#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fcw s GLN 2 N 0.00 1.97 0.01 1.96 -0.21 0.09 -4.82 119.66 118.66 3fcw s GLN 2 Ca 0.00 -1.11 0.07 0.00 0.02 0.00 0.00 55.36 54.34 3fcw s GLN 2 Cb 0.00 -2.41 -0.02 0.00 1.00 0.00 0.00 33.01 31.58 3fcw s GLN 2 CO 0.00 -1.19 -0.21 1.03 -2.12 0.00 0.00 175.29 172.80 3fcw s ARG 3 N -4.98 1.58 0.03 2.91 1.81 -1.26 -2.52 118.95 116.52 3fcw s ARG 3 Ca 0.64 -0.86 -0.01 0.00 -1.72 0.00 0.00 55.73 53.77 3fcw s ARG 3 Cb -0.07 -1.62 -0.03 0.00 -0.45 0.00 0.00 34.95 32.79 3fcw s ARG 3 CO 0.42 0.43 -0.01 -0.08 -0.68 0.00 0.00 175.30 175.38 3fcw s THR 4 N -0.65 0.16 -0.17 0.02 -1.32 -0.30 -4.67 115.64 108.71 3fcw s THR 4 Ca 0.08 -1.30 -0.07 0.00 -1.21 0.00 0.00 61.69 59.19 3fcw s THR 4 Cb -0.09 -0.86 -0.04 0.00 -1.51 0.00 0.00 72.50 70.00 3fcw s THR 4 CO 0.00 -0.72 0.08 -0.22 -2.21 0.00 0.00 174.62 171.56 3fcw s LEU 5 N -2.14 3.95 -0.08 9.08 0.20 -1.26 -0.67 118.68 127.75 3fcw s LEU 5 Ca -0.05 0.17 0.03 0.00 0.69 0.00 0.00 54.13 54.97 3fcw s LEU 5 Cb -0.01 -1.99 0.01 0.00 -0.43 0.00 0.00 46.19 43.76 3fcw s LEU 5 CO -0.05 0.23 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.38 3fcw s VAL 6 N 0.02 1.54 -0.19 1.68 1.01 0.13 -2.07 120.40 122.52 3fcw s VAL 6 Ca 0.07 -0.72 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 3fcw s VAL 6 Cb -0.12 -1.36 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 3fcw s VAL 6 CO 0.00 0.44 0.10 -0.76 0.00 0.00 0.00 175.10 174.89 3fcw s LEU 7 N 0.48 4.04 -0.39 3.92 1.43 0.43 -0.98 118.68 127.60 3fcw s LEU 7 Ca -0.16 0.18 -0.13 0.00 -1.03 0.00 0.00 54.13 52.99 3fcw s LEU 7 Cb -0.16 -2.03 0.02 0.00 0.03 0.00 0.00 46.19 44.05 3fcw s LEU 7 CO 0.06 0.19 0.25 -0.63 0.23 0.00 0.00 176.35 176.45 3fcw s ILE 8 N 0.26 4.89 0.83 -0.59 1.01 0.08 -0.23 121.20 127.45 3fcw s ILE 8 Ca 0.06 -0.77 -0.12 0.00 0.00 0.00 0.00 60.65 59.82 3fcw s ILE 8 Cb -0.12 -3.73 0.09 0.00 0.01 0.00 0.00 42.46 38.72 3fcw s ILE 8 CO -0.01 -0.27 1.12 -0.54 0.00 0.00 0.00 174.94 175.24 3fcw s LYS 9 N 1.61 1.79 0.12 2.79 1.02 -0.37 -2.04 119.74 124.67 3fcw s LYS 9 Ca 0.03 0.47 0.19 0.00 0.02 0.00 0.00 55.97 56.69 3fcw s LYS 9 Cb -0.19 -1.90 0.81 0.00 -0.52 0.00 0.00 37.83 36.03 3fcw s LYS 9 CO 0.08 -1.79 1.60 -2.30 -0.92 0.00 0.00 175.35 172.03 3fcw n PRO 10 N -3.52 0.10 0.15 -1.68 -0.02 -1.23 -1.91 135.00 126.89 3fcw n PRO 10 Ca 0.07 0.32 -0.00 0.00 -2.02 0.00 0.00 63.50 61.87 3fcw n PRO 10 Cb 0.58 -1.68 0.22 0.00 -0.02 0.00 0.00 33.50 32.60 3fcw n PRO 10 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 3fcw h ASP 11 N 0.00 0.00 -0.00 2.55 2.03 -1.91 -2.80 116.42 116.29 3fcw h ASP 11 Ca 0.00 -0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 56.23 3fcw h ASP 11 Cb 0.32 -0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.81 3fcw h ASP 11 CO 0.00 0.55 -0.18 0.00 -1.03 0.00 0.00 179.24 178.58 3fcw h ALA 12 N 1.45 1.33 0.01 4.15 0.00 -1.66 0.36 119.26 124.90 3fcw h ALA 12 Ca -0.01 -0.27 -0.23 0.00 0.00 0.00 0.00 54.91 54.41 3fcw h ALA 12 Cb 0.97 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3fcw h ALA 12 CO 0.07 0.45 -0.96 0.74 0.00 0.00 0.00 179.25 179.55 3fcw h PHE 13 N 0.31 0.59 -0.12 0.00 -1.00 -1.63 0.27 116.94 115.36 3fcw h PHE 13 Ca 0.06 -0.33 -0.01 0.00 2.81 0.00 0.00 57.97 60.50 3fcw h PHE 13 Cb 0.50 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.99 3fcw h PHE 13 CO 0.01 1.15 0.03 1.49 -1.61 0.00 0.00 178.31 179.39 3fcw h GLU 14 N 0.21 0.19 -0.10 1.51 4.22 -1.17 -2.88 114.58 116.57 3fcw h GLU 14 Ca -0.08 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.31 3fcw h GLU 14 Cb 1.61 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.83 3fcw h GLU 14 CO 0.17 0.35 0.00 0.54 -2.18 0.00 0.00 179.01 177.89 3fcw n ARG 15 N -4.86 1.62 -3.51 1.92 1.74 0.07 -4.96 116.66 108.68 3fcw n ARG 15 Ca -0.05 -0.93 -0.20 0.00 -0.77 0.00 0.00 57.85 55.90 3fcw n ARG 15 Cb 0.15 -1.42 0.08 0.00 -1.02 0.00 0.00 32.46 30.25 3fcw n ARG 15 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3fcw n SER 16 N 0.14 -3.07 -0.64 0.55 7.64 -0.45 -4.92 113.62 112.87 3fcw n SER 16 Ca 0.17 -0.63 0.07 0.00 1.01 0.00 0.00 58.87 59.49 3fcw n SER 16 Cb 0.31 -4.96 0.18 0.00 -1.01 0.00 0.00 64.21 58.73 3fcw n SER 16 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3fcw n LEU 17 N -4.37 3.19 0.37 -3.43 4.77 0.82 -4.74 117.00 113.61 3fcw n LEU 17 Ca -0.21 -2.51 -0.18 0.00 -0.03 0.00 0.00 56.01 53.08 3fcw n LEU 17 Cb 0.64 -0.36 -0.09 0.00 -2.33 0.00 0.00 43.42 41.28 3fcw n LEU 17 CO 0.63 0.68 0.65 0.58 -1.33 0.00 0.00 177.39 178.60 3fcw h VAL 18 N 1.58 0.33 -0.46 4.08 2.07 -1.91 -1.50 116.25 120.43 3fcw h VAL 18 Ca 0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 3fcw h VAL 18 Cb 1.03 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 3fcw h VAL 18 CO 0.09 0.00 0.11 0.00 0.02 0.00 0.00 177.57 177.79 3fcw h ALA 19 N -0.58 1.33 -0.18 1.67 0.00 -1.93 -1.37 119.26 118.19 3fcw h ALA 19 Ca -0.09 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.65 3fcw h ALA 19 Cb 0.70 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3fcw h ALA 19 CO 0.15 0.48 0.07 1.49 0.00 0.00 0.00 179.25 181.43 3fcw h GLU 20 N 0.67 0.16 -0.22 0.00 4.57 -1.83 0.34 114.58 118.28 3fcw h GLU 20 Ca 0.15 -0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.22 3fcw h GLU 20 Cb 0.26 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.81 3fcw h GLU 20 CO -0.00 0.11 -0.27 0.82 -1.18 0.00 0.00 179.01 178.48 3fcw h ILE 21 N 0.17 1.32 -0.49 2.32 2.04 -0.89 -2.56 117.51 119.42 3fcw h ILE 21 Ca 0.08 -1.46 -0.11 0.00 1.00 0.00 0.00 64.86 64.37 3fcw h ILE 21 Cb 0.04 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 3fcw h ILE 21 CO -0.07 0.45 -0.13 0.24 0.00 0.00 0.00 178.15 178.64 3fcw h MET 22 N 0.27 0.92 -0.21 2.37 2.86 -1.19 -2.80 114.93 117.14 3fcw h MET 22 Ca 0.03 -0.33 0.03 0.00 -2.06 0.00 0.00 59.70 57.36 3fcw h MET 22 Cb 0.84 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 3fcw h MET 22 CO 0.06 0.99 0.15 0.78 1.06 0.00 0.00 176.91 179.95 3fcw h GLY 23 N 0.95 0.19 1.39 8.32 0.00 -0.22 -0.95 103.07 112.75 3fcw h GLY 23 Ca 0.13 -0.07 -0.17 0.00 0.00 0.00 0.00 47.33 47.22 3fcw h GLY 23 CO 0.05 0.06 -0.59 3.21 0.00 0.00 0.00 176.54 179.27 3fcw h ARG 24 N 0.17 0.63 -0.05 4.80 3.08 -1.18 -1.75 114.38 120.08 3fcw h ARG 24 Ca 0.09 -0.42 -0.22 0.00 0.07 0.00 0.00 59.98 59.50 3fcw h ARG 24 Cb 0.16 0.06 0.02 0.00 0.08 0.00 0.00 29.97 30.28 3fcw h ARG 24 CO -0.01 1.04 -0.84 0.82 -1.07 0.00 0.00 179.97 179.91 3fcw h ILE 25 N 0.48 1.32 -0.54 2.04 2.04 -1.37 -3.11 117.51 118.37 3fcw h ILE 25 Ca 0.00 -2.10 0.03 0.00 1.00 0.00 0.00 64.86 63.79 3fcw h ILE 25 Cb 1.16 2.32 -0.04 0.00 -0.74 0.00 0.00 36.82 39.52 3fcw h ILE 25 CO 0.12 0.65 0.31 -0.08 0.00 0.00 0.00 178.15 179.14 3fcw h GLU 26 N 0.30 0.59 0.00 2.37 4.81 -1.20 -2.45 114.58 119.00 3fcw h GLU 26 Ca -0.09 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 3fcw h GLU 26 Cb 1.50 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.74 3fcw h GLU 26 CO 0.17 0.39 -0.08 0.87 -0.73 0.00 0.00 179.01 179.62 3fcw h LYS 27 N 0.61 0.00 -0.29 1.92 1.57 -1.29 0.35 116.57 119.44 3fcw h LYS 27 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 3fcw h LYS 27 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3fcw h LYS 27 CO -0.12 0.08 0.00 1.17 -0.57 0.00 0.00 179.45 180.02 3fcw n LYS 28 N -3.62 1.68 -2.43 3.15 4.81 -0.93 -4.91 118.16 115.91 3fcw n LYS 28 Ca -0.02 -1.05 -0.07 0.00 -0.87 0.00 0.00 58.31 56.30 3fcw n LYS 28 Cb 0.20 -1.24 0.01 0.00 0.02 0.00 0.00 35.03 34.02 3fcw n LYS 28 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 3fcw n ASN 29 N 0.35 -2.93 -4.89 3.14 4.05 0.12 -5.05 115.26 110.05 3fcw n ASN 29 Ca 0.10 -0.07 -0.31 0.00 0.45 0.00 0.00 54.58 54.75 3fcw n ASN 29 Cb 0.25 -1.94 -0.05 0.00 1.23 0.00 0.00 39.78 39.27 3fcw n ASN 29 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 3fcw s PHE 30 N -2.65 3.46 0.04 1.20 0.40 -1.15 -4.88 117.98 114.40 3fcw s PHE 30 Ca 0.08 0.67 0.08 0.00 -0.60 0.00 0.00 56.93 57.15 3fcw s PHE 30 Cb -0.03 -2.10 -0.03 0.00 0.51 0.00 0.00 43.02 41.36 3fcw s PHE 30 CO 0.10 0.33 -0.22 0.15 0.70 0.00 0.00 175.22 176.27 3fcw s LYS 31 N -2.91 1.97 -0.43 0.44 -0.14 -0.24 -4.48 119.74 113.94 3fcw s LYS 31 Ca 0.44 -1.03 -0.28 0.00 -1.36 0.00 0.00 55.97 53.74 3fcw s LYS 31 Cb -0.11 -2.10 0.00 0.00 -1.68 0.00 0.00 37.83 33.94 3fcw s LYS 31 CO 0.25 0.53 1.55 0.42 -0.76 0.00 0.00 175.35 177.33 3fcw s ILE 32 N -0.85 3.73 -0.08 2.17 1.01 -1.26 0.09 121.20 126.00 3fcw s ILE 32 Ca 0.13 0.71 -0.07 0.00 0.00 0.00 0.00 60.65 61.42 3fcw s ILE 32 Cb -0.10 -4.08 -0.05 0.00 0.01 0.00 0.00 42.46 38.23 3fcw s ILE 32 CO 0.03 -0.76 0.27 0.58 0.00 0.00 0.00 174.94 175.07 3fcw h VAL 33 N 6.57 0.19 -3.99 2.92 2.07 -0.90 -3.48 116.25 119.63 3fcw h VAL 33 Ca -0.29 -1.01 -0.11 0.00 0.82 0.00 0.00 66.70 66.11 3fcw h VAL 33 Cb 1.12 0.34 -0.14 0.00 -1.52 0.00 0.00 31.29 31.09 3fcw h VAL 33 CO 1.10 0.06 -0.46 -0.94 0.02 0.00 0.00 177.57 177.35 3fcw s SER 34 N -5.44 0.20 -0.27 0.57 1.04 -1.22 -4.99 113.70 103.59 3fcw s SER 34 Ca -0.04 -0.84 -0.15 0.00 0.48 0.00 0.00 55.95 55.40 3fcw s SER 34 Cb 0.00 0.33 0.08 0.00 0.10 0.00 0.00 66.02 66.53 3fcw s SER 34 CO 0.14 -0.74 0.66 -0.32 0.98 0.00 0.00 173.24 173.97 3fcw s MET 35 N -3.92 0.67 -0.08 4.02 0.00 -1.26 -0.37 119.30 118.36 3fcw s MET 35 Ca 0.10 1.22 0.03 0.00 0.00 0.00 0.00 55.69 57.04 3fcw s MET 35 Cb 0.05 0.19 0.00 0.00 0.00 0.00 0.00 34.83 35.08 3fcw s MET 35 CO -0.07 -0.16 -0.19 0.15 0.00 0.00 0.00 175.02 174.76 3fcw s LYS 36 N 1.74 2.43 -0.47 4.11 1.02 0.67 -4.96 119.74 124.28 3fcw s LYS 36 Ca -0.10 -0.68 -0.16 0.00 0.02 0.00 0.00 55.97 55.06 3fcw s LYS 36 Cb -0.06 -1.90 0.07 0.00 -0.52 0.00 0.00 37.83 35.42 3fcw s LYS 36 CO -0.19 0.13 0.40 0.12 -0.92 0.00 0.00 175.35 174.88 3fcw s PHE 37 N 0.44 3.23 -0.51 3.18 5.36 -1.26 -0.54 117.98 127.89 3fcw s PHE 37 Ca -0.16 -0.86 -0.20 0.00 -0.96 0.00 0.00 56.93 54.75 3fcw s PHE 37 Cb -0.17 -3.13 0.05 0.00 -0.34 0.00 0.00 43.02 39.44 3fcw s PHE 37 CO 0.06 -0.79 0.67 -1.58 -1.46 0.00 0.00 175.22 172.13 3fcw s TRP 38 N 1.71 3.01 0.54 10.12 0.52 -0.41 -4.92 118.94 129.50 3fcw s TRP 38 Ca 0.05 -0.42 0.21 0.00 0.02 0.00 0.00 56.10 55.96 3fcw s TRP 38 Cb -0.23 -3.60 1.42 0.00 -1.15 0.00 0.00 33.47 29.91 3fcw s TRP 38 CO 0.07 -1.07 2.14 0.66 0.02 0.00 0.00 176.95 178.78 3fcw h SER 39 N 9.03 0.00 -2.35 2.95 4.64 -1.93 0.23 113.55 126.12 3fcw h SER 39 Ca -0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.03 3fcw h SER 39 Cb 1.09 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 62.94 3fcw h SER 39 CO 0.98 0.00 -0.24 -0.75 -0.87 0.00 0.00 176.83 175.94 3fcw s LYS 40 N -4.94 0.46 -0.39 4.77 2.20 -1.26 -2.82 119.74 117.75 3fcw s LYS 40 Ca -0.05 1.22 -0.29 0.00 -0.36 0.00 0.00 55.97 56.49 3fcw s LYS 40 Cb 0.17 0.54 0.02 0.00 -1.51 0.00 0.00 37.83 37.05 3fcw s LYS 40 CO 0.65 -0.22 1.14 0.00 -0.36 0.00 0.00 175.35 176.55 3fcw s ALA 41 N 2.63 3.31 -0.20 3.13 0.00 -1.26 -4.93 121.76 124.44 3fcw s ALA 41 Ca -0.04 -0.24 -0.18 0.00 0.00 0.00 0.00 51.96 51.49 3fcw s ALA 41 Cb -0.11 -3.80 -0.08 0.00 0.00 0.00 0.00 23.12 19.13 3fcw s ALA 41 CO -0.16 -1.90 0.70 -2.30 0.00 0.00 0.00 175.76 172.10 3fcw n PRO 42 N 7.40 0.00 0.31 0.00 -0.02 -1.26 -4.74 135.00 136.70 3fcw n PRO 42 Ca 0.12 0.00 0.19 0.00 -2.02 0.00 0.00 63.50 61.79 3fcw n PRO 42 Cb 0.48 -0.60 1.05 0.00 -0.02 0.00 0.00 33.50 34.41 3fcw n PRO 42 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3fcw h ARG 43 N 2.44 0.00 -0.20 -0.52 2.43 -1.99 -1.22 114.38 115.32 3fcw h ARG 43 Ca -0.14 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 58.91 3fcw h ARG 43 Cb 0.55 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 3fcw h ARG 43 CO 0.40 0.00 -0.36 -2.95 -1.51 0.00 0.00 179.97 175.56 3fcw h ASN 44 N 0.00 0.66 -0.53 -3.80 -1.07 -1.98 0.02 115.58 108.87 3fcw h ASN 44 Ca 0.01 -0.54 0.10 0.00 0.07 0.00 0.00 56.30 55.94 3fcw h ASN 44 Cb 0.05 -0.19 -0.08 0.00 -2.07 0.00 0.00 38.32 36.03 3fcw h ASN 44 CO -0.00 1.07 0.03 -0.07 0.07 0.00 0.00 177.43 178.53 3fcw h LEU 45 N 0.27 -0.16 -0.13 6.14 4.07 -1.57 0.68 115.31 124.60 3fcw h LEU 45 Ca 0.01 0.12 -0.02 0.00 0.08 0.00 0.00 57.88 58.08 3fcw h LEU 45 Cb 0.95 0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.89 3fcw h LEU 45 CO 0.08 -0.05 0.02 0.40 -1.08 0.00 0.00 178.44 177.81 3fcw h ILE 46 N 0.15 1.21 -0.67 1.22 1.08 -1.45 0.28 117.51 119.34 3fcw h ILE 46 Ca 0.27 -0.68 0.02 0.00 -0.39 0.00 0.00 64.86 64.09 3fcw h ILE 46 Cb 0.41 1.41 -0.04 0.00 -3.07 0.00 0.00 36.82 35.53 3fcw h ILE 46 CO -0.42 0.20 0.42 -0.08 -0.69 0.00 0.00 178.15 177.58 3fcw h GLU 47 N 0.00 0.81 -0.06 2.37 4.81 -0.50 -1.16 114.58 120.84 3fcw h GLU 47 Ca 0.04 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 3fcw h GLU 47 Cb 0.29 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 3fcw h GLU 47 CO 0.00 0.53 -0.32 1.96 -0.73 0.00 0.00 179.01 180.45 3fcw h GLN 48 N 0.83 -0.35 -0.60 1.92 1.08 0.54 -0.39 115.11 118.14 3fcw h GLN 48 Ca 0.26 0.02 0.11 0.00 -1.45 0.00 0.00 58.65 57.60 3fcw h GLN 48 Cb -0.01 0.08 -0.12 0.00 -0.05 0.00 0.00 27.48 27.39 