#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fzw n ASN 2 N 0.00 0.00 -4.70 6.12 3.02 -1.25 -4.18 115.26 114.27 3fzw n ASN 2 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 3fzw n ASN 2 Cb 0.00 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.14 3fzw n ASN 2 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3fzw s LEU 3 N 0.00 4.38 0.35 3.41 2.96 -1.16 -3.23 118.68 125.39 3fzw s LEU 3 Ca 0.00 2.69 -0.28 0.00 -0.22 0.00 0.00 54.13 56.32 3fzw s LEU 3 Cb 0.00 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 43.02 3fzw s LEU 3 CO 0.00 -0.95 1.27 -2.84 -1.32 0.00 0.00 176.35 172.52 3fzw s PRO 4 N 2.27 4.29 1.05 0.98 0.02 -1.26 -4.96 135.00 137.38 3fzw s PRO 4 Ca 0.77 2.13 -0.13 0.00 0.02 0.00 0.00 61.00 63.79 3fzw s PRO 4 Cb -0.45 -2.99 0.22 0.00 0.02 0.00 0.00 34.50 31.30 3fzw s PRO 4 CO 0.34 -0.22 1.08 0.95 -0.33 0.00 0.00 177.00 178.82 3fzw s THR 5 N -1.19 1.99 0.25 0.99 -4.23 -1.26 -3.87 115.64 108.31 3fzw s THR 5 Ca 0.51 0.00 -0.04 0.00 -1.18 0.00 0.00 61.69 60.98 3fzw s THR 5 Cb -0.38 -2.42 0.22 0.00 1.34 0.00 0.00 72.50 71.26 3fzw s THR 5 CO 0.50 0.00 1.79 0.00 -0.54 0.00 0.00 174.62 176.37 3fzw h ALA 6 N -2.09 1.18 -0.57 3.99 0.00 -1.91 0.97 119.26 120.83 3fzw h ALA 6 Ca -0.56 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.32 3fzw h ALA 6 Cb 1.34 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 3fzw h ALA 6 CO 0.56 0.03 0.07 1.96 0.00 0.00 0.00 179.25 181.87 3fzw h GLN 7 N 0.72 0.97 -0.50 0.00 4.20 -1.92 -1.14 115.11 117.44 3fzw h GLN 7 Ca 0.41 -0.27 -0.06 0.00 0.06 0.00 0.00 58.65 58.79 3fzw h GLN 7 Cb 0.44 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 3fzw h GLN 7 CO -0.28 0.93 0.08 0.93 -0.67 0.00 0.00 178.83 179.82 3fzw h GLU 8 N 0.86 0.78 -0.37 1.46 5.08 -1.70 -1.65 114.58 119.04 3fzw h GLU 8 Ca 0.17 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3fzw h GLU 8 Cb 0.45 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3fzw h GLU 8 CO 0.02 0.74 0.23 0.28 -1.00 0.00 0.00 179.01 179.27 3fzw h VAL 9 N 0.75 1.12 -0.77 3.13 2.07 -0.41 0.36 116.25 122.50 3fzw h VAL 9 Ca 0.16 -0.26 0.05 0.00 0.82 0.00 0.00 66.70 67.47 3fzw h VAL 9 Cb 0.34 0.62 -0.06 0.00 -1.52 0.00 0.00 31.29 30.68 3fzw h VAL 9 CO 0.01 0.12 0.46 1.56 0.02 0.00 0.00 177.57 179.74 3fzw h GLN 10 N 0.49 0.83 -0.50 1.57 4.20 -0.77 -0.31 115.11 120.62 3fzw h GLN 10 Ca 0.13 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.72 3fzw h GLN 10 Cb -0.01 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.57 3fzw h GLN 10 CO -0.03 0.55 0.00 0.78 -0.67 0.00 0.00 178.83 179.47 3fzw h GLY 11 N 0.86 0.95 1.01 3.46 0.00 -0.72 -1.52 103.07 107.11 3fzw h GLY 11 Ca 0.33 -0.70 -0.09 0.00 0.00 0.00 0.00 47.33 46.88 3fzw h GLY 11 CO -0.16 0.64 -0.04 1.41 0.00 0.00 0.00 176.54 178.39 3fzw h LEU 12 N 0.75 0.85 -0.71 3.11 3.38 -0.55 -1.11 115.31 121.02 3fzw h LEU 12 Ca 0.14 -0.33 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 3fzw h LEU 12 Cb 0.51 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 3fzw h LEU 12 CO 0.03 0.97 -0.02 0.24 0.09 0.00 0.00 178.44 179.75 3fzw h MET 13 N 0.70 0.97 -0.84 1.13 2.86 -1.01 -0.57 114.93 118.18 3fzw h MET 13 Ca 0.13 -0.30 -0.04 0.00 -2.06 0.00 0.00 59.70 57.43 3fzw h MET 13 Cb 0.56 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.09 3fzw h MET 13 CO 0.03 0.97 0.38 0.00 1.06 0.00 0.00 176.91 179.35 3fzw h ALA 14 N 1.08 1.08 -0.75 6.32 0.00 -1.17 -2.57 119.26 123.25 3fzw h ALA 14 Ca 0.16 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3fzw h ALA 14 Cb 0.54 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3fzw h ALA 14 CO 0.03 0.66 0.25 -0.09 0.00 0.00 0.00 179.25 180.11 3fzw h ARG 15 N 1.20 1.15 -0.58 0.00 2.43 -0.79 -2.08 114.38 115.71 3fzw h ARG 15 Ca 0.29 -0.23 0.09 0.00 -0.81 0.00 0.00 59.98 59.31 3fzw h ARG 15 Cb 0.15 -0.17 -0.07 0.00 -0.42 0.00 0.00 29.97 29.45 3fzw h ARG 15 CO -0.03 0.97 0.21 -0.92 -1.51 0.00 0.00 179.97 178.68 3fzw h TYR 16 N 1.11 0.36 -0.39 2.20 3.20 -0.82 -0.64 116.97 122.00 3fzw h TYR 16 Ca 0.25 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 62.06 3fzw h TYR 16 Cb 0.28 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 