#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g18 s ARG 5 N 0.00 3.88 0.38 -0.14 3.00 -1.26 -5.01 118.95 119.80 3g18 s ARG 5 Ca 0.00 -0.10 0.08 0.00 0.00 0.00 0.00 55.73 55.71 3g18 s ARG 5 Cb 0.00 -3.31 0.77 0.00 0.00 0.00 0.00 34.95 32.40 3g18 s ARG 5 CO 0.00 0.51 1.94 0.28 0.00 0.00 0.00 175.30 178.04 3g18 h VAL 6 N 4.32 1.16 -0.00 3.52 2.07 -1.99 -3.03 116.25 122.31 3g18 h VAL 6 Ca -0.47 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.42 3g18 h VAL 6 Cb 1.19 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 3g18 h VAL 6 CO 0.68 0.21 -0.00 -0.90 0.02 0.00 0.00 177.57 177.57 3g18 n ASP 7 N -4.33 0.21 -4.51 0.57 5.75 -1.26 -4.83 116.55 108.15 3g18 n ASP 7 Ca 0.01 -1.01 -0.24 0.00 -0.01 0.00 0.00 54.79 53.54 3g18 n ASP 7 Cb 0.21 -0.02 -0.09 0.00 -1.03 0.00 0.00 41.12 40.19 3g18 n ASP 7 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3g18 s VAL 8 N -2.04 2.71 0.39 2.12 -7.23 -1.15 -5.10 120.40 110.09 3g18 s VAL 8 Ca 0.45 -2.28 -0.27 0.00 -1.81 0.00 0.00 61.98 58.07 3g18 s VAL 8 Cb 0.22 -2.42 -0.11 0.00 0.56 0.00 0.00 36.38 34.62 3g18 s VAL 8 CO 0.37 -0.39 1.28 1.15 -0.31 0.00 0.00 175.10 177.21 3g18 n MET 9 N -0.66 2.04 -3.46 4.82 0.00 -1.26 -4.87 117.12 113.72 3g18 n MET 9 Ca -0.05 0.72 -0.40 0.00 0.00 0.00 0.00 57.70 57.96 3g18 n MET 9 Cb 0.60 -2.37 -0.10 0.00 0.00 0.00 0.00 33.22 31.35 3g18 n MET 9 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 3g18 s ASP 10 N -0.42 6.12 -0.28 3.17 3.68 -1.26 -5.01 116.67 122.67 3g18 s ASP 10 Ca 0.58 -0.30 -0.11 0.00 2.13 0.00 0.00 52.55 54.86 3g18 s ASP 10 Cb -0.53 -2.17 -0.04 0.00 -1.45 0.00 0.00 42.92 38.73 3g18 s ASP 10 CO 0.60 -0.28 0.18 -0.69 0.13 0.00 0.00 175.17 175.11 3g18 s VAL 11 N 1.88 5.14 0.19 1.11 1.01 -1.26 -5.02 120.40 123.45 3g18 s VAL 11 Ca 0.09 0.05 -0.32 0.00 0.00 0.00 0.00 61.98 61.80 3g18 s VAL 11 Cb -0.17 -3.47 -0.12 0.00 0.00 0.00 0.00 36.38 32.62 3g18 s VAL 11 CO 0.11 0.22 1.71 0.80 0.00 0.00 0.00 175.10 177.94 3g18 n MET 12 N 5.04 2.64 -1.09 2.72 1.56 -1.26 -1.76 117.12 124.98 3g18 n MET 12 Ca -0.14 0.95 -0.03 0.00 -0.27 0.00 0.00 57.70 58.21 3g18 n MET 12 Cb 0.52 -2.79 -0.01 0.00 2.15 0.00 0.00 33.22 33.09 3g18 n MET 12 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 3g18 n ASN 13 N 4.06 -5.73 -2.50 6.12 5.03 -1.26 -2.88 115.26 118.09 3g18 n ASN 13 Ca 0.17 0.07 -0.17 0.00 0.87 0.00 0.00 54.58 55.52 3g18 n ASN 13 Cb 0.34 -3.49 -0.00 0.00 -1.02 0.00 0.00 39.78 35.60 3g18 n ASN 13 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3g18 n ARG 14 N 0.25 -2.23 -3.91 3.52 1.74 -0.72 -4.96 116.66 110.35 3g18 n ARG 14 Ca -0.03 0.77 -0.28 0.00 -0.77 0.00 0.00 57.85 57.54 3g18 n ARG 14 Cb 0.49 -5.42 -0.17 0.00 -1.02 0.00 0.00 32.46 26.35 3g18 n ARG 14 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3g18 s LEU 15 N -5.88 1.52 -0.16 0.55 2.96 -1.14 -1.45 118.68 115.08 3g18 s LEU 15 Ca 0.04 -0.56 -0.06 0.00 -0.22 0.00 0.00 54.13 53.33 3g18 s LEU 15 Cb -0.02 -0.92 -0.04 0.00 0.50 0.00 0.00 46.19 45.71 3g18 s LEU 15 CO 0.04 -0.16 0.05 -0.63 -1.32 0.00 0.00 176.35 174.34 3g18 s ILE 16 N 1.64 4.71 -0.18 6.68 1.01 0.18 -4.63 121.20 130.61 3g18 s ILE 16 Ca 0.02 -0.07 -0.22 0.00 0.00 0.00 0.00 60.65 60.38 3g18 s ILE 16 Cb -0.14 -3.09 -0.02 0.00 0.01 0.00 0.00 42.46 39.21 3g18 s ILE 16 CO -0.08 