3fcw h GLN 48 CO -0.09 -0.23 -0.27 1.25 -0.95 0.00 0.00 178.83 178.54 3fcw h HIS 49 N -0.36 -0.69 -0.01 2.96 2.76 -0.17 -0.99 115.15 118.64 3fcw h HIS 49 Ca 0.02 0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 3fcw h HIS 49 Cb 0.41 0.40 0.00 0.00 1.55 0.00 0.00 27.41 29.77 3fcw h HIS 49 CO -0.51 -0.35 -0.10 0.66 -1.30 0.00 0.00 177.93 176.33 3fcw n TYR 50 N -5.44 0.00 0.00 5.26 4.02 -0.51 -4.53 117.16 115.96 3fcw n TYR 50 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.95 3fcw n TYR 50 Cb 0.35 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.61 3fcw n TYR 50 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 3fcw n LYS 51 N -0.33 0.00 0.00 -0.72 4.81 -0.16 0.26 118.16 122.02 3fcw n LYS 51 Ca 0.17 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.66 3fcw n LYS 51 Cb 0.32 0.00 0.31 0.00 0.02 0.00 0.00 35.03 35.68 3fcw n LYS 51 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 3fcw n GLU 52 N 0.00 0.28 -0.00 1.64 4.07 -1.26 -1.94 120.64 123.43 3fcw n GLU 52 Ca 0.00 0.06 0.04 0.00 -0.06 0.00 0.00 57.16 57.20 3fcw n GLU 52 Cb 0.00 -1.50 -0.05 0.00 -0.06 0.00 0.00 31.44 29.83 3fcw n GLU 52 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 3fcw n HIS 53 N -1.08 0.00 0.27 4.31 8.25 0.73 -4.71 115.22 122.99 3fcw n HIS 53 Ca 0.07 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.64 3fcw n HIS 53 Cb 0.05 -0.00 0.56 0.00 1.12 0.00 0.00 29.99 31.72 3fcw n HIS 53 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3fcw h SER 54 N 0.00 0.00 -0.59 0.41 4.64 -1.45 0.77 113.55 117.33 3fcw h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fcw h SER 54 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3fcw h SER 54 CO 0.00 0.00 0.00 1.21 -0.87 0.00 0.00 176.83 177.17 3fcw n GLU 55 N -2.53 3.85 -4.08 4.77 4.07 -1.26 -4.91 120.64 120.54 3fcw n GLU 55 Ca -0.01 -2.75 -0.32 0.00 -0.06 0.00 0.00 57.16 54.02 3fcw n GLU 55 Cb 0.42 -1.96 -0.07 0.00 -0.06 0.00 0.00 31.44 29.78 3fcw n GLU 55 CO 0.00 0.00 0.00 -0.65 -0.06 0.00 0.00 177.13 176.42 3fcw s GLN 56 N -2.05 3.01 0.38 5.31 -1.52 0.27 -5.01 119.66 120.05 3fcw s GLN 56 Ca 0.49 -0.56 0.07 0.00 -1.95 0.00 0.00 55.36 53.40 3fcw s GLN 56 Cb 0.33 -2.81 0.79 0.00 -0.22 0.00 0.00 33.01 31.09 3fcw s GLN 56 CO 0.21 0.61 1.99 0.66 -0.25 0.00 0.00 175.29 178.52 3fcw h SER 57 N 3.76 0.59 0.49 5.90 4.64 -1.91 -1.31 113.55 125.71 3fcw h SER 57 Ca -0.48 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3fcw h SER 57 Cb 1.17 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 3fcw h SER 57 CO 0.64 0.40 0.00 0.00 -0.87 0.00 0.00 176.83 177.00 3fcw n TYR 58 N -4.47 0.00 -0.11 4.77 0.18 -1.26 -4.18 117.16 112.09 3fcw n TYR 58 Ca 0.08 0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.81 3fcw n TYR 58 Cb 0.17 -0.25 0.01 0.00 -0.38 0.00 0.00 39.34 38.89 3fcw n TYR 58 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 3fcw h PHE 59 N 0.00 -0.31 -0.37 -3.48 3.04 -1.49 0.65 116.94 114.99 3fcw h PHE 59 Ca 0.00 0.04 -0.14 0.00 3.98 0.00 0.00 57.97 61.84 3fcw h PHE 59 Cb 0.24 0.20 -0.01 0.00 2.56 0.00 0.00 35.95 38.95 3fcw h PHE 59 CO 0.00 -0.21 -0.35 -0.91 -2.02 0.00 0.00 178.31 174.82 3fcw h ASN 60 N -0.05 0.89 0.18 0.41 2.35 -1.80 -0.02 115.58 117.53 3fcw h ASN 60 Ca 0.19 -0.38 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 3fcw h ASN 60 Cb 0.34 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.47 3fcw h ASN 60 CO -0.43 1.14 -0.09 0.44 -1.65 0.00 0.00 177.43 176.85 3fcw h ASP 61 N 0.70 -0.21 -0.65 5.81 3.32 -1.65 -0.52 116.42 123.22 3fcw h ASP 61 Ca 0.07 -0.23 0.13 0.00 0.02 0.00 0.00 57.03 57.02 3fcw h ASP 61 Cb 0.91 0.05 -0.10 0.00 0.22 0.00 0.00 39.33 40.41 3fcw h ASP 61 CO 0.08 0.13 0.11 0.25 -1.72 0.00 0.00 179.24 178.10 3fcw h LEU 62 N -0.57 -0.07 -0.49 1.55 5.85 0.33 0.28 115.31 122.19 3fcw h LEU 62 Ca -0.02 0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 3fcw h LEU 62 Cb 0.43 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 3fcw h LEU 62 CO 0.04 -0.04 0.07 0.00 -0.34 0.00 0.00 178.44 178.17 3fcw h ASP 64 N 0.68 1.06 0.22 0.00 3.32 0.03 -2.17 116.42 119.57 3fcw h ASP 64 Ca 0.15 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 3fcw h ASP 64 Cb 0.40 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3fcw h ASP 64 CO 0.01 0.76 -0.11 0.15 -1.72 0.00 0.00 179.24 178.33 3fcw h PHE 65 N 1.25 -0.28 0.00 4.55 -0.00 -0.13 -2.60 116.94 119.73 3fcw h PHE 65 Ca 0.35 -0.01 0.00 0.00 -0.00 0.00 0.00 57.97 58.32 3fcw h PHE 65 Cb -0.10 0.09 0.00 0.00 -0.00 0.00 0.00 35.95 35.94 3fcw h PHE 65 CO -0.00 -0.14 0.00 -1.33 -0.00 0.00 0.00 178.31 176.84 3fcw n MET 66 N -5.20 0.08 -0.06 1.11 2.81 -0.09 -0.80 117.12 114.96 3fcw n MET 66 Ca -0.09 0.58 0.05 0.00 -1.81 0.00 0.00 57.70 56.42 3fcw n MET 66 Cb 0.15 -1.76 0.07 0.00 -0.71 0.00 0.00 33.22 30.98 3fcw n MET 66 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 3fcw n VAL 67 N -1.92 0.37 0.48 2.03 3.14 -0.86 -4.62 118.33 116.96 3fcw n VAL 67 Ca -0.01 -0.69 0.12 0.00 -2.96 0.00 0.00 64.34 60.81 3fcw n VAL 67 Cb 0.02 0.94 0.46 0.00 -1.06 0.00 0.00 33.84 34.20 3fcw n VAL 67 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3fcw n SER 68 N 0.48 0.73 -2.34 6.55 3.41 0.02 -4.79 113.62 117.68 3fcw n SER 68 Ca 0.07 0.63 -0.04 0.00 -0.26 0.00 0.00 58.87 59.28 3fcw n SER 68 Cb 0.30 -0.80 0.02 0.00 -0.26 0.00 0.00 64.21 63.46 3fcw n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fcw n GLY 69 N 0.50 1.06 3.68 5.00 0.00 -1.26 -5.09 105.19 109.08 3fcw n GLY 69 Ca 0.03 -1.11 -0.32 0.00 0.00 0.00 0.00 46.02 44.62 3fcw n GLY 69 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3fcw s PRO 70 N -2.04 1.28 0.28 1.61 0.02 -1.13 -4.58 135.00 130.44 3fcw s PRO 70 Ca 0.13 1.66 0.02 0.00 0.02 0.00 0.00 61.00 62.83 3fcw s PRO 70 Cb -0.02 -1.75 -0.05 0.00 0.02 0.00 0.00 34.50 32.70 3fcw s PRO 70 CO 0.05 -2.46 0.09 0.96 -0.33 0.00 0.00 177.00 175.31 3fcw s ILE 71 N -2.40 0.71 -0.05 2.83 -4.36 0.07 -3.47 121.20 114.53 3fcw s ILE 71 Ca 0.70 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 59.12 3fcw s ILE 71 Cb -0.26 -2.67 0.01 0.00 1.25 0.00 0.00 42.46 40.79 3fcw s ILE 71 CO 0.54 0.00 -0.12 -0.63 0.24 0.00 0.00 174.94 174.97 3fcw s ILE 72 N -3.63 1.09 -0.16 8.37 1.01 -0.87 -1.29 121.20 125.72 3fcw s ILE 72 Ca 0.37 -0.48 -0.05 0.00 0.00 0.00 0.00 60.65 60.49 3fcw s ILE 72 Cb 0.08 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.53 3fcw s ILE 72 CO 0.14 0.34 0.01 -0.94 0.00 0.00 0.00 174.94 174.49 3fcw s SER 73 N 0.47 5.22 -0.01 3.58 1.04 0.30 -0.74 113.70 123.57 3fcw s SER 73 Ca -0.10 -0.01 0.01 0.00 0.48 0.00 0.00 55.95 56.33 3fcw s SER 73 Cb -0.14 -1.84 0.01 0.00 0.10 0.00 0.00 66.02 64.15 3fcw s SER 73 CO 0.03 0.19 -0.02 -0.63 0.98 0.00 0.00 173.24 173.79 3fcw s ILE 74 N 0.25 0.18 -0.22 -1.02 1.01 -0.15 -0.23 121.20 121.02 3fcw s ILE 74 Ca 0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.51 3fcw s ILE 74 Cb -0.13 -0.19 -0.05 0.00 0.01 0.00 0.00 42.46 42.10 3fcw s ILE 74 CO 0.02 0.08 0.13 -0.69 0.00 0.00 0.00 174.94 174.47 3fcw s VAL 75 N 0.22 5.20 -0.07 2.92 1.01 0.50 0.18 120.40 130.37 3fcw s VAL 75 Ca -0.02 0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.11 3fcw s VAL 75 Cb -0.04 -3.40 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 3fcw s VAL 75 CO -0.01 0.39 -0.13 -0.31 0.00 0.00 0.00 175.10 175.05 3fcw s TYR 76 N 0.80 2.76 -0.08 5.22 1.51 0.15 -0.17 117.35 127.55 3fcw s TYR 76 Ca 0.07 -0.20 0.03 0.00 -1.01 0.00 0.00 57.07 55.96 3fcw s TYR 76 Cb -0.13 -1.68 -0.02 0.00 -0.11 0.00 0.00 41.96 40.02 3fcw s TYR 76 CO 0.02 0.15 -0.15 -2.00 -1.11 0.00 0.00 175.55 172.47 3fcw s GLU 77 N -0.58 2.78 0.00 -0.62 2.12 0.11 -1.15 118.70 121.37 3fcw s GLU 77 Ca 0.08 -0.71 0.00 0.00 0.36 0.00 0.00 54.97 54.70 3fcw s GLU 77 Cb -0.11 -2.44 0.00 0.00 0.26 0.00 0.00 34.13 31.84 3fcw s GLU 77 CO 0.01 0.48 0.00 0.41 -0.54 0.00 0.00 175.26 175.62 3fcw n GLY 78 N 2.74 -1.70 3.66 -1.50 0.00 -1.05 -1.08 105.19 106.26 3fcw n GLY 78 Ca -0.17 -1.10 -0.43 0.00 0.00 0.00 0.00 46.02 44.32 3fcw n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fcw s THR 79 N -2.38 4.61 -1.47 2.61 2.01 -1.26 -0.73 115.64 119.03 3fcw s THR 79 Ca 0.00 1.94 0.00 0.00 0.31 0.00 0.00 61.69 63.94 3fcw s THR 79 Cb 0.00 -4.25 0.00 0.00 0.01 0.00 0.00 72.50 68.26 3fcw s THR 79 CO 0.00 -0.16 0.00 -0.67 -0.69 0.00 0.00 174.62 173.10 3fcw n ASP 80 N 6.31 -4.99 -0.08 3.53 4.64 -1.26 -4.86 116.55 119.84 3fcw n ASP 80 Ca 0.12 0.01 -0.09 0.00 -1.38 0.00 0.00 54.79 53.45 3fcw n ASP 80 Cb 0.46 -4.09 -0.03 0.00 -1.04 0.00 0.00 41.12 36.42 3fcw n ASP 80 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3fcw h ALA 81 N 0.76 -0.31 -0.25 -1.67 0.00 -1.81 -0.57 119.26 115.42 3fcw h ALA 81 Ca -0.40 