3fzw h TYR 16 CO 0.02 0.09 -0.10 0.82 -1.64 0.00 0.00 178.16 177.35 3fzw h ILE 17 N 0.39 1.25 -0.80 1.81 1.08 -1.10 -0.31 117.51 119.82 3fzw h ILE 17 Ca 0.29 -1.10 0.03 0.00 -0.39 0.00 0.00 64.86 63.69 3fzw h ILE 17 Cb 0.35 1.06 -0.05 0.00 -3.07 0.00 0.00 36.82 35.12 3fzw h ILE 17 CO -0.30 0.37 0.52 -0.33 -0.69 0.00 0.00 178.15 177.72 3fzw h GLU 18 N 0.62 0.99 -0.12 2.37 5.08 -0.68 -0.23 114.58 122.61 3fzw h GLU 18 Ca 0.11 -0.06 -0.17 0.00 -1.00 0.00 0.00 59.36 58.24 3fzw h GLU 18 Cb 0.54 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3fzw h GLU 18 CO 0.03 0.65 -0.65 -0.07 -1.00 0.00 0.00 179.01 177.97 3fzw h LEU 19 N 1.02 0.52 -0.54 1.33 3.38 -0.53 -2.50 115.31 117.99 3fzw h LEU 19 Ca 0.32 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3fzw h LEU 19 Cb -0.01 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 3fzw h LEU 19 CO -0.10 1.04 0.36 0.58 0.09 0.00 0.00 178.44 180.40 3fzw h VAL 20 N 0.33 1.14 -0.70 1.22 2.07 -0.71 -0.46 116.25 119.13 3fzw h VAL 20 Ca -0.02 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.28 3fzw h VAL 20 Cb 1.21 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.29 3fzw h VAL 20 CO 0.12 0.13 0.46 -0.78 0.02 0.00 0.00 177.57 177.52 3fzw h ASP 21 N 0.73 0.75 -0.10 0.57 3.58 -0.79 -1.36 116.42 119.80 3fzw h ASP 21 Ca 0.20 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.64 3fzw h ASP 21 Cb -0.08 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 40.79 3fzw h ASP 21 CO -0.04 0.52 0.00 1.33 -2.88 0.00 0.00 179.24 178.17 3fzw n VAL 22 N -4.45 0.10 -2.09 2.25 0.24 -0.96 -4.64 118.33 108.79 3fzw n VAL 22 Ca 0.08 -0.48 -0.06 0.00 -2.04 0.00 0.00 64.34 61.85 3fzw n VAL 22 Cb 0.10 1.10 -0.00 0.00 -1.47 0.00 0.00 33.84 33.57 3fzw n VAL 22 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fzw n GLY 23 N 1.32 0.14 3.44 7.63 0.00 -0.28 -4.93 105.19 112.52 3fzw n GLY 23 Ca 0.16 -0.64 -0.44 0.00 0.00 0.00 0.00 46.02 45.10 3fzw n GLY 23 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3fzw n ASP 24 N 0.88 5.10 -0.36 1.61 -0.08 -0.63 -4.79 116.55 118.27 3fzw n ASP 24 Ca -0.07 -2.97 -0.02 0.00 -1.51 0.00 0.00 54.79 50.22 3fzw n ASP 24 Cb 0.54 -1.62 0.12 0.00 2.34 0.00 0.00 41.12 42.50 3fzw n ASP 24 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 3fzw h ILE 25 N 4.84 1.26 -0.38 5.18 2.04 -1.92 -1.56 117.51 126.96 3fzw h ILE 25 Ca 0.37 -0.48 0.04 0.00 1.00 0.00 0.00 64.86 65.78 3fzw h ILE 25 Cb 0.85 -0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 3fzw h ILE 25 CO 1.35 0.25 0.17 -0.33 0.00 0.00 0.00 178.15 179.59 3fzw h GLU 26 N 1.33 0.34 -0.22 2.37 3.07 -1.99 -0.73 114.58 118.75 3fzw h GLU 26 Ca 0.36 -0.02 -0.15 0.00 -0.50 0.00 0.00 59.36 59.04 3fzw h GLU 26 Cb -0.14 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.69 3fzw h GLU 26 CO -0.08 0.22 -0.50 0.00 -1.40 0.00 0.00 179.01 177.26 3fzw h ALA 27 N 1.22 0.73 0.02 3.43 0.00 -1.87 -2.18 119.26 120.61 3fzw h ALA 27 Ca 0.17 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 3fzw h ALA 27 Cb 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3fzw h ALA 27 CO -0.14 0.68 -0.01 0.82 0.00 0.00 0.00 179.25 180.59 3fzw h ILE 28 N 0.47 1.03 -0.92 0.00 2.04 -0.87 -2.64 117.51 116.62 3fzw h ILE 28 Ca 0.02 -0.14 0.09 0.00 1.00 0.00 0.00 64.86 65.83 3fzw h ILE 28 Cb 1.03 1.12 -0.07 0.00 -0.74 0.00 0.00 36.82 38.17 3fzw h ILE 28 CO 0.10 0.04 0.56 0.58 0.00 0.00 0.00 178.15 179.43 3fzw h VAL 29 N -0.09 0.96 0.00 1.67 2.07 -0.99 -0.44 116.25 119.44 3fzw h VAL 29 Ca -0.00 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.19 3fzw h VAL 29 Cb 0.08 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 3fzw h VAL 29 CO 0.00 0.17 0.00 1.56 0.02 0.00 0.00 177.57 179.33 3fzw h GLN 30 N 0.95 0.00 0.00 1.57 4.20 -1.17 -1.51 115.11 119.15 3fzw h GLN 30 Ca 0.43 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 59.09 3fzw h GLN 30 Cb 0.34 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 3fzw h GLN 30 CO -0.23 0.00 -0.24 0.52 -0.67 0.00 0.00 178.83 178.21 3fzw h MET 31 N 0.00 0.00 -6.62 1.46 2.86 -0.71 -3.45 114.93 108.47 3fzw h MET 31 Ca 0.00 0.00 -0.51 0.00 -2.06 0.00 0.00 59.70 57.13 3fzw h MET 31 Cb 0.31 