0.50 0.67 -0.22 0.00 0.00 0.00 174.94 175.81 3g18 s LEU 17 N 0.03 4.17 -0.68 2.97 2.96 -0.86 -0.85 118.68 126.42 3g18 s LEU 17 Ca 0.05 0.92 -0.20 0.00 -0.22 0.00 0.00 54.13 54.68 3g18 s LEU 17 Cb -0.12 -2.96 0.10 0.00 0.50 0.00 0.00 46.19 43.70 3g18 s LEU 17 CO 0.01 -0.28 0.88 0.00 -1.32 0.00 0.00 176.35 175.64 3g18 s ALA 18 N 1.84 3.31 -1.08 5.97 0.00 0.19 -0.02 121.76 131.97 3g18 s ALA 18 Ca 0.31 -2.20 -0.18 0.00 0.00 0.00 0.00 51.96 49.89 3g18 s ALA 18 Cb -0.16 -3.74 0.11 0.00 0.00 0.00 0.00 23.12 19.33 3g18 s ALA 18 CO 0.11 -2.62 1.37 1.41 0.00 0.00 0.00 175.76 176.04 3g18 s MET 19 N 3.15 3.78 0.00 0.00 1.75 -0.37 -4.43 119.30 123.18 3g18 s MET 19 Ca 0.19 -1.87 0.21 0.00 -1.25 0.00 0.00 55.69 52.97 3g18 s MET 19 Cb -0.18 -5.15 0.57 0.00 2.84 0.00 0.00 34.83 32.91 3g18 s MET 19 CO 0.05 -1.94 1.46 -0.25 -0.65 0.00 0.00 175.02 173.68 3g18 n ASP 20 N 7.12 2.53 -4.77 1.11 8.00 -1.26 -4.39 116.55 124.89 3g18 n ASP 20 Ca 0.33 -1.87 -0.36 0.00 0.71 0.00 0.00 54.79 53.61 3g18 n ASP 20 Cb 0.47 -0.19 -0.00 0.00 -0.02 0.00 0.00 41.12 41.38 3g18 n ASP 20 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3g18 s LEU 21 N -1.46 3.81 0.00 0.64 1.43 -1.26 -4.76 118.68 117.07 3g18 s LEU 21 Ca 0.35 2.21 0.21 0.00 -1.03 0.00 0.00 54.13 55.86 3g18 s LEU 21 Cb 0.19 -4.51 0.04 0.00 0.03 0.00 0.00 46.19 41.95 3g18 s LEU 21 CO 0.28 -1.15 1.06 0.23 0.23 0.00 0.00 176.35 176.99 3g18 n MET 22 N -1.12 1.57 -3.86 1.70 2.81 -1.26 -4.20 117.12 112.75 3g18 n MET 22 Ca 0.11 -1.19 -0.35 0.00 -1.81 0.00 0.00 57.70 54.46 3g18 n MET 22 Cb 0.50 -1.41 -0.09 0.00 -0.71 0.00 0.00 33.22 31.51 3g18 n MET 22 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3g18 s ASN 23 N -2.13 5.89 0.18 7.83 2.47 -1.26 -4.62 114.94 123.31 3g18 s ASN 23 Ca 0.19 0.14 -0.13 0.00 0.42 0.00 0.00 52.86 53.48 3g18 s ASN 23 Cb 0.17 -2.03 0.10 0.00 -1.45 0.00 0.00 41.25 38.05 3g18 s ASN 23 CO 0.44 0.16 1.83 -0.09 -3.72 0.00 0.00 177.10 175.72 3g18 h ARG 24 N 6.80 0.67 -0.15 0.43 2.43 -1.94 -0.34 114.38 122.28 3g18 h ARG 24 Ca -0.39 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 58.78 3g18 h ARG 24 Cb 1.16 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.53 3g18 h ARG 24 CO 0.72 0.44 -0.05 -0.44 -1.51 0.00 0.00 179.97 179.13 3g18 h ASP 25 N 0.69 -0.18 -0.43 -3.80 3.45 -2.00 -0.79 116.42 113.36 3g18 h ASP 25 Ca 0.22 0.05 -0.11 0.00 0.43 0.00 0.00 57.03 57.61 3g18 h ASP 25 Cb -0.01 0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 38.86 3g18 h ASP 25 CO -0.08 -0.07 -0.17 0.44 -1.57 0.00 0.00 179.24 177.79 3g18 h ASP 26 N -0.03 0.90 -0.38 6.45 3.32 -1.95 -2.42 116.42 122.31 3g18 h ASP 26 Ca 0.08 -0.39 0.01 0.00 0.02 0.00 0.00 57.03 56.75 3g18 h ASP 26 Cb 0.14 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 3g18 h ASP 26 CO -0.17 1.09 0.23 0.00 -1.72 0.00 0.00 179.24 178.67 3g18 h ALA 27 N 0.84 0.48 -0.40 3.45 0.00 -0.78 -1.88 119.26 120.98 3g18 h ALA 27 Ca 0.10 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3g18 h ALA 27 Cb 0.73 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3g18 h ALA 27 CO 0.06 -0.10 -0.29 -0.07 0.00 0.00 0.00 179.25 178.85 3g18 h LEU 28 N 0.47 0.89 -0.10 0.00 3.38 -1.16 -2.40 115.31 116.39 3g18 h LEU 28 Ca 0.15 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 3g18 h LEU 28 Cb -0.02 