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.61 3fcw h ALA 81 Cb 1.29 0.73 -0.04 0.00 0.00 0.00 0.00 17.79 19.76 3fcw h ALA 81 CO 0.48 -0.79 -0.27 0.82 0.00 0.00 0.00 179.25 179.49 3fcw h ILE 82 N -0.32 0.00 0.11 0.00 2.04 -1.89 0.95 117.51 118.40 3fcw h ILE 82 Ca 0.14 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.00 3fcw h ILE 82 Cb 0.56 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 3fcw h ILE 82 CO -0.49 0.00 -0.08 -1.28 0.00 0.00 0.00 178.15 176.29 3fcw h SER 83 N -0.15 -0.22 -0.03 1.72 0.87 -1.82 -2.15 113.55 111.76 3fcw h SER 83 Ca 0.04 0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.64 3fcw h SER 83 Cb 0.27 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 3fcw h SER 83 CO -0.32 -0.14 -0.07 0.11 -0.53 0.00 0.00 176.83 175.89 3fcw h LYS 84 N -0.20 -0.10 0.00 2.24 1.79 -0.81 -1.31 116.57 118.18 3fcw h LYS 84 Ca -0.00 0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.45 3fcw h LYS 84 Cb 0.18 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.85 3fcw h LYS 84 CO -0.01 -0.07 -0.12 0.82 -1.08 0.00 0.00 179.45 178.99 3fcw h ILE 85 N -0.10 0.78 -0.49 1.86 2.04 -0.83 -0.25 117.51 120.52 3fcw h ILE 85 Ca 0.04 -0.47 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 3fcw h ILE 85 Cb 0.16 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 3fcw h ILE 85 CO -0.09 0.12 0.20 0.03 0.00 0.00 0.00 178.15 178.40 3fcw h ARG 86 N 0.00 0.72 -0.34 2.37 2.47 -0.59 -0.73 114.38 118.29 3fcw h ARG 86 Ca -0.00 -0.13 -0.17 0.00 -1.26 0.00 0.00 59.98 58.42 3fcw h ARG 86 Cb 0.27 -0.12 -0.00 0.00 -1.65 0.00 0.00 29.97 28.46 3fcw h ARG 86 CO 0.02 0.64 -0.45 0.00 0.56 0.00 0.00 179.97 180.74 3fcw h ARG 87 N 0.64 0.88 -0.80 0.04 3.08 -0.22 -0.68 114.38 117.33 3fcw h ARG 87 Ca 0.16 -0.50 0.06 0.00 0.07 0.00 0.00 59.98 59.78 3fcw h ARG 87 Cb 0.18 0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.21 3fcw h ARG 87 CO -0.01 1.14 0.48 1.25 -1.07 0.00 0.00 179.97 181.75 3fcw h LEU 88 N 0.70 0.74 0.12 3.04 5.85 -1.00 -2.50 115.31 122.26 3fcw h LEU 88 Ca 0.04 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 3fcw h LEU 88 Cb 1.04 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.94 3fcw h LEU 88 CO 0.10 0.47 -0.06 -0.61 -0.34 0.00 0.00 178.44 178.01 3fcw h GLN 89 N 0.87 -0.15 0.00 1.25 4.15 -0.80 0.47 115.11 120.91 3fcw h GLN 89 Ca 0.35 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.78 3fcw h GLN 89 Cb 0.18 0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.91 3fcw h GLN 89 CO -0.18 0.01 0.00 0.41 -1.93 0.00 0.00 178.83 177.14 3fcw n GLY 90 N -0.81 0.88 3.27 2.39 0.00 -0.29 -1.72 105.19 108.91 3fcw n GLY 90 Ca -0.08 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.15 3fcw n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fcw s ASN 91 N -4.00 0.11 0.00 1.61 2.20 -1.26 -4.81 114.94 108.79 3fcw s ASN 91 Ca 0.00 -1.30 0.09 0.00 -0.94 0.00 0.00 52.86 50.71 3fcw s ASN 91 Cb 0.00 0.41 0.45 0.00 -2.00 0.00 0.00 41.25 40.12 3fcw s ASN 91 CO 0.00 -0.89 1.16 -0.38 -2.94 0.00 0.00 177.10 174.05 3fcw n ILE 92 N -0.28 0.79 0.88 0.54 2.08 -1.26 -1.69 119.36 120.41 3fcw n ILE 92 Ca 0.01 0.20 0.10 0.00 0.56 0.00 0.00 62.75 63.61 3fcw n ILE 92 Cb 0.65 -1.05 -0.01 0.00 -0.75 0.00 0.00 39.64 38.48 3fcw n ILE 92 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 3fcw n LEU 93 N -1.28 1.83 -4.08 1.39 4.77 -1.26 -4.66 117.00 113.71 3fcw n LEU 93 Ca 0.04 -0.75 -0.34 0.00 -0.03 0.00 0.00 56.01 54.92 3fcw n LEU 93 Cb 0.07 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.03 3fcw n LEU 93 CO 0.07 0.35 -0.21 -0.89 -1.33 0.00 0.00 177.39 175.38 3fcw s THR 94 N -2.24 2.98 0.68 -5.08 2.01 -0.68 -5.04 115.64 108.26 3fcw s THR 94 Ca 0.16 -2.25 -0.17 0.00 0.31 0.00 0.00 61.69 59.74 3fcw s THR 94 Cb 0.16 -3.08 0.01 0.00 0.01 0.00 0.00 72.50 69.60 3fcw s THR 94 CO 0.51 -0.68 1.24 -2.84 -0.69 0.00 0.00 174.62 172.16 3fcw s PRO 95 N 0.94 2.40 0.00 4.92 0.02 -1.26 -2.86 135.00 139.16 3fcw s PRO 95 Ca 0.10 1.88 0.00 0.00 0.02 0.00 0.00 61.00 63.00 3fcw s PRO 95 Cb -0.22 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.45 3fcw s PRO 95 CO -0.05 -1.66 0.00 0.41 -0.33 0.00 0.00 177.00 175.37 3fcw n GLY 96 N 0.59 3.17 3.99 0.52 0.00 -1.26 -4.94 105.19 107.26 3fcw n GLY 96 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 3fcw n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fcw s THR 