#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3guz s LEU 2 N 0.00 2.65 -0.22 -0.89 1.43 -0.83 -5.00 118.68 115.82 3guz s LEU 2 Ca 0.00 -0.24 -0.09 0.00 -1.03 0.00 0.00 54.13 52.77 3guz s LEU 2 Cb 0.00 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 3guz s LEU 2 CO 0.00 0.33 0.10 -0.63 0.23 0.00 0.00 176.35 176.38 3guz s ILE 3 N -0.62 4.91 -0.13 -0.59 1.01 -1.26 -0.82 121.20 123.70 3guz s ILE 3 Ca 0.09 0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.79 3guz s ILE 3 Cb -0.11 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.09 3guz s ILE 3 CO 0.01 0.38 -0.20 -0.63 0.00 0.00 0.00 174.94 174.50 3guz s ILE 4 N 0.96 2.30 -0.01 2.92 -1.09 0.21 -4.97 121.20 121.51 3guz s ILE 4 Ca 0.05 -0.92 0.06 0.00 -2.23 0.00 0.00 60.65 57.61 3guz s ILE 4 Cb -0.14 -1.92 -0.09 0.00 -1.58 0.00 0.00 42.46 38.74 3guz s ILE 4 CO 0.03 0.54 0.11 -0.62 -1.23 0.00 0.00 174.94 173.78 3guz n GLU 5 N 3.79 0.59 -4.28 2.79 1.02 -1.26 -0.91 120.64 122.37 3guz n GLU 5 Ca -0.19 -0.05 -0.27 0.00 -0.02 0.00 0.00 57.16 56.63 3guz n GLU 5 Cb 0.52 -1.14 -0.09 0.00 -0.02 0.00 0.00 31.44 30.71 3guz n GLU 5 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3guz s THR 6 N -2.36 3.20 0.25 2.62 -4.23 -1.26 -4.24 115.64 109.62 3guz s THR 6 Ca -0.02 -1.61 -0.05 0.00 -1.18 0.00 0.00 61.69 58.83 3guz s THR 6 Cb 0.03 -2.57 0.24 0.00 1.34 0.00 0.00 72.50 71.55 3guz s THR 6 CO 0.24 -0.08 1.89 -0.07 -0.54 0.00 0.00 174.62 176.05 3guz h LEU 7 N 3.01 1.00 -0.36 4.79 3.38 -1.97 -0.14 115.31 125.04 3guz h LEU 7 Ca -0.47 -0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.31 3guz h LEU 7 Cb 1.20 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 3guz h LEU 7 CO 0.54 0.67 -0.81 -0.65 0.09 0.00 0.00 178.44 178.28 3guz h PRO 8 N 1.16 0.26 -0.00 1.13 0.11 -1.99 0.34 132.00 133.01 3guz h PRO 8 Ca 0.39 -0.25 -0.13 0.00 0.11 0.00 0.00 66.00 66.12 3guz h PRO 8 Cb 0.06 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.21 3guz h PRO 8 CO -0.14 0.94 -0.63 -0.07 -0.21 0.00 0.00 178.00 177.88 3guz h LEU 9 N 0.16 0.00 -0.40 2.35 3.38 -1.94 -1.20 115.31 117.66 3guz h LEU 9 Ca -0.04 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.80 3guz h LEU 9 Cb 1.41 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.15 3guz h LEU 9 CO 0.13 0.64 -0.24 0.25 0.09 0.00 0.00 178.44 179.30 3guz h LEU 10 N 0.00 0.91 -0.49 1.67 5.85 -0.51 -1.95 115.31 120.80 3guz h LEU 10 Ca -0.01 -0.42 0.08 0.00 0.84 0.00 0.00 57.88 58.37 3guz h LEU 10 Cb 1.12 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.83 3guz h LEU 10 CO 0.08 1.13 0.10 -0.09 -0.34 0.00 0.00 178.44 179.32 3guz h ARG 11 N 0.69 0.23 -0.52 1.25 1.12 0.20 0.72 114.38 118.06 3guz h ARG 11 Ca 0.08 -0.01 0.05 0.00 -1.11 0.00 0.00 59.98 58.99 3guz h ARG 11 Cb 0.81 -0.05 -0.05 0.00 -0.01 0.00 0.00 29.97 30.67 3guz h ARG 11 CO 0.07 0.15 0.25 0.37 -3.11 0.00 0.00 179.97 177.69 3guz h GLN 12 N 0.23 0.46 -0.30 0.20 4.15 -1.10 -0.11 115.11 118.64 3guz h GLN 12 Ca 0.24 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.61 3guz h GLN 12 Cb 0.32 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 3guz h GLN 12 CO -0.32 0.30 0.09 1.96 -1.93 0.00 0.00 178.83 178.94 3guz h GLN 13 N 0.47 0.47 -0.20 1.69 1.08 -0.42 -2.52 115.11 115.68 3guz h GLN 13 Ca 0.24 -0.10 -0.14 0.00 -1.45 0.00 0.00 58.65 57.19 3guz h GLN 13 Cb 0.18 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 3guz h GLN 13 CO -0.19 0.52 -0.48 0.82 -0.95 0.00 0.00 178.83 178.56 3guz h ILE 14 N 0.33 1.31 -0.75 2.54 1.08 -0.67 -1.51 117.51 119.85 3guz h ILE 14 Ca 0.10 -1.69 -0.05 0.00 -0.39 0.00 0.00 64.86 62.83 3guz h ILE 14 Cb 0.25 1.68 -0.03 0.00 -3.07 0.00 0.00 36.82 35.64 3guz h ILE 14 CO -0.00 0.53 0.27 0.03 -0.69 0.00 0.00 178.15 178.28 3guz h ARG 15 N 0.42 1.14 -0.50 2.37 3.08 -1.00 -0.73 114.38 119.15 3guz h ARG 15 Ca 0.02 -0.22 -0.07 0.00 0.07 0.00 0.00 59.98 59.78 3guz h ARG 15 Cb 0.99 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.85 3guz h ARG 15 CO 0.09 0.95 0.05 -0.09 -1.07 0.00 0.00 179.97 179.90 3guz h ARG 16 N 1.09 0.86 -0.44 0.04 2.43 -1.26 -1.07 114.38 116.03 3guz h ARG 16 Ca 0.24 -0.25 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 3guz h ARG 16 Cb 0.26 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 3guz h ARG 16 CO -0.01 0.87 -0.13 -0.07 -1.51 0.00 0.00 179.97 179.11 3guz h LEU 17 N 0.73 0.80 -0.11 3.80 3.38 -0.96 -0.88 115.31 122.06 3guz h LEU 17 Ca 0.15 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3guz h LEU 17 Cb 0.45 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 3guz h LEU 17 CO 0.02 0.94 0.07 -0.09 0.09 0.00 0.00 178.44 179.46 3guz h ARG 18 N 0.72 0.15 0.00 1.13 9.65 -0.91 -1.62 114.38 123.51 3guz h ARG 18 Ca 0.12 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.98 3guz h ARG 18 Cb 0.62 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.17 3guz h ARG 18 CO 0.04 0.15 0.00 0.00 2.80 0.00 0.00 179.97 182.96 3guz h MET 19 N 0.11 0.00 0.00 0.20 -0.00 -0.96 -0.01 114.93 114.27 3guz h MET 19 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.74 3guz h MET 19 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.64 3guz h MET 19 CO -0.01 0.00 0.00 0.39 -0.00 0.00 0.00 176.91 177.29 3guz n GLU 20 N -3.09 0.02 -1.60 -0.10 1.02 -0.36 -4.92 120.64 111.61 3guz n GLU 20 Ca 0.02 0.07 -0.16 0.00 -0.02 0.00 0.00 57.16 57.07 3guz n GLU 20 Cb 0.42 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.28 3guz n GLU 20 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3guz n GLY 21 N 1.09 1.27 3.77 0.62 0.00 -0.02 -4.99 105.19 106.93 3guz n GLY 21 Ca 0.06 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 3guz n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3guz s LYS 22 N -3.57 3.28 -0.08 1.61 -0.14 -1.08 -5.01 119.74 114.75 3guz s LYS 22 Ca 0.00 1.66 -0.25 0.00 -1.36 0.00 0.00 55.97 56.02 3guz s LYS 22 Cb 0.00 -1.99 -0.03 0.00 -1.68 0.00 0.00 37.83 34.13 3guz s LYS 22 CO 0.00 -0.92 0.76 0.50 -0.76 0.00 0.00 175.35 174.93 3guz s ARG 23 N -3.29 4.43 -0.05 1.68 3.52 -1.26 -4.85 118.95 119.12 3guz s ARG 23 Ca 0.74 0.98 0.05 0.00 -0.13 0.00 0.00 55.73 57.37 3guz s ARG 23 Cb -0.25 -3.47 -0.01 0.00 -1.56 0.00 0.00 34.95 29.66 3guz s ARG 23 CO 0.28 -0.03 -0.21 0.08 -0.81 0.00 0.00 175.30 174.61 3guz s VAL 24 N 1.08 1.77 -0.00 7.11 1.01 -1.26 -1.65 120.40 128.46 3guz s VAL 24 Ca 0.40 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 61.53 3guz s VAL 24 Cb -0.18 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.66 3guz s VAL 24 CO 0.18 0.50 -0.16 0.00 0.00 0.00 0.00 175.10 175.63 3guz s ALA 25 N -0.02 2.64 -0.08 5.51 0.00 -0.22 -0.15 121.76 129.44 3guz s ALA 25 Ca -0.05 -1.08 0.04 0.00 0.00 0.00 0.00 51.96 50.87 3guz s ALA 25 Cb -0.13 -0.87 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 3guz s ALA 25 CO 0.03 0.57 -0.20 -1.17 0.00 0.00 0.00 175.76 174.99 3guz s LEU 26 N -1.09 2.35 -0.36 0.00 2.96 0.28 -0.69 118.68 122.12 3guz s LEU 26 Ca 0.13 -0.42 -0.01 0.00 -0.22 0.00 0.00 54.13 53.62 3guz s LEU 26 Cb -0.11 -1.47 0.09 0.00 0.50 0.00 0.00 46.19 45.21 3guz s LEU 26 CO 0.03 0.23 0.11 -0.69 -1.32 0.00 0.00 176.35 174.72 3guz s VAL 27 N -0.06 2.96 0.09 1.68 1.01 -0.41 -1.35 120.40 124.32 3guz s VAL 27 Ca -0.05 -1.96 -0.31 0.00 0.00 0.00 0.00 61.98 59.66 3guz s VAL 27 Cb -0.14 -2.98 -0.07 0.00 0.00 0.00 0.00 36.38 33.19 3guz s VAL 27 CO 0.04 -0.52 1.25 -2.84 0.00 0.00 0.00 175.10 173.03 3guz s PRO 28 N 1.11 4.41 0.15 2.72 0.02 -1.26 -1.86 135.00 140.29 3guz s PRO 28 Ca 0.05 1.86 -0.03 0.00 0.02 0.00 0.00 61.00 62.91 3guz s PRO 28 Cb -0.21 -3.31 -0.03 0.00 0.02 0.00 0.00 34.50 30.97 3guz s PRO 28 CO -0.04 -0.28 0.11 0.95 -0.33 0.00 0.00 177.00 177.41 3guz s THR 29 N 0.90 0.08 -0.39 0.99 -4.23 -0.40 -4.91 115.64 107.68 3guz s THR 29 Ca 0.59 -1.83 0.06 0.00 -1.18 0.00 0.00 61.69 59.33 3guz s THR 29 Cb -0.32 -2.09 0.56 0.00 1.34 0.00 0.00 72.50 71.99 3guz s THR 29 CO 0.31 -0.35 1.67 0.23 -0.54 0.00 0.00 174.62 175.94 3guz n MET 30 N -0.15 2.15 0.00 3.99 2.81 -1.26 -1.69 117.12 122.98 3guz n MET 30 Ca -0.04 -3.19 0.00 0.00 -1.81 0.00 0.00 57.70 52.66 3guz n MET 30 Cb 0.64 -2.02 0.00 0.00 -0.71 0.00 0.00 33.22 31.13 3guz n MET 30 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3guz n GLY 31 N -1.10 -0.25 3.71 3.03 0.00 -1.26 -4.50 105.19 104.83 3guz n GLY 31 Ca 0.47 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.11 3guz n GLY 31 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3guz n ASN 32 N -1.69 -5.18 -4.77 1.61 5.15 -1.26 -4.91 115.26 104.21 3guz n ASN 32 Ca 0.00 -1.04 -0.38 0.00 -0.60 0.00 0.00 54.58 52.56 3guz n ASN 32 Cb 0.00 -3.24 -0.06 0.00 -0.53 0.00 0.00 39.78 35.94 3guz n ASN 32 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3guz s LEU 33 N -6.56 4.50 0.00 1.20 1.43 -1.26 -5.05 118.68 112.94 3guz s LEU 33 Ca 0.47 1.77 0.00 0.00 -1.03 0.00 0.00 54.13 55.35 3guz s LEU 33 Cb -0.18 -3.67 0.00 0.00 0.03 0.00 0.00 46.19 42.38 3guz s LEU 33 CO 0.87 0.08 0.00 1.41 0.23 0.00 0.00 176.35 178.94 3guz n HIS 34 N 1.11 -0.03 -0.36 0.29 8.25 -1.26 -4.88 115.22 118.34 3guz n HIS 34 Ca -0.02 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.48 3guz n HIS 34 Cb 0.49 0.00 0.18 0.00 1.12 0.00 0.00 29.99 31.78 3guz n HIS 34 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 3guz h ASP 35 N 0.00 1.00 -0.56 0.41 5.19 -2.00 -1.41 116.42 119.05 3guz h ASP 35 Ca 0.00 0.02 -0.04 0.00 -0.62 0.00 0.00 57.03 56.39 3guz h ASP 35 Cb 0.00 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 39.29 3guz h ASP 35 CO 0.00 0.62 0.21 1.23 -3.12 0.00 0.00 179.24 178.18 3guz h GLY 36 N 1.12 0.96 1.74 2.75 0.00 -1.97 -1.45 103.07 106.22 3guz h GLY 36 Ca 0.44 -0.51 -0.15 0.00 0.00 0.00 0.00 47.33 47.11 3guz h GLY 36 CO -0.19 0.48 -0.60 0.45 0.00 0.00 0.00 176.54 176.69 3guz h HIS 37 N 0.87 0.34 -0.51 5.60 3.86 -1.67 -2.91 115.15 120.74 3guz h HIS 37 Ca 0.20 -0.13 -0.03 0.00 -1.16 0.00 0.00 60.37 59.25 3guz h HIS 37 Cb 0.22 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 3guz h HIS 37 CO 0.01 0.79 0.19 0.52 0.86 0.00 0.00 177.93 180.31 3guz h MET 38 N 0.20 0.74 -0.59 2.45 2.07 -0.73 -0.58 114.93 118.49 3guz h MET 38 Ca -0.01 -0.11 0.02 0.00 -2.07 0.00 0.00 59.70 57.54 3guz h MET 38 Cb 1.10 -0.13 -0.03 0.00 -1.87 0.00 0.00 31.60 30.67 3guz h MET 38 CO 0.09 0.62 0.39 0.87 1.07 0.00 0.00 176.91 179.95 3guz h LYS 39 N 0.73 0.70 -0.21 1.72 1.57 -1.19 0.23 116.57 120.12 3guz h LYS 39 Ca 0.17 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.81 3guz h LYS 39 Cb 0.17 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 3guz h LYS 39 CO -0.01 0.46 -0.28 -0.07 -0.57 0.00 0.00 179.45 178.98 3guz h LEU 40 N 0.72 0.61 -0.39 2.94 3.38 -1.13 -1.86 115.31 119.57 3guz h LEU 40 Ca 0.23 -0.51 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 3guz h LEU 40 Cb 0.03 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 3guz h LEU 40 CO -0.06 1.00 0.07 0.58 0.09 0.00 0.00 178.44 180.11 3guz h VAL 41 N 0.24 1.24 -0.64 1.22 2.07 -0.53 -1.13 116.25 118.71 3guz h VAL 41 Ca 0.02 -0.85 0.07 0.00 0.82 0.00 0.00 66.70 66.76 3guz h VAL 41 Cb 0.85 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 3guz h VAL 41 CO 0.07 0.29 0.34 0.44 0.02 0.00 0.00 177.57 178.72 3guz h ASP 42 N 0.50 0.47 -0.59 0.57 3.32 -0.47 0.52 116.42 120.74 3guz h ASP 42 Ca 0.12 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 3guz h ASP 42 Cb 0.36 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.84 3guz