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 3fzw h MET 31 CO 0.00 0.24 0.02 0.71 1.06 0.00 0.00 176.91 178.94 3fzw s TYR 32 N -3.40 3.40 0.75 -0.22 2.02 -0.57 -0.40 117.35 118.92 3fzw s TYR 32 Ca 0.02 1.07 -0.14 0.00 -0.37 0.00 0.00 57.07 57.65 3fzw s TYR 32 Cb 0.09 -2.42 0.05 0.00 -0.40 0.00 0.00 41.96 39.27 3fzw s TYR 32 CO 0.66 0.15 1.19 0.00 -1.57 0.00 0.00 175.55 175.98 3fzw s ALA 33 N -1.94 2.08 0.46 3.71 0.00 0.18 -4.71 121.76 121.53 3fzw s ALA 33 Ca 0.51 0.81 0.20 0.00 0.00 0.00 0.00 51.96 53.48 3fzw s ALA 33 Cb -0.11 -3.45 1.23 0.00 0.00 0.00 0.00 23.12 20.80 3fzw s ALA 33 CO 0.20 -1.93 2.05 0.38 0.00 0.00 0.00 175.76 176.46 3fzw h ASP 34 N -0.47 0.00 -0.20 0.00 2.03 -1.95 -1.64 116.42 114.19 3fzw h ASP 34 Ca -0.47 0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 55.76 3fzw h ASP 34 Cb 1.29 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.74 3fzw h ASP 34 CO 0.49 0.13 -0.12 -0.90 -1.03 0.00 0.00 179.24 177.82 3fzw n ASP 35 N -4.09 2.66 -4.52 4.15 5.75 -1.26 -1.64 116.55 117.60 3fzw n ASP 35 Ca -0.02 -3.49 -0.31 0.00 -0.01 0.00 0.00 54.79 50.96 3fzw n ASP 35 Cb 0.22 -0.56 0.17 0.00 -1.03 0.00 0.00 41.12 39.92 3fzw n ASP 35 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3fzw n ALA 36 N -1.04 -2.08 -2.50 2.12 0.00 -0.62 -4.35 120.51 112.06 3fzw n ALA 36 Ca 0.25 -0.76 -0.29 0.00 0.00 0.00 0.00 53.44 52.64 3fzw n ALA 36 Cb 0.87 -1.97 -0.11 0.00 0.00 0.00 0.00 19.45 18.24 3fzw n ALA 36 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3fzw s THR 37 N -2.48 2.85 -0.06 0.00 -4.23 -0.73 -1.06 115.64 109.94 3fzw s THR 37 Ca 0.63 -1.57 0.02 0.00 -1.18 0.00 0.00 61.69 59.60 3fzw s THR 37 Cb -0.22 -2.33 0.01 0.00 1.34 0.00 0.00 72.50 71.31 3fzw s THR 37 CO 0.63 0.05 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.94 3fzw s VAL 38 N -1.27 1.17 -0.24 2.29 1.01 -0.78 -1.27 120.40 121.30 3fzw s VAL 38 Ca 0.19 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.69 3fzw s VAL 38 Cb -0.10 -1.06 0.05 0.00 0.00 0.00 0.00 36.38 35.27 3fzw s VAL 38 CO 0.11 0.36 -0.13 -1.61 0.00 0.00 0.00 175.10 173.83 3fzw s GLU 39 N 0.59 2.43 -0.28 2.72 2.02 0.19 -1.07 118.70 125.29 3fzw s GLU 39 Ca -0.13 -1.22 0.02 0.00 0.02 0.00 0.00 54.97 53.66 3fzw s GLU 39 Cb -0.15 -2.82 0.17 0.00 0.10 0.00 0.00 34.13 31.43 3fzw s GLU 39 CO 0.04 -0.48 0.46 1.21 0.02 0.00 0.00 175.26 176.50 3fzw s ASN 40 N 1.15 -0.23 0.50 -0.19 3.84 -1.26 -0.83 114.94 117.93 3fzw s ASN 40 Ca -0.06 -0.09 -0.18 0.00 0.21 0.00 0.00 52.86 52.74 3fzw s ASN 40 Cb -0.18 1.40 -0.08 0.00 -0.55 0.00 0.00 41.25 41.84 3fzw s ASN 40 CO -0.07 -0.33 1.01 -2.16 -2.79 0.00 0.00 177.10 172.76 3fzw s PRO 41 N 2.63 3.84 0.28 0.43 0.04 -1.26 -4.95 135.00 136.01 3fzw s PRO 41 Ca 0.11 1.16 -0.30 0.00 0.04 0.00 0.00 61.00 62.01 3fzw s PRO 41 Cb -0.12 -2.11 -0.13 0.00 0.04 0.00 0.00 34.50 32.17 3fzw s PRO 41 CO -0.27 -0.37 1.25 0.34 0.04 0.00 0.00 177.00 177.99 3fzw n PHE 42 N -1.28 1.91 0.00 0.56 7.35 0.58 -1.07 117.46 125.50 3fzw n PHE 42 Ca 0.08 0.56 0.00 0.00 -0.76 0.00 0.00 57.45 57.33 3fzw n PHE 42 Cb 0.53 -2.38 0.00 0.00 0.35 0.00 0.00 39.48 37.98 3fzw n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3fzw n GLY 43 N 1.48 2.55 3.93 7.13 0.00 -1.26 -4.84 105.19 114.18 3fzw n GLY 43 Ca 0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 3fzw n GLY 43 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fzw s GLN 44 N -0.36 3.51 0.50 1.61 -1.52 -0.24 -5.06 119.66 118.11 3fzw s GLN 44 Ca 0.00 -0.27 -0.23 0.00 -1.95 0.00 0.00 55.36 52.91 3fzw s GLN 44 Cb 0.00 -2.67 -0.06 0.00 -0.22 0.00 0.00 33.01 30.06 3fzw s GLN 44 CO 0.00 0.17 1.38 -2.14 -0.25 0.00 0.00 175.29 174.45 3fzw s PRO 45 N -4.11 3.39 0.50 2.91 0.02 -1.26 -4.72 135.00 131.72 3fzw s PRO 45 Ca 0.41 2.29 -0.22 0.00 0.02 0.00 0.00 61.00 63.49 3fzw s PRO 45 Cb -0.10 -2.42 -0.06 0.00 0.02 0.00 0.00 34.50 31.93 3fzw s PRO 45 CO 0.35 -1.01 1.22 -1.25 -0.33 0.00 0.00 177.00 175.98 3fzw s PRO 46 N -2.71 3.52 0.26 5.54 0.04 -1.26 -4.74 135.00 135.64 3fzw s PRO 46 Ca 0.67 1.91 0.04 0.00 0.04 0.00 0.00 61.00 63.65 3fzw s PRO 46 Cb -0.41 -2.32 -0.03 0.00 0.04 0.00 0.00 34.50 31.78 3fzw s PRO 46 CO 0.50 -0.79 0.40 0.96 0.04 0.00 0.00 177.00 178.12 3fzw s ILE 47 N -1.48 5.23 -0.02 0.56 -4.36 -0.23 -4.95 121.20 115.94 3fzw s ILE 47 Ca 0.67 -0.83 0.02 0.00 -0.26 0.00 0.00 60.65 60.26 3fzw s ILE 47 Cb -0.32 -3.85 0.00 0.00 1.25 0.00 0.00 42.46 39.55 3fzw s ILE 47 CO 0.38 -0.36 -0.07 -1.00 0.24 0.00 0.00 174.94 174.13 3fzw s HIS 48 N -2.03 0.80 0.00 1.37 3.76 -1.26 -1.87 115.29 116.06 3fzw s HIS 48 Ca 0.36 -0.19 0.00 0.00 -0.15 0.00 0.00 55.06 55.08 3fzw s HIS 48 Cb -0.09 -0.58 0.00 0.00 1.11 0.00 0.00 32.58 33.01 3fzw s HIS 48 CO 0.31 -0.09 0.00 0.41 -0.85 0.00 0.00 174.74 174.52 3fzw n GLY 49 N 3.32 -0.46 0.26 -2.22 0.00 -0.22 -4.30 105.19 101.57 3fzw n GLY 49 Ca -0.18 -1.63 -0.02 0.00 0.00 0.00 0.00 46.02 44.19 3fzw n GLY 49 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3fzw h ARG 50 N 0.00 0.54 -0.24 1.61 3.08 -1.55 -1.07 114.38 116.76 3fzw h ARG 50 Ca 0.00 -0.16 -0.07 0.00 0.07 0.00 0.00 59.98 59.82 3fzw h ARG 50 Cb 0.00 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 3fzw h ARG 50 CO 0.00 0.65 -0.14 1.49 -1.07 0.00 0.00 179.97 180.90 3fzw h GLU 51 N 0.50 0.52 -0.79 0.04 4.57 -1.87 0.10 114.58 117.65 3fzw h GLU 51 Ca 0.09 -0.24 -0.02 0.00 -1.18 0.00 0.00 59.36 58.02 3fzw h GLU 51 Cb 0.49 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.03 3fzw h GLU 51 CO 0.03 0.79 0.42 1.96 -1.18 0.00 0.00 179.01 181.04 3fzw h GLN 52 N 0.23 1.11 -0.35 1.92 4.20 -1.70 -0.01 115.11 120.51 3fzw h GLN 52 Ca 0.05 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 3fzw h GLN 52 Cb 0.65 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 3fzw h GLN 52 CO 0.04 0.82 -0.02 0.82 -0.67 0.00 0.00 178.83 179.81 3fzw h ILE 53 N 1.11 1.26 -0.51 2.54 2.04 -1.05 -1.15 117.51 121.76 3fzw h ILE 53 Ca 0.28 -1.02 0.07 0.00 1.00 0.00 0.00 64.86 65.19 3fzw h ILE 53 Cb 0.04 1.24 -0.06 0.00 -0.74 0.00 0.00 36.82 37.30 3fzw h ILE 53 CO -0.04 0.34 0.18 0.00 0.00 0.00 0.00 178.15 178.62 3fzw h ALA 54 N 0.85 0.62 -0.80 1.87 0.00 -0.36 -0.39 119.26 121.05 3fzw h ALA 54 Ca 0.10 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3fzw h ALA 54 Cb 0.49 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 3fzw h ALA 54 CO 0.02 -0.22 0.51 0.00 0.00 0.00 0.00 179.25 179.57 3fzw h ALA 55 N 1.34 1.04 -0.41 0.00 0.00 -0.85 0.11 119.26 120.48 3fzw h ALA 55 Ca 0.24 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 3fzw h ALA 55 Cb 0.27 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3fzw h ALA 55 CO -0.25 0.35 0.16 0.35 0.00 0.00 0.00 179.25 179.86 3fzw h PHE 56 N 1.02 0.63 -0.01 0.00 3.57 -0.68 -0.98 116.94 120.48 3fzw h PHE 56 Ca 0.31 -0.05 -0.10 0.00 3.53 0.00 0.00 57.97 61.66 3fzw h PHE 56 Cb -0.03 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 3fzw h PHE 56 CO -0.03 0.56 -0.48 1.88 -2.23 0.00 0.00 178.31 178.01 3fzw h TYR 57 N 0.52 0.04 -0.50 0.41 0.05 -0.60 -0.89 116.97 116.00 3fzw h TYR 57 Ca 0.14 -0.01 -0.09 0.00 0.05 0.00 0.00 58.73 58.82 3fzw h TYR 57 Cb 0.19 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 37.91 3fzw h TYR 57 CO 0.00 0.51 -0.05 0.00 -1.05 0.00 0.00 178.16 177.56 3fzw h ARG 58 N 0.02 0.89 0.00 4.88 3.08 -0.39 -0.03 114.38 122.84 3fzw h ARG 58 Ca -0.00 -0.28 -0.17 0.00 0.07 0.00 0.00 59.98 59.60 3fzw h ARG 58 Cb 0.86 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.81 3fzw h ARG 58 CO 0.06 0.92 -0.79 1.96 -1.07 0.00 0.00 179.97 181.05 3fzw h GLN 59 N 0.81 0.00 -0.03 0.04 1.08 -1.01 0.18 115.11 116.18 3fzw h GLN 59 Ca 0.14 0.00 -0.24 0.00 -1.45 0.00 0.00 58.65 57.11 3fzw h GLN 59 Cb 0.56 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.00 3fzw h GLN 59 CO 0.03 0.79 -0.94 0.78 -0.95 0.00 0.00 178.83 178.54 3fzw h GLY 60 N 2.75 0.64 0.00 3.46 0.00 -0.95 -3.38 103.07 105.59 3fzw h GLY 60 Ca -0.01 -1.06 0.00 0.00 0.00 0.00 0.00 47.33 46.26 3fzw h GLY 60 CO 0.10 0.94 -0.37 1.04 0.00 0.00 0.00 176.54 178.25 3fzw n LEU 61 N -3.82 0.29 0.30 3.11 4.77 -0.04 -4.71 117.00 116.88 3fzw n LEU 61 Ca -0.08 -0.47 0.19 0.00 -0.03 0.00 0.00 56.01 55.62 3fzw n LEU 61 Cb 0.83 0.00 0.87 0.00 -2.33 0.00 0.00 43.42 42.78 3fzw n LEU 61 CO 0.53 0.07 1.06 1.23 -1.33 0.00 0.00 177.39 178.95 3fzw h GLY 62 N 1.51 0.00 