcv n TYR 50 N -4.86 2.91 0.22 5.26 0.53 -0.48 -4.71 117.16 116.02 3fcv n TYR 50 Ca 0.11 -2.48 0.14 0.00 -1.02 0.00 0.00 57.90 54.64 3fcv n TYR 50 Cb 0.26 -1.09 0.76 0.00 -1.03 0.00 0.00 39.34 38.24 3fcv n TYR 50 CO 0.00 0.00 0.00 1.57 -1.02 0.00 0.00 176.86 177.41 3fcv h LYS 51 N 1.66 0.00 0.00 -0.72 2.10 -0.68 -0.89 116.57 118.04 3fcv h LYS 51 Ca 0.55 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 59.17 3fcv h LYS 51 Cb 1.52 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.85 3fcv h LYS 51 CO 1.25 0.00 -0.15 0.93 -2.00 0.00 0.00 179.45 179.48 3fcv h GLU 52 N 0.00 0.00 -0.73 0.07 3.07 -1.85 -2.95 114.58 112.19 3fcv h GLU 52 Ca 0.06 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 3fcv h GLU 52 Cb 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 3fcv h GLU 52 CO -0.00 0.15 0.00 0.72 -1.40 0.00 0.00 179.01 178.48 3fcv n HIS 53 N -3.37 1.04 0.25 4.33 8.25 -0.34 -4.58 115.22 120.80 3fcv n HIS 53 Ca -0.00 -0.51 0.14 0.00 -0.26 0.00 0.00 57.72 57.08 3fcv n HIS 53 Cb 0.35 -0.03 0.80 0.00 1.12 0.00 0.00 29.99 32.23 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 4.27 0.00 -0.24 0.41 4.64 -1.54 -0.57 113.55 120.52 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 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 3fcv h SER 54 CO 0.03 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.37 3fcv n GLU 55 N -4.07 2.37 -2.40 4.77 -0.58 -1.26 -4.91 120.64 114.55 3fcv n GLU 55 Ca -0.01 -2.11 -0.31 0.00 -0.42 0.00 0.00 57.16 54.30 3fcv n GLU 55 Cb 0.17 -1.48 -0.03 0.00 -0.57 0.00 0.00 31.44 29.54 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 -1.64 3.85 0.39 3.49 -1.52 -0.22 -4.98 119.66 119.03 3fcv s GLN 56 Ca 0.33 0.81 0.11 0.00 -1.95 0.00 0.00 55.36 54.66 3fcv s GLN 56 Cb 0.21 -2.18 0.81 0.00 -0.22 0.00 0.00 33.01 31.63 3fcv s GLN 56 CO 0.30 -0.28 1.91 0.66 -0.25 0.00 0.00 175.29 177.63 3fcv h SER 57 N 0.75 0.13 0.16 5.90 4.64 -1.93 -2.78 113.55 120.42 3fcv h SER 57 Ca -0.46 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3fcv h SER 57 Cb 1.19 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3fcv h SER 57 CO 0.62 0.34 -0.18 0.00 -0.87 0.00 0.00 176.83 176.75 3fcv n TYR 58 N -4.25 0.00 -0.15 4.77 0.18 -1.26 -4.50 117.16 111.96 3fcv n TYR 58 Ca -0.01 0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.72 3fcv n TYR 58 Cb 0.30 -0.09 0.02 0.00 -0.38 0.00 0.00 39.34 39.19 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 1.55 -0.56 -0.51 -3.48 3.04 -1.71 0.87 116.94 116.15 3fcv h PHE 59 Ca 0.00 0.05 -0.03 0.00 3.98 0.00 0.00 57.97 61.98 3fcv h PHE 59 Cb 0.50 0.32 -0.02 0.00 2.56 0.00 0.00 35.95 39.31 3fcv h PHE 59 CO 0.00 -0.30 0.22 -0.91 -2.02 0.00 0.00 178.31 175.29 3fcv h ASN 60 N -0.12 0.69 -0.34 0.41 2.35 -1.83 -1.30 115.58 115.43 3fcv