h ASP 42 CO 0.01 0.30 0.25 -0.33 -1.72 0.00 0.00 179.24 177.75 3guz h GLU 43 N 0.61 0.87 -0.79 3.56 4.39 -1.04 -1.77 114.58 120.41 3guz h GLU 43 Ca 0.30 -0.15 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 3guz h GLU 43 Cb 0.23 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 28.70 3guz h GLU 43 CO -0.21 0.73 0.46 0.00 -1.16 0.00 0.00 179.01 178.83 3guz h ALA 44 N 1.09 1.01 -0.37 3.43 0.00 -0.43 -1.62 119.26 122.37 3guz h ALA 44 Ca 0.20 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3guz h ALA 44 Cb 0.17 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3guz h ALA 44 CO -0.02 0.50 0.01 0.87 0.00 0.00 0.00 179.25 180.62 3guz h LYS 45 N 1.09 0.58 0.00 0.00 1.57 -0.71 -2.19 116.57 116.92 3guz h LYS 45 Ca 0.28 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 3guz h LYS 45 Cb -0.00 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.22 3guz h LYS 45 CO -0.05 0.60 0.00 0.00 -0.57 0.00 0.00 179.45 179.43 3guz h ALA 46 N 1.46 1.00 -0.01 3.86 0.00 -0.41 -3.32 119.26 121.84 3guz h ALA 46 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3guz h ALA 46 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3guz h ALA 46 CO 0.01 0.00 -0.11 0.54 0.00 0.00 0.00 179.25 179.69 3guz n ARG 47 N -2.42 1.27 -3.63 0.00 1.74 -0.81 -5.03 116.66 107.78 3guz n ARG 47 Ca 0.04 -0.92 -0.11 0.00 -0.77 0.00 0.00 57.85 56.10 3guz n ARG 47 Cb 0.40 -1.17 -0.05 0.00 -1.02 0.00 0.00 32.46 30.63 3guz n ARG 47 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3guz s ALA 48 N -1.18 -0.95 0.06 7.54 0.00 -0.90 -4.97 121.76 121.36 3guz s ALA 48 Ca 0.11 -0.00 -0.18 0.00 0.00 0.00 0.00 51.96 51.89 3guz s ALA 48 Cb 0.09 0.66 -0.13 0.00 0.00 0.00 0.00 23.12 23.74 3guz s ALA 48 CO 0.20 -0.63 1.35 -0.44 0.00 0.00 0.00 175.76 176.24 3guz h ASP 49 N 2.42 0.54 -3.68 0.00 3.45 -1.63 -3.44 116.42 114.07 3guz h ASP 49 Ca -0.34 -0.51 -0.67 0.00 0.43 0.00 0.00 57.03 55.94 3guz h ASP 49 Cb 1.25 -0.15 -0.32 0.00 -0.56 0.00 0.00 39.33 39.55 3guz h ASP 49 CO 0.46 0.94 -0.88 -0.69 -1.57 0.00 0.00 179.24 177.50 3guz s VAL 50 N -4.21 2.00 -0.11 -1.35 1.01 -0.66 -5.03 120.40 112.05 3guz s VAL 50 Ca -0.13 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 60.86 3guz s VAL 50 Cb 0.06 -1.71 -0.00 0.00 0.00 0.00 0.00 36.38 34.73 3guz s VAL 50 CO 0.79 0.55 -0.21 -0.69 0.00 0.00 0.00 175.10 175.54 3guz s VAL 51 N 0.10 2.31 -0.09 2.92 1.01 -1.26 -1.05 120.40 124.35 3guz s VAL 51 Ca -0.11 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 60.96 3guz s VAL 51 Cb -0.16 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 3guz s VAL 51 CO 0.06 0.55 -0.11 0.00 0.00 0.00 0.00 175.10 175.60 3guz s ALA 52 N 0.39 2.76 -0.10 5.51 0.00 0.13 -1.35 121.76 129.10 3guz s ALA 52 Ca -0.16 -0.92 0.04 0.00 0.00 0.00 0.00 51.96 50.92 3guz s ALA 52 Cb -0.17 -1.15 -0.00 0.00 0.00 0.00 0.00 23.12 21.80 3guz s ALA 52 CO 0.07 0.45 -0.24 0.08 0.00 0.00 0.00 175.76 176.12 3guz s VAL 53 N -0.36 2.09 0.01 0.00 1.01 0.30 -1.29 120.40 122.17 3guz s VAL 53 Ca 0.04 -1.01 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 3guz s VAL 53 Cb -0.12 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 3guz s VAL 53 CO 0.02 0.56 0.24 -0.94 0.00 0.00 0.00 175.10 174.98 3guz s SER 54 N 0.34 6.44 -0.21 3.32 1.04 -0.78 -0.62 113.70 123.24 3guz s SER 54 Ca -0.19 0.47 -0.01 0.00 0.48 0.00 0.00 55.95 56.71 3guz s SER 54 Cb -0.18 -2.05 0.06 0.00 0.10 0.00 0.00 66.02 63.94 3guz s SER 54 CO 0.09 0.24 -0.03 -0.63 0.98 0.00 0.00 173.24 173.89 3guz s ILE 55 N -1.34 1.15 -0.29 -1.02 1.01 0.04 -1.28 121.20 119.47 3guz s ILE 55 Ca 0.28 -0.90 -0.02 0.00 0.00 0.00 0.00 60.65 60.01 3guz s ILE 55 Cb -0.13 -1.47 0.18 0.00 0.01 0.00 0.00 42.46 41.05 3guz s ILE 55 CO 0.18 -0.08 0.59 0.12 0.00 0.00 0.00 174.94 175.74 3guz s PHE 56 N 1.58 -1.50 -0.69 3.97 5.36 -0.68 -3.96 117.98 122.06 3guz s PHE 56 Ca -0.03 1.73 -0.27 0.00 -0.96 0.00 0.00 56.93 57.40 3guz s PHE 56 Cb -0.18 0.56 0.02 0.00 -0.34 0.00 0.00 43.02 43.08 3guz s PHE 56 CO -0.07 -0.83 1.37 0.08 -1.46 0.00 0.00 175.22 174.31 3guz s VAL 57 N 2.84 3.70 -0.44 3.12 1.01 -1.26 -4.25 120.40 125.10 3guz s VAL 57 Ca 0.16 0.45 -0.26 0.00 0.00 0.00 0.00 61.98 62.33 3guz s VAL 57 Cb -0.15 -4.71 0.03 0.00 0.00 0.00 0.00 36.38 31.55 3guz s VAL 57 CO -0.20 -1.61 0.94 0.21 0.00 0.00 0.00 175.10 174.44 3guz s ASN 58 N 4.39 6.54 0.49 3.32 2.47 -1.26 -4.90 114.94 126.00 3guz s ASN 58 Ca 0.42 0.23 0.21 0.00 0.42 0.00 0.00 52.86 54.14 3guz s ASN 58 Cb -0.09 -2.46 1.26 0.00 -1.45 0.00 0.00 41.25 38.51 3guz s ASN 58 CO 0.18 -1.03 2.04 -0.65 -3.72 0.00 0.00 177.10 173.92 3guz h PRO 59 N 8.98 0.00 0.00 0.43 0.11 -1.95 -2.18 132.00 137.39 3guz h PRO 59 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3guz h PRO 59 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3guz h PRO 59 CO 1.03 0.15 0.00 1.98 -0.21 0.00 0.00 178.00 180.94 3guz h MET 60 N 0.00 0.00 -0.61 1.05 4.05 -1.90 -1.97 114.93 115.54 3guz h MET 60 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3guz h MET 60 Cb 0.31 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.11 3guz h MET 60 CO 0.02 0.00 0.00 0.00 0.23 0.00 0.00 176.91 177.16 3guz n GLN 61 N -2.98 2.65 -4.37 0.39 10.64 -0.82 -4.12 117.38 118.77 3guz n GLN 61 Ca -0.01 -2.54 -0.34 0.00 -1.83 0.00 0.00 57.00 52.28 3guz n GLN 61 Cb 0.19 -1.55 -0.13 0.00 -0.86 0.00 0.00 30.24 27.88 3guz n GLN 61 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 3guz s PHE 62 N -1.18 2.93 0.17 2.61 0.08 -0.74 -4.54 117.98 117.31 3guz s PHE 62 Ca 0.46 -0.62 -0.01 0.00 0.12 0.00 0.00 56.93 56.88 3guz s PHE 62 Cb 0.25 -1.97 0.02 0.00 -0.57 0.00 0.00 43.02 40.75 3guz s PHE 62 CO 0.33 -0.26 1.40 0.22 -0.10 0.00 0.00 175.22 176.81 3guz h