#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uf7 n ARG 2 N 0.00 0.81 -4.77 -2.82 5.12 -1.26 -4.94 116.66 108.80 1uf7 n ARG 2 Ca 0.00 -0.80 -0.31 0.00 -1.93 0.00 0.00 57.85 54.81 1uf7 n ARG 2 Cb 0.00 -0.84 -0.13 0.00 -1.16 0.00 0.00 32.46 30.33 1uf7 n ARG 2 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1uf7 s GLN 3 N -0.37 2.05 0.21 5.56 -1.52 -1.26 0.04 119.66 124.37 1uf7 s GLN 3 Ca 0.00 -0.98 -0.23 0.00 -1.95 0.00 0.00 55.36 52.20 1uf7 s GLN 3 Cb 0.00 -2.15 0.05 0.00 -0.22 0.00 0.00 33.01 30.69 1uf7 s GLN 3 CO 0.00 0.54 0.89 0.00 -0.25 0.00 0.00 175.29 176.47 1uf7 s MET 4 N -1.29 1.45 -0.21 2.91 0.23 -0.39 -5.01 119.30 117.00 1uf7 s MET 4 Ca 0.13 -0.83 0.01 0.00 -1.03 0.00 0.00 55.69 53.98 1uf7 s MET 4 Cb -0.10 0.48 0.04 0.00 -1.53 0.00 0.00 34.83 33.72 1uf7 s MET 4 CO 0.04 -0.67 -0.12 0.42 -2.03 0.00 0.00 175.02 172.66 1uf7 s ILE 5 N -3.27 1.83 0.04 3.16 1.01 -1.26 -0.19 121.20 122.52 1uf7 s ILE 5 Ca 0.13 -1.14 -0.13 0.00 0.00 0.00 0.00 60.65 59.51 1uf7 s ILE 5 Cb -0.03 -1.87 -0.06 0.00 0.01 0.00 0.00 42.46 40.51 1uf7 s ILE 5 CO 0.05 0.18 0.42 -0.22 0.00 0.00 0.00 174.94 175.37 1uf7 s LEU 6 N 1.31 4.42 0.15 2.97 2.96 -0.74 -0.65 118.68 129.09 1uf7 s LEU 6 Ca -0.02 0.91 0.06 0.00 -0.22 0.00 0.00 54.13 54.86 1uf7 s LEU 6 Cb -0.17 -2.80 -0.04 0.00 0.50 0.00 0.00 46.19 43.68 1uf7 s LEU 6 CO -0.08 0.25 -0.13 0.00 -1.32 0.00 0.00 176.35 175.07 1uf7 s ALA 7 N -1.24 1.56 -0.09 5.97 0.00 0.65 -1.22 121.76 127.40 1uf7 s ALA 7 Ca 0.29 -1.43 0.02 0.00 0.00 0.00 0.00 51.96 50.83 1uf7 s ALA 7 Cb -0.15 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 22.95 1uf7 s ALA 7 CO 0.16 0.02 -0.13 0.08 0.00 0.00 0.00 175.76 175.89 1uf7 s VAL 8 N -2.74 1.25 -0.74 0.00 1.01 -0.06 -0.83 120.40 118.30 1uf7 s VAL 8 Ca 0.14 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 61.54 1uf7 s VAL 8 Cb -0.01 -1.16 0.19 0.00 0.00 0.00 0.00 36.38 35.40 1uf7 s VAL 8 CO 0.03 0.39 0.61 -0.83 0.00 0.00 0.00 175.10 175.29 1uf7 s GLY 9 N 0.93 2.64 0.35 4.51 0.00 0.85 -1.88 107.32 114.72 1uf7 s GLY 9 Ca -0.09 -3.36 -0.27 0.00 0.00 0.00 0.00 44.72 41.00 1uf7 s GLY 9 CO 0.00 1.17 1.18 1.62 0.00 0.00 0.00 173.10 177.08 1uf7 s GLN 10 N -0.15 4.27 0.04 2.90 0.74 0.56 -4.25 119.66 123.78 1uf7 s GLN 10 Ca 0.19 1.91 0.03 0.00 0.05 0.00 0.00 55.36 57.54 1uf7 s GLN 10 Cb -0.15 -2.89 -0.04 0.00 1.10 0.00 0.00 33.01 31.03 1uf7 s GLN 10 CO -0.06 -0.15 0.00 -0.65 -0.55 0.00 0.00 175.29 173.88 1uf7 s GLN 11 N -1.98 2.69 0.15 1.67 -0.21 -0.75 -0.88 119.66 120.36 1uf7 s GLN 11 Ca 0.52 -0.71 -0.01 0.00 0.02 0.00 0.00 55.36 55.17 1uf7 s GLN 11 Cb -0.33 -2.62 0.03 0.00 1.00 0.00 0.00 33.01 31.10 1uf7 s GLN 11 CO 0.42 0.59 0.20 0.41 -2.12 0.00 0.00 175.29 174.79 1uf7 n GLY 12 N 0.99 -0.18 3.74 3.09 0.00 -1.25 -0.47 105.19 111.11 1uf7 n GLY 12 Ca -0.13 -1.83 -0.36 0.00 0.00 0.00 0.00 46.02 43.71 1uf7 n GLY 12 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1uf7 s PRO 13 N -3.17 2.61 -0.20 1.61 0.02 -0.84 -4.46 135.00 130.56 1uf7 s PRO 13 Ca 0.12 1.86 0.00 0.00 0.02 0.00 0.00 61.00 63.01 1uf7 s PRO 13 Cb -0.01 -1.88 0.02 0.00 0.02 0.00 0.00 34.50 32.66 1uf7 s PRO 13 CO 0.09 -1.50 -0.15 0.42 -0.33 0.00 0.00 177.00 175.52 1uf7 s ILE 14 N -1.67 2.36 0.70 2.83 1.01 -1.26 -5.06 121.20 120.10 1uf7 s ILE 14 Ca 0.78 -0.98 -0.14 0.00 0.00 0.00 0.00 60.65 60.31 1uf7 s ILE 14 Cb -0.32 -2.08 0.02 0.00 0.01 0.00 0.00 42.46 40.09 1uf7 s ILE 14 CO 0.39 0.41 1.11 0.00 0.00 0.00 0.00 174.94 176.85 1uf7 s ALA 15 N 1.30 2.36 0.41 9.38 0.00 -1.26 -3.98 121.76 129.97 1uf7 s ALA 15 Ca 0.03 0.51 0.11 0.00 0.00 0.00 0.00 51.96 52.61 1uf7 s ALA 15 Cb -0.15 -3.32 0.95 0.00 0.00 0.00 0.00 23.12 20.60 1uf7 s ALA 15 CO -0.10 -1.48 1.97 -0.09 0.00 0.00 0.00 175.76 176.06 1uf7 h ARG 16 N -0.33 0.49 -0.02 0.00 2.43 -1.98 -1.70 114.38 113.28 1uf7 h ARG 16 Ca -0.46 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1uf7 h ARG 16 Cb 1.25 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1uf7 h ARG 16 CO 0.53 0.33 -0.29 0.00 -1.51 0.00 0.00 179.97 179.02 1uf7 n ALA 17 N -2.50 3.14 -1.91 2.80 0.00 -1.26 -4.87 120.51 115.91 1uf7 n ALA 17 Ca 0.10 -0.62 -0.42 0.00 0.00 0.00 0.00 53.44 52.50 1uf7 n ALA 17 Cb 0.34 -0.85 -0.03 0.00 0.00 0.00 0.00 19.45 18.91 1uf7 n ALA 17 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1uf7 s GLU 18 N -2.31 4.19 0.70 0.00 2.12 -0.64 -4.96 118.70 117.80 1uf7 s GLU 18 Ca 0.23 2.35 -0.11 0.00 0.36 0.00 0.00 54.97 57.80 1uf7 s GLU 18 Cb 0.19 -3.55 0.01 0.00 0.26 0.00 0.00 34.13 31.04 1uf7 s GLU 18 CO 0.47 -0.73 1.06 0.95 -0.54 0.00 0.00 175.26 176.48 1uf7 s THR 19 N 2.50 3.98 0.39 -1.70 -4.23 -1.26 -4.86 115.64 110.45 1uf7 s THR 19 Ca 0.74 0.64 0.14 0.00 -1.18 0.00 0.00 61.69 62.04 1uf7 s THR 19 Cb -0.41 -3.40 0.13 0.00 1.34 0.00 0.00 72.50 70.17 1uf7 s THR 19 CO 0.32 -0.84 1.89 0.03 -0.54 0.00 0.00 174.62 175.48 1uf7 h ARG 20 N -0.73 0.00 -0.74 3.99 3.08 -1.93 -1.74 114.38 116.31 1uf7 h ARG 20 Ca -0.44 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.58 1uf7 h ARG 20 Cb 1.21 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.23 1uf7 h ARG 20 CO 0.57 0.30 0.35 0.93 -1.07 0.00 0.00 179.97 181.05 1uf7 h GLU 21 N 0.00 1.07 -0.24 0.04 3.07 -1.92 0.23 114.58 116.83 1uf7 h GLU 21 Ca -0.00 -0.16 -0.14 0.00 -0.50 0.00 0.00 59.36 58.55 1uf7 h GLU 21 Cb 0.55 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.26 1uf7 h GLU 21 CO 0.04 0.85 -0.43 1.96 -1.40 0.00 0.00 179.01 180.02 1uf7 h GLN 22 N 1.04 0.60 -0.38 2.33 4.20 -1.79 -2.26 115.11 118.86 1uf7 h GLN 22 Ca 0.25 -0.32 -0.15 0.00 0.06 0.00 0.00 58.65 58.49 1uf7 h GLN 22 Cb 0.13 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1uf7 h GLN 22 CO -0.03 0.92 -0.36 0.28 -0.67 0.00 0.00 178.83 178.97 1uf7 h VAL 23 N 0.48 1.28 -0.47 -0.54 2.07 -0.90 -2.76 116.25 115.41 1uf7 h VAL 23 Ca 0.03 -1.53 -0.03 0.00 0.82 0.00 0.00 66.70 66.00 1uf7 h VAL 23 Cb 0.95 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1uf7 h VAL 23 CO 0.09 0.51 0.16 0.58 0.02 0.00 0.00 177.57 178.93 1uf7 h VAL 24 N 0.73 1.19 -0.56 2.57 2.07 -0.39 -0.26 116.25 121.60 1uf7 h VAL 24 Ca 0.07 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 1uf7 h VAL 24 Cb 0.93 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 1uf7 h VAL 24 CO 0.09 0.23 0.31 0.58 0.02 0.00 0.00 177.57 178.80 1uf7 h VAL 25 N 0.68 1.18 -0.57 2.57 2.07 -1.18 0.92 116.25 121.92 1uf7 h VAL 25 Ca 0.16 -0.45 -0.09 0.00 0.82 0.00 0.00 66.70 67.14 1uf7 h VAL 25 Cb 0.18 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1uf7 h VAL 25 CO -0.01 0.19 -0.01 0.03 0.02 0.00 0.00 177.57 177.80 1uf7 h ARG 26 N 0.75 0.99 -0.41 1.57 3.08 -1.03 -1.97 114.38 117.36 1uf7 h ARG 26 Ca 0.20 -0.30 -0.11 0.00 0.07 0.00 0.00 59.98 59.84 1uf7 h ARG 26 Cb 0.04 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1uf7 h ARG 26 CO -0.03 0.98 -0.17 -0.07 -1.07 0.00 0.00 179.97 179.61 1uf7 h LEU 27 N 0.91 0.85 -0.67 3.04 3.38 -0.73 -2.48 115.31 119.61 1uf7 h LEU 27 Ca 0.16 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 1uf7 h LEU 27 Cb 0.54 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1uf7 h LEU 27 CO 0.03 1.05 0.39 -0.07 0.09 0.00 0.00 178.44 179.93 1uf7 h LEU 28 N 0.64 0.82 -0.24 1.67 3.38 -0.71 -0.85 115.31 120.01 1uf7 h LEU 28 Ca 0.09 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1uf7 h LEU 28 Cb 0.72 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1uf7 h LEU 28 CO 0.05 0.65 0.09 -0.78 0.09 0.00 0.00 178.44 178.55 1uf7 h ASP 29 N 0.91 0.12 -0.54 -0.43 3.58 -1.22 0.11 116.42 118.95 1uf7 h ASP 29 Ca 0.24 0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.62 1uf7 h ASP 29 Cb -0.01 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.03 1uf7 h ASP 29 CO -0.04 0.10 -0.00 0.24 -2.88 0.00 0.00 179.24 176.66 1uf7 h MET 30 N 0.21 0.95 -0.72 0.28 2.86 -1.20 -0.62 114.93 116.69 1uf7 h MET 30 Ca 0.10 -0.30 -0.06 0.00 -2.06 0.00 0.00 59.70 57.39 1uf7 h MET 30 Cb 0.06 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 1uf7 h MET 30 CO -0.10 0.96 0.23 1.25 1.06 0.00 0.00 176.91 180.32 1uf7 h LEU 31 N 0.82 1.04 -0.36 1.22 6.46 -0.92 0.91 115.31 124.49 1uf7 h LEU 31 Ca 0.15 -0.20 -0.05 0.00 -0.12 0.00 0.00 57.88 57.66 1uf7 h LEU 31 Cb 0.53 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.18 1uf7 h LEU 31 CO 0.03 0.97 0.05 0.74 -0.62 0.00 0.00 178.44 179.61 1uf7 h THR 32 N 1.06 1.24 -0.60 1.05 2.02 -0.60 -1.42 112.91 115.66 1uf7 h THR 32 Ca 0.23 -0.87 -0.08 0.00 0.77 0.00 0.00 66.41 66.47 1uf7 h THR 32 Cb 0.29 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 1uf7 h THR 32 CO -0.01 0.29 0.08 0.11 0.37 0.00 0.00 175.52 176.36 1uf7 h LYS 33 N 0.44 1.00 -0.43 6.66 1.57 -0.84 -1.98 116.57 122.99 1uf7 h LYS 33 Ca 0.11 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1uf7 h LYS 33 Cb 0.38 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 1uf7 h LYS 33 CO 0.01 0.95 0.25 0.00 -0.57 0.00 0.00 179.45 180.09 1uf7 h ALA 34 N 1.01 0.56 -0.57 3.86 0.00 -0.67 -2.62 119.26 120.82 1uf7 h ALA 34 Ca 0.18 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1uf7 h ALA 34 Cb 0.45 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1uf7 h ALA 34 CO 0.01 0.07 0.18 0.00 0.00 0.00 0.00 179.25 179.51 1uf7 h ALA 35 N 1.10 1.23 0.00 0.00 0.00 -1.11 -1.38 119.26 119.10 1uf7 h ALA 35 Ca 0.15 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1uf7 h ALA 35 Cb 0.04 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1uf7 h ALA 35 CO -0.03 0.54 -0.00 0.66 0.00 0.00 0.00 179.25 180.42 1uf7 h SER 36 N 0.84 0.00 -0.54 0.00 4.64 -1.01 -0.91 113.55 116.57 1uf7 h SER 36 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1uf7 h SER 36 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1uf7 h SER 36 CO -0.01 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.49 1uf7 n ARG 37 N -3.09 4.26 -0.05 4.77 1.74 -0.61 -4.95 116.66 118.73 1uf7 n ARG 37 Ca -0.01 -3.02 0.00 0.00 -0.77 0.00 0.00 57.85 54.05 1uf7 n ARG 37 Cb 0.20 -2.08 0.00 0.00 -1.02 0.00 0.00 32.46 29.56 1uf7 n ARG 37 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uf7 n GLY 38 N 0.58 1.28 3.76 -0.13 0.00 -0.34 -5.05 105.19 105.29 1uf7 n GLY 38 Ca 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 1uf7 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uf7 s ALA 39 N -2.50 3.56 -0.45 4.61 0.00 -0.65 -4.44 121.76 121.89 1uf7 s ALA 39 Ca 0.00 1.33 0.05 0.00 0.00 0.00 0.00 51.96 53.34 1uf7 s ALA 39 Cb 0.00 -3.53 0.15 0.00 0.00 0.00 0.00 23.12 19.74 1uf7 s ALA 39 CO 0.00 -0.74 1.13 0.27 0.00 0.00 0.00 175.76 176.42 1uf7 n ASN 40 N 1.39 2.46 -3.64 0.00 6.94 0.18 -4.16 115.26 118.43 1uf7 n ASN 40 Ca 0.03 -2.01 -0.10 0.00 -0.02 0.00 0.00 54.58 52.48 1uf7 n ASN 40 Cb 0.41 -0.12 -0.07 0.00 -2.36 0.00 0.00 39.78 37.64 1uf7 n ASN 40 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 1uf7 s PHE 41 N -1.02 -0.82 -0.04 -2.53 5.36 -1.23 -1.36 117.98 116.34 1uf7 s PHE 41 Ca 0.12 1.80 0.01 0.00 -0.96 0.00 0.00 56.93 57.90 1uf7 s PHE 41 Cb 0.06 0.42 0.02 0.00 -0.34 0.00 0.00 43.02 43.18 1uf7 s PHE 41 CO 0.08 -0.40 -0.05 -1.50 -1.46 0.00 0.00 175.22 171.89 1uf7 s ILE 42 N 0.90 0.56 -0.12 3.12 2.07 -0.10 -0.25 121.20 127.38 1uf7 s ILE 42 Ca -0.04 -0.14 -0.18 0.00 -1.41 0.00 0.00 60.65 58.88 1uf7 s ILE 42 Cb -0.05 -0.58 -0.04 0.00 0.13 0.00 0.00 42.46 41.92 1uf7 s ILE 42 CO -0.09 0.23 0.45 -0.69 -1.91 0.00 0.00 174.94 172.93 1uf7 s VAL 43 N 0.88 5.20 0.32 4.00 1.01 -0.01 -1.93 120.40 129.87 1uf7 s VAL 43 Ca -0.12 0.90 0.08 0.00 0.00 0.00 0.00 61.98 62.85 1uf7 s VAL 43 Cb -0.14 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1uf7 s VAL 43 CO 0.00 0.34 0.12 -0.36 0.00 0.00 0.00 175.10 175.20 1uf7 s PHE 44 N 0.54 2.72 1.11 5.22 2.99 -0.25 -0.10 117.98 130.21 1uf7 s PHE 44 Ca 0.25 -0.35 -0.13 0.00 0.00 0.00 0.00 56.93 56.71 1uf7 s PHE 44 Cb -0.15 -1.55 0.25 0.00 0.00 0.00 0.00 43.02 41.57 1uf7 s PHE 44 CO 0.10 0.40 1.05 -2.14 -0.00 0.00 0.00 175.22 174.62 1uf7 s PRO 45 N -3.81 -0.50 0.40 0.24 0.02 -1.25 -4.00 135.00 126.10 1uf7 s PRO 45 Ca 0.36 0.79 -0.25 0.00 0.02 0.00 0.00 61.00 61.92 1uf7 s PRO 45 Cb -0.03 -1.61 -0.08 0.00 0.02 0.00 0.00 34.50 32.80 1uf7 s PRO 45 CO 0.22 -3.43 1.18 -2.00 -0.33 0.00 0.00 177.00 172.64 1uf7 s GLU 46 N -4.60 4.05 -1.28 5.54 2.12 -1.26 -2.86 118.70 120.40 1uf7 s GLU 46 Ca 0.68 1.87 -0.26 0.00 0.36 0.00 0.00 54.97 57.62 1uf7 s GLU 46 Cb -0.23 -2.69 0.03 0.00 0.26 0.00 0.00 34.13 31.50 1uf7 s GLU 46 CO 0.62 -0.33 0.55 1.28 -0.54 0.00 0.00 175.26 176.84 1uf7 n LEU 47 N 0.09 -0.64 0.00 2.70 4.77 -1.24 -4.75 117.00 117.93 1uf7 n LEU 47 Ca 0.04 -1.27 0.10 0.00 -0.03 0.00 0.00 56.01 54.86 1uf7 n LEU 47 Cb 0.46 -1.69 0.60 0.00 -2.33 0.00 0.00 43.42 40.46 1uf7 n LEU 47 CO 0.51 0.71 0.87 0.00 -1.33 0.00 0.00 177.39 178.15 1uf7 n ALA 48 N -4.89 2.57 0.55 -1.18 0.00 -0.32 -3.57 120.51 113.67 1uf7 n ALA 48 Ca -0.16 -0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.23 1uf7 n ALA 48 Cb 0.60 -1.33 -0.10 0.00 0.00 0.00 0.00 19.45 18.62 1uf7 n ALA 48 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1uf7 n LEU 49 N -0.83 0.55 -4.21 0.00 4.77 -1.26 -4.98 117.00 111.04 1uf7 n LEU 49 Ca 0.15 -0.37 -0.15 0.00 -0.03 0.00 0.00 56.01 55.61 1uf7 n LEU 49 Cb 0.07 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.08 1uf7 n LEU 49 CO 0.11 0.14 -0.13 0.42 -1.33 0.00 0.00 177.39 176.61 1uf7 s THR 50 N -2.62 0.00 0.77 -5.08 -4.23 -1.23 -4.59 115.64 98.66 1uf7 s THR 50 Ca 0.03 -1.92 -0.11 0.00 -1.18 0.00 0.00 61.69 58.51 1uf7 s THR 50 Cb 0.11 -2.49 0.06 0.00 1.34 0.00 0.00 72.50 71.52 1uf7 s THR 50 CO 0.64 0.00 1.09 0.28 -0.54 0.00 0.00 174.62 176.10 1uf7 s THR 51 N -3.77 3.28 -1.26 3.99 -1.32 -1.26 -4.82 115.64 110.48 1uf7 s THR 51 Ca 0.38 0.42 -0.20 0.00 -1.21 0.00 0.00 61.69 61.08 1uf7 s THR 51 Cb 0.04 -2.89 0.02 0.00 -1.51 0.00 0.00 72.50 68.15 1uf7 s THR 51 CO 0.18 -0.54 1.81 0.33 -2.21 0.00 0.00 174.62 174.20 1uf7 n PHE 52 N -3.51 4.01 0.30 9.09 7.35 -1.26 -4.80 117.46 128.63 1uf7 n PHE 52 Ca 0.09 -2.38 0.19 0.00 -0.76 0.00 0.00 57.45 54.59 1uf7 n PHE 52 Cb 0.53 -2.63 1.01 0.00 0.35 0.00 0.00 39.48 38.74 1uf7 n PHE 52 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 1uf7 h PHE 53 N 8.26 0.00 0.00 -5.13 -5.15 -1.98 -2.89 116.94 110.06 1uf7 h PHE 53 Ca 0.37 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.14 1uf7 h PHE 53 Cb 0.89 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.06 1uf7 h PHE 53 CO 1.36 0.00 0.00 -2.30 -2.00 0.00 0.00 178.31 175.37 1uf7 n PRO 54 N -3.42 0.01 0.00 6.09 -0.02 -1.26 -1.70 135.00 134.70 1uf7 n PRO 54 Ca -0.02 0.33 0.11 0.00 -2.02 0.00 0.00 63.50 61.90 1uf7 n PRO 54 Cb 0.16 -1.50 0.47 0.00 -0.02 0.00 0.00 33.50 32.61 1uf7 n PRO 54 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1uf7 n ARG 55 N -1.34 0.01 -4.28 -0.52 1.85 -1.09 -1.50 116.66 109.78 1uf7 n ARG 55 Ca 0.00 0.12 -0.27 0.00 -1.00 0.00 0.00 57.85 56.71 1uf7 n ARG 55 Cb 0.00 -1.51 -0.09 0.00 -1.05 0.00 0.00 32.46 29.81 1uf7 n ARG 55 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1uf7 s TRP 56 N -3.01 2.67 -0.40 2.89 0.51 -0.69 -1.21 118.94 119.70 1uf7 s TRP 56 Ca 0.11 -0.21 -0.18 0.00 -2.12 0.00 0.00 56.10 53.69 1uf7 s TRP 56 Cb 0.14 -1.30 0.01 0.00 -0.81 0.00 0.00 33.47 31.52 1uf7 s TRP 56 CO 0.41 0.51 0.51 -1.58 -0.51 0.00 0.00 176.95 176.29 1uf7 s HIS 57 N -1.70 3.14 0.27 -1.98 5.65 -1.26 -4.84 115.29 114.57 1uf7 s HIS 57 Ca 0.25 -0.13 -0.15 0.00 0.25 0.00 0.00 55.06 55.28 1uf7 s HIS 57 Cb -0.09 -3.02 -0.08 0.00 -1.18 0.00 0.00 32.58 28.21 1uf7 s HIS 57 CO 0.16 -0.70 0.69 -0.06 -0.65 0.00 0.00 174.74 174.18 1uf7 s PHE 58 N 2.39 3.47 0.00 3.88 0.40 -1.26 -4.96 117.98 121.90 1uf7 s PHE 58 Ca 0.17 1.19 0.00 0.00 -0.60 0.00 0.00 56.93 57.69 1uf7 s PHE 58 Cb -0.16 -2.50 0.00 0.00 0.51 0.00 0.00 43.02 40.88 1uf7 s PHE 58 CO 0.15 0.21 0.09 0.25 0.70 0.00 0.00 175.22 176.62 1uf7 n THR 59 N 0.05 0.00 -4.04 0.64 -2.24 -1.26 -5.00 114.28 102.43 1uf7 n THR 59 Ca 0.01 -0.28 -0.31 0.00 -2.27 0.00 0.00 64.05 61.20 1uf7 n THR 59 Cb 0.52 1.14 -0.16 0.00 -2.10 0.00 0.00 70.33 69.74 1uf7 n THR 59 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1uf7 s ASP 60 N -0.38 3.13 0.37 3.42 -1.08 -1.26 -5.02 116.67 115.86 1uf7 s ASP 60 Ca 0.00 -0.71 0.10 0.00 -0.52 0.00 0.00 52.55 51.42 1uf7 s ASP 60 Cb 0.00 -1.31 0.73 0.00 -1.46 0.00 0.00 42.92 40.88 1uf7 s ASP 60 CO 0.00 -0.07 1.86 -0.08 0.52 0.00 0.00 175.17 177.40 1uf7 h GLU 61 N 7.98 0.17 -0.55 4.34 4.81 -1.99 -2.32 114.58 127.01 1uf7 h GLU 61 Ca -0.36 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 58.73 1uf7 h GLU 61 Cb 1.12 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 1uf7 h GLU 61 CO 0.54 0.40 0.00 0.00 -0.73 0.00 0.00 179.01 179.22 1uf7 h ALA 62 N 1.61 0.74 -0.45 2.92 0.00 -1.98 0.16 119.26 122.25 1uf7 h ALA 62 Ca 0.03 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 1uf7 h ALA 62 Cb 0.51 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1uf7 h ALA 62 CO 0.04 0.56 0.05 0.93 0.00 0.00 0.00 179.25 180.83 1uf7 h GLU 63 N 0.84 0.76 0.44 0.00 5.08 -1.94 -2.13 114.58 117.64 1uf7 h GLU 63 Ca 0.16 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1uf7 h GLU 63 Cb 0.53 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1uf7 h GLU 63 CO 0.03 0.80 -0.21 1.25 -1.00 0.00 0.00 179.01 179.87 1uf7 h LEU 64 N 0.62 -0.50 -1.80 1.33 5.85 -1.18 -2.75 115.31 116.89 1uf7 h LEU 64 Ca 0.14 0.01 0.26 0.00 0.84 0.00 0.00 57.88 59.13 1uf7 h LEU 64 Cb 0.42 0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 1uf7 h LEU 64 CO 0.01 -0.35 0.67 0.44 -0.34 0.00 0.00 178.44 178.87 1uf7 h ASP 65 N -0.61 0.16 -0.00 1.25 3.45 -0.56 -1.16 116.42 118.95 1uf7 h ASP 65 Ca -0.06 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.42 1uf7 h ASP 65 Cb 0.46 -0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1uf7 h ASP 65 CO 0.10 0.05 0.01 0.77 -1.57 0.00 0.00 179.24 178.60 1uf7 h SER 66 N 0.15 0.00 0.26 6.45 4.64 -1.06 -1.59 113.55 122.39 1uf7 h SER 66 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 1uf7 h SER 66 Cb 1.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.74 1uf7 h SER 66 CO -0.09 0.00 -0.19 0.49 -0.87 0.00 0.00 176.83 176.17 1uf7 n PHE 67 N -3.15 0.00 -3.93 4.77 3.01 -0.44 -4.91 117.46 112.80 1uf7 n PHE 67 Ca -0.03 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.21 1uf7 n PHE 67 Cb 0.08 -0.13 -0.02 0.00 -0.01 0.00 0.00 39.48 39.40 1uf7 n PHE 67 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 1uf7 s TYR 68 N -2.45 3.46 -0.17 1.38 1.51 -0.60 -4.52 117.35 115.96 1uf7 s TYR 68 Ca 0.27 0.03 -0.08 0.00 -1.01 0.00 0.00 57.07 56.27 1uf7 s TYR 68 Cb 0.20 -1.61 -0.04 0.00 -0.11 0.00 0.00 41.96 40.40 1uf7 s TYR 68 CO 0.49 0.44 0.11 -1.21 -1.11 0.00 0.00 175.55 174.26 1uf7 s GLU 69 N -3.86 3.85 0.00 -0.62 0.41 0.26 -4.89 118.70 113.85 1uf7 s GLU 69 Ca 0.34 -0.24 0.22 0.00 -0.41 0.00 0.00 54.97 54.88 1uf7 s GLU 69 Cb -0.09 -3.26 -0.17 0.00 -1.78 0.00 0.00 34.13 28.82 1uf7 s GLU 69 CO 0.29 0.45 0.86 0.25 -0.49 0.00 0.00 175.26 176.62 1uf7 n THR 70 N 3.00 0.02 -3.75 3.63 -2.24 -1.26 -1.77 114.28 111.91 1uf7 n THR 70 Ca -0.17 -0.14 -0.12 0.00 -2.27 0.00 0.00 64.05 61.35 1uf7 n THR 70 Cb 0.53 0.64 -0.08 0.00 -2.10 0.00 0.00 70.33 69.32 1uf7 n THR 70 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1uf7 s GLU 71 N -3.14 0.79 -0.24 -0.78 -1.05 -1.26 -4.97 118.70 108.06 1uf7 s GLU 71 Ca 0.04 -0.44 -0.03 0.00 -0.15 0.00 0.00 54.97 54.39 1uf7 s GLU 71 Cb 0.15 0.34 0.10 0.00 -0.44 0.00 0.00 34.13 34.29 1uf7 s GLU 71 CO 0.86 -0.25 0.20 1.41 0.95 0.00 0.00 175.26 178.44 1uf7 s MET 72 N -2.30 0.20 0.28 -4.83 1.75 -1.26 -3.78 119.30 109.36 1uf7 s MET 72 Ca -0.07 -0.06 0.01 0.00 -1.25 0.00 0.00 55.69 54.32 1uf7 s MET 72 Cb -0.02 -1.16 -0.04 0.00 2.84 0.00 0.00 34.83 36.46 1uf7 s MET 72 CO -0.02 -0.82 0.46 -1.25 -0.65 0.00 0.00 175.02 172.75 1uf7 s PRO 73 N 2.26 3.49 0.34 4.11 0.04 -1.26 -5.09 135.00 138.89 1uf7 s PRO 73 Ca 0.07 -0.43 -0.00 0.00 0.04 0.00 0.00 61.00 60.68 1uf7 s PRO 73 Cb -0.15 -2.77 0.07 0.00 0.04 0.00 0.00 34.50 31.69 1uf7 s PRO 73 CO -0.21 0.29 0.47 0.41 0.04 0.00 0.00 177.00 177.99 1uf7 n GLY 74 N -1.37 0.67 0.35 0.56 0.00 -1.25 -4.78 105.19 99.39 1uf7 n GLY 74 Ca -0.06 -1.98 0.03 0.00 0.00 0.00 0.00 46.02 44.01 1uf7 n GLY 74 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1uf7 h PRO 75 N 0.00 0.93 -0.51 1.61 0.11 -2.00 -1.59 132.00 130.54 1uf7 h PRO 75 Ca -0.15 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 65.82 1uf7 h PRO 75 Cb 0.56 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.45 1uf7 h PRO 75 CO 0.16 0.62 -0.00 0.28 -0.21 0.00 0.00 178.00 178.85 1uf7 h VAL 76 N 0.96 1.26 0.00 3.15 2.07 -1.99 -3.22 116.25 118.48 1uf7 h VAL 76 Ca 0.32 -1.09 -0.06 0.00 0.82 0.00 0.00 66.70 66.69 1uf7 h VAL 76 Cb 0.07 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1uf7 h VAL 76 CO -0.10 0.39 -0.67 0.58 0.02 0.00 0.00 177.57 177.79 1uf7 h VAL 77 N 0.78 0.29 -1.02 2.57 2.07 -1.88 -3.38 116.25 115.68 1uf7 h VAL 77 Ca 0.15 -1.47 0.28 0.00 0.82 0.00 0.00 66.70 66.48 1uf7 h VAL 77 Cb 0.53 1.96 -0.13 0.00 -1.52 0.00 0.00 31.29 32.12 1uf7 h VAL 77 CO 0.03 0.17 0.61 -0.09 0.02 0.00 0.00 177.57 178.30 1uf7 h ARG 78 N 0.00 0.44 -0.66 1.57 2.43 -1.30 -1.14 114.38 115.72 1uf7 h ARG 78 Ca -0.03 -0.03 0.15 0.00 -0.81 0.00 0.00 59.98 59.26 1uf7 h ARG 78 Cb 1.20 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.61 1uf7 h ARG 78 CO 0.02 0.29 0.45 -1.35 -1.51 0.00 0.00 179.97 177.87 1uf7 h PRO 79 N 0.45 0.24 -0.50 0.20 0.11 -1.76 -0.84 132.00 129.90 1uf7 h PRO 79 Ca 0.68 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.71 1uf7 h PRO 79 Cb 1.47 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.51 1uf7 h PRO 79 CO -0.49 0.16 0.06 1.25 -0.21 0.00 0.00 178.00 178.76 1uf7 h LEU 80 N 0.24 0.81 -0.48 2.35 5.85 -1.51 -1.39 115.31 121.18 1uf7 h LEU 80 Ca 0.32 -0.27 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1uf7 h LEU 80 Cb 0.90 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 1uf7 h LEU 80 CO -0.07 0.88 0.14 -0.26 -0.34 0.00 0.00 178.44 178.79 1uf7 h PHE 81 N 0.71 0.79 -0.90 1.25 -1.00 -1.28 -1.52 116.94 114.99 1uf7 h PHE 81 Ca 0.15 -0.08 -0.02 0.00 2.81 0.00 0.00 57.97 60.82 1uf7 h PHE 81 Cb 0.43 -0.23 -0.04 0.00 3.61 0.00 0.00 35.95 39.72 1uf7 h PHE 81 CO 0.03 0.70 0.48 0.93 -1.61 0.00 0.00 178.31 178.84 1uf7 h GLU 82 N 0.65 1.26 -0.16 1.51 5.08 -1.12 -1.79 114.58 120.02 1uf7 h GLU 82 Ca 0.15 -0.15 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 1uf7 h GLU 82 Cb 0.29 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1uf7 h GLU 82 CO -0.00 0.93 -0.53 -0.22 -1.00 0.00 0.00 179.01 178.19 1uf7 h LYS 83 N 1.26 0.45 -0.56 2.33 1.63 -1.08 -1.43 116.57 119.17 1uf7 h LYS 83 Ca 0.31 -0.27 -0.03 0.00 -0.85 0.00 0.00 60.65 59.81 1uf7 h LYS 83 Cb 0.04 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.68 1uf7 h LYS 83 CO -0.05 0.87 0.22 0.00 -3.45 0.00 0.00 179.45 177.04 1uf7 h ALA 84 N 1.08 0.73 -0.50 5.00 0.00 -0.88 -0.44 119.26 124.24 1uf7 h ALA 84 Ca 0.01 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 1uf7 h ALA 84 Cb 1.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1uf7 h ALA 84 CO 0.09 0.35 -0.14 0.00 0.00 0.00 0.00 179.25 179.56 1uf7 h ALA 85 N 1.07 0.69 0.22 0.00 0.00 -1.23 0.83 119.26 120.84 1uf7 h ALA 85 Ca 0.19 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1uf7 h ALA 85 Cb 0.20 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1uf7 h ALA 85 CO -0.02 0.62 -0.10 1.49 0.00 0.00 0.00 179.25 181.24 1uf7 h GLU 86 N 0.84 -0.28 -0.00 0.00 4.81 -0.94 -3.13 114.58 115.87 1uf7 h GLU 86 Ca 0.13 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1uf7 h GLU 86 Cb 0.70 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.15 1uf7 h GLU 86 CO 0.05 -0.11 -0.16 1.28 -0.73 0.00 0.00 179.01 179.35 1uf7 n LEU 87 N -5.17 0.26 -2.36 1.64 4.77 -0.20 -4.96 117.00 110.98 1uf7 n LEU 87 Ca -0.09 0.21 -0.09 0.00 -0.03 0.00 0.00 56.01 56.01 1uf7 n LEU 87 Cb 0.17 -0.33 0.05 0.00 -2.33 0.00 0.00 43.42 40.98 1uf7 n LEU 87 CO 0.34 0.06 0.05 0.61 -1.33 0.00 0.00 177.39 177.11 1uf7 n GLY 88 N 1.42 -0.05 2.74 -0.72 0.00 0.14 -5.02 105.19 103.69 1uf7 n GLY 88 Ca 0.09 -0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 1uf7 n GLY 88 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1uf7 s ILE 89 N -3.20 -0.23 1.05 -0.61 2.07 -0.35 -4.62 121.20 115.30 1uf7 s ILE 89 Ca 0.07 0.05 -0.17 0.00 -1.41 0.00 0.00 60.65 59.19 1uf7 s ILE 89 Cb -0.01 -0.50 0.24 0.00 0.13 0.00 0.00 42.46 42.32 1uf7 s ILE 89 CO 0.40 -0.09 1.27 -0.83 -1.91 0.00 0.00 174.94 173.78 1uf7 s GLY 90 N 2.26 1.73 0.22 1.50 0.00 -0.47 -4.57 107.32 107.99 1uf7 s GLY 90 Ca 0.04 -1.17 -0.21 0.00 0.00 0.00 0.00 44.72 43.38 1uf7 s GLY 90 CO -0.09 -0.34 0.64 -0.11 0.00 0.00 0.00 173.10 173.20 1uf7 s PHE 91 N -3.64 -0.33 -0.25 1.90 -0.12 -0.10 -0.93 117.98 114.51 1uf7 s PHE 91 Ca 0.74 -0.01 0.00 0.00 -0.05 0.00 0.00 56.93 57.62 1uf7 s PHE 91 Cb -0.05 0.61 0.04 0.00 -0.63 0.00 0.00 43.02 42.99 1uf7 s PHE 91 CO 0.54 -1.03 -0.10 1.21 -0.05 0.00 0.00 175.22 175.79 1uf7 s ASN 92 N -2.84 4.21 -0.12 1.98 3.84 -0.81 -0.36 114.94 120.84 1uf7 s ASN 92 Ca 0.06 -1.06 0.01 0.00 0.21 0.00 0.00 52.86 52.08 1uf7 s ASN 92 Cb -0.03 -1.60 -0.01 0.00 -0.55 0.00 0.00 41.25 39.06 1uf7 s ASN 92 CO -0.03 -0.14 -0.15 -0.22 -2.79 0.00 0.00 177.10 173.77 1uf7 s LEU 93 N 1.23 2.59 0.02 3.21 2.96 -0.65 -1.09 118.68 126.96 1uf7 s LEU 93 Ca -0.03 -0.37 -0.02 0.00 -0.22 0.00 0.00 54.13 53.49 1uf7 s LEU 93 Cb -0.17 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 1uf7 s LEU 93 CO -0.06 0.16 0.20 -0.83 -1.32 0.00 0.00 176.35 174.50 1uf7 s GLY 94 N 0.35 2.19 0.07 7.98 0.00 -1.14 -1.42 107.32 115.36 1uf7 s GLY 94 Ca -0.12 -0.79 -0.27 0.00 0.00 0.00 0.00 44.72 43.54 1uf7 s GLY 94 CO 0.06 -0.71 0.99 -2.52 0.00 0.00 0.00 173.10 170.92 1uf7 s TYR 95 N -1.41 -0.18 -0.24 1.90 -0.85 0.78 -1.17 117.35 116.18 1uf7 s TYR 95 Ca 0.31 -0.04 -0.19 0.00 -0.52 0.00 0.00 57.07 56.63 1uf7 s TYR 95 Cb -0.13 0.59 -0.02 0.00 0.38 0.00 0.00 41.96 42.78 1uf7 s TYR 95 CO 0.23 -0.65 0.57 0.00 -1.52 0.00 0.00 175.55 174.18 1uf7 s ALA 96 N -3.10 3.59 -0.25 9.51 0.00 -1.26 -0.81 121.76 129.44 1uf7 s ALA 96 Ca 0.10 -0.46 -0.09 0.00 0.00 0.00 0.00 51.96 51.50 1uf7 s ALA 96 Cb -0.01 -2.94 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 1uf7 s ALA 96 CO -0.02 -0.69 0.13 -2.00 0.00 0.00 0.00 175.76 173.18 1uf7 s GLU 97 N 2.22 3.91 -0.23 0.00 2.12 -0.19 0.90 118.70 127.43 1uf7 s GLU 97 Ca 0.24 -0.35 -0.02 0.00 0.36 0.00 0.00 54.97 55.20 1uf7 s GLU 97 Cb -0.16 -3.47 0.01 0.00 0.26 0.00 0.00 34.13 30.77 1uf7 s GLU 97 CO 0.09 -0.05 -0.07 -1.17 -0.54 0.00 0.00 175.26 173.52 1uf7 s LEU 98 N 1.32 2.92 -0.04 2.70 2.96 -0.73 -1.28 118.68 126.52 1uf7 s LEU 98 Ca 0.06 -0.63 0.07 0.00 -0.22 0.00 0.00 54.13 53.41 1uf7 s LEU 98 Cb -0.15 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.86 1uf7 s LEU 98 CO 0.06 -0.06 -0.25 -0.69 -1.32 0.00 0.00 176.35 174.08 1uf7 s VAL 99 N 1.39 2.08 -0.34 1.68 1.01 0.04 -4.49 120.40 121.77 1uf7 s VAL 99 Ca 0.03 -1.08 -0.05 0.00 0.00 0.00 0.00 61.98 60.89 1uf7 s VAL 99 Cb -0.15 -1.73 0.05 0.00 0.00 0.00 0.00 36.38 34.55 1uf7 s VAL 99 CO -0.05 0.58 0.09 -0.69 0.00 0.00 0.00 175.10 175.02 1uf7 s VAL 100 N -0.39 3.50 -0.30 2.92 1.01 -1.26 0.35 120.40 126.24 1uf7 s VAL 100 Ca 0.03 -1.32 -0.06 0.00 0.00 0.00 0.00 61.98 60.64 1uf7 s VAL 100 Cb -0.12 -3.04 0.02 0.00 0.00 0.00 0.00 36.38 33.24 1uf7 s VAL 100 CO 0.01 -0.22 0.06 -1.61 0.00 0.00 0.00 175.10 173.34 1uf7 s GLU 101 N 1.33 2.95 -1.57 2.72 2.02 0.21 -4.64 118.70 121.73 1uf7 s GLU 101 Ca -0.02 -0.94 -0.12 0.00 0.02 0.00 0.00 54.97 53.91 1uf7 s GLU 101 Cb -0.20 -3.32 0.09 0.00 0.10 0.00 0.00 34.13 30.80 1uf7 s GLU 101 CO 0.01 -0.48 0.76 0.41 0.02 0.00 0.00 175.26 175.98 1uf7 n GLY 102 N 4.82 -0.40 2.23 -1.39 0.00 -1.26 0.04 105.19 109.23 1uf7 n GLY 102 Ca -0.14 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1uf7 n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uf7 n GLY 103 N -1.62 0.60 3.37 -0.02 0.00 -1.26 -5.02 105.19 101.23 1uf7 n GLY 103 Ca -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 1uf7 n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uf7 s VAL 104 N -2.40 3.14 0.10 1.61 1.01 0.11 -5.11 120.40 118.86 1uf7 s VAL 104 Ca 0.00 -0.62 -0.23 0.00 0.00 0.00 0.00 61.98 61.12 1uf7 s VAL 104 Cb 0.00 -2.34 -0.07 0.00 0.00 0.00 0.00 36.38 33.97 1uf7 s VAL 104 CO 0.00 0.51 0.71 -0.54 0.00 0.00 0.00 175.10 175.78 1uf7 s LYS 105 N 0.49 4.45 -0.08 2.72 1.02 -1.26 0.66 119.74 127.74 1uf7 s LYS 105 Ca -0.08 1.00 0.03 0.00 0.02 0.00 0.00 55.97 56.94 1uf7 s LYS 105 Cb -0.15 -3.29 0.01 0.00 -0.52 0.00 0.00 37.83 33.88 1uf7 s LYS 105 CO 0.04 0.50 -0.15 1.03 -0.92 0.00 0.00 175.35 175.84 1uf7 s ARG 106 N -0.78 2.05 -0.10 1.68 0.52 0.15 -4.95 118.95 117.52 1uf7 s ARG 106 Ca 0.34 -0.53 0.03 0.00 -0.52 0.00 0.00 55.73 55.05 1uf7 s ARG 106 Cb -0.21 -1.64 -0.01 0.00 0.52 0.00 0.00 34.95 33.61 1uf7 s ARG 106 CO 0.23 0.06 -0.20 1.03 0.02 0.00 0.00 175.30 176.44 1uf7 s ARG 107 N 0.60 3.04 0.05 3.54 0.52 -1.26 -0.78 118.95 124.66 1uf7 s ARG 107 Ca -0.15 -0.81 0.02 0.00 -0.52 0.00 0.00 55.73 54.27 1uf7 s ARG 107 Cb -0.16 -2.39 -0.03 0.00 0.52 0.00 0.00 34.95 32.89 1uf7 s ARG 107 CO 0.05 0.25 -0.08 -0.06 0.02 0.00 0.00 175.30 175.48 1uf7 s PHE 108 N 0.19 0.74 -0.44 -0.53 0.40 -0.41 -0.71 117.98 117.23 1uf7 s PHE 108 Ca -0.12 -0.54 -0.18 0.00 -0.60 0.00 0.00 56.93 55.49 1uf7 s PHE 108 Cb -0.16 -0.44 0.03 0.00 0.51 0.00 0.00 43.02 42.96 1uf7 s PHE 108 CO 0.07 -0.08 0.49 1.21 0.70 0.00 0.00 175.22 177.60 1uf7 s ASN 109 N -1.75 6.21 0.27 1.36 3.84 -1.26 -1.02 114.94 122.59 1uf7 s ASN 109 Ca -0.07 -0.75 0.11 0.00 0.21 0.00 0.00 52.86 52.37 1uf7 s ASN 109 Cb -0.08 -2.24 -0.05 0.00 -0.55 0.00 0.00 41.25 38.33 1uf7 s ASN 109 CO 0.00 -0.66 -0.15 -0.89 -2.79 0.00 0.00 177.10 172.61 1uf7 s THR 110 N 2.24 2.73 -0.05 -5.21 2.01 0.01 -0.87 115.64 116.51 1uf7 s THR 110 Ca 0.13 -2.26 -0.05 0.00 0.31 0.00 0.00 61.69 59.82 1uf7 s THR 110 Cb -0.18 -2.43 0.01 0.00 0.01 0.00 0.00 72.50 69.91 1uf7 s THR 110 CO 0.13 -0.38 0.14 -0.94 -0.69 0.00 0.00 174.62 172.89 1uf7 s SER 111 N -3.51 -0.12 0.14 3.53 1.04 -0.64 -0.16 113.70 113.99 1uf7 s SER 111 Ca 0.30 0.21 0.07 0.00 0.48 0.00 0.00 55.95 57.01 1uf7 s SER 111 Cb -0.06 0.29 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 1uf7 s SER 111 CO 0.16 -0.10 -0.16 0.27 0.98 0.00 0.00 173.24 174.39 1uf7 s ILE 112 N -0.17 1.56 -0.15 -1.02 -4.36 -0.51 -1.15 121.20 115.40 1uf7 s ILE 112 Ca -0.02 -1.82 -0.02 0.00 -0.26 0.00 0.00 60.65 58.52 1uf7 s ILE 112 Cb -0.02 -1.69 -0.02 0.00 1.25 0.00 0.00 42.46 41.98 1uf7 s ILE 112 CO 0.00 -0.38 -0.08 -0.76 0.24 0.00 0.00 174.94 173.97 1uf7 s LEU 113 N -2.58 2.98 -0.08 0.37 1.43 -0.51 -1.63 118.68 118.66 1uf7 s LEU 113 Ca 0.12 -0.25 0.05 0.00 -1.03 0.00 0.00 54.13 53.03 1uf7 s LEU 113 Cb -0.05 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 1uf7 s LEU 113 CO 