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 3g18 h LEU 28 CO -0.06 1.11 0.06 -0.09 0.09 0.00 0.00 178.44 179.55 3g18 h ARG 29 N 0.73 0.13 -0.12 1.13 2.43 -1.21 -1.03 114.38 116.43 3g18 h ARG 29 Ca 0.08 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 3g18 h ARG 29 Cb 0.84 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.36 3g18 h ARG 29 CO 0.07 0.13 0.00 0.28 -1.51 0.00 0.00 179.97 178.94 3g18 h VAL 30 N 0.10 1.25 -0.28 0.20 2.07 -1.36 -2.63 116.25 115.60 3g18 h VAL 30 Ca 0.03 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.77 3g18 h VAL 30 Cb 0.03 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3g18 h VAL 30 CO -0.01 0.23 0.18 0.74 0.02 0.00 0.00 177.57 178.73 3g18 h THR 31 N -0.04 1.06 -0.52 2.57 2.02 -1.40 -2.50 112.91 114.10 3g18 h THR 31 Ca 0.04 -0.13 -0.00 0.00 0.77 0.00 0.00 66.41 67.09 3g18 h THR 31 Cb 0.35 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 3g18 h THR 31 CO 0.01 0.07 0.32 1.23 0.37 0.00 0.00 175.52 177.51 3g18 h GLY 32 N 0.37 0.74 2.00 2.16 0.00 -1.21 -2.13 103.07 105.01 3g18 h GLY 32 Ca 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.14 3g18 h GLY 32 CO -0.03 0.29 0.00 0.83 0.00 0.00 0.00 176.54 177.63 3g18 h GLU 33 N 0.71 0.00 -0.16 4.80 5.08 -1.06 -3.11 114.58 120.84 3g18 h GLU 33 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3g18 h GLU 33 Cb -0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.21 3g18 h GLU 33 CO -0.04 0.00 0.00 1.33 -1.00 0.00 0.00 179.01 179.30 3g18 n VAL 34 N -2.95 0.61 0.19 3.13 0.24 -0.85 -4.39 118.33 114.32 3g18 n VAL 34 Ca 0.01 -0.81 0.15 0.00 -2.04 0.00 0.00 64.34 61.66 3g18 n VAL 34 Cb 0.29 0.76 0.77 0.00 -1.47 0.00 0.00 33.84 34.19 3g18 n VAL 34 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3g18 h ARG 35 N 1.57 0.00 0.00 7.34 9.65 -1.36 0.32 114.38 131.90 3g18 h ARG 35 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3g18 h ARG 35 Cb 0.55 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.13 3g18 h ARG 35 CO 0.00 0.00 0.00 -0.85 2.80 0.00 0.00 179.97 181.92 3g18 n GLU 36 N -4.08 0.10 -0.01 0.20 0.28 -1.26 -3.64 120.64 112.22 3g18 n GLU 36 Ca 0.01 0.22 -0.01 0.00 -0.16 0.00 0.00 57.16 57.23 3g18 n GLU 36 Cb 0.29 -1.65 -0.02 0.00 1.43 0.00 0.00 31.44 31.50 3g18 n GLU 36 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3g18 n TYR 37 N -1.82 0.00 -4.97 -1.84 4.02 0.14 -5.03 117.16 107.66 3g18 n TYR 37 Ca 0.04 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.65 3g18 n TYR 37 Cb 0.28 -0.10 -0.17 0.00 -0.02 0.00 0.00 39.34 39.33 3g18 n TYR 37 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3g18 s ILE 38 N -2.05 1.67 -0.52 -0.72 1.01 0.90 -4.50 121.20 117.00 3g18 s ILE 38 Ca -0.01 -0.81 0.05 0.00 0.00 0.00 0.00 60.65 59.87 3g18 s ILE 38 Cb 0.01 -1.46 0.07 0.00 0.01 0.00 0.00 42.46 41.09 3g18 s ILE 38 CO 0.08 0.47 0.83 -0.90 0.00 0.00 0.00 174.94 175.42 3g18 n ASP 39 N 3.46 1.79 -3.90 3.58 5.75 -1.26 -4.18 116.55 121.79 3g18 n ASP 39 Ca -0.20 -1.51 -0.25 0.00 -0.01 0.00 0.00 54.79 52.82 3g18 n ASP 39 Cb 0.52 -0.04 -0.17 0.00 -1.03 0.00 0.00 41.12 40.41 3g18 n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3g18 s THR 40 N -0.63 0.88 -0.06 2.12 2.01 -1.26 0.50 115.64 119.19 3g18 s THR 40 Ca 0.07 -0.23 0.05 0.00 0.31 0.00 0.00 61.69 61.89 3g18 s THR 40 Cb 