2.00 -0.72 0.00 -0.73 -1.80 103.07 103.32 3fzw h GLY 62 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fzw h GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3fzw n GLY 63 N -0.36 -1.34 2.81 4.60 0.00 -1.26 -4.93 105.19 104.70 3fzw n GLY 63 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3fzw n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fzw n GLY 64 N 0.14 1.55 2.04 -0.02 0.00 -0.68 -4.90 105.19 103.33 3fzw n GLY 64 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 3fzw n GLY 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fzw n LYS 65 N -2.00 2.91 -5.01 1.61 5.02 -1.26 -4.94 118.16 114.48 3fzw n LYS 65 Ca 0.00 -3.61 -0.32 0.00 -2.02 0.00 0.00 58.31 52.36 3fzw n LYS 65 Cb 0.00 -2.21 -0.15 0.00 -0.02 0.00 0.00 35.03 32.65 3fzw n LYS 65 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3fzw s VAL 66 N -4.45 2.68 0.28 -0.18 1.01 -1.26 -4.31 120.40 114.17 3fzw s VAL 66 Ca 0.56 -0.84 0.09 0.00 0.00 0.00 0.00 61.98 61.79 3fzw s VAL 66 Cb 0.46 -2.04 -0.06 0.00 0.00 0.00 0.00 36.38 34.74 3fzw s VAL 66 CO 0.02 0.57 -0.12 -0.13 0.00 0.00 0.00 175.10 175.44 3fzw s ARG 67 N -0.28 1.59 -0.06 2.72 1.81 -0.29 -4.82 118.95 119.62 3fzw s ARG 67 Ca 0.01 -1.77 -0.16 0.00 -1.72 0.00 0.00 55.73 52.09 3fzw s ARG 67 Cb -0.13 -1.40 0.03 0.00 -0.45 0.00 0.00 34.95 33.01 3fzw s ARG 67 CO 0.03 0.15 0.36 0.00 -0.68 0.00 0.00 175.30 175.16 3fzw s ALA 68 N -2.81 -0.91 -0.10 2.13 0.00 -1.26 -0.69 121.76 118.12 3fzw s ALA 68 Ca 0.29 0.63 -0.25 0.00 0.00 0.00 0.00 51.96 52.63 3fzw s ALA 68 Cb 0.01 -0.14 0.06 0.00 0.00 0.00 0.00 23.12 23.04 3fzw s ALA 68 CO 0.12 -0.25 0.59 0.00 0.00 0.00 0.00 175.76 176.23 3fzw n LEU 70 N 1.50 4.40 -0.11 0.00 4.77 -1.26 -1.09 117.00 125.21 3fzw n LEU 70 Ca -0.18 1.17 0.09 0.00 -0.03 0.00 0.00 56.01 57.06 3fzw n LEU 70 Cb 0.56 -1.56 0.13 0.00 -2.33 0.00 0.00 43.42 40.23 3fzw n LEU 70 CO 0.19 -0.27 0.54 0.35 -1.33 0.00 0.00 177.39 176.87 3fzw n THR 71 N 0.08 1.79 0.00 -5.08 -2.24 -0.28 -4.82 114.28 103.73 3fzw n THR 71 Ca 0.04 -2.17 0.00 0.00 -2.27 0.00 0.00 64.05 59.66 3fzw n THR 71 Cb 0.39 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 3fzw n THR 71 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fzw n GLY 72 N -1.34 0.03 3.77 3.38 0.00 -1.24 -4.94 105.19 104.85 3fzw n GLY 72 Ca 0.15 -1.02 -0.34 0.00 0.00 0.00 0.00 46.02 44.81 3fzw n GLY 72 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3fzw s PRO 73 N -2.00 3.12 -0.02 1.61 0.04 -1.26 -4.61 135.00 131.88 3fzw s PRO 73 Ca 0.00 1.49 -0.30 0.00 0.04 0.00 0.00 61.00 62.23 3fzw s PRO 73 Cb 0.00 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 3fzw s PRO 73 CO 0.00 -1.01 1.29 0.08 0.04 0.00 0.00 177.00 177.40 3fzw s VAL 74 N -2.06 3.97 0.00 -0.36 1.01 -1.26 -4.53 120.40 117.18 3fzw s VAL 74 Ca 0.70 1.34 -0.23 0.00 0.00 0.00 0.00 61.98 63.79 3fzw s VAL 74 Cb -0.22 -3.86 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 3fzw s VAL 74 CO 0.34 0.01 0.68 -0.13 0.00 0.00 0.00 175.10 176.00 3fzw s ARG 75 N 2.15 4.41 0.01 2.72 3.00 0.24 -4.90 118.95 126.58 3fzw s ARG 75 Ca 0.60 0.89 0.03 0.00 0.00 0.00 0.00 55.73 57.25 3fzw s ARG 75 Cb -0.28 -3.37 -0.01 0.00 0.00 0.00 0.00 34.95 31.29 3fzw s ARG 75 CO 0.25 0.28 -0.10 0.00 0.00 0.00 0.00 175.30 175.72 3fzw s ALA 76 N 0.04 0.86 0.63 2.13 0.00 -1.26 -0.39 121.76 123.77 3fzw s ALA 76 Ca 0.35 -0.53 0.06 0.00 0.00 0.00 0.00 51.96 51.84 3fzw s ALA 76 Cb -0.19 -0.18 0.11 0.00 0.00 0.00 0.00 23.12 22.86 3fzw s ALA 76 CO 0.20 0.18 0.87 -1.54 0.00 0.00 0.00 175.76 175.48 3fzw s SER 77 N -0.54 4.79 0.00 0.00 1.04 0.22 -4.93 113.70 114.28 3fzw s SER 77 Ca 0.02 -0.70 0.15 0.00 0.48 0.00 0.00 55.95 55.90 3fzw s SER 77 Cb -0.05 0.24 0.44 0.00 0.10 0.00 0.00 66.02 66.74 3fzw s SER 77 CO 0.00 -1.56 1.35 1.41 0.98 0.00 0.00 173.24 175.42 3fzw n HIS 78 N -2.48 0.51 -1.89 5.02 8.25 -1.26 -3.72 115.22 119.65 3fzw n HIS 78 Ca 0.16 -0.26 -0.01 0.00 -0.26 0.00 0.00 57.72 57.35 3fzw n HIS 78 Cb 0.61 0.00 0.13 0.00 1.12 0.00 0.00 29.99 31.86 3fzw n HIS 78 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3fzw n ASN 79 N 0.71 2.28 0.00 0.41 6.94 -1.26 -4.90 115.26 119.44 3fzw n ASN 79 Ca 