0.05 0.14 -0.24 -0.69 0.23 0.00 0.00 176.35 175.84 1uf7 s VAL 114 N 0.51 2.15 0.86 -1.59 1.01 0.51 -0.34 120.40 123.51 1uf7 s VAL 114 Ca -0.06 -1.01 -0.11 0.00 0.00 0.00 0.00 61.98 60.80 1uf7 s VAL 114 Cb -0.15 -1.80 0.16 0.00 0.00 0.00 0.00 36.38 34.58 1uf7 s VAL 114 CO 0.03 0.56 1.20 1.51 0.00 0.00 0.00 175.10 178.40 1uf7 s ASP 115 N 0.08 3.71 0.00 3.32 1.47 -0.15 -0.93 116.67 124.17 1uf7 s ASP 115 Ca -0.10 0.17 0.05 0.00 1.18 0.00 0.00 52.55 53.84 1uf7 s ASP 115 Cb -0.16 -0.39 0.30 0.00 -0.34 0.00 0.00 42.92 42.32 1uf7 s ASP 115 CO 0.06 -2.33 0.67 2.29 0.68 0.00 0.00 175.17 176.54 1uf7 n LYS 116 N -3.41 0.26 -0.08 2.11 2.85 -1.26 -0.15 118.16 118.48 1uf7 n LYS 116 Ca 0.14 0.00 0.08 0.00 -1.05 0.00 0.00 58.31 57.47 1uf7 n LYS 116 Cb 0.60 -1.30 0.11 0.00 -0.65 0.00 0.00 35.03 33.79 1uf7 n LYS 116 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1uf7 n SER 117 N -0.80 2.60 -0.46 -5.58 7.64 -1.26 -4.01 113.62 111.74 1uf7 n SER 117 Ca 0.04 -1.75 -0.05 0.00 1.01 0.00 0.00 58.87 58.11 1uf7 n SER 117 Cb 0.02 -0.11 -0.02 0.00 -1.01 0.00 0.00 64.21 63.10 1uf7 n SER 117 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uf7 n GLY 118 N 0.86 0.58 3.62 0.23 0.00 0.79 -4.56 105.19 106.71 1uf7 n GLY 118 Ca 0.11 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 45.01 1uf7 n GLY 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uf7 s LYS 119 N -3.02 3.22 -0.15 1.61 1.02 -1.25 -4.87 119.74 116.30 1uf7 s LYS 119 Ca 0.00 -0.45 -0.29 0.00 0.02 0.00 0.00 55.97 55.25 1uf7 s LYS 119 Cb 0.00 -2.83 -0.03 0.00 -0.52 0.00 0.00 37.83 34.45 1uf7 s LYS 119 CO 0.00 0.54 1.44 0.42 -0.92 0.00 0.00 175.35 176.82 1uf7 s ILE 120 N -0.43 3.97 -0.48 2.17 1.01 -1.26 -0.98 121.20 125.20 1uf7 s ILE 120 Ca 0.08 1.16 0.07 0.00 0.00 0.00 0.00 60.65 61.95 1uf7 s ILE 120 Cb -0.12 -3.80 0.18 0.00 0.01 0.00 0.00 42.46 38.73 1uf7 s ILE 120 CO 0.02 -0.17 1.15 1.33 0.00 0.00 0.00 174.94 177.28 1uf7 n VAL 121 N 5.62 1.08 0.00 2.92 0.24 0.53 -4.97 118.33 123.76 1uf7 n VAL 121 Ca 0.16 -1.07 0.00 0.00 -2.04 0.00 0.00 64.34 61.38 1uf7 n VAL 121 Cb 0.44 0.45 0.00 0.00 -1.47 0.00 0.00 33.84 33.26 1uf7 n VAL 121 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1uf7 n GLY 122 N -0.02 1.59 3.07 7.63 0.00 -1.21 -4.78 105.19 111.47 1uf7 n GLY 122 Ca 0.07 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.57 1uf7 n GLY 122 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1uf7 s LYS 123 N -2.00 0.55 0.01 1.61 2.20 -1.26 -1.42 119.74 119.42 1uf7 s LYS 123 Ca 0.00 -0.79 -0.01 0.00 -0.36 0.00 0.00 55.97 54.81 1uf7 s LYS 123 Cb 0.00 -0.32 -0.01 0.00 -1.51 0.00 0.00 37.83 35.99 1uf7 s LYS 123 CO 0.00 0.06 0.01 -0.47 -0.36 0.00 0.00 175.35 174.59 1uf7 s TYR 124 N -1.43 0.12 -0.12 4.03 5.04 -0.30 -4.88 117.35 119.81 1uf7 s TYR 124 Ca -0.09 -0.25 0.01 0.00 -2.44 0.00 0.00 57.07 54.31 1uf7 s TYR 124 Cb -0.10 -0.10 0.02 0.00 0.35 0.00 0.00 41.96 42.13 1uf7 s TYR 124 CO 0.00 -0.14 -0.15 1.03 -1.34 0.00 0.00 175.55 174.96 1uf7 s ARG 125 N -0.89 2.21 -0.39 4.97 0.52 -1.26 -1.62 118.95 122.49 1uf7 s ARG 125 Ca -0.10 -0.55 -0.42 0.00 -0.52 0.00 0.00 55.73 54.14 1uf7 s ARG 125 Cb -0.06 -1.93 -0.17 0.00 0.52 0.00 0.00 34.95 33.31 1uf7 s ARG 125 CO -0.00 -0.11 1.80 1.17 0.02 0.00 0.00 175.30 178.18 1uf7 n LYS 126 N 4.36 0.62 -0.02 3.54 4.81 -0.05 -3.65 118.16 127.78 1uf7 n LYS 126 Ca -0.18 0.22 -0.18 0.00 -0.87 0.00 0.00 58.31 57.30 1uf7 n LYS 126 Cb 0.51 -1.87 -0.14 0.00 0.02 0.00 0.00 35.03 33.55 1uf7 n LYS 126 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1uf7 n ILE 127 N 4.95 1.71 -3.28 3.15 5.41 -1.26 0.29 119.36 130.33 1uf7 n ILE 127 Ca 0.33 -0.69 -0.45 0.00 1.00 0.00 0.00 62.75 62.95 1uf7 n ILE 127 Cb 0.06 -1.51 -0.06 0.00 -0.71 0.00 0.00 39.64 37.42 1uf7 n ILE 127 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 1uf7 s HIS 128 N -2.56 3.17 -0.28 1.39 3.76 -1.26 -4.52 115.29 114.99 1uf7 s HIS 128 Ca -0.19 -0.98 -0.14 0.00 -0.15 0.00 0.00 55.06 53.60 1uf7 s HIS 128 Cb 0.07 -3.56 -0.04 0.00 1.11 0.00 0.00 32.58 30.16 1uf7 s HIS 128 CO 0.77 -0.98 0.33 -0.51 -0.85 0.00 0.00 174.74 173.49 1uf7 s LEU 129 N 1.95 4.08 0.00 0.89 1.43 -1.26 -4.35 118.68 121.42 1uf7 s LEU 129 Ca 0.07 0.15 -0.04 0.00 -1.03 0.00 0.00 54.13 53.28 1uf7 s LEU 129 Cb -0.25 -2.34 0.08 0.00 0.03 0.00 0.00 46.19 43.71 1uf7 s LEU 129 CO 0.06 -0.17 0.51 -0.81 0.23 0.00 0.00 176.35 176.18 1uf7 n PRO 130 N 5.27 -0.16 0.00 1.29 -0.04 -1.26 -4.83 135.00 135.27 1uf7 n PRO 130 Ca -0.10 -1.03 0.00 0.00 -0.04 0.00 0.00 63.50 62.33 1uf7 n PRO 130 Cb 0.51 -0.45 0.00 0.00 -0.04 0.00 0.00 33.50 33.52 1uf7 n PRO 130 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1uf7 n GLY 131 N 1.41 -0.68 3.54 0.55 0.00 -1.26 -4.15 105.19 104.61 1uf7 n GLY 131 Ca 0.07 -1.40 -0.26 0.00 0.00 0.00 0.00 46.02 44.43 1uf7 n GLY 131 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1uf7 s HIS 132 N 0.00 1.82 -0.25 1.61 -3.43 -0.88 -4.98 115.29 109.18 1uf7 s HIS 132 Ca 0.00 -1.20 0.00 0.00 -0.80 0.00 0.00 55.06 53.07 1uf7 s HIS 132 Cb 0.00 -1.24 -0.16 0.00 -1.43 0.00 0.00 32.58 29.76 1uf7 s HIS 132 CO 0.00 -0.19 -0.23 1.63 -2.00 0.00 0.00 174.74 173.95 1uf7 n LYS 133 N -0.93 0.61 -4.12 -0.38 4.76 -1.26 -4.07 118.16 112.76 1uf7 n LYS 133 Ca -0.07 0.15 -0.25 0.00 -2.87 0.00 0.00 58.31 55.27 1uf7 n LYS 133 Cb 0.65 -1.48 -0.05 0.00 -1.84 0.00 0.00 35.03 32.31 1uf7 n LYS 133 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1uf7 s GLU 134 N -2.49 2.83 0.28 1.97 2.02 -1.26 -4.70 118.70 117.35 1uf7 s GLU 134 Ca -0.33 -0.98 -0.30 0.00 0.02 0.00 0.00 54.97 53.38 1uf7 s GLU 134 Cb 0.09 -2.57 -0.12 0.00 0.10 0.00 0.00 34.13 31.63 1uf7 s GLU 134 CO 0.55 0.45 1.48 0.98 0.02 0.00 0.00 175.26 178.74 1uf7 n TYR 135 N -0.61 2.52 -3.88 1.61 9.36 -1.26 -4.97 117.16 119.93 1uf7 n TYR 135 Ca -0.08 0.37 -0.30 0.00 3.32 0.00 0.00 57.90 61.21 1uf7 n TYR 135 Cb 0.56 -2.52 -0.15 0.00 -0.63 0.00 0.00 39.34 36.60 1uf7 n TYR 135 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1uf7 s GLU 136 N -0.73 1.19 0.37 2.98 2.02 -1.26 -5.03 118.70 118.24 1uf7 s GLU 136 Ca 0.64 -1.26 0.15 0.00 0.02 0.00 0.00 54.97 54.52 1uf7 s GLU 136 Cb -0.56 -2.52 1.00 0.00 0.10 0.00 0.00 34.13 32.14 1uf7 s GLU 136 CO 0.52 -0.85 1.78 0.00 0.02 0.00 0.00 175.26 176.72 1uf7 h ALA 137 N 7.92 2.05 0.00 5.21 0.00 -2.02 -2.63 119.26 129.79 1uf7 h ALA 137 Ca -0.12 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1uf7 h ALA 137 Cb 1.04 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1uf7 h ALA 137 CO 0.46 -0.45 -0.27 0.10 0.00 0.00 0.00 179.25 179.10 1uf7 h TYR 138 N 0.50 0.00 -2.93 0.00 -0.00 -2.01 -3.45 116.97 109.08 1uf7 h TYR 138 Ca 0.58 0.00 -0.53 0.00 -0.00 0.00 0.00 58.73 58.78 1uf7 h TYR 138 Cb 1.30 0.00 0.03 0.00 -0.00 0.00 0.00 36.73 38.05 1uf7 h TYR 138 CO -0.00 0.27 0.79 1.03 -0.00 0.00 0.00 178.16 180.24 1uf7 s ARG 139 N -4.30 4.28 0.49 0.10 0.52 -0.99 -4.90 118.95 114.15 1uf7 s ARG 139 Ca -0.03 2.15 0.16 0.00 -0.52 0.00 0.00 55.73 57.48 1uf7 s ARG 139 Cb 0.14 -3.29 1.17 0.00 0.52 0.00 0.00 34.95 33.50 1uf7 s ARG 139 CO 0.69 -0.51 2.09 -1.00 0.02 0.00 0.00 175.30 176.58 1uf7 h PRO 140 N 7.02 0.00 -3.08 3.54 0.13 -1.90 -3.42 132.00 134.30 1uf7 h PRO 140 Ca -0.42 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.57 1uf7 h PRO 140 Cb 1.20 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.10 1uf7 h PRO 140 CO 0.88 0.08 -0.36 -0.59 -0.23 0.00 0.00 178.00 177.78 1uf7 s PHE 141 N -4.88 -0.25 0.82 1.56 -0.71 -1.26 -5.12 117.98 108.14 1uf7 s PHE 141 Ca -0.05 0.58 -0.06 0.00 -1.04 0.00 0.00 56.93 56.36 1uf7 s PHE 141 Cb 0.16 0.09 0.17 0.00 -1.21 0.00 0.00 43.02 42.23 1uf7 s PHE 141 CO 0.68 -0.22 1.12 -0.65 -1.34 0.00 0.00 175.22 174.81 1uf7 s GLN 142 N -0.33 1.20 -0.47 1.99 -1.52 -0.35 -4.96 119.66 115.21 1uf7 s GLN 142 Ca -0.05 -0.96 0.06 0.00 -1.95 0.00 0.00 55.36 52.46 1uf7 s GLN 142 Cb -0.03 -2.16 0.22 0.00 -0.22 0.00 0.00 33.01 30.81 1uf7 s GLN 142 CO 0.01 -1.86 0.69 1.58 -0.25 0.00 0.00 175.29 175.46 1uf7 n HIS 143 N -3.19 -2.62 -1.27 0.91 -0.00 -1.23 -3.99 115.22 103.83 1uf7 n HIS 143 Ca 0.16 -2.18 -0.27 0.00 0.46 0.00 0.00 57.72 55.89 1uf7 n HIS 143 Cb 0.60 1.01 0.03 0.00 -0.12 0.00 0.00 29.99 31.51 1uf7 n HIS 143 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 1uf7 n LEU 144 N 2.18 6.93 0.06 0.27 4.77 -0.57 -2.07 117.00 128.57 1uf7 n LEU 144 Ca 0.17 -3.92 0.02 0.00 -0.03 0.00 0.00 56.01 52.25 1uf7 n LEU 144 Cb 0.57 -1.08 0.36 0.00 -2.33 0.00 0.00 43.42 40.94 1uf7 n LEU 144 CO 0.05 1.47 0.95 -0.33 -1.33 0.00 0.00 177.39 178.20 1uf7 h GLU 145 N 2.14 0.38 0.00 3.23 5.08 -1.76 -1.77 114.58 121.88 1uf7 h GLU 145 Ca 0.43 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1uf7 h GLU 145 Cb 0.74 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 1uf7 h GLU 145 CO 1.09 0.44 -0.00 0.87 -1.00 0.00 0.00 179.01 180.40 1uf7 h LYS 146 N 0.37 0.00 0.06 2.33 1.57 -1.72 -0.75 116.57 118.43 1uf7 h LYS 146 Ca 0.08 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.50 1uf7 h LYS 146 Cb 0.29 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 1uf7 h LYS 146 CO 0.01 0.00 -2.16 -2.13 -0.57 0.00 0.00 179.45 174.60 1uf7 n ARG 147 N -3.11 0.70 0.00 3.15 0.63 -0.71 -4.42 116.66 112.89 1uf7 n ARG 147 Ca -0.02 0.21 0.13 0.00 -0.92 0.00 0.00 57.85 57.25 1uf7 n ARG 147 Cb 0.16 -1.64 0.41 0.00 0.45 0.00 0.00 32.46 31.84 1uf7 n ARG 147 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1uf7 n TYR 148 N -3.31 0.00 -3.99 -0.14 0.53 -0.92 -4.90 117.16 104.43 1uf7 n TYR 148 Ca -0.35 0.00 -0.09 0.00 -1.02 0.00 0.00 57.90 56.44 1uf7 n TYR 148 Cb 1.04 -0.18 -0.11 0.00 -1.03 0.00 0.00 39.34 39.06 1uf7 n TYR 148 CO 0.00 0.00 0.00 -0.06 -1.02 0.00 0.00 176.86 175.78 1uf7 s PHE 149 N -2.63 0.28 0.01 -0.72 2.99 -0.31 -4.63 117.98 112.97 1uf7 s PHE 149 Ca 0.22 -0.58 -0.01 0.00 0.00 0.00 0.00 56.93 56.56 1uf7 s PHE 149 Cb 0.19 -0.21 -0.04 0.00 0.00 0.00 0.00 43.02 42.96 1uf7 s PHE 149 CO 0.55 -0.21 0.15 -1.21 -0.00 0.00 0.00 175.22 174.50 1uf7 s GLU 150 N -1.74 3.30 0.38 0.44 2.02 0.12 -4.61 118.70 118.61 1uf7 s GLU 150 Ca -0.13 -0.41 -0.28 0.00 0.02 0.00 0.00 54.97 54.17 1uf7 s GLU 150 Cb -0.08 -3.00 -0.11 0.00 0.10 0.00 0.00 34.13 31.04 1uf7 s GLU 150 CO -0.02 0.65 1.43 -2.30 0.02 0.00 0.00 175.26 175.04 1uf7 n PRO 151 N 0.87 2.48 -1.50 0.39 -0.02 -1.26 -4.68 135.00 131.28 1uf7 n PRO 151 Ca -0.10 0.87 -0.39 0.00 -2.02 0.00 0.00 63.50 61.86 1uf7 n PRO 151 Cb 0.52 -2.58 0.04 0.00 -0.02 0.00 0.00 33.50 31.46 1uf7 n PRO 151 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uf7 n GLY 152 N 0.55 -1.19 0.19 -1.23 0.00 0.15 -4.92 105.19 98.73 1uf7 n GLY 152 Ca 0.03 -0.12 0.03 0.00 0.00 0.00 0.00 46.02 45.95 1uf7 n GLY 152 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1uf7 n ASP 153 N 0.32 2.33 -0.92 1.61 5.75 -1.26 -4.61 116.55 119.77 1uf7 n ASP 153 Ca 0.12 -2.16 0.11 0.00 -0.01 0.00 0.00 54.79 52.85 1uf7 n ASP 153 Cb 0.46 -0.12 0.13 0.00 -1.03 0.00 0.00 41.12 40.56 1uf7 n ASP 153 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1uf7 n LEU 154 N -0.36 2.96 0.00 -2.12 4.77 -1.26 -5.08 117.00 115.91 1uf7 n LEU 154 Ca 0.05 -1.20 0.00 0.00 -0.03 0.00 0.00 56.01 54.83 1uf7 n LEU 154 Cb 0.36 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1uf7 n LEU 154 CO 0.03 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1uf7 n GLY 155 N 1.24 -0.01 2.79 -0.72 0.00 -1.26 -4.15 105.19 103.08 1uf7 n GLY 155 Ca 0.14 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.87 1uf7 n GLY 155 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1uf7 n PHE 156 N 0.00 3.55 -1.38 1.61 3.01 -1.26 -4.72 117.46 118.27 1uf7 n PHE 156 Ca 0.00 -4.04 -0.30 0.00 1.01 0.00 0.00 57.45 54.12 1uf7 n PHE 156 Cb 0.00 -0.80 0.09 0.00 -0.01 0.00 0.00 39.48 38.76 1uf7 n PHE 156 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1uf7 s PRO 157 N -1.96 2.13 -0.07 -1.08 0.04 -1.26 -4.36 135.00 128.44 1uf7 s PRO 157 Ca 0.32 0.93 0.02 0.00 0.04 0.00 0.00 61.00 62.30 1uf7 s PRO 157 Cb 0.03 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.68 1uf7 s PRO 157 CO -0.07 -1.66 -0.11 0.08 0.04 0.00 0.00 177.00 175.27 1uf7 s VAL 158 N -3.00 1.11 0.25 -0.36 1.01 -1.26 -4.06 120.40 114.09 1uf7 s VAL 158 Ca 0.61 -0.44 0.11 0.00 0.00 0.00 0.00 61.98 62.26 1uf7 s VAL 158 Cb -0.16 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 1uf7 s VAL 158 CO 0.56 0.36 -0.15 -0.31 0.00 0.00 0.00 175.10 175.55 1uf7 s TYR 159 N 0.87 2.42 -0.28 5.22 1.51 0.97 -4.90 117.35 123.16 1uf7 s TYR 159 Ca -0.11 -0.30 -0.18 0.00 -1.01 0.00 0.00 57.07 55.47 1uf7 s TYR 159 Cb -0.15 -1.09 -0.02 0.00 -0.11 0.00 0.00 41.96 40.58 1uf7 s TYR 159 CO 0.01 0.64 0.53 -0.51 -1.11 0.00 0.00 175.55 175.11 1uf7 s ASP 160 N -3.33 6.42 -0.28 2.29 1.11 -1.26 0.03 116.67 121.65 1uf7 s ASP 160 Ca 0.28 0.42 0.03 0.00 0.18 0.00 0.00 52.55 53.46 1uf7 s ASP 160 Cb -0.06 -2.28 0.07 0.00 1.07 0.00 0.00 42.92 41.72 1uf7 s ASP 160 CO 0.15 -0.34 -0.04 -0.69 1.18 0.00 0.00 175.17 175.43 1uf7 s VAL 161 N 2.36 2.05 -1.26 -1.27 1.01 0.12 -4.83 120.40 118.59 1uf7 s VAL 161 Ca 0.21 -1.80 -0.19 0.00 0.00 0.00 0.00 61.98 60.21 1uf7 s VAL 161 Cb -0.15 -2.31 0.01 0.00 0.00 0.00 0.00 36.38 33.92 1uf7 s VAL 161 CO 0.10 -0.26 0.60 0.47 0.00 0.00 0.00 175.10 176.02 1uf7 n ASP 162 N 4.43 -3.29 -0.17 3.32 8.00 -1.26 -1.30 116.55 126.28 1uf7 n ASP 162 Ca -0.07 -1.13 -0.02 0.00 0.71 0.00 0.00 54.79 54.28 1uf7 n ASP 162 Cb 0.42 -2.62 -0.01 0.00 -0.02 0.00 0.00 41.12 38.90 1uf7 n ASP 162 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1uf7 n ALA 163 N -4.54 -0.03 -2.86 2.24 0.00 -1.26 -5.00 120.51 109.05 1uf7 n ALA 163 Ca -0.17 0.03 -0.27 0.00 0.00 0.00 0.00 53.44 53.04 1uf7 n ALA 163 Cb 0.61 -0.72 -0.16 0.00 0.00 0.00 0.00 19.45 19.19 1uf7 n ALA 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uf7 s ALA 164 N -1.80 1.61 -0.40 0.00 0.00 -0.42 -4.93 121.76 115.82 1uf7 s ALA 164 Ca 0.00 -0.74 -0.21 0.00 0.00 0.00 0.00 51.96 51.01 1uf7 s ALA 164 Cb 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.61 1uf7 s ALA 164 CO 0.00 0.30 0.66 0.15 0.00 0.00 0.00 175.76 176.87 1uf7 s LYS 165 N -0.01 3.49 -0.03 0.00 1.02 -1.26 0.16 119.74 123.11 1uf7 s LYS 165 Ca -0.03 -0.12 0.07 0.00 0.02 0.00 0.00 55.97 55.91 1uf7 s LYS 165 Cb -0.12 -3.88 -0.02 0.00 -0.52 0.00 0.00 37.83 33.30 1uf7 s LYS 165 CO 0.02 -0.89 -0.24 -1.64 -0.92 0.00 0.00 175.35 171.68 1uf7 s MET 166 N 2.83 2.21 0.19 1.68 -1.94 0.10 -0.24 119.30 124.12 1uf7 s MET 166 Ca 0.24 -0.90 0.11 0.00 -1.71 0.00 0.00 55.69 53.44 1uf7 s MET 166 Cb -0.14 -2.10 -0.04 0.00 2.01 0.00 0.00 34.83 34.56 1uf7 s MET 166 CO 0.17 0.55 -0.24 0.20 -0.01 0.00 0.00 175.02 175.70 1uf7 s GLY 167 N -0.58 1.70 -0.01 -0.03 0.00 0.62 -0.02 107.32 109.00 1uf7 s GLY 167 Ca 0.09 -1.62 0.06 0.00 0.00 0.00 0.00 44.72 43.25 1uf7 s GLY 167 CO -0.00 -1.64 -0.18 1.06 0.00 0.00 0.00 173.10 172.33 1uf7 s MET 168 N -2.63 2.24 0.11 2.90 -1.94 -1.26 -1.43 119.30 117.30 1uf7 s MET 168 Ca 0.20 -0.86 0.05 0.00 -1.71 0.00 0.00 55.69 53.37 1uf7 s MET 168 Cb -0.08 -2.22 -0.04 0.00 2.01 0.00 0.00 34.83 34.50 1uf7 s MET 168 CO 0.10 0.58 -0.12 -0.59 -0.01 0.00 0.00 175.02 174.98 1uf7 s PHE 169 N -0.78 1.21 -0.15 -0.03 -0.12 -0.84 -4.90 117.98 112.37 1uf7 s PHE 169 Ca 0.12 -0.62 -0.01 0.00 -0.05 0.00 0.00 56.93 56.37 1uf7 s PHE 169 Cb -0.10 -0.64 0.04 0.00 -0.63 0.00 0.00 43.02 41.68 1uf7 s PHE 169 CO 0.02 0.06 -0.04 0.42 -0.05 0.00 0.00 175.22 175.63 1uf7 s ILE 170 N -2.39 0.97 0.00 -4.49 1.01 -1.26 -4.04 121.20 111.00 1uf7 s ILE 170 Ca 0.08 -0.50 0.00 0.00 0.00 0.00 0.00 60.65 60.23 1uf7 s ILE 170 Cb -0.03 -1.15 0.00 0.00 0.01 0.00 0.00 42.46 41.28 1uf7 s ILE 170 CO 0.01 0.15 0.00 0.00 0.00 0.00 0.00 174.94 175.10 1uf7 n ALA 171 N 4.93 0.00 -0.43 9.38 0.00 0.68 -1.73 120.51 133.33 1uf7 n ALA 171 Ca -0.11 0.00 0.35 0.00 0.00 0.00 0.00 53.44 53.68 1uf7 n ALA 171 Cb 0.48 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.57 1uf7 n ALA 171 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1uf7 h ASN 172 N 0.00 0.25 -1.10 0.00 -0.73 -1.88 0.08 115.58 112.20 1uf7 h ASN 172 Ca 0.00 0.11 0.30 0.00 1.87 0.00 0.00 56.30 58.58 1uf7 h ASN 172 Cb 0.00 0.09 -0.08 0.00 0.27 0.00 0.00 38.32 38.59 1uf7 h ASN 172 CO 0.00 -0.10 0.73 0.44 -0.37 0.00 0.00 177.43 178.13 1uf7 h ASP 173 N 0.13 0.30 0.10 1.15 3.32 -1.53 -1.16 116.42 118.72 1uf7 h ASP 173 Ca 0.76 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.88 1uf7 h ASP 173 Cb 2.42 0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.99 1uf7 h ASP 173 CO -0.34 0.04 0.00 0.08 -1.72 0.00 0.00 179.24 177.30 1uf7 h ARG 174 N 0.25 0.00 -0.00 3.56 0.11 -1.21 -1.74 114.38 115.35 1uf7 h ARG 174 Ca 0.60 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.68 1uf7 h ARG 174 Cb 1.80 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.88 1uf7 h ARG 174 CO -0.22 0.00 -0.28 0.54 0.10 0.00 0.00 179.97 180.11 1uf7 n ARG 175 N -2.91 0.55 -3.60 0.08 1.74 -0.44 -4.63 116.66 107.45 1uf7 n ARG 175 Ca -0.02 -0.29 -0.40 0.00 -0.77 0.00 0.00 57.85 56.36 1uf7 n ARG 175 Cb 0.09 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 29.92 1uf7 n ARG 175 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1uf7 s TRP 176 N -2.65 3.21 0.54 -1.55 0.52 -0.66 -4.97 118.94 113.39 1uf7 s TRP 176 Ca 0.21 -0.66 0.25 0.00 0.02 0.00 0.00 56.10 55.92 1uf7 s TRP 176 Cb 0.19 -2.43 1.42 0.00 -1.15 0.00 0.00 33.47 31.51 1uf7 s TRP 176 CO 0.56 -0.52 2.03 -1.00 0.02 0.00 0.00 176.95 178.03 1uf7 h PRO 177 N 8.43 0.00 -0.85 4.98 0.13 -1.87 -1.82 132.00 141.00 1uf7 h PRO 177 Ca -0.29 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.82 1uf7 h PRO 177 Cb 1.13 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.22 1uf7 h PRO 177 CO 0.65 0.00 0.47 0.93 -0.23 0.00 0.00 178.00 179.82 1uf7 h GLU 178 N 0.00 1.19 0.10 0.86 3.07 -1.93 0.11 114.58 117.97 1uf7 h GLU 178 Ca 0.19 -0.14 -0.00 0.00 -0.50 0.00 0.00 59.36 58.91 1uf7 h GLU 178 Cb 0.80 -0.23 0.00 0.00 -0.84 0.00 0.00 28.75 28.48 1uf7 h GLU 178 CO -0.00 0.87 -0.05 0.00 -1.40 0.00 0.00 179.01 178.43 1uf7 h ALA 179 N 1.25 -0.13 -0.35 3.43 0.00 -1.61 -1.71 119.26 120.14 1uf7 h ALA 179 Ca 0.30 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1uf7 h ALA 179 Cb 0.02 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1uf7 h ALA 179 CO -0.05 -0.55 0.18 -1.49 0.00 0.00 0.00 179.25 177.34 1uf7 h TRP 180 N -0.18 0.48 -0.55 0.00 4.06 -1.53 -2.94 115.95 115.30 1uf7 h TRP 180 Ca -0.01 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.92 1uf7 h TRP 180 Cb 0.14 -0.15 -0.03 0.00 -1.00 0.00 0.00 29.16 28.12 1uf7 h TRP 180 CO -0.06 0.39 0.35 -0.09 -3.56 0.00 0.00 178.44 175.48 1uf7 h ARG 181 N 0.43 0.73 -0.22 0.49 9.65 -0.87 0.67 114.38 125.26 1uf7 h ARG 181 Ca 0.12 -0.05 0.03 0.00 -1.10 0.00 0.00 59.98 58.98 1uf7 h ARG 181 Cb 0.07 -0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 28.47 1uf7 h ARG 181 CO -0.02 0.50 0.04 0.28 2.80 0.00 0.00 179.97 183.57 1uf7 h VAL 182 N 0.74 0.90 -0.08 0.20 2.07 -1.27 0.46 116.25 119.27 1uf7 h VAL 182 Ca 0.20 -0.04 -0.10 0.00 0.82 0.00 0.00 66.70 67.58 1uf7 h VAL 182 Cb -0.06 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1uf7 h VAL 182 CO -0.04 0.02 -0.39 0.24 0.02 0.00 0.00 177.57 177.42 1uf7 h MET 183 N 0.13 0.17 -0.61 1.57 2.86 -1.28 -1.80 114.93 115.97 1uf7 h MET 183 Ca 0.10 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 1uf7 h MET 183 Cb 0.09 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 1uf7 h MET 183 CO -0.13 0.54 0.15 0.78 1.06 0.00 0.00 176.91 179.31 1uf7 h GLY 184 N 1.19 1.04 2.00 8.32 0.00 0.14 -1.94 103.07 113.82 1uf7 h GLY 184 Ca 0.01 -0.66 -0.02 0.00 0.00 0.00 0.00 47.33 46.67 1uf7 h GLY 184 CO 0.06 0.61 -0.09 1.41 0.00 0.00 0.00 176.54 178.52 1uf7 h LEU 185 N 0.88 0.00 -1.12 3.11 3.38 0.32 -1.61 115.31 120.28 1uf7 h LEU 185 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1uf7 h LEU 185 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1uf7 h LEU 185 CO 0.00 0.09 0.00 0.54 0.09 0.00 0.00 178.44 179.17 1uf7 n ARG 186 N -3.27 1.72 -1.20 1.13 1.74 -0.72 -4.94 116.66 111.12 1uf7 n ARG 186 Ca -0.00 -1.10 -0.02 0.00 -0.77 0.00 0.00 57.85 55.96 1uf7 n ARG 186 Cb 0.32 -1.32 -0.01 0.00 -1.02 0.00 0.00 32.46 30.44 1uf7 n ARG 186 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uf7 n GLY 187 N 1.06 0.47 3.76 -0.13 0.00 -0.61 -4.93 105.19 104.82 1uf7 n GLY 187 Ca 0.13 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.75 1uf7 n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uf7 s ALA 188 N -2.06 3.68 -0.12 4.61 0.00 -0.80 -4.86 121.76 122.21 1uf7 s ALA 188 Ca 0.00 1.60 0.18 0.00 0.00 0.00 0.00 51.96 53.74 1uf7 s ALA 188 Cb 