h ASN 60 Ca 0.22 -0.16 -0.07 0.00 -0.55 0.00 0.00 56.30 55.75 3fcv h ASN 60 Cb 0.46 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 3fcv h ASN 60 CO -0.55 0.65 -0.01 0.44 -1.65 0.00 0.00 177.43 176.32 3fcv h ASP 61 N 0.67 0.68 -0.51 5.81 3.32 -1.73 -0.67 116.42 124.00 3fcv h ASP 61 Ca 0.17 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 3fcv h ASP 61 Cb 0.17 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 3fcv h ASP 61 CO -0.02 0.76 0.22 0.25 -1.72 0.00 0.00 179.24 178.73 3fcv h LEU 62 N 0.67 0.69 -0.14 1.55 5.85 -0.30 -1.03 115.31 122.61 3fcv h LEU 62 Ca 0.13 -0.15 -0.12 0.00 0.84 0.00 0.00 57.88 58.59 3fcv h LEU 62 Cb 0.43 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.28 3fcv h LEU 62 CO 0.02 0.65 -0.37 0.00 -0.34 0.00 0.00 178.44 178.40 3fcv h ASP 64 N 0.10 0.31 -0.54 0.00 3.32 -1.04 -1.31 116.42 117.26 3fcv h ASP 64 Ca -0.01 0.09 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 3fcv h ASP 64 Cb 0.98 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 3fcv h ASP 64 CO 0.08 0.15 0.03 0.15 -1.72 0.00 0.00 179.24 177.93 3fcv h PHE 65 N 0.47 1.04 0.00 4.55 3.04 -1.15 -2.69 116.94 122.19 3fcv h PHE 65 Ca 0.36 -0.16 0.00 0.00 3.98 0.00 0.00 57.97 62.16 3fcv h PHE 65 Cb 0.48 -0.28 0.00 0.00 2.56 0.00 0.00 35.95 38.71 3fcv h PHE 65 CO -0.15 0.92 0.00 0.52 -2.02 0.00 0.00 178.31 177.57 3fcv h MET 66 N 0.90 0.00 -0.33 1.11 2.86 -0.61 -2.55 114.93 116.31 3fcv h MET 66 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 3fcv h MET 66 Cb 0.49 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.15 3fcv h MET 66 CO 0.02 0.00 0.00 1.33 1.06 0.00 0.00 176.91 179.32 3fcv n VAL 67 N -3.06 1.06 1.31 -2.22 0.24 -0.91 -4.51 118.33 110.24 3fcv n VAL 67 Ca 0.01 -1.04 0.14 0.00 -2.04 0.00 0.00 64.34 61.40 3fcv n VAL 67 Cb 0.30 0.46 0.53 0.00 -1.47 0.00 0.00 33.84 33.66 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 0.43 0.56 -2.91 -1.34 3.41 -0.96 -4.85 113.62 107.96 3fcv n SER 68 Ca 0.12 -0.55 -0.09 0.00 -0.26 0.00 0.00 58.87 58.09 3fcv n SER 68 Cb 0.44 -0.03 0.02 0.00 -0.26 0.00 0.00 64.21 64.39 3fcv n SER 68 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3fcv s GLY 69 N -2.56 0.37 0.83 5.00 0.00 -1.26 -5.08 107.32 104.63 3fcv s GLY 69 Ca 0.25 -0.75 -0.11 0.00 0.00 0.00 0.00 44.72 44.11 3fcv s GLY 69 CO 0.51 -0.29 1.10 -4.14 0.00 0.00 0.00 173.10 170.28 3fcv s PRO 70 N -2.28 1.76 0.08 2.90 0.02 -1.21 -4.56 135.00 131.71 3fcv s PRO 70 Ca 0.16 1.11 -0.03 0.00 0.02 0.00 0.00 61.00 62.25 3fcv s PRO 70 Cb -0.05 -1.84 -0.03 0.00 0.02 0.00 0.00 34.50 32.59 3fcv s PRO 70 CO 0.11 -1.97 0.05 0.96 -0.33 0.00 0.00 177.00 175.82 3fcv s ILE 71 N -2.87 0.18 -0.14 2.83 -4.36 -0.04 -3.32 121.20 113.48 3fcv s ILE 71 Ca 0.63 -1.66 0.02 0.00 -0.26 0.00 0.00 60.65 59.37 3fcv