0.04 -0.91 -0.01 0.00 0.01 0.00 0.00 72.50 71.64 3g18 s THR 40 CO 0.06 0.33 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.42 3g18 s VAL 41 N 1.51 1.80 -0.24 3.82 1.01 0.04 -2.04 120.40 126.30 3g18 s VAL 41 Ca 0.00 -0.91 -0.10 0.00 0.00 0.00 0.00 61.98 60.97 3g18 s VAL 41 Cb -0.13 -1.54 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 3g18 s VAL 41 CO -0.05 0.50 0.15 -0.75 0.00 0.00 0.00 175.10 174.96 3g18 s LYS 42 N 0.03 4.03 -0.03 2.72 2.20 0.97 -1.19 119.74 128.47 3g18 s LYS 42 Ca -0.07 -0.29 0.06 0.00 -0.36 0.00 0.00 55.97 55.31 3g18 s LYS 42 Cb -0.14 -3.52 -0.02 0.00 -1.51 0.00 0.00 37.83 32.63 3g18 s LYS 42 CO 0.04 0.03 -0.21 0.42 -0.36 0.00 0.00 175.35 175.27 3g18 s ILE 43 N 1.14 2.48 0.25 5.43 -1.09 -0.35 -1.24 121.20 127.83 3g18 s ILE 43 Ca 0.07 -0.97 0.00 0.00 -2.23 0.00 0.00 60.65 57.52 3g18 s ILE 43 Cb -0.14 -1.92 0.00 0.00 -1.58 0.00 0.00 42.46 38.83 3g18 s ILE 43 CO 0.05 0.57 0.03 0.61 -1.23 0.00 0.00 174.94 174.97 3g18 n GLY 44 N 2.33 3.74 0.27 6.18 0.00 -1.26 -0.36 105.19 116.09 3g18 n GLY 44 Ca -0.16 -2.28 0.02 0.00 0.00 0.00 0.00 46.02 43.59 3g18 n GLY 44 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3g18 h TYR 45 N 1.04 0.44 -0.57 1.61 0.99 -1.97 -2.46 116.97 116.06 3g18 h TYR 45 Ca -0.20 -0.03 0.10 0.00 2.00 0.00 0.00 58.73 60.60 3g18 h TYR 45 Cb 0.63 -0.13 -0.08 0.00 1.00 0.00 0.00 36.73 38.14 3g18 h TYR 45 CO 0.00 0.41 0.11 -1.35 -0.00 0.00 0.00 178.16 177.33 3g18 h PRO 46 N 0.42 0.24 -0.01 4.88 0.11 -1.94 0.26 132.00 135.96 3g18 h PRO 46 Ca 0.10 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.14 3g18 h PRO 46 Cb 0.22 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.28 3g18 h PRO 46 CO 0.00 0.16 -0.20 1.25 -0.21 0.00 0.00 178.00 179.00 3g18 h LEU 47 N 0.24 0.19 -0.88 2.35 5.85 -1.70 -2.97 115.31 118.40 3g18 h LEU 47 Ca 0.29 -0.75 -0.02 0.00 0.84 0.00 0.00 57.88 58.25 3g18 h LEU 47 Cb 0.43 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 3g18 h LEU 47 CO -0.39 0.91 0.48 0.58 -0.34 0.00 0.00 178.44 179.69 3g18 h VAL 48 N -0.51 1.26 0.00 1.05 2.07 -1.21 0.26 116.25 119.17 3g18 h VAL 48 Ca -0.02 -0.64 -0.11 0.00 0.82 0.00 0.00 66.70 66.75 3g18 h VAL 48 Cb 0.94 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 3g18 h VAL 48 CO 0.04 0.29 -0.54 -0.07 0.02 0.00 0.00 177.57 177.31 3g18 h LEU 49 N 1.23 0.00 0.17 2.57 3.38 -0.61 0.28 115.31 122.33 3g18 h LEU 49 Ca 0.31 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.97 3g18 h LEU 49 Cb 0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.79 3g18 h LEU 49 CO -0.05 0.54 -1.42 0.28 0.09 0.00 0.00 178.44 177.88 3g18 h SER 50 N 0.00 0.55 -0.00 -0.43 0.02 -1.30 -3.39 113.55 109.00 3g18 h SER 50 Ca -0.01 -0.64 0.00 0.00 -0.84 0.00 0.00 61.79 60.30 3g18 h SER 50 Cb 1.12 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.48 3g18 h SER 50 CO 0.07 1.51 -0.24 -0.62 -1.14 0.00 0.00 176.83 176.41 3g18 n GLU 51 N -3.57 4.34 0.00 3.45 -0.58 0.05 -5.04 120.64 119.29 3g18 n GLU 51 Ca -0.14 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.48 3g18 n GLU 51 Cb 1.06 -0.83 0.00 0.00 -0.57 0.00 0.00 31.44 31.10 3g18 n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3g18 n GLY 52 N 1.04 2.26 0.29 0.62 0.00 1.00 -4.67 105.19 105.72 3g18 n GLY 52 Ca 0.02 -1.77 0.19 0.00 0.00 0.00 0.00 