0.15 -3.49 0.00 0.00 -0.02 0.00 0.00 54.58 51.21 3fzw n ASN 79 Cb 0.36 -0.45 0.00 0.00 -2.36 0.00 0.00 39.78 37.33 3fzw n ASN 79 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3fzw n GLY 80 N -0.77 0.42 3.57 4.83 0.00 -1.25 -4.87 105.19 107.12 3fzw n GLY 80 Ca 0.22 -0.77 -0.25 0.00 0.00 0.00 0.00 46.02 45.21 3fzw n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fzw s GLY 82 N -3.64 0.03 -0.04 0.00 0.00 0.08 -0.61 107.32 103.14 3fzw s GLY 82 Ca 0.33 -0.30 -0.08 0.00 0.00 0.00 0.00 44.72 44.67 3fzw s GLY 82 CO 0.17 0.42 0.18 0.00 0.00 0.00 0.00 173.10 173.87 3fzw s ALA 83 N -2.94 -0.45 -0.02 3.20 0.00 0.47 -0.97 121.76 121.05 3fzw s ALA 83 Ca 0.15 0.26 -0.06 0.00 0.00 0.00 0.00 51.96 52.31 3fzw s ALA 83 Cb -0.04 -0.11 0.01 0.00 0.00 0.00 0.00 23.12 22.97 3fzw s ALA 83 CO 0.06 -0.15 0.13 0.00 0.00 0.00 0.00 175.76 175.80 3fzw s MET 84 N -0.62 0.32 -0.13 0.00 0.23 -0.34 -0.59 119.30 118.18 3fzw s MET 84 Ca -0.07 -0.13 -0.09 0.00 -1.03 0.00 0.00 55.69 54.37 3fzw s MET 84 Cb -0.04 0.14 -0.04 0.00 -1.53 0.00 0.00 34.83 33.35 3fzw s MET 84 CO 0.01 -0.06 0.17 -1.25 -2.03 0.00 0.00 175.02 171.86 3fzw s PRO 85 N -0.69 3.68 0.26 3.16 0.04 -1.26 -1.54 135.00 138.66 3fzw s PRO 85 Ca -0.08 -0.08 -0.15 0.00 0.04 0.00 0.00 61.00 60.74 3fzw s PRO 85 Cb -0.05 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.25 3fzw s PRO 85 CO 0.01 0.65 0.54 -0.59 0.04 0.00 0.00 177.00 177.65 3fzw s PHE 86 N -0.68 0.24 -0.03 0.56 -0.71 -0.26 -1.13 117.98 115.98 3fzw s PHE 86 Ca 0.15 -0.63 0.05 0.00 -1.04 0.00 0.00 56.93 55.45 3fzw s PHE 86 Cb -0.12 0.32 -0.01 0.00 -1.21 0.00 0.00 43.02 42.00 3fzw s PHE 86 CO 0.04 -1.07 -0.18 0.50 -1.34 0.00 0.00 175.22 173.17 3fzw s ARG 87 N -3.93 1.72 -0.09 1.99 3.52 -0.25 -0.83 118.95 121.08 3fzw s ARG 87 Ca 0.20 -0.65 -0.00 0.00 -0.13 0.00 0.00 55.73 55.14 3fzw s ARG 87 Cb -0.02 -1.55 -0.03 0.00 -1.56 0.00 0.00 34.95 31.79 3fzw s ARG 87 CO 0.09 0.31 -0.06 0.08 -0.81 0.00 0.00 175.30 174.91 3fzw s VAL 88 N -0.16 3.77 -0.13 7.11 1.01 0.06 -1.44 120.40 130.61 3fzw s VAL 88 Ca 0.01 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 3fzw s VAL 88 Cb -0.10 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 3fzw s VAL 88 CO 0.01 0.57 -0.12 -1.61 0.00 0.00 0.00 175.10 173.95 3fzw s GLU 89 N -0.51 3.41 0.00 2.72 2.02 0.13 -0.53 118.70 125.94 3fzw s GLU 89 Ca 0.08 -0.67 0.00 0.00 0.02 0.00 0.00 54.97 54.40 3fzw s GLU 89 Cb -0.12 -2.66 0.00 0.00 0.10 0.00 0.00 34.13 31.45 3fzw s GLU 89 CO 0.02 0.21 0.00 0.00 0.02 0.00 0.00 175.26 175.51 3fzw n MET 90 N 3.55 0.00 -4.44 1.61 0.00 -0.80 -1.14 117.12 115.90 3fzw n MET 90 Ca -0.18 0.00 -0.34 0.00 0.00 0.00 0.00 57.70 57.18 3fzw n MET 90 Cb 0.53 0.00 -0.10 0.00 0.00 0.00 0.00 33.22 33.64 3fzw n MET 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 3fzw s VAL 91 N -2.61 4.07 -0.06 3.17 1.01 -1.26 -0.80 120.40 123.93 3fzw s VAL 91 Ca 0.00 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.66 3fzw s VAL 91 Cb 0.00 -2.72 0.02 0.00 0.00 0.00 0.00 36.38 33.69 3fzw s VAL 91 CO 0.00 0.58 -0.05 0.86 0.00 0.00 0.00 175.10 176.49 3fzw s TRP 92 N -0.58 0.88 -1.53 5.22 -0.11 -0.16 -4.84 118.94 117.82 3fzw s TRP 92 Ca 0.09 -0.28 -0.11 0.00 1.22 0.00 0.00 56.10 57.01 3fzw s TRP 92 Cb -0.12 -0.78 0.08 0.00 -1.50 0.00 0.00 33.47 31.15 3fzw s TRP 92 CO 0.02 -0.25 0.83 -1.71 -4.62 0.00 0.00 176.95 171.23 3fzw n ASN 93 N 4.25 -3.41 0.00 5.86 5.15 -1.26 -1.62 115.26 124.23 3fzw n ASN 93 Ca -0.21 -0.87 0.00 0.00 -0.60 0.00 0.00 54.58 52.90 3fzw n ASN 93 Cb 0.51 -3.55 0.00 0.00 -0.53 0.00 0.00 39.78 36.21 3fzw n ASN 93 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3fzw n GLY 94 N -1.65 0.80 3.23 8.20 0.00 -1.26 -5.00 105.19 109.51 3fzw n GLY 94 Ca -0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.80 3fzw n GLY 94 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fzw s GLN 95 N -0.05 0.98 0.09 1.61 -0.21 -0.64 -5.11 119.66 116.33 3fzw s GLN 95 Ca 0.00 -1.16 -0.31 0.00 0.02 0.00 0.00 55.36 53.91 3fzw s GLN 95 Cb 0.00 -0.91 -0.09 0.00 1.00 0.00 0.00 33.01 33.01 3fzw s GLN 95 CO 0.00 0.19 1.63 -2.14 -2.12 0.00 0.00 175.29 172.84 3fzw s PRO 96 N -2.38 4.20 0.31 