ASP 63 N 7.15 0.43 -3.32 1.36 3.58 -1.87 -3.45 116.42 120.31 3guz h ASP 63 Ca -0.32 -0.31 -0.66 0.00 0.42 0.00 0.00 57.03 56.16 3guz h ASP 63 Cb 1.19 -0.13 -0.27 0.00 1.72 0.00 0.00 39.33 41.83 3guz h ASP 63 CO 0.59 1.07 -0.77 -0.13 -2.88 0.00 0.00 179.24 177.12 3guz s ARG 64 N -3.46 3.35 0.40 0.28 0.52 -1.26 -4.99 118.95 113.79 3guz s ARG 64 Ca -0.05 -0.70 0.12 0.00 -0.52 0.00 0.00 55.73 54.58 3guz s ARG 64 Cb 0.10 -2.64 0.93 0.00 0.52 0.00 0.00 34.95 33.86 3guz s ARG 64 CO 0.84 0.17 1.92 -1.00 0.02 0.00 0.00 175.30 177.25 3guz h PRO 65 N 6.85 0.53 -0.93 3.54 0.13 -1.99 -0.84 132.00 139.29 3guz h PRO 65 Ca -0.27 -0.03 0.10 0.00 -0.87 0.00 0.00 66.00 64.93 3guz h PRO 65 Cb 1.21 -0.12 -0.07 0.00 0.13 0.00 0.00 31.00 32.15 3guz h PRO 65 CO 0.56 0.35 0.60 0.93 -0.23 0.00 0.00 178.00 180.21 3guz h GLU 66 N 0.55 0.91 -0.14 0.86 3.07 -1.99 -0.32 114.58 117.52 3guz h GLU 66 Ca 0.37 -0.05 -0.15 0.00 -0.50 0.00 0.00 59.36 59.02 3guz h GLU 66 Cb 0.66 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 28.36 3guz h GLU 66 CO -0.13 0.60 -0.55 -0.44 -1.40 0.00 0.00 179.01 177.09 3guz h ASP 67 N 0.94 0.48 -0.40 1.42 3.32 -1.58 -2.22 116.42 118.38 3guz h ASP 67 Ca 0.43 -0.26 -0.15 0.00 0.02 0.00 0.00 57.03 57.07 3guz h ASP 67 Cb 0.40 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 3guz h ASP 67 CO -0.19 0.94 -0.34 0.25 -1.72 0.00 0.00 179.24 178.18 3guz h LEU 68 N 0.33 1.00 -0.50 1.55 5.85 -1.14 -3.01 115.31 119.39 3guz h LEU 68 Ca 0.00 -0.43 -0.14 0.00 0.84 0.00 0.00 57.88 58.15 3guz h LEU 68 Cb 1.07 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 3guz h LEU 68 CO 0.10 1.23 -0.66 0.00 -0.34 0.00 0.00 178.44 178.77 3guz h ALA 69 N 0.82 0.77 0.00 1.25 0.00 -1.02 -3.10 119.26 117.98 3guz h ALA 69 Ca 0.07 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3guz h ALA 69 Cb 0.93 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3guz h ALA 69 CO 0.09 0.83 0.00 -2.13 0.00 0.00 0.00 179.25 178.03 3guz n ARG 70 N -3.56 0.21 -2.01 0.00 0.63 -0.84 -4.90 116.66 106.18 3guz n ARG 70 Ca -0.00 0.19 -0.42 0.00 -0.92 0.00 0.00 57.85 56.70 3guz n ARG 70 Cb 0.70 -1.75 -0.03 0.00 0.45 0.00 0.00 32.46 31.83 3guz n ARG 70 CO 0.00 0.00 0.00 -0.47 -2.51 0.00 0.00 177.63 174.65 3guz s TYR 71 N -3.10 3.09 0.36 -0.14 5.04 -1.14 -4.87 117.35 116.60 3guz s TYR 71 Ca 0.11 0.84 -0.27 0.00 -2.44 0.00 0.00 57.07 55.31 3guz s TYR 71 Cb 0.13 -3.84 -0.09 0.00 0.35 0.00 0.00 41.96 38.52 3guz s TYR 71 CO 0.57 -2.93 1.21 -2.14 -1.34 0.00 0.00 175.55 170.91 3guz s PRO 72 N 0.59 4.23 -0.26 4.97 0.02 -1.26 -5.00 135.00 138.29 3guz s PRO 72 Ca 0.65 1.96 -0.01 0.00 0.02 0.00 0.00 61.00 63.62 3guz s PRO 72 Cb -0.42 -2.88 0.03 0.00 0.02 0.00 0.00 34.50 31.26 3guz s PRO 72 CO 0.35 -0.21 -0.06 1.03 -0.33 0.00 0.00 177.00 177.79 3guz s ARG 73 N -2.01 2.68 -0.45 5.54 3.00 -1.26 -4.41 118.95 122.04 3guz s ARG 73 Ca 0.53 -1.08 0.08 0.00 0.00 0.00 0.00 55.73 55.26 3guz s ARG 73 Cb -0.34 -3.00 0.26 0.00 0.00 0.00 0.00 34.95 31.87 3guz s ARG 73 CO 0.44 -0.46 0.61 0.25 0.00 0.00 0.00 175.30 176.13 3guz n THR 74 N 4.63 0.20 -0.15 0.02 -2.24 -1.26 -4.97 114.28 110.50 3guz n THR 74 Ca -0.16 -4.40 -0.11 0.00 -2.27 0.00 0.00 64.05 57.11 3guz n THR 74 Cb 0.46 -1.84 -0.01 0.00 -2.10 0.00 0.00 70.33 66.84 3guz n THR 74 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3guz h LEU 75 N 3.93 0.90 -0.02 3.22 5.85 -1.98 -0.09 115.31 127.12 3guz h LEU 75 Ca 0.11 -0.37 -0.00 0.00 0.84 0.00 0.00 57.88 58.45 3guz h LEU 75 Cb 0.82 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.60 3guz h LEU 75 CO 0.57 1.07 0.01 -0.61 -0.34 0.00 0.00 178.44 179.13 3guz h GLN 76 N 0.73 0.03 -0.33 1.25 4.15 -1.99 0.18 115.11 119.13 3guz h GLN 76 Ca 0.11 -0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.43 3guz h GLN 76 Cb 0.68 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.35 3guz h GLN 76 CO 0.05 0.10 -0.23 0.93 -1.93 0.00 0.00 178.83 177.75 3guz h GLU 77 N -0.05 0.63 -0.27 1.69 3.07 -1.97 -1.14 114.58 116.54 3guz h GLU 77 Ca 0.01 -0.24 0.05 0.00 -0.50 0.00 0.00 59.36 58.67 3guz h GLU 77 Cb 0.08 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 27.91 3guz h GLU 77 CO -0.00 0.81 -0.03 -0.44 -1.40 0.00 0.00 179.01 177.95 3guz h ASP 78 N 0.56 -0.16 0.35 1.42 3.32 -0.72 -2.29 116.42 118.90 3guz h ASP 78 Ca 0.08 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.13 3guz h ASP 78 Cb 0.69 0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 3guz h ASP 78 CO 0.05 -0.05 -0.33 0.00 -1.72 0.00 0.00 179.24 177.20 3guz h GLU 80 N 0.00 0.40 -0.42 0.00 4.22 -0.89 0.98 114.58 118.88 3guz h GLU 80 Ca -0.00 -0.04 -0.09 0.00 0.08 0.00 0.00 59.36 59.30 3guz h GLU 80 Cb 0.59 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3guz h GLU 80 CO 0.04 0.34 -0.10 0.87 -2.18 0.00 0.00 179.01 177.98 3guz h LYS 81 N 0.36 0.82 -0.24 1.92 1.57 -1.21 -2.07 116.57 117.72 3guz h LYS 81 Ca 0.10 -0.31 -0.13 0.00 -1.87 0.00 0.00 60.65 58.44 3guz h LYS 81 Cb 0.05 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3guz h LYS 81 CO -0.02 0.93 -0.41 -0.07 -0.57 0.00 0.00 179.45 179.32 3guz h LEU 82 N 0.64 0.60 -0.67 2.94 3.38 -1.22 -2.63 115.31 118.35 3guz h LEU 82 Ca 0.11 -0.27 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 3guz h LEU 82 Cb 0.63 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 3guz h LEU 82 CO 0.04 0.94 -0.01 -1.13 0.09 0.00 0.00 178.44 178.37 3guz h ASN 83 N 0.47 1.00 -0.44 -0.43 -0.00 -0.57 -0.86 115.58 114.75 3guz h ASN 83 Ca 0.04 -0.28 -0.02 0.00 -0.00 0.00 0.00 56.30 56.04 3guz h ASN 83 Cb 0.91 -0.27 -0.02 0.00 -0.00 0.00 0.00 38.32 38.94 3guz h ASN 83 CO 0.08 1.06 0.22 0.50 -0.00 0.00 0.00 177.43 179.28 3guz h LYS 84 N 0.93 0.67 -0.03 6.67 3.64 -1.27 