46.02 44.45 3g18 n GLY 52 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3g18 h MET 53 N 0.00 0.00 0.00 1.61 2.86 -1.94 -2.38 114.93 115.08 3g18 h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g18 h MET 53 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3g18 h MET 53 CO 0.00 0.00 0.00 -0.25 1.06 0.00 0.00 176.91 177.72 3g18 n ASP 54 N -3.00 0.56 0.26 1.22 8.00 -1.26 -1.73 116.55 120.60 3g18 n ASP 54 Ca -0.01 0.72 0.12 0.00 0.71 0.00 0.00 54.79 56.33 3g18 n ASP 54 Cb 0.21 -0.81 0.69 0.00 -0.02 0.00 0.00 41.12 41.19 3g18 n ASP 54 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 3g18 h ILE 55 N 0.00 0.63 -0.14 0.53 6.09 -1.70 -2.56 117.51 120.36 3g18 h ILE 55 Ca 0.00 -0.57 -0.03 0.00 -1.37 0.00 0.00 64.86 62.89 3g18 h ILE 55 Cb 0.12 1.36 -0.00 0.00 0.47 0.00 0.00 36.82 38.76 3g18 h ILE 55 CO 0.00 0.13 -0.02 0.40 -3.07 0.00 0.00 178.15 175.59 3g18 h ILE 56 N 0.00 1.27 -0.60 2.19 2.04 -1.58 -1.79 117.51 119.05 3g18 h ILE 56 Ca -0.00 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 3g18 h ILE 56 Cb 0.35 1.61 -0.03 0.00 -0.74 0.00 0.00 36.82 38.01 3g18 h ILE 56 CO 0.02 0.27 0.34 0.00 0.00 0.00 0.00 178.15 178.77 3g18 h ALA 57 N 0.72 1.47 -0.55 1.87 0.00 -1.56 -2.18 119.26 119.04 3g18 h ALA 57 Ca 0.04 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 3g18 h ALA 57 Cb 0.42 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3g18 h ALA 57 CO 0.01 0.45 0.06 1.49 0.00 0.00 0.00 179.25 181.26 3g18 h GLU 58 N 0.83 0.93 -0.80 0.00 4.81 -1.26 0.31 114.58 119.40 3g18 h GLU 58 Ca 0.21 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 3g18 h GLU 58 Cb 0.00 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.25 3g18 h GLU 58 CO -0.04 0.91 0.42 0.74 -0.73 0.00 0.00 179.01 180.31 3g18 h PHE 59 N 0.81 1.12 -0.17 0.92 -1.00 -0.83 0.69 116.94 118.47 3g18 h PHE 59 Ca 0.16 -0.04 -0.10 0.00 2.81 0.00 0.00 57.97 60.81 3g18 h PHE 59 Cb 0.45 -0.35 -0.00 0.00 3.61 0.00 0.00 35.95 39.66 3g18 h PHE 59 CO 0.03 0.79 -0.27 0.00 -1.61 0.00 0.00 178.31 177.26 3g18 h ARG 60 N 1.12 0.49 -0.15 1.51 3.08 -1.07 -0.51 114.38 118.84 3g18 h ARG 60 Ca 0.28 -0.29 -0.12 0.00 0.07 0.00 0.00 59.98 59.91 3g18 h ARG 60 Cb 0.06 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 3g18 h ARG 60 CO -0.04 0.89 -0.44 -0.22 -1.07 0.00 0.00 179.97 179.09 3g18 h LYS 61 N 0.13 0.36 0.07 0.04 3.64 -0.24 0.27 116.57 120.84 3g18 h LYS 61 Ca 0.02 -0.18 -0.32 0.00 -1.27 0.00 0.00 60.65 58.90 3g18 h LYS 61 Cb 0.85 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.64 3g18 h LYS 61 CO 0.06 0.73 -1.73 0.00 -2.27 0.00 0.00 179.45 176.24 3g18 h ARG 62 N 0.29 0.15 0.00 1.90 3.08 -0.91 -3.41 114.38 115.47 3g18 h ARG 62 Ca 0.02 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.82 3g18 h ARG 62 Cb 0.89 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.03 3g18 h ARG 62 CO 0.07 0.89 -0.49 1.19 -1.07 0.00 0.00 179.97 180.57 3g18 n PHE 63 N -3.30 0.00 -2.74 3.04 0.99 -0.21 -5.02 117.46 110.23 3g18 n PHE 63 Ca -0.21 0.00 -0.22 0.00 -0.00 0.00 0.00 57.45 57.03 3g18 n PHE 63 Cb 1.04 -0.02 0.02 0.00 -1.00 0.00 0.00 39.48 39.52 3g18 n PHE 63 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3g18 n GLY 64 N 1.53 -0.50 3.95 1.37 0.00 0.94 -4.98 105.19 107.50 3g18 n GLY 64 Ca 0.00 0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 