s ILE 71 Cb -0.18 -1.57 0.02 0.00 1.25 0.00 0.00 42.46 41.98 3fcv s ILE 71 CO 0.57 -0.81 -0.18 -0.63 0.24 0.00 0.00 174.94 174.13 3fcv s ILE 72 N -3.93 1.77 -0.18 8.37 1.01 -0.99 -0.93 121.20 126.32 3fcv s ILE 72 Ca 0.09 -0.79 -0.14 0.00 0.00 0.00 0.00 60.65 59.82 3fcv s ILE 72 Cb 0.07 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 3fcv s ILE 72 CO -0.08 0.49 0.30 -0.94 0.00 0.00 0.00 174.94 174.71 3fcv s SER 73 N 1.08 6.39 -0.03 3.58 1.04 -0.75 -0.64 113.70 124.37 3fcv s SER 73 Ca -0.03 0.45 0.01 0.00 0.48 0.00 0.00 55.95 56.87 3fcv s SER 73 Cb -0.14 -2.18 0.02 0.00 0.10 0.00 0.00 66.02 63.81 3fcv s SER 73 CO -0.05 0.05 -0.04 -0.63 0.98 0.00 0.00 173.24 173.54 3fcv s ILE 74 N 0.77 0.48 -0.30 -1.02 1.01 0.27 -1.74 121.20 120.67 3fcv s ILE 74 Ca 0.16 -0.13 -0.13 0.00 0.00 0.00 0.00 60.65 60.54 3fcv s ILE 74 Cb -0.13 -0.49 -0.03 0.00 0.01 0.00 0.00 42.46 41.82 3fcv s ILE 74 CO 0.05 0.19 0.29 -0.69 0.00 0.00 0.00 174.94 174.79 3fcv s VAL 75 N 0.66 5.23 -0.10 2.92 1.01 -0.32 -0.14 120.40 129.66 3fcv s VAL 75 Ca -0.08 0.21 -0.05 0.00 0.00 0.00 0.00 61.98 62.05 3fcv s VAL 75 Cb -0.12 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 3fcv s VAL 75 CO -0.00 0.10 0.10 -0.31 0.00 0.00 0.00 175.10 174.99 3fcv s TYR 76 N 1.91 3.46 -0.05 5.22 1.51 -0.46 -1.20 117.35 127.73 3fcv s TYR 76 Ca 0.10 0.41 0.05 0.00 -1.01 0.00 0.00 57.07 56.63 3fcv s TYR 76 Cb -0.16 -1.88 -0.01 0.00 -0.11 0.00 0.00 41.96 39.80 3fcv s TYR 76 CO 0.11 0.65 -0.22 -2.00 -1.11 0.00 0.00 175.55 172.98 3fcv s GLU 77 N -1.06 2.27 0.00 -0.62 2.12 0.32 -1.17 118.70 120.55 3fcv s GLU 77 Ca 0.15 -0.80 0.00 0.00 0.36 0.00 0.00 54.97 54.69 3fcv s GLU 77 Cb -0.12 -1.94 0.00 0.00 0.26 0.00 0.00 34.13 32.33 3fcv s GLU 77 CO 0.05 0.33 0.00 0.41 -0.54 0.00 0.00 175.26 175.51 3fcv n GLY 78 N 3.01 0.65 3.60 -1.50 0.00 -0.75 -2.05 105.19 108.15 3fcv n GLY 78 Ca -0.18 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 3fcv n GLY 78 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3fcv s THR 79 N -2.00 3.40 -0.64 2.61 -1.32 -1.26 -0.42 115.64 116.01 3fcv s THR 79 Ca 0.00 0.41 -0.04 0.00 -1.21 0.00 0.00 61.69 60.85 3fcv s THR 79 Cb 0.00 -3.53 0.00 0.00 -1.51 0.00 0.00 72.50 67.46 3fcv s THR 79 CO 0.00 -0.33 0.55 0.47 -2.21 0.00 0.00 174.62 173.10 3fcv n ASP 80 N 10.40 -3.77 -0.30 8.08 10.43 -1.26 -4.85 116.55 135.28 3fcv n ASP 80 Ca 0.24 -0.26 -0.03 0.00 2.57 0.00 0.00 54.79 57.31 3fcv n ASP 80 Cb 0.46 -2.68 0.14 0.00 1.84 0.00 0.00 41.12 40.88 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 0.48 1.25 0.80 2.24 0.00 -1.70 -2.86 119.26 119.47 3fcv h ALA 81 Ca -0.27 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 3fcv h ALA 81 Cb 1.17 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.63 3fcv h ALA 81 CO 0.26 0.62 -0.39 0.82 0.00 0.00 0.00 179.25 180.57 3fcv h ILE 82 N 1.18 0.00 -0.56 0.00 2.04 -1.88 -1.33 117.51 116.96 3fcv h ILE 82 Ca 0.30 -0.01 -0.05 0.00 1.00 0.00 0.00 64.86 66.10 3fcv h ILE 82 Cb -0.00 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.05 3fcv h ILE 82 CO -0.05 0.00 0.13 0.77 0.00 0.00 0.00 178.15 179.00 3fcv h SER 83 N -1.09 0.82 -0.11 1.72 4.64 -1.89 -2.05 113.55 115.59 3fcv h SER 83 Ca -0.11 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.03 3fcv h SER 83 Cb 0.83 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.70 3fcv h SER 83 CO 0.18 0.80 -0.02 0.11 -0.87 0.00 0.00 176.83 177.04 3fcv h LYS 84 N 0.84 0.20 -0.23 4.77 1.57 -1.48 -1.80 116.57 120.44 3fcv h LYS 84 Ca 0.18 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.79 3fcv h LYS 84 Cb 0.32 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3fcv h LYS 84 CO 0.00 0.50 -0.27 0.82 -0.57 0.00 0.00 179.45 179.93 3fcv h ILE 85 N -0.10 1.27 -0.88 1.86 2.04 -1.22 -0.93 117.51 119.53 3fcv h ILE 85 Ca 0.03 -1.28 0.07 0.00 1.00 0.00 0.00 64.86 64.68 3fcv h ILE 85 Cb 0.42 1.39 -0.06 0.00 -0.74 0.00 0.00 36.82 37.83 3fcv h ILE 85 CO 0.01 0.40 0.58 0.03 0.00 0.00 0.00 178.15 179.17 3fcv h ARG 86 N 0.39 0.96 -0.17 2.37 2.47 -1.28 0.18 114.38 119.30 3fcv h ARG 86 Ca 0.06 -0.06 -0.03 0.00 -1.26 0.00 0.00 59.98 58.68 3fcv h ARG 86 Cb 0.67 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.77 3fcv h ARG 86 CO 0.05 0.63 -0.03 -0.09 0.56 0.00 0.00 179.97 181.10 3fcv h ARG 87 N 0.99 0.32 -0.91 0.04 9.65 -0.32 -2.63 114.38 121.52 3fcv h ARG 87 Ca 0.38 -0.12 0.11 0.00 -1.10 0.00 0.00 59.98 59.26 3fcv h ARG 87 Cb 0.22 -0.02 -0.07 0.00 -1.39 0.00 0.00 29.97 28.71 3fcv h ARG 87 CO -0.14 0.57 0.59 -0.07 2.80 0.00 0.00 179.97 183.71 3fcv h LEU 88 N 0.05 0.79 0.55 3.80 4.07 -0.80 -3.19 115.31 120.57 3fcv h LEU 88 Ca 0.05 0.03 -0.03 0.00 0.08 0.00 0.00 57.88 58.01 3fcv h LEU 88 Cb 0.44 -0.13 0.01 0.00 1.08 0.00 0.00 40.66 42.06 3fcv h LEU 88 CO 0.01 0.44 -0.26 -0.61 -1.08 0.00 0.00 178.44 176.94 3fcv h GLN 89 N 0.86 -0.71 0.00 1.13 4.15 -0.60 0.13 115.11 120.07 3fcv h GLN 89 Ca 0.44 0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.91 3fcv h GLN 89 Cb 0.50 0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.36 3fcv h GLN 89 CO -0.20 -0.47 0.00 0.41 -1.93 0.00 0.00 178.83 176.64 3fcv n GLY 90 N -1.40 1.29 3.68 2.39 0.00 -1.14 -1.33 105.19 108.67 3fcv n GLY 90 Ca -0.12 -1.79 -0.38 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.38 1.61 -0.13 1.61 2.85 -1.26 -4.85 115.26 114.70 3fcv n ASN 91 Ca 0.00 0.86 -0.00 0.00 -0.11 0.00 0.00 54.58 55.32 3fcv n ASN 91 Cb 0.00 -1.48 0.26 0.00 1.24 0.00 0.00 39.78 39.79 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 0.72 1.19 -3.34 -0.44 2.02 -1.95 -3.40 112.91 107.72 