2.91 0.02 -1.26 -0.99 135.00 137.82 3fzw s PRO 96 Ca 0.06 2.33 0.03 0.00 0.02 0.00 0.00 61.00 63.44 3fzw s PRO 96 Cb -0.07 -3.48 -0.05 0.00 0.02 0.00 0.00 34.50 30.92 3fzw s PRO 96 CO 0.03 -0.70 0.08 0.00 -0.33 0.00 0.00 177.00 176.08 3fzw s ALA 98 N -3.44 0.59 -0.09 0.00 0.00 -0.29 -1.90 121.76 116.63 3fzw s ALA 98 Ca 0.36 -0.47 0.01 0.00 0.00 0.00 0.00 51.96 51.85 3fzw s ALA 98 Cb 0.08 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.14 3fzw s ALA 98 CO 0.15 0.09 -0.09 -1.17 0.00 0.00 0.00 175.76 174.74 3fzw s LEU 99 N -0.68 1.37 0.04 0.00 2.96 0.32 -0.55 118.68 122.14 3fzw s LEU 99 Ca -0.01 -0.30 -0.24 0.00 -0.22 0.00 0.00 54.13 53.36 3fzw s LEU 99 Cb -0.05 -0.83 -0.06 0.00 0.50 0.00 0.00 46.19 45.76 3fzw s LEU 99 CO 0.00 -0.06 0.74 -1.81 -1.32 0.00 0.00 176.35 173.90 3fzw s ASP 100 N 1.28 7.18 0.03 3.68 1.01 -0.65 -0.76 116.67 128.43 3fzw s ASP 100 Ca -0.03 1.41 0.00 0.00 0.71 0.00 0.00 52.55 54.64 3fzw s ASP 100 Cb -0.14 -2.45 -0.02 0.00 1.01 0.00 0.00 42.92 41.32 3fzw s ASP 100 CO -0.03 0.04 -0.04 -0.69 0.21 0.00 0.00 175.17 174.65 3fzw s VAL 101 N -0.11 0.19 -0.11 -1.27 1.01 -0.01 -4.75 120.40 115.35 3fzw s VAL 101 Ca 0.37 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.33 3fzw s VAL 101 Cb -0.20 -0.46 0.01 0.00 0.00 0.00 0.00 36.38 35.73 3fzw s VAL 101 CO 0.22 -0.54 -0.18 -0.63 0.00 0.00 0.00 175.10 173.96 3fzw s ILE 102 N -1.74 1.72 -0.15 2.22 1.01 -0.52 -1.10 121.20 122.63 3fzw s ILE 102 Ca -0.12 -0.79 -0.08 0.00 0.00 0.00 0.00 60.65 59.66 3fzw s ILE 102 Cb -0.08 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.81 3fzw s ILE 102 CO -0.02 0.48 0.13 0.20 0.00 0.00 0.00 174.94 175.73 3fzw s ASN 103 N 0.82 6.25 -0.17 3.58 0.01 -0.59 -0.27 114.94 124.57 3fzw s ASN 103 Ca -0.09 0.36 -0.02 0.00 -0.71 0.00 0.00 52.86 52.40 3fzw s ASN 103 Cb -0.16 -2.05 -0.01 0.00 0.41 0.00 0.00 41.25 39.44 3fzw s ASN 103 CO 0.00 0.32 -0.09 -0.69 -1.51 0.00 0.00 177.10 175.13 3fzw s VAL 104 N -0.49 3.21 -0.01 1.60 1.01 0.09 -1.19 120.40 124.62 3fzw s VAL 104 Ca 0.12 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 61.57 3fzw s VAL 104 Cb -0.12 -2.40 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 3fzw s VAL 104 CO 0.02 0.48 -0.14 -0.04 0.00 0.00 0.00 175.10 175.42 3fzw s MET 105 N 0.86 1.09 -0.10 2.72 -1.94 -0.15 -1.14 119.30 120.64 3fzw s MET 105 Ca -0.03 -0.50 0.01 0.00 -1.71 0.00 0.00 55.69 53.46 3fzw s MET 105 Cb -0.15 -1.06 -0.02 0.00 2.01 0.00 0.00 34.83 35.61 3fzw s MET 105 CO 0.01 0.29 -0.13 0.50 -0.01 0.00 0.00 175.02 175.68 3fzw s ARG 106 N -0.37 3.09 0.05 2.03 3.52 -0.66 -0.74 118.95 125.87 3fzw s ARG 106 Ca 0.05 -0.68 -0.02 0.00 -0.13 0.00 0.00 55.73 54.96 3fzw s ARG 106 Cb -0.05 -2.56 -0.04 0.00 -1.56 0.00 0.00 34.95 30.73 3fzw s ARG 106 CO -0.00 0.36 0.23 -0.06 -0.81 0.00 0.00 175.30 175.02 3fzw s PHE 107 N -0.04 3.53 0.32 5.12 0.40 -0.21 0.15 117.98 127.25 3fzw s PHE 107 Ca -0.03 0.33 -0.01 0.00 -0.60 0.00 0.00 56.93 56.62 3fzw s PHE 107 Cb -0.14 -1.82 0.07 0.00 0.51 0.00 0.00 43.02 41.64 3fzw s PHE 107 CO 0.04 0.59 0.44 -0.40 0.70 0.00 0.00 175.22 176.58 3fzw n ASP 108 N 0.47 0.45 0.00 1.36 5.68 1.00 -4.79 116.55 120.71 3fzw n ASP 108 Ca -0.06 -1.41 0.10 0.00 -0.50 0.00 0.00 54.79 52.92 3fzw n ASP 108 Cb 0.52 -0.30 0.62 0.00 -1.14 0.00 0.00 41.12 40.82 3fzw n ASP 108 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3fzw n GLU 109 N -1.84 0.74 -0.14 0.11 0.00 -1.26 -1.31 120.64 116.94 3fzw n GLU 109 Ca 0.07 0.00 0.04 0.00 0.00 0.00 0.00 57.16 57.27 3fzw n GLU 109 Cb 0.24 -1.44 0.12 0.00 0.00 0.00 0.00 31.44 30.36 3fzw n GLU 109 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 3fzw n HIS 110 N -0.94 0.37 -1.00 -1.84 8.25 -1.26 -2.96 115.22 115.84 3fzw n HIS 110 Ca 0.16 -0.51 -0.00 0.00 -0.26 0.00 0.00 57.72 57.10 3fzw n HIS 110 Cb 0.07 -0.04 -0.00 0.00 1.12 0.00 0.00 29.99 31.14 3fzw n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fzw n GLY 111 N 0.26 0.47 3.94 -1.41 0.00 -0.43 -4.46 105.19 103.56 3fzw n GLY 111 Ca 0.09 -0.28 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 3fzw n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fzw s ARG 112 N -0.54 3.44 -0.13 