3g18 n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g18 s ARG 66 N -4.39 4.49 -0.12 0.00 3.52 0.18 -4.60 118.95 118.02 3g18 s ARG 66 Ca 0.43 1.15 0.03 0.00 -0.13 0.00 0.00 55.73 57.20 3g18 s ARG 66 Cb -0.10 -2.96 0.01 0.00 -1.56 0.00 0.00 34.95 30.34 3g18 s ARG 66 CO 0.37 0.40 -0.21 0.42 -0.81 0.00 0.00 175.30 175.46 3g18 s ILE 67 N -1.45 1.97 -0.22 4.11 -1.09 -1.26 -0.78 121.20 122.47 3g18 s ILE 67 Ca 0.44 -0.94 -0.05 0.00 -2.23 0.00 0.00 60.65 57.87 3g18 s ILE 67 Cb -0.19 -1.74 -0.02 0.00 -1.58 0.00 0.00 42.46 38.93 3g18 s ILE 67 CO 0.24 0.53 0.01 -0.63 -1.23 0.00 0.00 174.94 173.86 3g18 s ILE 68 N 0.71 3.84 -0.46 2.92 1.01 -0.33 -1.09 121.20 127.80 3g18 s ILE 68 Ca -0.10 -0.34 -0.22 0.00 0.00 0.00 0.00 60.65 59.99 3g18 s ILE 68 Cb -0.16 -2.76 0.03 0.00 0.01 0.00 0.00 42.46 39.58 3g18 s ILE 68 CO 0.01 0.40 0.74 0.00 0.00 0.00 0.00 174.94 176.08 3g18 s ALA 69 N 1.38 3.30 -1.28 9.38 0.00 0.55 -1.21 121.76 133.89 3g18 s ALA 69 Ca 0.05 -1.19 -0.13 0.00 0.00 0.00 0.00 51.96 50.68 3g18 s ALA 69 Cb -0.15 -3.43 0.13 0.00 0.00 0.00 0.00 23.12 19.68 3g18 s ALA 69 CO 0.00 -1.94 1.72 -3.47 0.00 0.00 0.00 175.76 172.07 3g18 n ASP 70 N 6.59 4.96 -0.89 0.00 -0.08 0.52 -1.25 116.55 126.39 3g18 n ASP 70 Ca -0.00 -2.99 0.12 0.00 -1.51 0.00 0.00 54.79 50.41 3g18 n ASP 70 Cb 0.48 -1.59 0.09 0.00 2.34 0.00 0.00 41.12 42.44 3g18 n ASP 70 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3g18 n PHE 71 N 5.69 0.00 -4.01 -0.67 0.99 -1.25 -4.18 117.46 114.02 3g18 n PHE 71 Ca 0.42 0.00 -0.31 0.00 -0.00 0.00 0.00 57.45 57.56 3g18 n PHE 71 Cb 0.41 0.00 -0.04 0.00 -1.00 0.00 0.00 39.48 38.85 3g18 n PHE 71 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 3g18 n LYS 72 N 1.19 -0.71 -1.66 -1.08 5.02 -0.64 -4.71 118.16 115.57 3g18 n LYS 72 Ca 0.13 0.02 -0.51 0.00 -2.02 0.00 0.00 58.31 55.94 3g18 n LYS 72 Cb 0.57 -2.51 -0.06 0.00 -0.02 0.00 0.00 35.03 33.01 3g18 n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3g18 n VAL 73 N -4.12 0.19 -2.74 -0.18 0.31 -0.98 -4.39 118.33 106.43 3g18 n VAL 73 Ca -0.20 -0.03 -0.09 0.00 -0.01 0.00 0.00 64.34 64.00 3g18 n VAL 73 Cb 0.53 -1.31 0.06 0.00 -0.91 0.00 0.00 33.84 32.21 3g18 n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3g18 n ALA 74 N 4.24 2.12 -4.03 3.52 0.00 -1.26 -0.83 120.51 124.27 3g18 n ALA 74 Ca 0.21 -2.35 -0.02 0.00 0.00 0.00 0.00 53.44 51.28 3g18 n ALA 74 Cb 0.22 -0.98 -0.00 0.00 0.00 0.00 0.00 19.45 18.69 3g18 n ALA 74 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3g18 n ASP 75 N -0.19 2.06 -4.80 0.00 -0.08 -1.26 -4.97 116.55 107.32 3g18 n ASP 75 Ca 0.06 -1.14 -0.31 0.00 -1.51 0.00 0.00 54.79 51.90 3g18 n ASP 75 Cb 0.80 0.02 0.07 0.00 2.34 0.00 0.00 41.12 44.36 3g18 n ASP 75 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3g18 s ILE 76 N -1.08 3.65 0.19 5.18 -4.36 -1.26 -4.72 121.20 118.80 3g18 s ILE 76 Ca 0.00 0.54 -0.22 0.00 -0.26 0.00 0.00 60.65 60.71 3g18 s ILE 76 Cb -0.00 -3.17 0.12 0.00 1.25 0.00 0.00 42.46 40.65 3g18 s ILE 76 CO 0.00 -0.70 1.58 -0.65 0.24 0.00 0.00 174.94 175.41 3g18 h PRO 77 N -0.93 -0.15 -0.71 0.37 0.11 -1.87 -0.14 132.00 128.68 3g18 h PRO 77 Ca -0.44 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 3g18 h PRO 77 Cb 1.22 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 