0.31 116.57 127.50 3guz h LYS 84 Ca 0.17 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3guz h LYS 84 Cb 0.55 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 3guz h LYS 84 CO 0.03 0.54 0.00 0.54 -2.27 0.00 0.00 179.45 178.29 3guz n ARG 85 N -4.38 1.20 -3.46 1.90 3.00 -0.76 -4.91 116.66 109.26 3guz n ARG 85 Ca 0.04 -0.30 -0.25 0.00 -0.01 0.00 0.00 57.85 57.33 3guz n ARG 85 Cb 0.13 -1.38 0.05 0.00 0.00 0.00 0.00 32.46 31.26 3guz n ARG 85 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 3guz n LYS 86 N -0.54 -6.34 -1.77 5.56 5.02 0.10 -4.95 118.16 115.24 3guz n LYS 86 Ca 0.17 0.79 -0.40 0.00 -2.02 0.00 0.00 58.31 56.86 3guz n LYS 86 Cb 0.15 -5.74 0.02 0.00 -0.02 0.00 0.00 35.03 29.44 3guz n LYS 86 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3guz n VAL 87 N -4.74 2.71 0.05 -0.18 0.31 -0.42 -4.93 118.33 111.13 3guz n VAL 87 Ca -0.02 -0.50 -0.17 0.00 -0.01 0.00 0.00 64.34 63.63 3guz n VAL 87 Cb 0.57 -1.88 -0.14 0.00 -0.91 0.00 0.00 33.84 31.48 3guz n VAL 87 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3guz h ASP 88 N 2.38 0.38 -3.66 4.52 3.32 -1.57 -3.37 116.42 118.42 3guz h ASP 88 Ca -0.51 -0.58 -0.21 0.00 0.02 0.00 0.00 57.03 55.76 3guz h ASP 88 Cb 1.26 -0.12 -0.28 0.00 0.22 0.00 0.00 39.33 40.41 3guz h ASP 88 CO 0.61 1.49 -0.57 -0.22 -1.72 0.00 0.00 179.24 178.83 3guz s LEU 89 N -6.94 1.22 -0.18 1.55 0.20 -0.97 -1.96 118.68 111.61 3guz s LEU 89 Ca -0.11 0.29 0.01 0.00 0.69 0.00 0.00 54.13 55.01 3guz s LEU 89 Cb 0.07 0.44 0.02 0.00 -0.43 0.00 0.00 46.19 46.29 3guz s LEU 89 CO 0.84 -0.08 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.96 3guz s VAL 90 N 0.44 1.90 -0.37 1.68 1.01 -0.00 -0.54 120.40 124.51 3guz s VAL 90 Ca -0.03 -0.89 -0.15 0.00 0.00 0.00 0.00 61.98 60.91 3guz s VAL 90 Cb -0.04 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.58 3guz s VAL 90 CO -0.02 0.47 0.35 0.12 0.00 0.00 0.00 175.10 176.02 3guz s PHE 91 N 1.34 3.21 -0.56 5.22 5.36 0.21 -0.62 117.98 132.15 3guz s PHE 91 Ca 0.04 -0.24 0.05 0.00 -0.96 0.00 0.00 56.93 55.83 3guz s PHE 91 Cb -0.13 -2.67 0.20 0.00 -0.34 0.00 0.00 43.02 40.07 3guz s PHE 91 CO -0.12 -0.51 0.51 0.00 -1.46 0.00 0.00 175.22 173.65 3guz n ALA 92 N 5.35 3.24 -2.18 11.12 0.00 -0.09 -0.78 120.51 137.17 3guz n ALA 92 Ca -0.10 -4.00 -0.29 0.00 0.00 0.00 0.00 53.44 49.06 3guz n ALA 92 Cb 0.49 -0.89 -0.00 0.00 0.00 0.00 0.00 19.45 19.04 3guz n ALA 92 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3guz s PRO 93 N -1.22 3.59 0.74 0.00 0.04 -1.25 -4.55 135.00 132.34 3guz s PRO 93 Ca 0.32 0.35 -0.12 0.00 0.04 0.00 0.00 61.00 61.60 3guz s PRO 93 Cb 0.06 -2.32 0.03 0.00 0.04 0.00 0.00 34.50 32.31 3guz s PRO 93 CO -0.13 -0.25 1.12 -1.54 0.04 0.00 0.00 177.00 176.23 3guz s SER 94 N -3.97 5.16 0.21 6.66 1.04 -1.26 -4.86 113.70 116.68 3guz s SER 94 Ca 0.50 1.05 -0.08 0.00 0.48 0.00 0.00 55.95 57.89 3guz s SER 94 Cb -0.10 -1.77 0.17 0.00 0.10 0.00 0.00 66.02 64.41 3guz s SER 94 CO 0.44 -1.52 1.82 0.58 0.98 0.00 0.00 173.24 175.54 3guz h VAL 95 N -0.78 1.25 -0.28 5.02 2.07 -1.97 -1.93 116.25 119.63 3guz h VAL 95 Ca -0.45 -0.67 -0.05 0.00 0.82 0.00 0.00 66.70 66.35 3guz h VAL 95 Cb 1.27 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 3guz h VAL 95 CO 0.64 0.29 -0.05 0.11 0.02 0.00 0.00 177.57 178.58 3guz h LYS 96 N 1.13 0.44 -0.55 1.57 6.56 -1.94 0.37 116.57 124.16 3guz h LYS 96 Ca 0.28 -0.10 -0.10 0.00 -1.06 0.00 0.00 60.65 59.67 3guz h LYS 96 Cb 0.09 -0.06 -0.02 0.00 -0.57 0.00 0.00 32.23 31.67 3guz h LYS 96 CO -0.04 0.51 -0.06 1.49 -2.06 0.00 0.00 179.45 179.30 3guz h GLU 97 N 0.42 1.00 0.14 3.15 4.57 -1.75 -1.77 114.58 120.36 3guz h GLU 97 Ca 0.09 -0.35 -0.29 0.00 -1.18 0.00 0.00 59.36 57.63 3guz h GLU 97 Cb 0.36 -0.08 0.01 0.00 -0.16 0.00 0.00 28.75 28.89 3guz h GLU 97 CO 0.02 1.03 -1.31 0.82 -1.18 0.00 0.00 179.01 178.39 3guz h ILE 98 N 0.88 1.43 -2.15 2.32 1.08 -0.93 -3.40 117.51 116.75 3guz h ILE 98 Ca 0.15 -2.99 -0.57 0.00 -0.39 0.00 0.00 64.86 61.05 3guz h ILE 98 Cb 0.61 2.94 -0.41 0.00 -3.07 0.00 0.00 36.82 36.89 3guz h ILE 98 CO 0.04 0.88 -0.79 -1.22 -0.69 0.00 0.00 178.15 176.37 3guz n TYR 99 N -3.54 2.47 0.28 1.37 4.02 0.13 -4.91 117.16 116.96 3guz n TYR 99 Ca -0.10 -3.95 0.15 0.00 -0.01 0.00 0.00 57.90 53.99 3guz n TYR 99 Cb 1.04 -0.48 0.77 0.00 -0.02 0.00 0.00 39.34 40.65 3guz n TYR 99 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 3guz h PRO 100 N 3.71 0.00 -0.45 -0.72 0.13 -1.52 -1.05 132.00 132.09 3guz h PRO 100 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3guz h PRO 100 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 3guz h PRO 100 CO 0.71 0.08 0.00 0.09 -0.23 0.00 0.00 178.00 178.65 3guz n ASN 101 N -3.35 3.53 0.00 1.44 5.03 -1.26 -5.05 115.26 115.59 3guz n ASN 101 Ca -0.01 -2.21 0.00 0.00 0.87 0.00 0.00 54.58 53.23 3guz n ASN 101 Cb 0.25 -0.37 0.00 0.00 -1.02 0.00 0.00 39.78 38.64 3guz n ASN 101 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3guz n GLY 102 N 0.67 0.82 0.13 7.41 0.00 -0.40 -4.68 105.19 109.13 3guz n GLY 102 Ca 0.17 -1.72 -0.02 0.00 0.00 0.00 0.00 46.02 44.46 3guz n GLY 102 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3guz h THR 103 N 0.00 1.41 -0.54 2.61 1.35 -1.97 -3.28 112.91 112.49 3guz h THR 103 Ca 0.00 -2.36 0.04 0.00 -0.55 0.00 0.00 66.41 63.54 3guz h THR 103 Cb 0.00 2.30 -0.03 0.00 -1.73 0.00 0.00 68.15 68.69 3guz h THR 103 CO 0.00 0.66 0.36 -0.33 -0.25 0.00 0.00 175.52 175.95 3guz h GLU 104 N 0.00 0.56 -0.05 4.72 3.07 -1.99 -2.42 114.58 118.47 3guz h GLU 104 Ca -0.01 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 3guz h GLU 104 Cb 1.24 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 29.03 3guz h GLU 104 CO 0.09 0.37 0.00 0.25 -1.40 