97 N -2.87 3.83 0.12 2.61 -4.23 -1.14 -4.95 115.64 109.02 3fcw s THR 97 Ca 0.00 -0.93 -0.25 0.00 -1.18 0.00 0.00 61.69 59.33 3fcw s THR 97 Cb 0.00 -3.33 -0.06 0.00 1.34 0.00 0.00 72.50 70.45 3fcw s THR 97 CO 0.00 -0.14 1.66 0.40 -0.54 0.00 0.00 174.62 175.99 3fcw h ILE 98 N 0.76 0.53 -0.22 2.99 2.04 -0.94 -0.08 117.51 122.59 3fcw h ILE 98 Ca -0.45 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.35 3fcw h ILE 98 Cb 1.26 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 3fcw h ILE 98 CO 0.52 0.00 -0.09 0.03 0.00 0.00 0.00 178.15 178.61 3fcw h ARG 99 N -0.32 0.45 -0.27 2.37 3.08 -1.56 -1.88 114.38 116.25 3fcw h ARG 99 Ca 0.06 -0.19 0.06 0.00 0.07 0.00 0.00 59.98 59.98 3fcw h ARG 99 Cb 0.40 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 3fcw h ARG 99 CO -0.19 0.72 0.19 0.78 -1.07 0.00 0.00 179.97 180.40 3fcw h GLY 100 N 0.16 0.11 0.44 0.04 0.00 -1.19 -0.58 103.07 102.05 3fcw h GLY 100 Ca 0.05 -0.04 -0.18 0.00 0.00 0.00 0.00 47.33 47.16 3fcw h GLY 100 CO 0.03 0.03 -1.85 1.22 0.00 0.00 0.00 176.54 175.97 3fcw n ASP 101 N -4.48 0.38 0.00 0.19 8.00 -0.05 -4.28 116.55 116.31 3fcw n ASP 101 Ca 0.03 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.70 3fcw n ASP 101 Cb 0.28 0.88 0.00 0.00 -0.02 0.00 0.00 41.12 42.26 3fcw n ASP 101 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3fcw n LEU 102 N -2.68 0.23 -4.24 0.64 4.77 -0.71 -5.07 117.00 109.94 3fcw n LEU 102 Ca -0.15 -0.50 -0.17 0.00 -0.03 0.00 0.00 56.01 55.16 3fcw n LEU 102 Cb 0.87 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.85 3fcw n LEU 102 CO 0.44 0.06 -0.44 0.00 -1.33 0.00 0.00 177.39 176.12 3fcw s ALA 103 N -0.53 1.45 -0.06 -1.18 0.00 -0.25 -5.02 121.76 116.17 3fcw s ALA 103 Ca 0.00 -1.32 0.17 0.00 0.00 0.00 0.00 51.96 50.81 3fcw s ALA 103 Cb 0.00 -0.04 0.31 0.00 0.00 0.00 0.00 23.12 23.39 3fcw s ALA 103 CO 0.00 0.05 1.14 -1.71 0.00 0.00 0.00 175.76 175.25 3fcw n ASN 104 N 0.41 0.28 -3.77 0.00 5.15 -1.26 -4.71 115.26 111.35 3fcw n ASN 104 Ca -0.15 -2.02 -0.13 0.00 -0.60 0.00 0.00 54.58 51.68 3fcw n ASN 104 Cb 0.58 -0.07 -0.09 0.00 -0.53 0.00 0.00 39.78 39.67 3fcw n ASN 104 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3fcw s ASP 105 N -1.87 -0.22 0.30 1.20 3.68 -1.26 -5.04 116.67 113.46 3fcw s ASP 105 Ca 0.21 0.24 0.25 0.00 2.13 0.00 0.00 52.55 55.38 3fcw s ASP 105 Cb 0.27 0.41 0.70 0.00 -1.45 0.00 0.00 42.92 42.85 3fcw s ASP 105 CO -0.10 -0.33 1.73 0.16 0.13 0.00 0.00 175.17 176.76 3fcw h ILE 106 N 4.15 0.00 0.00 4.11 -0.00 -2.02 -3.38 117.51 120.37 3fcw h ILE 106 Ca -0.29 -0.63 0.00 0.00 -0.00 0.00 0.00 64.86 63.95 3fcw h ILE 106 Cb 1.18 1.61 0.00 0.00 -0.00 0.00 0.00 36.82 39.61 3fcw h ILE 106 CO 0.37 0.00 -0.68 -1.14 -0.00 0.00 0.00 178.15 176.70 3fcw n ARG 107 N -2.56 0.36 -2.42 0.16 0.63 -1.26 -4.83 116.66 106.74 3fcw n ARG 107 Ca 0.05 0.14 -0.37 0.00 -0.92 0.00 0.00 57.85 56.75 3fcw n ARG 107 Cb 0.44 -1.13 -0.03 0.00 0.45 0.00 0.00 32.46 32.19 3fcw n ARG 107 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 3fcw s GLU 108 N -2.36 3.32 -0.16 -0.14 2.02 -1.26 -4.73 118.70 115.39 3fcw s GLU 108 Ca -0.20 -0.95 0.15 0.00 0.02 0.00 0.00 54.97 53.99 3fcw s GLU 108 Cb 0.03 -5.29 0.43 0.00 0.10 0.00 0.00 34.13 29.40 3fcw s GLU 108 CO 0.29 -2.55 1.20 0.27 0.02 0.00 0.00 175.26 174.49 3fcw n ASN 109 N 10.29 1.81 0.00 -0.19 0.23 -1.26 -4.20 115.26 121.94 3fcw n ASN 109 Ca 0.36 -3.29 0.00 0.00 -0.53 0.00 0.00 54.58 51.12 3fcw n ASN 109 Cb 0.50 -0.45 0.00 0.00 -2.08 0.00 0.00 39.78 37.75 3fcw n ASN 109 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3fcw n LEU 110 N -0.62 0.00 -3.76 -4.53 4.77 -1.26 -4.81 117.00 106.79 3fcw n LEU 110 Ca 0.17 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 56.02 3fcw n LEU 110 Cb 0.85 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.83 3fcw n LEU 110 CO 0.01 0.00 -0.03 -0.51 -1.33 0.00 0.00 177.39 175.52 3fcw s ILE 111 N 0.00 -0.00 -0.06 -0.08 2.07 -1.26 -1.23 121.20 120.63 3fcw s ILE 111 Ca 0.00 0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.27 3fcw s ILE 111 Cb 0.00 -0.43 -0.03 0.00 0.13 0.00 0.00 42.46 42.13 3fcw s ILE 111 CO 0.00 0.00 -0.09 -2.28 -1.91 0.00 0.00 174.94 170.66 3fcw s HIS 112 N 0.24 2.86 -0.03 3.50 5.65 0.67 -4.95 115.29 123.24 3fcw s HIS 112 Ca -0.01 -0.04 0.01 0.00 0.25 0.00 0.00 55.06 55.27 3fcw s HIS 112 Cb -0.03 -1.68 0.02 0.00 -1.18 0.00 0.00 32.58 29.71 3fcw s HIS 112 CO -0.00 0.28 -0.03 0.00 -0.65 0.00 0.00 174.74 174.34 3fcw s ALA 113 N -0.77 0.45 0.52 1.58 0.00 -1.26 -0.43 121.76 121.84 3fcw s ALA 113 Ca 0.12 0.02 -0.21 0.00 0.00 0.00 0.00 51.96 51.89 3fcw s ALA 113 Cb -0.11 -0.30 -0.08 0.00 0.00 0.00 0.00 23.12 22.63 3fcw s ALA 113 CO 0.01 -0.01 0.90 0.43 0.00 0.00 0.00 175.76 177.09 3fcw n SER 114 N 3.84 0.63 -0.12 0.00 7.64 -0.88 -4.94 113.62 119.79 3fcw n SER 114 Ca -0.24 0.89 0.01 0.00 1.01 0.00 0.00 58.87 60.55 3fcw n SER 114 Cb 0.52 -1.33 0.02 0.00 -1.01 0.00 0.00 64.21 62.41 3fcw n SER 114 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3fcw n ASP 115 N 0.04 1.71 -3.58 6.43 5.75 -1.26 -4.74 116.55 120.90 3fcw n ASP 115 Ca 0.11 -1.56 -0.08 0.00 -0.01 0.00 0.00 54.79 53.25 3fcw n ASP 115 Cb 0.44 -0.03 -0.02 0.00 -1.03 0.00 0.00 41.12 40.48 3fcw n ASP 115 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3fcw s SER 116 N -0.61 -0.38 0.24 -1.12 1.04 -1.26 -4.98 113.70 106.63 3fcw s SER 116 Ca 0.04 -0.17 -0.04 0.00 0.48 0.00 0.00 55.95 56.26 3fcw s SER 116 Cb 0.02 0.53 0.27 0.00 0.10 0.00 0.00 66.02 66.94 3fcw s SER 116 CO 0.03 -0.90 1.75 -0.33 0.98 0.00 0.00 173.24 174.77 3fcw h GLU 117 N 2.00 0.91 0.91 4.02 5.08 -1.96 0.52 114.58 126.06 3fcw h GLU 117 Ca -0.26 -0.23 -0.04 0.00 -1.00 0.00 0.00 59.36 57.82 3fcw h GLU 117 Cb 1.26 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 30.41 3fcw h GLU 117 CO 0.31 0.86 -0.44 -0.44 -1.00 0.00 0.00 179.01 178.31 3fcw h ASP 118 N 0.86 -1.04 -0.89 1.42 3.32 -1.98 0.26 116.42 118.37 3fcw h ASP 118 Ca 0.17 0.04 0.22 0.00 0.02 0.00 0.00 57.03 57.47 3fcw h ASP 118 Cb 0.42 0.27 -0.16 0.00 0.22 0.00 0.00 39.33 40.07 3fcw h ASP 118 CO 0.01 -0.70 -0.04 0.28 -1.72 0.00 0.00 179.24 177.07 3fcw h SER 119 N -1.31 -0.52 0.64 6.45 0.02 -1.85 1.59 113.55 118.56 3fcw h SER 119 Ca -0.13 0.25 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 3fcw h SER 119 Cb 0.94 0.46 -0.01 0.00 0.14 0.00 0.00 62.40 63.92 3fcw h SER 119 CO 0.21 -0.28 -0.48 0.00 -1.14 0.00 0.00 176.83 175.14 3fcw h ALA 120 N 1.87 -1.21 0.12 3.77 0.00 0.25 1.17 119.26 125.23 3fcw h ALA 120 Ca 0.50 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.20 3fcw h ALA 120 Cb 0.92 0.64 -0.04 0.00 0.00 0.00 0.00 17.79 19.31 3fcw h ALA 120 CO -0.84 -1.20 -0.45 0.28 0.00 0.00 0.00 179.25 177.05 3fcw h VAL 121 N -1.07 0.00 0.00 0.00 2.07 0.26 0.90 116.25 118.41 3fcw h VAL 121 Ca -0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.44 3fcw h VAL 121 Cb 0.89 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3fcw h VAL 121 CO 0.03 0.00 0.00 -0.67 0.02 0.00 0.00 177.57 176.95 3fcw n ASP 122 N -5.02 0.00 0.07 0.57 -0.08 0.51 0.75 116.55 113.35 3fcw n ASP 122 Ca -0.07 0.55 -0.02 0.00 -1.51 0.00 0.00 54.79 53.74 3fcw n ASP 122 Cb 0.35 -0.21 0.24 0.00 2.34 0.00 0.00 41.12 43.85 3fcw n ASP 122 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 3fcw h GLU 123 N 0.00 0.32 -0.48 -0.67 5.08 0.16 0.23 114.58 119.23 3fcw h GLU 123 Ca 0.00 -0.13 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 3fcw h GLU 123 Cb 0.00 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 3fcw h GLU 123 CO 0.00 0.60 0.07 0.82 -1.00 0.00 0.00 179.01 179.51 3fcw h ILE 124 N 0.28 1.22 0.25 3.13 2.04 0.11 -1.00 117.51 123.55 3fcw h ILE 124 Ca 0.04 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 3fcw h ILE 124 Cb 0.69 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3fcw h ILE 124 CO 0.05 0.30 -0.12 0.28 0.00 0.00 0.00 178.15 178.66 3fcw h SER 125 N 0.71 -0.29 -0.79 1.72 0.02 0.21 1.65 113.55 116.78 3fcw h SER 125 Ca 0.15 -0.19 0.19 0.00 -0.84 0.00 0.00 61.79 61.09 3fcw h SER 125 Cb 0.33 0.07 -0.12 0.00 0.14 0.00 0.00 62.40 62.82 3fcw h SER 125 CO 0.01 0.06 0.16 0.40 -1.14 0.00 0.00 176.83 176.32 3fcw h ILE 126 N -0.67 0.41 0.00 3.27 2.04 -0.50 -2.79 117.51 119.28 3fcw h ILE 126 Ca -0.03 -0.08 -0.20 0.00 1.00 0.00 0.00 64.86 65.55 3fcw h ILE 126 Cb 0.47 0.17 -0.04 0.00 -0.74 0.00 0.00 36.82 36.69 3fcw h ILE 126 CO 0.06 0.04 -1.80 0.79 0.00 0.00 0.00 178.15 177.24 3fcw n TRP 127 N -5.22 0.54 -0.96 1.37 7.02 -0.39 -5.01 117.44 114.79 3fcw n TRP 127 Ca 0.16 0.18 0.00 0.00 -1.02 0.00 0.00 57.50 56.83 3fcw n TRP 127 Cb 0.54 -0.97 0.00 0.00 -2.42 0.00 0.00 31.31 28.46 3fcw n TRP 127 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86