0.00 -3.64 -0.27 0.00 0.00 0.00 0.00 23.12 19.21 1uf7 s ALA 188 CO 0.00 -1.04 0.22 0.39 0.00 0.00 0.00 175.76 175.33 1uf7 n GLU 189 N 1.42 0.79 -4.14 0.00 1.02 0.66 -4.74 120.64 115.66 1uf7 n GLU 189 Ca 0.05 -0.08 -0.20 0.00 -0.02 0.00 0.00 57.16 56.92 1uf7 n GLU 189 Cb 0.38 -1.49 -0.16 0.00 -0.02 0.00 0.00 31.44 30.15 1uf7 n GLU 189 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1uf7 s ILE 190 N -2.84 0.49 -0.17 -3.67 1.01 -0.62 -0.86 121.20 114.54 1uf7 s ILE 190 Ca -0.09 -0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.47 1uf7 s ILE 190 Cb 0.09 -0.52 0.03 0.00 0.01 0.00 0.00 42.46 42.06 1uf7 s ILE 190 CO 0.80 0.21 -0.15 -0.63 0.00 0.00 0.00 174.94 175.18 1uf7 s ILE 191 N 0.92 1.75 0.13 2.92 1.01 -0.21 -0.28 121.20 127.44 1uf7 s ILE 191 Ca -0.11 -0.84 -0.03 0.00 0.00 0.00 0.00 60.65 59.67 1uf7 s ILE 191 Cb -0.14 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.63 1uf7 s ILE 191 CO -0.00 0.40 0.10 0.00 0.00 0.00 0.00 174.94 175.44 1uf7 n GLY 193 N -0.10 -1.43 3.12 0.00 0.00 -0.79 -1.99 105.19 104.00 1uf7 n GLY 193 Ca -0.07 -1.00 -0.25 0.00 0.00 0.00 0.00 46.02 44.70 1uf7 n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uf7 n GLY 194 N -0.12 3.42 3.50 -0.02 0.00 -1.26 -0.86 105.19 109.85 1uf7 n GLY 194 Ca 0.00 -2.18 -0.14 0.00 0.00 0.00 0.00 46.02 43.70 1uf7 n GLY 194 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1uf7 s TYR 195 N -2.84 -0.54 -0.39 1.61 -0.85 0.14 -0.23 117.35 114.25 1uf7 s TYR 195 Ca 0.12 0.70 0.02 0.00 -0.52 0.00 0.00 57.07 57.39 1uf7 s TYR 195 Cb 0.01 0.48 0.12 0.00 0.38 0.00 0.00 41.96 42.94 1uf7 s TYR 195 CO 0.09 -0.64 0.16 -0.80 -1.52 0.00 0.00 175.55 172.84 1uf7 s ASN 196 N -1.82 4.03 -0.33 -0.18 0.01 -1.26 -1.41 114.94 113.99 1uf7 s ASN 196 Ca -0.04 -2.25 0.01 0.00 -0.71 0.00 0.00 52.86 49.87 1uf7 s ASN 196 Cb -0.00 -1.14 0.08 0.00 0.41 0.00 0.00 41.25 40.60 1uf7 s ASN 196 CO -0.01 -0.33 0.03 -0.89 -1.51 0.00 0.00 177.10 174.40 1uf7 s THR 197 N 0.82 2.61 0.37 1.60 2.01 -1.26 -5.01 115.64 116.77 1uf7 s THR 197 Ca 0.14 -1.93 -0.28 0.00 0.31 0.00 0.00 61.69 59.93 1uf7 s THR 197 Cb -0.21 -2.72 -0.10 0.00 0.01 0.00 0.00 72.50 69.48 1uf7 s THR 197 CO -0.10 -0.39 1.40 -2.84 -0.69 0.00 0.00 174.62 172.00 1uf7 s PRO 198 N 1.07 4.14 0.00 4.92 0.02 -1.26 -0.04 135.00 143.84 1uf7 s PRO 198 Ca 0.03 2.38 0.28 0.00 0.02 0.00 0.00 61.00 63.71 1uf7 s PRO 198 Cb -0.20 -2.95 1.62 0.00 0.02 0.00 0.00 34.50 32.99 1uf7 s PRO 198 CO -0.05 -0.43 2.02 0.25 -0.33 0.00 0.00 177.00 178.46 1uf7 n THR 199 N 0.48 0.03 -4.88 0.99 -2.24 -0.61 -4.64 114.28 103.41 1uf7 n THR 199 Ca 0.01 0.01 -0.27 0.00 -2.27 0.00 0.00 64.05 61.53 1uf7 n THR 199 Cb 0.41 -0.56 -0.16 0.00 -2.10 0.00 0.00 70.33 67.92 1uf7 n THR 199 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1uf7 s HIS 200 N -2.15 1.83 -0.24 4.78 5.65 -1.26 -4.61 115.29 119.28 1uf7 s HIS 200 Ca 0.38 -0.58 0.02 0.00 0.25 0.00 0.00 55.06 55.13 1uf7 s HIS 200 Cb 0.19 -1.24 0.06 0.00 -1.18 0.00 0.00 32.58 30.41 1uf7 s HIS 200 CO 0.35 -0.22 -0.08 1.21 -0.65 0.00 0.00 174.74 175.36 1uf7 s ASN 201 N 0.16 4.05 0.20 9.88 2.47 -1.26 -5.04 114.94 125.40 1uf7 s ASN 201 Ca -0.07 -1.24 -0.11 0.00 0.42 0.00 0.00 52.86 51.85 1uf7 s ASN 201 Cb -0.13 -1.31 0.26 0.00 -1.45 0.00 0.00 41.25 38.62 1uf7 s ASN 201 CO 0.03 -0.22 1.68 -0.65 -3.72 0.00 0.00 177.10 174.23 1uf7 h PRO 202 N 7.89 0.14 0.00 0.43 0.11 -1.98 -0.88 132.00 137.71 1uf7 h PRO 202 Ca -0.19 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.80 1uf7 h PRO 202 Cb 1.06 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1uf7 h PRO 202 CO 0.43 0.09 -0.53 -1.00 -0.21 0.00 0.00 178.00 176.79 1uf7 h PRO 203 N 0.14 0.00 -2.03 1.05 0.13 -2.00 -3.36 132.00 125.93 1uf7 h PRO 203 Ca 0.30 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.89 1uf7 h PRO 203 Cb 0.47 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.20 1uf7 h PRO 203 CO -0.47 0.53 -1.07 0.28 -0.23 0.00 0.00 178.00 177.04 1uf7 n VAL 204 N -3.79 -0.07 0.28 1.56 0.31 -1.07 -4.95 118.33 110.61 1uf7 n VAL 204 Ca -0.01 -4.38 0.13 0.00 -0.01 0.00 0.00 64.34 60.07 1uf7 n VAL 204 Cb 0.56 -1.44 0.60 0.00 -0.91 0.00 0.00 33.84 32.65 1uf7 n VAL 204 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1uf7 h PRO 205 N 3.67 0.00 0.00 5.55 0.13 -1.32 -2.73 132.00 137.29 1uf7 h PRO 205 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1uf7 h PRO 205 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1uf7 h PRO 205 CO 0.53 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.30 1uf7 n GLN 206 N -2.36 0.46 -0.10 0.86 0.00 -1.26 -1.81 117.38 113.17 1uf7 n GLN 206 Ca 0.00 0.04 0.06 0.00 0.00 0.00 0.00 57.00 57.10 1uf7 n GLN 206 Cb 0.14 -1.50 0.11 0.00 0.00 0.00 0.00 30.24 28.99 1uf7 n GLN 206 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1uf7 n HIS 207 N -1.09 0.27 -0.17 2.61 8.25 -1.03 -4.69 115.22 119.37 1uf7 n HIS 207 Ca 0.12 -0.27 -0.03 0.00 -0.26 0.00 0.00 57.72 57.28 1uf7 n HIS 207 Cb 0.09 -0.01 0.07 0.00 1.12 0.00 0.00 29.99 31.25 1uf7 n HIS 207 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 1uf7 h ASP 208 N 2.27 0.23 0.22 0.41 5.19 -1.54 -0.85 116.42 122.35 1uf7 h ASP 208 Ca 0.00 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 1uf7 h ASP 208 Cb 0.64 0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.17 1uf7 h ASP 208 CO 0.00 0.16 0.00 0.00 -3.12 0.00 0.00 179.24 176.28 1uf7 n HIS 209 N -4.98 0.00 0.25 4.55 1.44 -1.26 -2.17 115.22 113.06 1uf7 n HIS 209 Ca 0.06 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 55.85 1uf7 n HIS 209 Cb 0.20 -0.20 0.15 0.00 0.12 0.00 0.00 29.99 30.26 1uf7 n HIS 209 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1uf7 n LEU 210 N -1.20 2.90 -0.17 2.39 4.77 -0.33 -4.69 117.00 120.67 1uf7 n LEU 210 Ca 0.10 -1.47 -0.01 0.00 -0.03 0.00 0.00 56.01 54.60 1uf7 n LEU 210 Cb 0.11 -0.17 0.07 0.00 -2.33 0.00 0.00 43.42 41.11 1uf7 n LEU 210 CO 0.12 0.63 0.86 0.74 -1.33 0.00 0.00 177.39 178.41 1uf7 h THR 211 N 3.26 0.61 -0.19 -5.08 2.02 -1.34 0.15 112.91 112.34 1uf7 h THR 211 Ca 0.00 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 1uf7 h THR 211 Cb 0.78 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1uf7 h THR 211 CO 0.00 0.03 0.03 -1.28 0.37 0.00 0.00 175.52 174.67 1uf7 h SER 212 N 0.14 0.31 -0.42 4.18 0.87 -1.85 -2.69 113.55 114.09 1uf7 h SER 212 Ca 0.27 -0.26 0.08 0.00 -1.23 0.00 0.00 61.79 60.65 1uf7 h SER 212 Cb 0.40 -0.08 -0.08 0.00 -0.44 0.00 0.00 62.40 62.20 1uf7 h SER 212 CO -0.42 0.49 -0.07 0.15 -0.53 0.00 0.00 176.83 176.45 1uf7 h PHE 213 N 0.12 -0.15 -0.47 2.24 3.57 -1.64 -0.52 116.94 120.09 1uf7 h PHE 213 Ca 0.06 0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.50 1uf7 h PHE 213 Cb 0.31 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 1uf7 h PHE 213 CO 0.02 -0.15 -0.10 0.45 -2.23 0.00 0.00 178.31 176.29 1uf7 h HIS 214 N 0.04 0.94 0.55 0.41 3.86 -1.00 0.91 115.15 120.85 1uf7 h HIS 214 Ca 0.21 -0.18 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 1uf7 h HIS 214 Cb 0.31 -0.24 0.01 0.00 1.06 0.00 0.00 27.41 28.55 1uf7 h HIS 214 CO -0.34 0.91 -0.26 1.25 0.86 0.00 0.00 177.93 180.34 1uf7 h HIS 215 N 0.77 -0.68 -0.63 2.45 -0.00 -1.11 -1.67 115.15 114.27 1uf7 h HIS 215 Ca 0.13 -0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.44 1uf7 h HIS 215 Cb 0.61 0.23 -0.03 0.00 -0.00 0.00 0.00 27.41 28.22 1uf7 h HIS 215 CO 0.03 -0.36 0.23 -0.07 -0.00 0.00 0.00 177.93 177.76 1uf7 h LEU 216 N -0.94 0.87 -0.68 0.26 3.38 -1.09 -2.16 115.31 114.95 1uf7 h LEU 216 Ca -0.08 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 57.79 1uf7 h LEU 216 Cb 0.63 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1uf7 h LEU 216 CO 0.12 0.80 0.43 0.25 0.09 0.00 0.00 178.44 180.13 1uf7 h LEU 217 N 0.92 0.72 -0.56 1.67 5.85 -0.79 0.33 115.31 123.47 1uf7 h LEU 217 Ca 0.21 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 1uf7 h LEU 217 Cb 0.22 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1uf7 h LEU 217 CO -0.01 0.51 0.14 0.28 -0.34 0.00 0.00 178.44 179.01 1uf7 h SER 218 N 0.86 0.84 -0.25 1.25 0.02 -0.84 -1.53 113.55 113.90 1uf7 h SER 218 Ca 0.27 -0.23 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 1uf7 h SER 218 Cb -0.02 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 1uf7 h SER 218 CO -0.09 0.85 -0.08 0.24 -1.14 0.00 0.00 176.83 176.61 1uf7 h MET 219 N 0.79 0.49 -0.10 3.45 2.86 -0.99 -1.90 114.93 119.53 1uf7 h MET 219 Ca 0.17 -0.20 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1uf7 h MET 219 Cb 0.34 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.97 1uf7 h MET 219 CO 0.00 0.72 0.04 1.96 1.06 0.00 0.00 176.91 180.70 1uf7 h GLN 220 N 0.22 0.14 -0.45 1.72 4.20 -0.89 -1.88 115.11 118.17 1uf7 h GLN 220 Ca 0.06 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 1uf7 h GLN 220 Cb 0.56 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.29 1uf7 h GLN 220 CO 0.03 0.22 0.19 0.00 -0.67 0.00 0.00 178.83 178.61 1uf7 h ALA 221 N 0.91 0.58 -0.31 3.87 0.00 -1.33 -1.52 119.26 121.45 1uf7 h ALA 221 Ca 0.03 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1uf7 h ALA 221 Cb 0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1uf7 h ALA 221 CO -0.00 0.17 0.16 0.78 0.00 0.00 0.00 179.25 180.35 1uf7 h GLY 222 N 0.58 0.42 0.93 0.00 0.00 -1.29 -1.19 103.07 102.53 1uf7 h GLY 222 Ca 0.15 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 1uf7 h GLY 222 CO -0.02 0.09 -0.29 1.76 0.00 0.00 0.00 176.54 178.09 1uf7 h SER 223 N 0.33 -0.68 0.02 0.19 0.02 -1.19 -2.85 113.55 109.39 1uf7 h SER 223 Ca 0.13 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.10 1uf7 h SER 223 Cb 0.04 0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 1uf7 h SER 223 CO -0.09 -0.43 -0.40 0.22 -1.14 0.00 0.00 176.83 174.99 1uf7 h TYR 224 N -0.88 -1.13 0.00 3.45 3.20 -1.21 0.46 116.97 120.86 1uf7 h TYR 224 Ca -0.08 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.82 1uf7 h TYR 224 Cb 0.65 0.49 0.00 0.00 1.54 0.00 0.00 36.73 39.41 1uf7 h TYR 224 CO -0.02 -0.49 0.00 1.04 -1.64 0.00 0.00 178.16 177.06 1uf7 n GLN 225 N -5.45 0.09 -0.01 1.82 6.02 -0.46 -1.92 117.38 117.48 1uf7 n GLN 225 Ca -0.06 0.39 0.01 0.00 -0.01 0.00 0.00 57.00 57.33 1uf7 n GLN 225 Cb 0.36 -1.70 0.01 0.00 1.02 0.00 0.00 30.24 29.94 1uf7 n GLN 225 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1uf7 