3fcv h THR 92 Ca -0.50 -0.54 -0.57 0.00 0.77 0.00 0.00 66.41 65.57 3fcv h THR 92 Cb 1.34 0.44 -0.06 0.00 -1.74 0.00 0.00 68.15 68.13 3fcv h THR 92 CO 0.53 0.22 0.28 0.21 0.37 0.00 0.00 175.52 177.13 3fcv s ASN 93 N -6.52 6.96 0.65 4.18 3.84 -1.26 -4.32 114.94 118.46 3fcv s ASN 93 Ca -0.10 1.17 0.38 0.00 0.21 0.00 0.00 52.86 54.52 3fcv s ASN 93 Cb 0.17 -2.44 2.08 0.00 -0.55 0.00 0.00 41.25 40.51 3fcv s ASN 93 CO 0.78 -0.30 2.22 -0.65 -2.79 0.00 0.00 177.10 176.36 3fcv h PRO 94 N 7.16 0.00 0.00 0.43 0.11 -1.86 0.57 132.00 138.41 3fcv h PRO 94 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3fcv h PRO 94 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3fcv h PRO 94 CO 0.80 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 178.52 3fcv h LEU 95 N 0.00 0.00 0.00 2.35 3.38 -1.95 -3.36 115.31 115.74 3fcv h LEU 95 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 3fcv h LEU 95 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3fcv h LEU 95 CO -0.00 0.00 -1.23 0.00 0.09 0.00 0.00 178.44 177.30 3fcv n ALA 96 N -2.08 2.16 -2.03 1.53 0.00 0.03 -5.00 120.51 115.11 3fcv n ALA 96 Ca 0.04 -0.13 -0.42 0.00 0.00 0.00 0.00 53.44 52.93 3fcv n ALA 96 Cb 0.51 -0.15 -0.03 0.00 0.00 0.00 0.00 19.45 19.78 3fcv n ALA 96 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3fcv s SER 97 N -2.62 6.69 0.17 0.00 1.04 -0.27 -4.70 113.70 114.01 3fcv s SER 97 Ca -0.02 2.43 -0.24 0.00 0.48 0.00 0.00 55.95 58.60 3fcv s SER 97 Cb 0.03 -2.58 -0.08 0.00 0.10 0.00 0.00 66.02 63.49 3fcv s SER 97 CO 0.20 -0.78 0.76 0.00 0.98 0.00 0.00 173.24 174.39 3fcv s ALA 98 N 1.75 3.45 0.32 5.32 0.00 -1.26 -4.52 121.76 126.82 3fcv s ALA 98 Ca 0.69 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 52.67 3fcv s ALA 98 Cb -0.39 -2.92 -0.12 0.00 0.00 0.00 0.00 23.12 19.69 3fcv s ALA 98 CO 0.31 0.30 1.31 -2.30 0.00 0.00 0.00 175.76 175.38 3fcv n PRO 99 N 1.44 2.12 0.00 0.00 -0.02 -1.26 -1.81 135.00 135.46 3fcv n PRO 99 Ca -0.05 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 3fcv n PRO 99 Cb 0.49 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 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 1.05 3.12 3.92 -1.23 0.00 -1.26 -4.95 105.19 105.83 3fcv n GLY 100 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.77 4.80 0.10 2.61 -4.23 -0.75 -4.95 115.64 110.45 3fcv s THR 101 Ca 0.00 0.01 -0.35 0.00 -1.18 0.00 0.00 61.69 60.18 3fcv s THR 101 Cb 0.00 -3.81 -0.15 0.00 1.34 0.00 0.00 72.50 69.88 3fcv s THR 101 CO 0.00 -0.74 1.57 0.40 -0.54 0.00 0.00 174.62 175.31 3fcv h ILE 102 N 0.30 0.04 -0.35 2.99 2.04 -0.68 -1.23 117.51 120.63 3fcv h ILE 102 Ca -0.47 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.33 3fcv h ILE 102 Cb 1.21 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 3fcv h ILE 102 CO 