0.00 0.00 179.01 178.32 3guz n THR 105 N -4.47 1.28 -2.11 1.13 -2.24 -1.26 -5.02 114.28 101.60 3guz n THR 105 Ca 0.06 -1.35 -0.39 0.00 -2.27 0.00 0.00 64.05 60.10 3guz n THR 105 Cb 0.17 0.28 -0.01 0.00 -2.10 0.00 0.00 70.33 68.67 3guz n THR 105 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3guz s HIS 106 N -1.54 2.89 0.25 4.78 5.04 -0.91 -4.97 115.29 120.83 3guz s HIS 106 Ca 0.12 1.44 -0.29 0.00 -1.54 0.00 0.00 55.06 54.80 3guz s HIS 106 Cb 0.10 -3.61 -0.15 0.00 0.04 0.00 0.00 32.58 28.95 3guz s HIS 106 CO 0.03 -1.91 0.92 2.41 -2.34 0.00 0.00 174.74 173.85 3guz n THR 107 N 0.17 1.84 -4.23 0.89 -1.04 -1.26 -4.98 114.28 105.67 3guz n THR 107 Ca 0.04 -0.46 -0.13 0.00 -2.04 0.00 0.00 64.05 61.45 3guz n THR 107 Cb 0.44 -0.75 -0.10 0.00 -1.82 0.00 0.00 70.33 68.10 3guz n THR 107 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 3guz s TYR 108 N -0.93 1.16 -0.10 -1.42 -0.85 -1.26 -5.01 117.35 108.94 3guz s TYR 108 Ca 0.62 -0.84 0.03 0.00 -0.52 0.00 0.00 57.07 56.36 3guz s TYR 108 Cb -0.78 -0.62 -0.00 0.00 0.38 0.00 0.00 41.96 40.94 3guz s TYR 108 CO 0.58 -0.02 -0.21 0.08 -1.52 0.00 0.00 175.55 174.46 3guz s VAL 109 N -3.46 2.34 -0.04 -3.49 1.01 -1.26 -5.01 120.40 110.49 3guz s VAL 109 Ca 0.17 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.25 3guz s VAL 109 Cb 0.04 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.51 3guz s VAL 109 CO -0.00 0.55 -0.12 -0.62 0.00 0.00 0.00 175.10 174.91 3guz s ASP 110 N 0.30 1.55 -0.35 3.32 2.15 -1.26 -3.98 116.67 118.40 3guz s ASP 110 Ca -0.16 -0.25 -0.03 0.00 0.43 0.00 0.00 52.55 52.54 3guz s ASP 110 Cb -0.17 -0.48 0.07 0.00 -0.30 0.00 0.00 42.92 42.04 3guz s ASP 110 CO 0.08 0.08 0.10 -0.69 -0.17 0.00 0.00 175.17 174.57 3guz s VAL 111 N 0.26 3.28 0.78 1.11 1.01 -1.26 -5.09 120.40 120.49 3guz s VAL 111 Ca -0.06 -1.59 -0.09 0.00 0.00 0.00 0.00 61.98 60.25 3guz s VAL 111 Cb -0.11 -3.02 0.17 0.00 0.00 0.00 0.00 36.38 33.42 3guz s VAL 111 CO 0.01 -0.35 1.07 -2.65 0.00 0.00 0.00 175.10 173.19 3guz n PRO 112 N 4.66 -0.73 -1.04 2.72 -0.02 -1.26 -5.07 135.00 134.26 3guz n PRO 112 Ca -0.09 -2.05 -0.01 0.00 -2.02 0.00 0.00 63.50 59.33 3guz n PRO 112 Cb 0.43 -0.98 -0.01 0.00 -0.02 0.00 0.00 33.50 32.93 3guz n PRO 112 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3guz n GLY 113 N -2.36 0.48 0.00 -1.23 0.00 -1.26 -5.07 105.19 95.75 3guz n GLY 113 Ca 0.15 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.18 3guz n GLY 113 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3guz n ARG 123 N -2.95 0.00 -1.55 1.61 1.85 -1.26 -5.21 116.66 109.15 3guz n ARG 123 Ca -0.01 0.00 -0.47 0.00 -1.00 0.00 0.00 57.85 56.37 3guz n ARG 123 Cb 0.04 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 31.42 3guz n ARG 123 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 3guz n PRO 124 N 0.00 1.01 0.00 2.89 -0.02 -1.26 -1.11 135.00 136.51 3guz n PRO 124 Ca 0.00 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3guz n PRO 124 Cb 0.00 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 3guz n PRO 124 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3guz n GLY 125 N 1.62 3.20 0.07 -1.23 0.00 -1.26 -4.81 105.19 102.78 3guz n GLY 125 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 3guz n GLY 125 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3guz h HIS 126 N 0.00 -0.05 -0.38 1.61 6.17 -1.36 -1.33 115.15 119.81 3guz h HIS 126 Ca 0.00 -0.00 -0.09 0.00 0.71 0.00 0.00 60.37 60.99 3guz h HIS 126 Cb 0.00 0.02 -0.02 0.00 2.52 0.00 0.00 27.41 29.93 3guz h HIS 126 CO 0.00 0.19 -0.15 0.74 0.71 0.00 0.00 177.93 179.42 3guz h PHE 127 N -0.29 0.76 -0.89 5.26 -1.00 -1.90 -1.94 116.94 116.94 3guz h PHE 127 Ca -0.01 -0.14 0.10 0.00 2.81 0.00 0.00 57.97 60.73 3guz h PHE 127 Cb 0.26 -0.19 -0.07 0.00 3.61 0.00 0.00 35.95 39.55 3guz h PHE 127 CO 0.00 0.80 0.54 -0.09 -1.61 0.00 0.00 178.31 177.95 3guz h ARG 128 N 0.62 0.87 -0.23 1.51 2.43 -1.80 -0.04 114.38 117.74 3guz h ARG 128 Ca 0.10 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.13 3guz h ARG 128 Cb 0.61 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 3guz h ARG 128 CO 0.04 0.58 -0.23 0.78 -1.51 0.00 0.00 179.97 179.63 3guz h GLY 129 N 0.90 0.46 0.52 2.80 0.00 -0.62 -1.07 103.07 106.06 3guz h GLY 129 Ca 0.43 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 3guz h GLY 129 CO -0.24 0.33 -0.09 -2.08 0.00 0.00 0.00 176.54 174.46 3guz h VAL 130 N 0.38 0.90 -0.90 4.60 2.07 -0.69 -1.99 116.25 120.62 3guz h VAL 130 Ca 0.06 -0.90 0.04 0.00 0.82 0.00 0.00 66.70 66.72 3guz h VAL 130 Cb 0.61 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.73 3guz h VAL 130 CO 0.04 0.19 0.58 0.77 0.02 0.00 0.00 177.57 179.17 3guz h SER 131 N -0.73 0.95 0.06 0.57 4.64 -0.92 -0.56 113.55 117.56 3guz h SER 131 Ca -0.03 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3guz h SER 131 Cb 0.50 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 3guz h SER 131 CO 0.04 0.64 -0.03 0.74 -0.87 0.00 0.00 176.83 177.35 3guz h THR 132 N 1.10 1.03 -0.23 2.95 2.02 -1.18 0.33 112.91 118.93 3guz h THR 132 Ca 0.37 -0.27 -0.16 0.00 0.77 0.00 0.00 66.41 67.12 3guz h THR 132 Cb 0.06 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 3guz h THR 132 CO -0.14 0.07 -0.51 -0.29 0.37 0.00 0.00 175.52 175.02 3guz h ILE 133 N -0.20 1.31 -0.22 3.11 6.09 -1.09 -1.31 117.51 125.19 3guz h ILE 133 Ca -0.01 -1.73 -0.17 0.00 -1.37 0.00 0.00 64.86 61.58 3guz h ILE 133 Cb 0.17 1.68 0.00 0.00 0.47 0.00 0.00 36.82 39.15 3guz h ILE 133 CO 0.01 0.55 -0.52 0.58 -3.07 0.00 0.00 178.15 175.70 3guz h VAL 134 N 0.49 1.30 -0.49 2.19 2.07 -1.05 0.61 116.25 121.38 3guz h VAL 134 Ca 0.02 -1.73 0.09 0.00 0.82 0.00 0.00 66.70 65.90 3guz h VAL 134 Cb 1.06 1.81 -0.07 