3g18 h PRO 77 CO 0.55 -0.10 0.39 1.05 -0.21 0.00 0.00 178.00 179.68 3g18 h GLU 78 N -0.15 0.98 -0.17 1.05 4.11 -1.95 -0.64 114.58 117.81 3g18 h GLU 78 Ca 0.23 -0.10 -0.21 0.00 0.07 0.00 0.00 59.36 59.35 3g18 h GLU 78 Cb 0.56 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.62 3g18 h GLU 78 CO -0.72 0.71 -0.73 1.15 0.07 0.00 0.00 179.01 179.49 3g18 h THR 79 N 0.99 1.29 -0.99 -1.06 2.02 -1.80 -2.73 112.91 110.63 3g18 h THR 79 Ca 0.25 -1.95 0.03 0.00 0.77 0.00 0.00 66.41 65.51 3g18 h THR 79 Cb 0.02 1.93 -0.06 0.00 -1.74 0.00 0.00 68.15 68.30 3g18 h THR 79 CO -0.04 0.62 0.65 0.78 0.37 0.00 0.00 175.52 177.90 3g18 h ASN 80 N 0.52 1.09 -0.45 4.18 4.21 -0.54 -0.22 115.58 124.37 3g18 h ASN 80 Ca -0.04 -0.02 -0.00 0.00 1.21 0.00 0.00 56.30 57.45 3g18 h ASN 80 Cb 1.34 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 38.26 3g18 h ASN 80 CO 0.15 0.76 0.27 -0.08 -1.29 0.00 0.00 177.43 177.23 3g18 h GLU 81 N 1.27 0.62 -0.59 0.81 4.81 -1.01 -0.95 114.58 119.54 3g18 h GLU 81 Ca 0.39 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.46 3g18 h GLU 81 Cb -0.03 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 3g18 h GLU 81 CO -0.11 0.47 0.01 0.87 -0.73 0.00 0.00 179.01 179.52 3g18 h LYS 82 N 0.60 1.03 -0.36 1.92 1.57 -1.08 -0.50 116.57 119.75 3g18 h LYS 82 Ca 0.16 -0.32 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 3g18 h LYS 82 Cb 0.01 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 3g18 h LYS 82 CO -0.03 1.01 0.15 0.82 -0.57 0.00 0.00 179.45 180.83 3g18 h ILE 83 N 0.93 1.18 -0.46 1.86 2.04 -0.84 -1.13 117.51 121.09 3g18 h ILE 83 Ca 0.17 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 3g18 h ILE 83 Cb 0.54 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 3g18 h ILE 83 CO 0.03 0.20 0.16 0.00 0.00 0.00 0.00 178.15 178.54 3g18 h ARG 85 N 0.60 0.94 -0.63 0.00 2.43 -0.96 0.54 114.38 117.31 3g18 h ARG 85 Ca 0.15 -0.17 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 3g18 h ARG 85 Cb 0.23 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 3g18 h ARG 85 CO -0.01 0.79 0.11 0.00 -1.51 0.00 0.00 179.97 179.35 3g18 h ALA 86 N 1.11 0.83 -0.49 2.80 0.00 -1.05 0.45 119.26 122.91 3g18 h ALA 86 Ca 0.21 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 3g18 h ALA 86 Cb 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3g18 h ALA 86 CO -0.02 0.59 -0.19 1.15 0.00 0.00 0.00 179.25 180.79 3g18 h THR 87 N 0.95 1.27 -0.10 0.00 2.02 -0.82 -1.52 112.91 114.71 3g18 h THR 87 Ca 0.19 -1.35 -0.18 0.00 0.77 0.00 0.00 66.41 65.85 3g18 h THR 87 Cb 0.43 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 3g18 h THR 87 CO 0.01 0.47 -0.68 -0.26 0.37 0.00 0.00 175.52 175.42 3g18 h PHE 88 N 0.84 0.56 -0.88 3.16 0.04 -0.79 -2.43 116.94 117.44 3g18 h PHE 88 Ca 0.11 -0.23 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 3g18 h PHE 88 Cb 0.76 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.78 3g18 h PHE 88 CO 0.05 0.98 0.53 0.87 -0.60 0.00 0.00 178.31 180.14 3g18 h LYS 89 N 0.30 1.19 0.00 1.51 1.79 -0.75 0.21 116.57 120.81 3g18 h LYS 89 Ca -0.02 -0.11 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 3g18 h LYS 89 Cb 1.25 -0.25 0.00 0.00 -1.58 0.00 0.00 32.23 31.65 3g18 h LYS 89 CO 0.12 0.83 0.00 0.00 -1.08 0.00 0.00 179.45 179.32 3g18 n ALA 90 N -2.41 1.58 0.00 