n ASN 226 N -1.88 1.50 -3.87 1.08 3.02 -1.02 -5.00 115.26 109.10 1uf7 n ASN 226 Ca 0.02 -1.41 -0.24 0.00 -0.03 0.00 0.00 54.58 52.92 1uf7 n ASN 226 Cb 0.16 -0.01 -0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1uf7 n ASN 226 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uf7 n GLY 227 N -0.08 -0.26 3.15 7.41 0.00 0.15 -4.87 105.19 110.69 1uf7 n GLY 227 Ca 0.01 0.15 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 1uf7 n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uf7 s ALA 228 N -3.86 1.31 0.51 4.61 0.00 -0.37 -4.54 121.76 119.42 1uf7 s ALA 228 Ca 0.01 -0.74 -0.20 0.00 0.00 0.00 0.00 51.96 51.02 1uf7 s ALA 228 Cb -0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 23.12 22.75 1uf7 s ALA 228 CO 0.86 0.30 1.11 -1.58 0.00 0.00 0.00 175.76 176.46 1uf7 s TRP 229 N -0.51 2.80 0.10 0.00 0.52 -0.04 -3.59 118.94 118.22 1uf7 s TRP 229 Ca 0.05 1.55 -0.04 0.00 0.02 0.00 0.00 56.10 57.68 1uf7 s TRP 229 Cb -0.07 -3.24 -0.02 0.00 -1.15 0.00 0.00 33.47 28.98 1uf7 s TRP 229 CO 0.00 -1.35 0.11 -1.54 0.02 0.00 0.00 176.95 174.19 1uf7 s SER 230 N -1.75 0.26 -0.20 2.95 1.04 0.28 -1.04 113.70 115.25 1uf7 s SER 230 Ca 0.69 -0.95 -0.14 0.00 0.48 0.00 0.00 55.95 56.03 1uf7 s SER 230 Cb -0.23 0.31 0.06 0.00 0.10 0.00 0.00 66.02 66.26 1uf7 s SER 230 CO 0.26 -0.72 0.50 0.00 0.98 0.00 0.00 173.24 174.26 1uf7 s ALA 231 N -3.95 -1.27 -0.13 5.32 0.00 -0.98 0.18 121.76 120.93 1uf7 s ALA 231 Ca 0.13 1.62 0.01 0.00 0.00 0.00 0.00 51.96 53.71 1uf7 s ALA 231 Cb 0.06 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.25 1uf7 s ALA 231 CO -0.05 -0.27 -0.13 0.00 0.00 0.00 0.00 175.76 175.31 1uf7 s ALA 232 N 0.89 1.67 -0.30 0.00 0.00 -0.02 -1.88 121.76 122.11 1uf7 s ALA 232 Ca -0.05 -0.75 -0.07 0.00 0.00 0.00 0.00 51.96 51.09 1uf7 s ALA 232 Cb -0.06 -0.94 0.01 0.00 0.00 0.00 0.00 23.12 22.14 1uf7 s ALA 232 CO -0.07 -0.28 0.09 0.00 0.00 0.00 0.00 175.76 175.49 1uf7 s ALA 233 N 1.36 3.08 0.26 0.00 0.00 -0.04 -1.37 121.76 125.04 1uf7 s ALA 233 Ca 0.01 -1.49 0.05 0.00 0.00 0.00 0.00 51.96 50.54 1uf7 s ALA 233 Cb -0.13 -2.18 -0.03 0.00 0.00 0.00 0.00 23.12 20.78 1uf7 s ALA 233 CO -0.07 -0.98 0.36 0.20 0.00 0.00 0.00 175.76 175.27 1uf7 s GLY 234 N 1.49 1.29 -0.31 0.00 0.00 -1.26 -0.68 107.32 107.84 1uf7 s GLY 234 Ca 0.02 -1.29 -0.07 0.00 0.00 0.00 0.00 44.72 43.39 1uf7 s GLY 234 CO 0.03 -1.29 0.09 1.25 0.00 0.00 0.00 173.10 173.18 1uf7 s LYS 235 N -3.99 2.88 0.51 2.90 2.20 -0.50 -1.81 119.74 121.92 1uf7 s LYS 235 Ca 0.36 -1.00 0.03 0.00 -0.36 0.00 0.00 55.97 54.99 1uf7 s LYS 235 Cb -0.09 -3.41 -0.00 0.00 -1.51 0.00 0.00 37.83 32.82 1uf7 s LYS 235 CO 0.29 -0.54 0.13 0.00 -0.36 0.00 0.00 175.35 174.87 1uf7 s ALA 236 N 1.46 4.16 0.00 3.13 0.00 0.38 -4.55 121.76 126.34 1uf7 s ALA 236 Ca 0.01 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.17 1uf7 s ALA 236 Cb -0.18 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.72 1uf7 s ALA 236 CO 0.03 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.04 1uf7 n GLY 237 N -1.41 -4.36 3.53 0.00 0.00 -0.88 -1.98 105.19 100.09 1uf7 n GLY 237 Ca -0.12 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.36 1uf7 n GLY 237 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1uf7 s MET 238 N -0.99 3.40 -0.31 1.61 -2.45 -1.26 -0.52 119.30 118.78 1uf7 s MET 238 Ca 0.00 -0.91 -0.10 0.00 -1.25 0.00 0.00 55.69 53.43 1uf7 s MET 238 Cb 0.00 -4.78 -0.01 0.00 1.25 0.00 0.00 34.83 31.29 1uf7 s MET 238 CO 0.00 -2.07 0.17 -2.00 1.05 0.00 0.00 175.02 172.17 1uf7 s GLU 239 N 4.75 3.43 -1.50 4.11 2.12 -0.41 -4.48 118.70 126.72 1uf7 s GLU 239 Ca 0.37 -0.66 -0.09 0.00 0.36 0.00 0.00 54.97 54.95 1uf7 s GLU 239 Cb -0.05 -3.62 0.06 0.00 0.26 0.00 0.00 34.13 30.78 1uf7 s GLU 239 CO 0.00 -0.40 0.73 0.39 -0.54 0.00 0.00 175.26 175.45 1uf7 n GLU 240 N 5.02 -4.27 -1.11 4.30 -0.58 -1.26 -1.28 120.64 121.45 1uf7 n GLU 240 Ca -0.14 0.50 -0.04 0.00 -0.42 0.00 0.00 57.16 57.06 1uf7 n GLU 240 Cb 0.50 -5.08 -0.02 0.00 -0.57 0.00 0.00 31.44 26.27 1uf7 n GLU 240 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1uf7 n ASN 241 N -2.88 -3.99 -4.02 1.62 3.02 -1.26 -5.01 115.26 102.74 1uf7 n ASN 241 Ca -0.11 0.09 -0.31 0.00 -0.03 0.00 0.00 54.58 54.23 1uf7 n ASN 241 Cb 0.59 -1.83 -0.16 0.00 -0.61 0.00 0.00 39.78 37.77 1uf7 n ASN 241 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uf7 s MET 243 N 1.44 4.28 -0.00 0.00 1.75 -1.26 -1.29 119.30 124.22 1uf7 s MET 243 Ca 0.03 1.71 0.00 0.00 -1.25 0.00 0.00 55.69 56.18 1uf7 s MET 243 Cb -0.14 -3.67 -0.04 0.00 2.84 0.00 0.00 34.83 33.83 1uf7 s MET 243 CO -0.10 -0.59 0.06 -0.51 -0.65 0.00 0.00 175.02 173.22 1uf7 s LEU 244 N 2.89 3.78 0.34 4.11 1.43 0.32 -1.58 118.68 129.97 1uf7 s LEU 244 Ca 0.57 0.10 -0.28 0.00 -1.03 0.00 0.00 54.13 53.48 1uf7 s LEU 244 Cb -0.24 -2.19 -0.10 0.00 0.03 0.00 0.00 46.19 43.69 1uf7 s LEU 244 CO 0.19 0.28 1.31 -0.22 0.23 0.00 0.00 176.35 178.14 1uf7 s LEU 245 N -1.67 4.41 0.00 1.79 2.96 0.94 -2.07 118.68 125.03 1uf7 s LEU 245 Ca 0.22 2.70 0.00 0.00 -0.22 0.00 0.00 54.13 56.83 1uf7 s LEU 245 Cb -0.12 -3.67 0.00 0.00 0.50 0.00 0.00 46.19 42.90 1uf7 s LEU 245 CO 0.13 -0.57 0.00 0.61 -1.32 0.00 0.00 176.35 175.20 1uf7 n GLY 246 N 0.77 0.54 3.80 7.98 0.00 -1.26 -4.09 105.19 112.93 1uf7 n GLY 246 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1uf7 n GLY 246 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1uf7 n HIS 247 N 0.00 -2.06 -1.80 1.61 -0.00 -1.26 -4.84 115.22 106.87 1uf7 n HIS 247 Ca 0.00 0.86 -0.35 0.00 -0.00 0.00 0.00 57.72 58.24 1uf7 n HIS 247 Cb 0.00 -4.20 0.05 0.00 -0.00 0.00 0.00 29.99 25.84 1uf7 n HIS 247 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 1uf7 s SER 248 N -3.95 4.92 0.14 0.41 0.01 -1.26 -4.79 113.70 109.19 1uf7 s SER 248 Ca 0.27 2.27 -0.17 0.00 1.31 0.00 0.00 55.95 59.63 1uf7 s SER 248 Cb -0.13 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.55 1uf7 s SER 248 CO 0.82 -1.77 0.44 0.00 0.41 0.00 0.00 173.24 173.14 1uf7 s ILE 250 N -3.81 1.71 -0.02 0.00 1.01 -0.58 -0.84 121.20 118.67 1uf7 s ILE 250 Ca 0.04 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 59.88 1uf7 s ILE 250 Cb 0.01 -1.48 -0.01 0.00 0.01 0.00 0.00 42.46 41.00 1uf7 s ILE 250 CO -0.10 0.48 -0.15 -0.69 0.00 0.00 0.00 174.94 174.48 1uf7 s VAL 251 N 0.14 1.18 0.70 2.92 1.01 0.13 -1.40 120.40 125.07 1uf7 s VAL 251 Ca -0.09 -0.63 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 1uf7 s VAL 251 Cb -0.14 -0.99 0.01 0.00 0.00 0.00 0.00 36.38 35.26 1uf7 s VAL 251 CO 0.04 0.34 1.07 0.00 0.00 0.00 0.00 175.10 176.55 1uf7 s ALA 252 N -0.28 2.79 -1.11 5.51 0.00 0.52 -0.55 121.76 128.64 1uf7 s ALA 252 Ca 0.04 -0.17 0.05 0.00 0.00 0.00 0.00 51.96 51.89 1uf7 s ALA 252 Cb -0.06 -3.08 0.25 0.00 0.00 0.00 0.00 23.12 20.22 1uf7 s ALA 252 CO -0.00 -1.14 1.14 -0.35 0.00 0.00 0.00 175.76 175.40 1uf7 n PRO 253 N -3.04 0.02 0.00 0.00 -0.04 -1.24 -0.32 135.00 130.38 1uf7 n PRO 253 Ca 0.07 0.36 0.12 0.00 -0.04 0.00 0.00 63.50 64.01 1uf7 n PRO 253 Cb 0.55 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.83 1uf7 n PRO 253 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1uf7 n THR 254 N -1.45 0.00 -0.18 0.52 -2.24 -1.26 -3.39 114.28 106.28 1uf7 n THR 254 Ca 0.02 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1uf7 n THR 254 Cb 0.06 0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.54 1uf7 n THR 254 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uf7 n GLY 255 N 1.44 0.75 3.72 3.38 0.00 0.57 -4.53 105.19 110.52 1uf7 n GLY 255 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1uf7 n GLY 255 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uf7 s GLU 256 N -0.70 4.47 -0.25 1.61 2.02 -1.25 -4.60 118.70 120.00 1uf7 s GLU 256 Ca 0.00 1.77 -0.29 0.00 0.02 0.00 0.00 54.97 56.47 1uf7 s GLU 256 Cb 0.00 -3.32 0.01 0.00 0.10 0.00 0.00 34.13 30.92 1uf7 s GLU 256 CO 0.00 -0.17 1.07 0.42 0.02 0.00 0.00 175.26 176.59 1uf7 s ILE 257 N 0.69 4.60 -0.49 -1.63 1.01 -1.26 -0.35 121.20 123.77 1uf7 s ILE 257 Ca 0.56 1.91 0.22 0.00 0.00 0.00 0.00 60.65 63.34 1uf7 s ILE 257 Cb -0.30 -4.32 -0.27 0.00 0.01 0.00 0.00 42.46 37.59 1uf7 s ILE 257 CO 0.31 -0.26 0.72 1.33 0.00 0.00 0.00 174.94 177.03 1uf7 n VAL 258 N 5.49 0.03 -3.70 2.92 0.24 -0.50 -4.95 118.33 117.86 1uf7 n VAL 258 Ca 0.12 -0.27 -0.13 0.00 -2.04 0.00 0.00 64.34 62.02 1uf7 n VAL 258 Cb 0.46 0.42 -0.09 0.00 -1.47 0.00 0.00 33.84 33.16 1uf7 n VAL 258 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1uf7 s ALA 259 N -3.27 -1.26 -0.11 2.33 0.00 -1.13 -4.98 121.76 113.34 1uf7 s ALA 259 Ca -0.00 1.47 -0.08 0.00 0.00 0.00 0.00 51.96 53.35 1uf7 s ALA 259 Cb 0.15 -0.86 0.03 0.00 0.00 0.00 0.00 23.12 22.44 1uf7 s ALA 259 CO 0.88 -0.25 0.27 -1.17 0.00 0.00 0.00 175.76 175.49 1uf7 s LEU 260 N 0.39 0.73 0.49 0.00 2.96 -1.26 -1.53 118.68 120.46 1uf7 s LEU 260 Ca -0.01 0.55 -0.17 0.00 -0.22 0.00 0.00 54.13 54.28 1uf7 s LEU 260 Cb -0.04 0.87 -0.08 0.00 0.50 0.00 0.00 46.19 47.44 1uf7 s LEU 260 CO -0.01 -0.12 0.96 0.42 -1.32 0.00 0.00 176.35 176.28 1uf7 s THR 261 N 0.59 4.53 0.00 3.68 -4.23 -0.75 -4.98 115.64 114.48 1uf7 s THR 261 Ca -0.04 1.22 0.00 0.00 -1.18 0.00 0.00 61.69 61.69 1uf7 s THR 261 Cb -0.05 -3.70 0.00 0.00 1.34 0.00 0.00 72.50 70.09 1uf7 s THR 261 CO -0.03 -0.61 0.09 0.35 -0.54 0.00 0.00 174.62 173.88 1uf7 n THR 262 N -1.38 0.00 -3.34 3.99 -2.24 -1.26 -4.17 114.28 105.88 1uf7 n THR 262 Ca 0.06 -0.45 -0.19 0.00 -2.27 0.00 0.00 64.05 61.20 1uf7 n THR 262 Cb 0.54 1.02 0.04 0.00 -2.10 0.00 0.00 70.33 69.83 1uf7 n THR 262 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1uf7 n THR 263 N -0.73 0.00 -1.70 4.28 -2.24 -1.26 -5.00 114.28 107.63 1uf7 n THR 263 Ca 0.00 -1.78 0.06 0.00 -2.27 0.00 0.00 64.05 60.06 1uf7 n THR 263 Cb 0.00 -0.39 0.17 0.00 -2.10 0.00 0.00 70.33 68.02 1uf7 n THR 263 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1uf7 n LEU 264 N 0.00 2.40 0.00 3.22 4.77 -1.26 -4.62 117.00 121.51 1uf7 n LEU 264 Ca 0.08 -3.53 -0.15 0.00 -0.03 0.00 0.00 56.01 52.38 1uf7 n LEU 264 Cb 0.53 -0.44 -0.04 0.00 -2.33 0.00 0.00 43.42 41.15 1uf7 n LEU 264 CO 0.33 1.21 -0.11 -0.62 -1.33 0.00 0.00 177.39 176.88 1uf7 n GLU 265 N -0.89 1.07 -1.70 3.23 1.02 -1.26 -3.79 120.64 118.32 1uf7 n GLU 265 Ca 0.17 -1.89 -0.43 0.00 -0.02 0.00 0.00 57.16 54.98 1uf7 n GLU 265 Cb 0.75 0.74 -0.03 0.00 -0.02 0.00 0.00 31.44 32.88 1uf7 n GLU 265 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1uf7 n ASP 266 N -1.45 3.81 -3.69 1.62 8.00 -1.26 -3.89 116.55 119.69 1uf7 n ASP 266 Ca -0.07 1.04 -0.11 0.00 0.71 0.00 0.00 54.79 56.36 1uf7 n ASP 266 Cb 0.33 -1.53 -0.10 0.00 -0.02 0.00 0.00 41.12 39.80 1uf7 n ASP 266 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1uf7 s GLU 267 N 1.66 0.48 -0.12 -1.24 2.12 -0.05 -4.90 118.70 116.63 1uf7 s GLU 267 Ca 0.78 0.81 -0.03 0.00 0.36 0.00 0.00 54.97 56.89 1uf7 s GLU 267 Cb -0.54 0.07 -0.03 0.00 0.26 0.00 0.00 34.13 33.89 1uf7 s GLU 267 CO 0.35 -0.13 0.00 0.08 -0.54 0.00 0.00 175.26 175.02 1uf7 s VAL 268 N 1.13 4.29 0.07 3.70 1.01 -1.26 -0.32 120.40 129.01 1uf7 s VAL 268 Ca -0.07 -0.24 0.05 0.00 0.00 0.00 0.00 61.98 61.72 1uf7 s VAL 268 Cb -0.07 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 1uf7 s VAL 268 CO -0.10 0.54 -0.13 0.27 0.00 0.00 0.00 175.10 175.68 1uf7 s ILE 269 N -0.28 1.03 0.07 2.22 -4.36 -0.79 -4.98 121.20 114.12 1uf7 s ILE 269 Ca 0.06 -1.27 0.01 0.00 -0.26 0.00 0.00 60.65 59.19 1uf7 s ILE 269 Cb -0.12 -1.01 -0.04 0.00 1.25 0.00 0.00 42.46 42.54 1uf7 s ILE 269 CO 0.02 -0.24 -0.05 0.42 0.24 0.00 0.00 174.94 175.33 1uf7 s THR 270 N -1.27 0.47 -0.18 8.37 -4.23 -1.26 -0.88 115.64 116.65 1uf7 s THR 270 Ca -0.03 -1.70 -0.16 0.00 -1.18 0.00 0.00 61.69 58.62 1uf7 s THR 270 Cb -0.10 -1.38 0.05 0.00 1.34 0.00 0.00 72.50 72.41 1uf7 s THR 270 CO 0.02 -0.82 0.47 0.00 -0.54 0.00 0.00 174.62 173.74 1uf7 s ALA 271 N -3.26 -1.16 0.17 3.99 0.00 -0.36 -4.88 121.76 116.26 1uf7 s ALA 271 Ca 0.05 1.37 -0.30 0.00 0.00 0.00 0.00 51.96 53.08 1uf7 s ALA 271 Cb 0.03 -0.80 -0.08 0.00 0.00 0.00 0.00 23.12 22.27 1uf7 s ALA 271 CO -0.06 -0.23 1.30 0.00 0.00 0.00 0.00 175.76 176.78 1uf7 s ALA 272 N 0.40 3.52 -0.13 0.00 0.00 -1.26 -1.79 121.76 122.50 1uf7 s ALA 272 Ca -0.01 1.07 0.02 0.00 0.00 0.00 0.00 51.96 53.04 1uf7 s ALA 272 Cb -0.04 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.61 1uf7 s ALA 272 CO -0.01 -0.52 -0.19 0.08 0.00 0.00 0.00 175.76 175.12 1uf7 s VAL 273 N 0.36 1.79 -0.34 0.00 1.01 0.73 -4.92 120.40 119.03 1uf7 s VAL 273 Ca 0.58 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.68 1uf7 s VAL 273 Cb -0.36 -1.61 0.04 0.00 0.00 0.00 0.00 36.38 34.46 1uf7 s VAL 273 CO 0.36 0.50 0.11 -0.62 0.00 0.00 0.00 175.10 175.45 1uf7 s ASP 274 N 0.94 5.34 0.60 3.32 -1.08 -1.26 -1.26 116.67 123.28 1uf7 s ASP 274 Ca -0.06 -1.14 0.32 0.00 -0.52 0.00 0.00 52.55 51.15 1uf7 s ASP 274 Cb -0.15 -1.88 1.93 0.00 -1.46 0.00 0.00 42.92 41.37 1uf7 s ASP 274 CO -0.03 -0.33 2.28 -0.07 0.52 0.00 0.00 175.17 177.54 1uf7 h LEU 275 N 8.23 0.00 -0.20 -1.34 3.38 -0.78 -1.18 115.31 123.42 1uf7 h LEU 275 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1uf7 h LEU 275 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1uf7 h LEU 275 CO 0.61 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.61 1uf7 n ASP 276 N -3.71 0.62 0.01 -0.43 8.00 -1.26 -3.21 116.55 116.57 1uf7 n ASP 276 Ca -0.03 0.59 0.10 0.00 0.71 0.00 0.00 54.79 56.15 1uf7 n ASP 276 Cb 0.08 -0.74 0.52 0.00 -0.02 0.00 0.00 41.12 40.96 1uf7 n ASP 276 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1uf7 h ARG 277 N 0.00 0.33 -0.95 -1.24 9.65 -1.59 -1.39 114.38 119.20 1uf7 h ARG 277 Ca 0.00 -0.02 0.24 0.00 -1.10 0.00 0.00 59.98 59.10 1uf7 h ARG 277 Cb 0.57 -0.08 -0.07 0.00 -1.39 0.00 0.00 29.97 29.01 1uf7 h ARG 277 CO 0.00 0.22 0.64 0.00 2.80 0.00 0.00 179.97 183.63 1uf7 h ARG 279 N 0.30 0.13 -0.35 0.00 3.08 -1.50 -1.44 114.38 114.60 1uf7 h ARG 279 Ca 0.50 -0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.64 1uf7 h ARG 279 Cb 1.42 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.43 1uf7 h ARG 279 CO -0.16 0.09 0.30 0.93 -1.07 0.00 0.00 179.97 180.06 1uf7 h GLU 280 N 0.14 0.00 0.00 0.04 5.08 -1.35 -1.34 114.58 117.15 1uf7 h GLU 280 Ca 0.17 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.28 1uf7 h GLU 280 Cb 0.49 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 1uf7 h GLU 280 CO -0.02 0.00 -1.74 1.28 -1.00 0.00 0.00 179.01 177.53 1uf7 n LEU 281 N -4.08 1.62 0.00 1.33 7.99 -0.76 -4.43 117.00 118.67 1uf7 n LEU 281 Ca 0.06 0.28 0.05 0.00 -0.01 0.00 0.00 56.01 56.38 1uf7 n LEU 281 Cb 0.47 -0.65 0.22 0.00 -0.11 0.00 0.00 43.42 43.35 1uf7 n LEU 281 CO 0.32 0.17 0.66 0.54 -1.51 0.00 0.00 177.39 177.57 1uf7 n ARG 282 N -4.08 0.00 -0.03 3.23 5.12 -0.62 -0.69 116.66 119.60 1uf7 n ARG 282 Ca -0.32 0.33 0.04 0.00 -1.93 0.00 0.00 57.85 55.97 1uf7 n ARG 282 Cb 0.67 -1.50 0.06 0.00 -1.16 0.00 0.00 32.46 30.52 1uf7 n ARG 282 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1uf7 n GLU 283 N -1.51 0.87 0.00 5.56 1.02 -0.51 -3.82 120.64 122.25 1uf7 n GLU 283 Ca 0.02 -1.24 0.00 0.00 -0.02 0.00 0.00 57.16 55.92 1uf7 n GLU 283 Cb 0.12 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 1uf7 n GLU 283 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1uf7 n HIS 284 N 0.44 0.00 -0.25 -0.32 8.25 -0.79 -4.74 115.22 117.81 1uf7 n HIS 284 Ca 0.06 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.66 1uf7 n HIS 284 Cb 0.26 0.00 0.42 0.00 1.12 0.00 0.00 29.99 31.79 1uf7 n HIS 284 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 1uf7 h ILE 285 N 0.00 0.80 -1.15 1.59 2.10 -1.79 -1.31 117.51 117.75 1uf7 h ILE 285 Ca 0.00 -0.21 -0.62 0.00 1.08 0.00 0.00 64.86 65.11 1uf7 h ILE 285 Cb 0.00 0.14 -0.38 0.00 -1.09 0.00 0.00 36.82 35.49 1uf7 h ILE 285 CO 0.00 0.11 -0.17 0.49 -1.08 0.00 0.00 178.15 177.50 1uf7 n PHE 286 N -4.55 3.05 -2.42 2.19 0.99 0.14 -4.93 117.46 111.93 1uf7 n PHE 286 Ca 0.17 -2.63 -0.39 0.00 -0.00 0.00 0.00 57.45 54.61 1uf7 n PHE 286 Cb 0.51 -0.64 -0.03 0.00 -1.00 0.00 0.00 39.48 38.32 1uf7 n PHE 286 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.76 177.97 1uf7 s ASN 287 N -2.86 6.03 0.16 4.37 3.84 -0.50 -4.20 114.94 121.79 1uf7 s ASN 287 Ca 0.54 -0.73 -0.27 0.00 0.21 0.00 0.00 52.86 52.61 1uf7 s ASN 287 Cb 0.43 -2.56 0.01 0.00 -0.55 0.00 0.00 41.25 38.58 1uf7 s ASN 287 CO -0.09 -1.91 1.57 -0.26 -2.79 0.00 0.00 177.10 173.62 1uf7 h PHE 288 N 10.78 -1.31 -0.74 0.43 0.05 -1.90 -1.44 116.94 122.81 1uf7 h PHE 288 Ca -0.06 0.08 0.03 0.00 3.82 0.00 0.00 57.97 61.84 1uf7 h PHE 288 Cb 1.05 0.65 -0.04 0.00 2.00 0.00 0.00 35.95 39.60 1uf7 h PHE 288 CO 1.18 -0.44 0.49 0.87 -0.18 0.00 0.00 178.31 180.24 1uf7 h LYS 289 N -0.28 0.88 0.00 1.51 6.56 -1.92 -0.90 116.57 122.43 1uf7 h LYS 289 Ca 0.15 -0.05 -0.19 0.00 -1.06 0.00 0.00 60.65 59.50 1uf7 h LYS 289 Cb 0.57 -0.20 -0.03 0.00 -0.57 0.00 0.00 32.23 32.01 1uf7 h LYS 289 CO -0.64 0.59 -0.90 0.37 -2.06 0.00 0.00 179.45 176.80 1uf7 h GLN 290 N 0.91 0.00 0.00 3.15 4.15 -1.82 -3.41 115.11 118.10 1uf7 h GLN 290 Ca 0.29 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.57 1uf7 h GLN 290 Cb 0.04 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 1uf7 h GLN 290 CO -0.08 0.90 -1.53 0.72 -1.93 0.00 0.00 178.83 176.90 1uf7 n HIS 291 N -3.46 0.00 -1.91 3.99 8.25 -0.60 -5.05 115.22 116.44 1uf7 n HIS 291 Ca -0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.10 1uf7 n HIS 291 Cb 0.86 -0.38 0.04 0.00 1.12 0.00 0.00 29.99 31.63 1uf7 n HIS 291 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1uf7 s ARG 292 N -2.19 2.84 -0.49 -0.41 0.52 -0.36 -4.99 118.95 113.88 1uf7 s ARG 292 Ca -0.06 1.80 0.08 0.00 -0.52 0.00 0.00 55.73 57.03 1uf7 s ARG 292 Cb 0.02 -1.91 0.31 0.00 0.52 0.00 0.00 34.95 33.89 1uf7 s ARG 292 CO 0.30 -1.30 0.75 1.04 0.02 0.00 0.00 175.30 176.11 1uf7 n GLN 293 N -1.80 1.87 0.12 3.54 1.13 -1.26 -4.96 117.38 116.03 1uf7 n GLN 293 Ca 0.13 -4.03 0.17 0.00 -1.94 0.00 0.00 57.00 51.34 1uf7 n GLN 293 Cb 0.50 -1.86 0.52 0.00 0.11 0.00 0.00 30.24 29.50 1uf7 n GLN 293 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1uf7 h PRO 294 N 3.44 0.00 0.00 -1.09 0.13 -1.97 -0.46 132.00 132.06 1uf7 h PRO 294 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1uf7 h PRO 294 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1uf7 h PRO 294 CO 0.65 0.00 0.00 -0.56 -0.23 0.00 0.00 178.00 177.86 1uf7 h GLN 295 N 0.00 0.00 -0.30 0.86 -0.00 -2.04 -1.62 115.11 112.00 1uf7 h GLN 295 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.84 1uf7 h GLN 295 Cb 1.70 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.18 1uf7 h GLN 295 CO -0.00 0.00 0.00 0.72 -0.00 0.00 0.00 178.83 179.55 1uf7 n HIS 296 N -2.33 0.39 0.68 0.06 8.25 -0.18 -4.42 115.22 117.68 1uf7 n HIS 296 Ca -0.00 -0.34 0.10 0.00 -0.26 0.00 0.00 57.72 57.21 1uf7 n HIS 296 Cb 0.13 -0.01 0.10 0.00 1.12 0.00 0.00 29.99 31.32 1uf7 n HIS 296 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1uf7 n TYR 297 N 0.77 0.09 -0.34 4.41 4.01 -0.61 -4.68 117.16 120.81 1uf7 n TYR 297 Ca 0.12 -0.06 0.25 0.00 -0.16 0.00 0.00 57.90 58.05 1uf7 n TYR 297 Cb 0.43 -0.00 0.49 0.00 -0.31 0.00 0.00 39.34 39.95 1uf7 n TYR 297 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1uf7 h GLY 298 N 3.80 1.94 1.32 2.72 0.00 -1.77 -0.50 103.07 110.58 1uf7 h GLY 298 Ca 0.00 -0.23 0.09 0.00 0.00 0.00 0.00 47.33 47.20 1uf7 h GLY 298 CO 0.00 -0.45 0.25 -2.00 0.00 0.00 0.00 176.54 174.34 1uf7 h LEU 299 N 0.32 0.00 -1.44 3.11 5.85 -1.95 -1.43 115.31 119.77 1uf7 h LEU 299 Ca 0.73 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 59.39 1uf7 h LEU 299 Cb 1.72 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.75 1uf7 h LEU 299 CO -0.56 0.00 -0.28 0.40 -0.34 0.00 0.00 178.44 177.66 1uf7 h ILE 300 N 0.00 1.20 -0.02 4.05 2.04 -1.46 -2.80 117.51 120.52 1uf7 h ILE 300 Ca 0.16 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 65.06 1uf7 h ILE 300 Cb 0.65 1.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1uf7 h ILE 300 CO -0.00 0.27 -0.16 0.00 0.00 0.00 0.00 178.15 178.26 1uf7 n ALA 301 N -2.49 2.86 -1.95 1.87 0.00 -0.55 -4.94 120.51 115.30 1uf7 n ALA 301 Ca -0.02 -0.59 -0.41 0.00 0.00 0.00 0.00 53.44 52.42 1uf7 n ALA 301 Cb 0.33 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 1uf7 n ALA 301 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1uf7 s GLU 302 N -2.20 4.35 0.00 0.00 2.02 -1.06 -5.15 118.70 116.66 1uf7 s GLU 302 Ca 0.27 2.14 0.31 0.00 0.02 0.00 0.00 54.97 57.71 1uf7 s GLU 302 Cb 0.20 -3.16 1.85 0.00 0.10 0.00 0.00 34.13 33.11 1uf7 s GLU 302 CO 0.41 -0.30 2.18 1.28 0.02 0.00 0.00 175.26 178.84