1.61 0.52 -1.26 -4.83 118.95 117.77 3fzw s ARG 112 Ca 0.00 -0.57 -0.29 0.00 -0.52 0.00 0.00 55.73 54.34 3fzw s ARG 112 Cb 0.00 -2.97 -0.02 0.00 0.52 0.00 0.00 34.95 32.48 3fzw s ARG 112 CO 0.00 0.53 1.25 0.42 0.02 0.00 0.00 175.30 177.52 3fzw s ILE 113 N -1.72 4.25 -0.11 1.52 1.01 0.47 -0.00 121.20 126.62 3fzw s ILE 113 Ca 0.35 1.53 -0.04 0.00 0.00 0.00 0.00 60.65 62.49 3fzw s ILE 113 Cb -0.11 -3.99 -0.26 0.00 0.01 0.00 0.00 42.46 38.11 3fzw s ILE 113 CO 0.28 -0.09 0.42 1.67 0.00 0.00 0.00 174.94 177.22 3fzw n GLN 114 N 6.15 0.74 -3.93 2.79 -0.06 0.12 -0.65 117.38 122.54 3fzw n GLN 114 Ca 0.13 0.27 -0.14 0.00 -2.00 0.00 0.00 57.00 55.26 3fzw n GLN 114 Cb 0.45 -1.72 -0.14 0.00 -4.06 0.00 0.00 30.24 24.76 3fzw n GLN 114 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 3fzw s THR 115 N -2.57 0.10 -0.03 1.69 -4.23 -1.03 -1.76 115.64 107.81 3fzw s THR 115 Ca -0.19 -0.02 0.04 0.00 -1.18 0.00 0.00 61.69 60.33 3fzw s THR 115 Cb 0.07 -0.11 -0.00 0.00 1.34 0.00 0.00 72.50 73.79 3fzw s THR 115 CO 0.78 0.05 -0.14 -0.32 -0.54 0.00 0.00 174.62 174.45 3fzw s MET 116 N 0.16 1.37 -0.12 3.99 -2.45 -0.40 -1.66 119.30 120.19 3fzw s MET 116 Ca -0.01 -0.48 -0.01 0.00 -1.25 0.00 0.00 55.69 53.94 3fzw s MET 116 Cb -0.03 -1.24 0.03 0.00 1.25 0.00 0.00 34.83 34.85 3fzw s MET 116 CO -0.00 0.21 -0.03 -0.65 1.05 0.00 0.00 175.02 175.60 3fzw s GLN 117 N 0.03 1.05 -0.34 4.11 -0.21 -0.29 -0.64 119.66 123.37 3fzw s GLN 117 Ca -0.02 -0.19 -0.08 0.00 0.02 0.00 0.00 55.36 55.08 3fzw s GLN 117 Cb -0.09 -1.51 0.02 0.00 1.00 0.00 0.00 33.01 32.43 3fzw s GLN 117 CO 0.01 -0.36 0.14 0.00 -2.12 0.00 0.00 175.29 172.95 3fzw s ALA 118 N 1.81 3.14 -0.20 6.09 0.00 -0.01 -0.73 121.76 131.87 3fzw s ALA 118 Ca 0.03 -1.64 -0.19 0.00 0.00 0.00 0.00 51.96 50.16 3fzw s ALA 118 Cb -0.14 -2.36 -0.03 0.00 0.00 0.00 0.00 23.12 20.60 3fzw s ALA 118 CO -0.07 -1.22 0.55 0.71 0.00 0.00 0.00 175.76 175.73 3fzw s TYR 119 N 1.49 3.37 -0.22 0.00 1.51 0.62 -0.31 117.35 123.83 3fzw s TYR 119 Ca 0.01 0.82 -0.35 0.00 -1.01 0.00 0.00 57.07 56.54 3fzw s TYR 119 Cb -0.19 -2.71 0.15 0.00 -0.11 0.00 0.00 41.96 39.10 3fzw s TYR 119 CO 0.04 -0.12 1.25 1.67 -1.11 0.00 0.00 175.55 177.28 3fzw s TRP 120 N 1.72 -0.10 0.02 2.71 1.48 -1.26 -1.44 118.94 122.06 3fzw s TRP 120 Ca 0.25 0.08 -0.00 0.00 -1.06 0.00 0.00 56.10 55.37 3fzw s TRP 120 Cb -0.16 0.51 0.00 0.00 -1.16 0.00 0.00 33.47 32.66 3fzw s TRP 120 CO 0.10 -0.16 0.03 -1.13 -4.06 0.00 0.00 176.95 171.73 3fzw n SER 121 N -0.01 -0.08 0.32 -2.66 3.41 -1.26 -4.72 113.62 108.61 3fzw n SER 121 Ca 0.01 -1.09 0.21 0.00 -0.26 0.00 0.00 58.87 57.74 3fzw n SER 121 Cb 0.58 0.15 1.08 0.00 -0.26 0.00 0.00 64.21 65.76 3fzw n SER 121 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 3fzw h GLU 122 N 0.00 0.00 0.00 4.33 9.09 -2.00 -0.34 114.58 125.66 3fzw h GLU 122 Ca -0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.39 3fzw h GLU 122 Cb 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.16 3fzw h GLU 122 CO 0.02 0.01 0.00 1.33 0.05 0.00 0.00 179.01 180.42 3fzw n VAL 123 N -3.17 1.06 0.02 -1.06 0.24 -1.26 -2.00 118.33 112.15 3fzw n VAL 123 Ca -0.02 0.32 0.09 0.00 -2.04 0.00 0.00 64.34 62.69 3fzw n VAL 123 Cb 0.12 -1.18 0.21 0.00 -1.47 0.00 0.00 33.84 31.52 3fzw n VAL 123 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3fzw n ASN 124 N -1.83 3.28 -4.73 -1.34 4.13 -0.14 -4.94 115.26 109.70 3fzw n ASN 124 Ca 0.02 -1.94 -0.35 0.00 1.68 0.00 0.00 54.58 53.99 3fzw n ASN 124 Cb 0.16 -0.28 -0.08 0.00 -1.54 0.00 0.00 39.78 38.04 3fzw n ASN 124 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 3fzw s LEU 125 N -1.17 4.21 0.11 3.41 2.96 -0.85 -1.64 118.68 125.71 3fzw s LEU 125 Ca 0.34 0.27 0.03 0.00 -0.22 0.00 0.00 54.13 54.56 3fzw s LEU 125 Cb 0.19 -2.14 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 3fzw s LEU 125 CO 0.26 0.16 -0.09 -0.94 -1.32 0.00 0.00 176.35 174.42 3fzw s SER 126 N 0.40 1.47 0.00 3.68 1.04 0.29 -4.99 113.70 115.59 3fzw s SER 126 Ca 0.09 -0.91 0.25 0.00 0.48 0.00 0.00 55.95 55.87 3fzw s SER 126 Cb -0.11 0.02 0.50 0.00 0.10 0.00 0.00 66.02 66.52 3fzw s SER 126 CO -0.01 -0.32 1.43 0.55 0.98 0.00 0.00 173.24 175.87