0.61 0.00 0.00 0.03 0.00 0.00 0.00 178.15 178.79 3fcv h ARG 103 N -0.87 0.62 -0.65 2.37 3.08 -1.45 -0.83 114.38 116.65 3fcv h ARG 103 Ca -0.03 -0.20 0.14 0.00 0.07 0.00 0.00 59.98 59.96 3fcv h ARG 103 Cb 0.80 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.76 3fcv h ARG 103 CO -0.16 0.74 0.45 0.78 -1.07 0.00 0.00 179.97 180.70 3fcv h GLY 104 N 0.43 0.47 0.33 0.04 0.00 -1.66 0.54 103.07 103.22 3fcv h GLY 104 Ca 0.10 -0.12 -0.27 0.00 0.00 0.00 0.00 47.33 47.03 3fcv h GLY 104 CO 0.02 0.05 -1.46 -0.55 0.00 0.00 0.00 176.54 174.60 3fcv h ASP 105 N 0.29 0.22 0.00 0.19 3.32 -1.06 -3.40 116.42 115.99 3fcv h ASP 105 Ca 0.31 -0.75 -0.24 0.00 0.02 0.00 0.00 57.03 56.38 3fcv h ASP 105 Cb 0.83 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 40.26 3fcv h ASP 105 CO -0.08 1.61 -1.89 0.18 -1.72 0.00 0.00 179.24 177.35 3fcv n LEU 106 N -4.04 1.15 -4.85 1.55 4.77 -0.33 -5.01 117.00 110.24 3fcv n LEU 106 Ca -0.29 -0.03 -0.34 0.00 -0.03 0.00 0.00 56.01 55.31 3fcv n LEU 106 Cb 0.84 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.84 3fcv n LEU 106 CO 0.32 0.49 0.30 0.00 -1.33 0.00 0.00 177.39 177.17 3fcv s ALA 107 N -2.31 3.50 -0.02 -1.18 0.00 0.16 -5.00 121.76 116.91 3fcv s ALA 107 Ca -0.12 -0.07 0.25 0.00 0.00 0.00 0.00 51.96 52.02 3fcv s ALA 107 Cb 0.04 -2.61 0.43 0.00 0.00 0.00 0.00 23.12 20.99 3fcv s ALA 107 CO 0.46 0.42 1.17 -1.71 0.00 0.00 0.00 175.76 176.10 3fcv n ASN 108 N 0.38 1.05 -3.67 0.00 5.15 -1.26 -4.69 115.26 112.22 3fcv n ASN 108 Ca -0.02 -2.05 -0.14 0.00 -0.60 0.00 0.00 54.58 51.77 3fcv n ASN 108 Cb 0.52 -0.32 -0.08 0.00 -0.53 0.00 0.00 39.78 39.37 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 -2.13 -0.59 0.37 1.20 -1.08 -1.26 -4.98 116.67 108.20 3fcv s ASP 109 Ca 0.34 1.11 0.17 0.00 -0.52 0.00 0.00 52.55 53.64 3fcv s ASP 109 Cb 0.39 1.12 0.70 0.00 -1.46 0.00 0.00 42.92 43.67 3fcv s ASP 109 CO -0.16 -0.23 1.76 -0.29 0.52 0.00 0.00 175.17 176.77 3fcv h ILE 110 N 4.14 1.02 0.00 4.11 2.10 -1.97 -3.30 117.51 123.61 3fcv h ILE 110 Ca -0.28 -1.49 -0.08 0.00 1.08 0.00 0.00 64.86 64.09 3fcv h ILE 110 Cb 1.17 1.87 -0.01 0.00 -1.09 0.00 0.00 36.82 38.75 3fcv h ILE 110 CO 0.16 0.38 -0.61 1.23 -1.08 0.00 0.00 178.15 178.24 3fcv h GLY 111 N 1.74 0.00 -7.47 8.18 0.00 -1.97 -3.42 103.07 100.14 3fcv h GLY 111 Ca -0.00 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.64 3fcv h GLY 111 CO 0.05 0.00 1.11 -0.54 0.00 0.00 0.00 176.54 177.16 3fcv s GLU 112 N -2.17 3.71 -0.14 4.80 2.02 -1.24 -4.78 118.70 120.90 3fcv s GLU 112 Ca -0.18 -1.83 0.17 0.00 0.02 0.00 0.00 54.97 53.16 3fcv s GLU 112 Cb 0.02 -5.05 0.35 0.00 0.10 0.00 0.00 34.13 29.55 3fcv s GLU 112 CO 0.38 -1.87 1.23 0.27 0.02 0.00 0.00 175.26 175.29 3fcv n ASN 113 N 6.84 2.80 0.00 -0.19 0.23 -1.25 -4.07 115.26 119.62 3fcv