0.00 -1.52 0.00 0.00 31.29 32.56 3guz h VAL 134 CO 0.10 0.55 0.05 0.28 0.02 0.00 0.00 177.57 178.57 3guz h SER 135 N 0.48 -0.11 -0.26 0.57 0.02 -0.80 0.49 113.55 113.94 3guz h SER 135 Ca -0.00 0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 3guz h SER 135 Cb 1.13 0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.83 3guz h SER 135 CO 0.11 -0.02 0.10 0.50 -1.14 0.00 0.00 176.83 176.38 3guz h LYS 136 N 0.17 0.39 -0.94 3.45 3.64 -0.95 -0.75 116.57 121.59 3guz h LYS 136 Ca 0.25 -0.07 0.08 0.00 -1.27 0.00 0.00 60.65 59.64 3guz h LYS 136 Cb 0.35 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.04 3guz h LYS 136 CO -0.37 0.43 0.59 -0.07 -2.27 0.00 0.00 179.45 177.76 3guz h LEU 137 N 0.28 0.91 -0.83 5.20 3.38 -0.59 0.41 115.31 124.06 3guz h LEU 137 Ca 0.09 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3guz h LEU 137 Cb 0.18 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 3guz h LEU 137 CO -0.01 0.55 0.20 -0.26 0.09 0.00 0.00 178.44 179.01 3guz h PHE 138 N 1.03 1.11 -0.37 1.13 0.05 -0.50 0.34 116.94 119.72 3guz h PHE 138 Ca 0.43 -0.11 -0.13 0.00 3.82 0.00 0.00 57.97 61.98 3guz h PHE 138 Cb 0.27 -0.32 -0.01 0.00 2.00 0.00 0.00 35.95 37.89 3guz h PHE 138 CO -0.02 0.89 -0.28 -0.91 -0.18 0.00 0.00 178.31 177.81 3guz h ASN 139 N 1.02 0.81 -0.27 2.17 2.35 -0.50 0.11 115.58 121.28 3guz h ASN 139 Ca 0.22 -0.31 -0.12 0.00 -0.55 0.00 0.00 56.30 55.54 3guz h ASN 139 Cb 0.31 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 3guz h ASN 139 CO -0.00 1.04 -0.29 -0.07 -1.65 0.00 0.00 177.43 176.45 3guz h LEU 140 N 0.67 0.71 0.00 1.61 3.38 -0.73 -3.34 115.31 117.62 3guz h LEU 140 Ca 0.08 -0.48 -0.26 0.00 0.09 0.00 0.00 57.88 57.31 3guz h LEU 140 Cb 0.80 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 3guz h LEU 140 CO 0.07 1.05 -2.08 0.52 0.09 0.00 0.00 178.44 178.09 3guz n VAL 141 N -4.29 1.12 -3.92 1.22 0.31 0.09 -4.85 118.33 108.01 3guz n VAL 141 Ca -0.04 -0.76 -0.28 0.00 -0.01 0.00 0.00 64.34 63.25 3guz n VAL 141 Cb 0.47 -0.48 -0.01 0.00 -0.91 0.00 0.00 33.84 32.91 3guz n VAL 141 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3guz n GLN 142 N -2.71 -2.69 -1.52 5.55 6.02 0.40 -4.93 117.38 117.49 3guz n GLN 142 Ca -0.22 0.39 -0.31 0.00 -0.01 0.00 0.00 57.00 56.85 3guz n GLN 142 Cb 0.98 -4.32 0.06 0.00 1.02 0.00 0.00 30.24 27.98 3guz n GLN 142 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3guz s PRO 143 N -6.52 2.70 0.17 -1.09 0.04 -1.26 -4.94 135.00 124.09 3guz s PRO 143 Ca 0.11 0.93 0.10 0.00 0.04 0.00 0.00 61.00 62.18 3guz s PRO 143 Cb -0.04 -1.96 -0.11 0.00 0.04 0.00 0.00 34.50 32.42 3guz s PRO 143 CO 0.89 -1.27 1.30 -0.44 0.04 0.00 0.00 177.00 177.53 3guz h ASP 144 N -0.84 0.00 -5.01 6.66 5.19 -0.85 -3.43 116.42 118.14 3guz h ASP 144 Ca -0.44 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 55.85 3guz h ASP 144 Cb 1.22 0.00 -0.19 0.00 0.18 0.00 0.00 39.33 40.54 3guz h ASP 144 CO 0.56 0.81 -0.34 0.27 -3.12 0.00 0.00 179.24 177.43 3guz s ILE 145 N -2.80 0.08 -0.01 0.35 -5.25 -0.99 -1.20 121.20 111.37 3guz s ILE 145 Ca 0.02 -0.63 -0.00 0.00 -0.99 0.00 0.00 60.65 59.04 3guz s ILE 145 Cb 0.09 -0.68 0.01 0.00 2.95 0.00 0.00 42.46 44.83 3guz s ILE 145 CO 0.79 -0.35 0.03 0.00 -1.79 0.00 0.00 174.94 173.62 3guz s ALA 146 N -1.76 -0.01 -0.09 2.27 0.00 -0.37 -0.55 121.76 121.24 3guz s ALA 146 Ca -0.11 0.16 -0.02 0.00 0.00 0.00 0.00 51.96 51.99 3guz s ALA 146 Cb -0.04 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.92 3guz s ALA 146 CO 0.01 -0.05 0.01 0.00 0.00 0.00 0.00 175.76 175.73 3guz s PHE 148 N -0.79 0.53 0.47 0.00 0.40 -0.45 -4.33 117.98 113.82 3guz s PHE 148 Ca 0.12 -0.80 -0.20 0.00 -0.60 0.00 0.00 56.93 55.45 3guz s PHE 148 Cb -0.11 -0.36 -0.09 0.00 0.51 0.00 0.00 43.02 42.96 3guz s PHE 148 CO 0.02 -0.24 0.99 0.20 0.70 0.00 0.00 175.22 176.89 3guz s GLY 149 N -2.33 2.36 0.29 4.36 0.00 -1.26 -0.96 107.32 109.78 3guz s GLY 149 Ca -0.01 0.43 0.15 0.00 0.00 0.00 0.00 44.72 45.29 3guz s GLY 149 CO -0.05 0.72 1.47 0.83 0.00 0.00 0.00 173.10 176.07 3guz h GLU 150 N 1.57 0.00 -0.82 2.90 5.08 -1.51 -3.36 114.58 118.43 3guz h GLU 150 Ca -0.49 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.83 3guz h GLU 150 Cb 1.20 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 3guz h GLU 150 CO 0.60 0.49 0.35 0.87 -1.00 0.00 0.00 179.01 180.33 3guz h LYS 151 N 0.00 1.21 -4.98 2.33 1.57 -1.82 -2.96 116.57 111.91 3guz h LYS 151 Ca -0.00 -0.20 -0.72 0.00 -1.87 0.00 0.00 60.65 57.85 3guz h LYS 151 Cb 1.35 -0.20 -0.13 0.00 0.08 0.00 0.00 32.23 33.32 3guz h LYS 151 CO 0.06 0.96 1.80 -3.47 -0.57 0.00 0.00 179.45 178.23 3guz n ASP 152 N -4.29 5.05 0.04 0.86 4.64 -1.26 -4.77 116.55 116.82 3guz n ASP 152 Ca 0.08 -2.96 -0.02 0.00 -1.38 0.00 0.00 54.79 50.51 3guz n ASP 152 Cb 0.17 -1.63 0.24 0.00 -1.04 0.00 0.00 41.12 38.86 3guz n ASP 152 CO 0.00 0.00 0.00 2.19 -0.82 0.00 0.00 177.20 178.57 3guz h PHE 153 N 7.10 0.45 -0.64 -0.67 -5.15 -1.80 -1.54 116.94 114.69 3guz h PHE 153 Ca 0.38 -0.09 -0.08 0.00 -0.20 0.00 0.00 57.97 57.99 3guz h PHE 153 Cb 0.84 -0.11 -0.02 0.00 0.22 0.00 0.00 35.95 36.87 3guz h PHE 153 CO 1.24 0.61 0.08 1.96 -2.00 0.00 0.00 178.31 180.21 3guz h GLN 154 N 0.36 1.07 -0.38 6.09 4.20 -1.89 -1.57 115.11 122.99 3guz h GLN 154 Ca 0.06 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.45 3guz h GLN 154 Cb 0.61 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.26 3guz h GLN 154 CO 0.04 1.00 0.15 0.37 -0.67 0.00 0.00 178.83 179.73 3guz h GLN 155 N 0.98 0.57 -0.25 1.46 4.15 -1.82 -0.49 115.11 119.71 3guz h GLN 155 Ca 0.19 -0.10 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 3guz h GLN 155 Cb 0.46 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 