n ASN 113 Ca 0.29 -2.99 0.00 0.00 -0.53 0.00 0.00 54.58 51.35 3fcv n ASN 113 Cb 0.48 -0.44 0.00 0.00 -2.08 0.00 0.00 39.78 37.74 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 -1.08 0.00 -3.89 -4.53 4.77 -1.26 -4.79 117.00 106.22 3fcv n LEU 114 Ca 0.17 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.03 3fcv n LEU 114 Cb 0.69 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.65 3fcv n LEU 114 CO 0.05 0.00 -0.36 -0.51 -1.33 0.00 0.00 177.39 175.24 3fcv s ILE 115 N 0.00 0.02 0.12 -0.08 2.07 -1.26 -0.52 121.20 121.55 3fcv s ILE 115 Ca 0.00 -0.17 0.06 0.00 -1.41 0.00 0.00 60.65 59.14 3fcv s ILE 115 Cb 0.00 -0.06 -0.04 0.00 0.13 0.00 0.00 42.46 42.49 3fcv s ILE 115 CO 0.00 -0.09 -0.03 -2.28 -1.91 0.00 0.00 174.94 170.63 3fcv s HIS 116 N -0.26 2.86 -0.19 3.50 5.65 -0.04 -4.95 115.29 121.85 3fcv s HIS 116 Ca -0.03 -0.10 -0.11 0.00 0.25 0.00 0.00 55.06 55.07 3fcv s HIS 116 Cb -0.02 -1.45 0.06 0.00 -1.18 0.00 0.00 32.58 29.99 3fcv s HIS 116 CO -0.00 0.48 0.47 0.00 -0.65 0.00 0.00 174.74 175.03 3fcv s ALA 117 N -1.43 -1.22 0.41 1.58 0.00 -1.26 -1.79 121.76 118.06 3fcv s ALA 117 Ca 0.25 1.70 -0.23 0.00 0.00 0.00 0.00 51.96 53.68 3fcv s ALA 117 Cb -0.11 -1.02 -0.12 0.00 0.00 0.00 0.00 23.12 21.87 3fcv s ALA 117 CO 0.17 -0.29 0.70 0.43 0.00 0.00 0.00 175.76 176.78 3fcv n SER 118 N 4.20 -0.17 -0.66 0.00 7.64 -0.82 -4.91 113.62 118.91 3fcv n SER 118 Ca -0.22 0.96 0.08 0.00 1.01 0.00 0.00 58.87 60.70 3fcv n SER 118 Cb 0.56 -1.19 0.08 0.00 -1.01 0.00 0.00 64.21 62.65 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 1.04 2.40 -3.71 6.43 5.75 -1.26 -4.79 116.55 122.42 3fcv n ASP 119 Ca 0.11 -1.69 -0.04 0.00 -0.01 0.00 0.00 54.79 53.16 3fcv n ASP 119 Cb 0.39 -0.03 -0.01 0.00 -1.03 0.00 0.00 41.12 40.43 3fcv n ASP 119 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3fcv s SER 120 N -1.28 -0.21 0.15 -1.12 1.04 -1.26 -4.97 113.70 106.04 3fcv s SER 120 Ca 0.20 -0.33 -0.17 0.00 0.48 0.00 0.00 55.95 56.13 3fcv s SER 120 Cb 0.13 0.47 0.05 0.00 0.10 0.00 0.00 66.02 66.78 3fcv s SER 120 CO 0.20 -0.86 1.72 -0.33 0.98 0.00 0.00 173.24 174.96 3fcv h GLU 121 N 2.00 0.15 -0.32 4.02 5.08 -1.96 -0.59 114.58 122.96 3fcv h GLU 121 Ca -0.24 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.05 3fcv h GLU 121 Cb 1.23 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 3fcv h GLU 121 CO 0.26 0.10 -0.03 -0.44 -1.00 0.00 0.00 179.01 177.90 3fcv h ASP 122 N 0.15 0.59 -0.03 1.42 3.32 -2.00 -2.53 116.42 117.34 3fcv h ASP 122 Ca 0.15 -0.33 -0.13 0.00 0.02 0.00 0.00 57.03 56.74 3fcv h ASP 122 Cb 0.18 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 3fcv h ASP 122 CO -0.22 0.78 -0.41 0.77 -1.72 0.00 0.00 179.24 178.44 3fcv h SER 123 N 0.38 0.58 -0.76 6.45 4.64 -1.94 -2.68 113.55 120.22 3fcv h SER 123 Ca 0.09 -0.26 -0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3fcv h SER 123 Cb 0.50 -0.16 -0.04 0.00 -0.31 0.00 0.00 62.40 62.39 3fcv h SER 123 CO 0.02 0.93 0.46 0.00 -0.87 0.00 0.00 176.83 177.37 3fcv h ALA 124 N 1.10 1.36 -0.55 5.18 0.00 -1.03 -0.14 119.26 125.18 3fcv h ALA 124 Ca 0.04 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3fcv h ALA 124 Cb 0.91 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3fcv h ALA 124 CO 0.08 0.55 -0.04 0.28 0.00 0.00 0.00 179.25 180.12 3fcv h VAL 125 N 1.06 1.27 0.41 0.00 2.07 -1.15 -1.11 116.25 118.79 3fcv h VAL 125 Ca 0.28 -1.18 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 3fcv h VAL 125 Cb -0.04 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3fcv h VAL 125 CO -0.05 0.42 -0.19 0.44 0.02 0.00 0.00 177.57 178.20 3fcv h ASP 126 N 0.89 -0.46 -0.61 0.57 3.45 -1.17 -2.89 116.42 116.19 3fcv h ASP 126 Ca 0.15 -0.12 0.10 0.00 0.43 0.00 0.00 57.03 57.59 3fcv h ASP 126 Cb 0.59 0.12 -0.04 0.00 -0.56 0.00 0.00 39.33 39.44 3fcv h ASP 126 CO 0.04 -0.07 0.41 -0.33 -1.57 0.00 0.00 179.24 177.71 3fcv h GLU 127 N -0.92 0.41 -0.28 3.56 5.08 -1.03 0.04 114.58 121.44 3fcv h GLU 127 Ca -0.06 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.14 3fcv h GLU 127 Cb 0.55 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 3fcv h GLU 127 CO 0.09 0.27 -0.39 0.82 -1.00 0.00 0.00 179.01 178.80 3fcv h ILE 128 N 0.43 1.29 0.00 3.13 2.04 -1.24 -2.85 117.51 120.31 3fcv h ILE 128 Ca 0.28 -1.56 0.00 0.00 1.00 0.00 0.00 64.86 64.59 3fcv h ILE 128 Cb 0.55 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3fcv h ILE 128 CO -0.08 0.50 0.00 0.77 0.00 0.00 0.00 178.15 179.34 3fcv h SER 129 N 0.55 0.00 0.12 1.72 4.64 -0.81 -1.37 113.55 118.40 3fcv h SER 129 Ca 0.05 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.11 3fcv h SER 129 Cb 0.92 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.02 3fcv h SER 129 CO 0.08 0.00 -1.03 0.40 -0.87 0.00 0.00 176.83 175.41 3fcv h ILE 130 N 0.00 1.32 0.00 0.95 2.04 -1.03 -3.29 117.51 117.50 3fcv h ILE 130 Ca 0.00 -2.33 -0.00 0.00 1.00 0.00 0.00 64.86 63.53 3fcv h ILE 130 Cb 0.73 2.42 -0.00 0.00 -0.74 0.00 0.00 36.82 39.24 3fcv h ILE 130 CO 0.00 0.71 -1.85 0.79 0.00 0.00 0.00 178.15 177.80 3fcv n TRP 131 N -3.81 0.15 -3.33 1.37 7.02 -1.14 -4.65 117.44 113.05 3fcv n TRP 131 Ca -0.10 0.04 -0.26 0.00 -1.02 0.00 0.00 57.50 56.17 3fcv n TRP 131 Cb 0.88 -0.57 -0.09 0.00 -2.42 0.00 0.00 31.31 29.11 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 -2.32 -0.18 1.89 -5.99 3.72 -0.52 -5.03 117.46 109.03 3fcv n PHE 132 Ca -0.04 -3.53 0.15 0.00 -0.05 0.00 0.00 57.45 53.99 3fcv n PHE 132 Cb 0.57 -0.11 0.90 0.00 -0.94 0.00 0.00 39.48 39.90 3fcv n PHE 132 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41