3guz h GLN 155 CO 0.02 0.55 0.13 1.25 -1.93 0.00 0.00 178.83 178.85 3guz h LEU 156 N 0.47 0.32 -0.96 -2.39 5.85 -1.19 -0.55 115.31 116.87 3guz h LEU 156 Ca 0.13 -0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.80 3guz h LEU 156 Cb 0.19 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 3guz h LEU 156 CO -0.01 0.33 0.62 0.00 -0.34 0.00 0.00 178.44 179.04 3guz h ALA 157 N 1.00 1.32 -0.43 1.25 0.00 -1.19 -0.11 119.26 121.10 3guz h ALA 157 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3guz h ALA 157 Cb 0.09 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3guz h ALA 157 CO -0.01 0.42 0.28 1.25 0.00 0.00 0.00 179.25 181.19 3guz h LEU 158 N 1.14 0.49 -0.25 0.00 5.85 -0.37 -1.61 115.31 120.57 3guz h LEU 158 Ca 0.41 -0.01 -0.21 0.00 0.84 0.00 0.00 57.88 58.91 3guz h LEU 158 Cb 0.14 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 41.05 3guz h LEU 158 CO -0.16 0.36 -0.71 0.40 -0.34 0.00 0.00 178.44 177.99 3guz h ILE 159 N 0.58 1.29 -0.67 4.05 1.08 -0.77 0.17 117.51 123.24 3guz h ILE 159 Ca 0.16 -1.93 0.07 0.00 -0.39 0.00 0.00 64.86 62.76 3guz h ILE 159 Cb -0.06 1.91 -0.06 0.00 -3.07 0.00 0.00 36.82 35.53 3guz h ILE 159 CO -0.03 0.61 0.36 0.03 -0.69 0.00 0.00 178.15 178.43 3guz h ARG 160 N 0.53 0.63 -0.19 2.37 3.08 -0.86 -0.25 114.38 119.70 3guz h ARG 160 Ca -0.03 -0.04 -0.21 0.00 0.07 0.00 0.00 59.98 59.77 3guz h ARG 160 Cb 1.32 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 31.24 3guz h ARG 160 CO 0.14 0.42 -0.72 -0.22 -1.07 0.00 0.00 179.97 178.52 3guz h LYS 161 N 0.65 0.81 -0.66 0.04 3.64 -1.04 -2.45 116.57 117.56 3guz h LYS 161 Ca 0.31 -0.62 0.01 0.00 -1.27 0.00 0.00 60.65 59.07 3guz h LYS 161 Cb 0.23 0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.13 3guz h LYS 161 CO -0.20 1.24 0.44 1.98 -2.27 0.00 0.00 179.45 180.63 3guz h MET 162 N 0.57 0.88 -0.22 1.90 4.05 -0.58 0.26 114.93 121.78 3guz h MET 162 Ca -0.04 -0.05 -0.07 0.00 -0.28 0.00 0.00 59.70 59.26 3guz h MET 162 Cb 1.35 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 31.95 3guz h MET 162 CO 0.15 0.58 -0.12 0.28 0.23 0.00 0.00 176.91 178.03 3guz h VAL 163 N 0.90 1.31 -0.61 -5.77 2.07 -1.03 0.54 116.25 113.66 3guz h VAL 163 Ca 0.24 -1.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.54 3guz h VAL 163 Cb -0.10 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 3guz h VAL 163 CO -0.05 0.37 0.31 0.00 0.02 0.00 0.00 177.57 178.21 3guz h ALA 164 N 0.70 0.79 -0.28 1.67 0.00 -1.22 -2.23 119.26 118.68 3guz h ALA 164 Ca 0.05 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 3guz h ALA 164 Cb 0.62 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3guz h ALA 164 CO 0.04 0.33 -0.46 -0.44 0.00 0.00 0.00 179.25 178.72 3guz h ASP 165 N 0.83 0.90 0.26 0.00 3.32 -0.34 -3.30 116.42 118.09 3guz h ASP 165 Ca 0.21 -0.52 0.00 0.00 0.02 0.00 0.00 57.03 56.74 3guz h ASP 165 Cb 0.09 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.39 3guz h ASP 165 CO -0.03 1.24 -0.26 0.23 -1.72 0.00 0.00 179.24 178.71 3guz n MET 166 N -4.10 0.79 -1.02 3.56 2.81 0.17 -4.94 117.12 114.39 3guz n MET 166 Ca -0.04 -0.45 -0.01 0.00 -1.81 0.00 0.00 57.70 55.39 3guz n MET 166 Cb 0.58 -1.49 -0.00 0.00 -0.71 0.00 0.00 33.22 31.59 3guz n MET 166 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3guz n GLY 167 N 1.34 0.44 3.71 3.03 0.00 -0.85 -5.00 105.19 107.86 3guz n GLY 167 Ca 0.12 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.72 3guz n GLY 167 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3guz s PHE 168 N -2.02 2.91 -1.54 1.61 0.40 -1.15 -4.91 117.98 113.29 3guz s PHE 168 Ca 0.00 0.60 -0.09 0.00 -0.60 0.00 0.00 56.93 56.84 3guz s PHE 168 Cb 0.00 -3.89 -0.02 0.00 0.51 0.00 0.00 43.02 39.62 3guz s PHE 168 CO 0.00 -3.34 2.74 -3.47 0.70 0.00 0.00 175.22 171.84 3guz n ASP 169 N 4.45 8.02 -3.92 1.36 2.03 -1.26 -4.84 116.55 122.39 3guz n ASP 169 Ca 0.14 -2.73 -0.21 0.00 0.52 0.00 0.00 54.79 52.51 3guz n ASP 169 Cb 0.40 -1.53 -0.16 0.00 -0.72 0.00 0.00 41.12 39.11 3guz n ASP 169 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3guz s ILE 170 N 1.52 0.64 -0.14 5.18 1.01 -1.26 -4.75 121.20 123.39 3guz s ILE 170 Ca 0.63 -0.19 -0.25 0.00 0.00 0.00 0.00 60.65 60.85 3guz s ILE 170 Cb 0.17 -0.64 -0.02 0.00 0.01 0.00 0.00 42.46 41.98 3guz s ILE 170 CO -0.07 0.25 0.80 -0.70 0.00 0.00 0.00 174.94 175.22 3guz s GLU 171 N 0.85 4.33 -0.19 2.79 2.12 -0.34 -4.95 118.70 123.31 3guz s GLU 171 Ca -0.12 0.99 -0.11 0.00 0.36 0.00 0.00 54.97 56.08 3guz s GLU 171 Cb -0.15 -3.54 -0.05 0.00 0.26 0.00 0.00 34.13 30.65 3guz s GLU 171 CO 0.01 -0.24 0.18 0.42 -0.54 0.00 0.00 175.26 175.09 3guz s ILE 172 N 1.82 5.38 -0.20 -3.70 -1.09 -1.26 -1.24 121.20 120.91 3guz s ILE 172 Ca 0.38 0.29 0.00 0.00 -2.23 0.00 0.00 60.65 59.10 3guz s ILE 172 Cb -0.17 -3.52 0.02 0.00 -1.58 0.00 0.00 42.46 37.21 3guz s ILE 172 CO 0.14 0.42 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.42 3guz s VAL 173 N 0.44 2.34 -0.04 2.92 1.01 -0.45 -4.96 120.40 121.66 3guz s VAL 173 Ca 0.10 -0.92 -0.17 0.00 0.00 0.00 0.00 61.98 61.00 3guz s VAL 173 Cb -0.12 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 3guz s VAL 173 CO 0.00 0.46 0.46 -0.83 0.00 0.00 0.00 175.10 175.20 3guz s GLY 174 N 1.31 2.47 -0.04 4.51 0.00 -1.26 -1.34 107.32 112.97 3guz s GLY 174 Ca 0.04 -0.17 0.05 0.00 0.00 0.00 0.00 44.72 44.65 3guz s GLY 174 CO -0.10 0.49 -0.21 0.14 0.00 0.00 0.00 173.10 173.42 3guz s VAL 175 N -0.28 1.71 -1.27 1.40 1.01 -0.13 -4.91 120.40 117.93 3guz s VAL 175 Ca 0.25 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.35 3guz s VAL 175 Cb -0.16 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.77 3guz s VAL 175 CO 0.13 0.48 0.32 -2.65 0.00 0.00 0.00 175.10 173.38