3.86 0.00 -0.59 -4.87 120.51 118.09 3g18 n ALA 90 Ca 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3g18 n ALA 90 Cb 0.06 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.31 3g18 n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g18 n GLY 91 N -0.21 0.80 3.78 0.00 0.00 0.06 -3.72 105.19 105.89 3g18 n GLY 91 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 3g18 n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g18 s ALA 92 N -2.00 3.56 -0.00 4.61 0.00 -0.94 -4.84 121.76 122.15 3g18 s ALA 92 Ca 0.00 1.50 0.11 0.00 0.00 0.00 0.00 51.96 53.57 3g18 s ALA 92 Cb 0.00 -3.58 -0.15 0.00 0.00 0.00 0.00 23.12 19.40 3g18 s ALA 92 CO 0.00 -0.95 1.14 -0.44 0.00 0.00 0.00 175.76 175.51 3g18 h ASP 93 N 3.17 0.00 -5.10 0.00 3.32 -1.46 -3.42 116.42 112.93 3g18 h ASP 93 Ca -0.50 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.50 3g18 h ASP 93 Cb 1.24 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.66 3g18 h ASP 93 CO 0.65 0.84 -0.08 0.00 -1.72 0.00 0.00 179.24 178.93 3g18 s ALA 94 N -2.77 -0.83 0.01 3.45 0.00 -1.07 -1.75 121.76 118.80 3g18 s ALA 94 Ca 0.00 -0.18 0.01 0.00 0.00 0.00 0.00 51.96 51.79 3g18 s ALA 94 Cb 0.09 0.74 -0.01 0.00 0.00 0.00 0.00 23.12 23.94 3g18 s ALA 94 CO 0.80 -0.68 -0.05 -1.50 0.00 0.00 0.00 175.76 174.34 3g18 s ILE 95 N -3.84 0.33 -0.19 0.00 2.07 -0.61 -0.33 121.20 118.63 3g18 s ILE 95 Ca 0.06 -0.46 -0.13 0.00 -1.41 0.00 0.00 60.65 58.71 3g18 s ILE 95 Cb 0.01 -0.33 -0.05 0.00 0.13 0.00 0.00 42.46 42.22 3g18 s ILE 95 CO -0.09 -0.09 0.25 -0.63 -1.91 0.00 0.00 174.94 172.47 3g18 s ILE 96 N -0.54 5.32 0.03 2.00 1.01 -0.38 -0.53 121.20 128.11 3g18 s ILE 96 Ca -0.03 0.43 0.07 0.00 0.00 0.00 0.00 60.65 61.12 3g18 s ILE 96 Cb -0.04 -3.59 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 3g18 s ILE 96 CO -0.00 0.37 -0.20 -0.69 0.00 0.00 0.00 174.94 174.42 3g18 s VAL 97 N 0.68 1.60 0.43 2.92 1.01 0.19 -1.62 120.40 125.61 3g18 s VAL 97 Ca 0.14 -1.08 -0.23 0.00 0.00 0.00 0.00 61.98 60.81 3g18 s VAL 97 Cb -0.13 -1.37 -0.09 0.00 0.00 0.00 0.00 36.38 34.79 3g18 s VAL 97 CO 0.03 0.27 1.04 -1.00 0.00 0.00 0.00 175.10 175.44 3g18 s HIS 98 N -0.70 3.17 -0.21 5.22 3.76 -0.01 -1.19 115.29 125.33 3g18 s HIS 98 Ca 0.07 1.62 0.22 0.00 -0.15 0.00 0.00 55.06 56.82 3g18 s HIS 98 Cb -0.08 -3.10 -0.31 0.00 1.11 0.00 0.00 32.58 30.19 3g18 s HIS 98 CO 0.01 -0.68 0.56 0.41 -0.85 0.00 0.00 174.74 174.19 3g18 n GLY 99 N 0.11 -1.01 0.30 -2.22 0.00 -1.24 -4.47 105.19 96.66 3g18 n GLY 99 Ca 0.07 -0.53 0.15 0.00 0.00 0.00 0.00 46.02 45.71 3g18 n GLY 99 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 3g18 h PHE 100 N 0.00 0.00 0.00 1.61 -5.15 -1.93 -1.30 116.94 110.17 3g18 h PHE 100 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 3g18 h PHE 100 Cb 0.91 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.08 3g18 h PHE 100 CO 0.00 0.00 0.00 -2.30 -2.00 0.00 0.00 178.31 174.01 3g18 n PRO 101 N -3.85 0.50 0.00 6.09 -0.02 -1.26 -4.99 135.00 131.46 3g18 n PRO 101 Ca -0.02 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 3g18 n PRO 101 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 3g18 n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g18 n GLY 102 N 0.51 1.54 0.25 -1.23 0.00 -0.49 -4.59 105.19 101.18 3g18 n GLY 102 Ca 0.13 -2.07 -0.08 0.00 0.00 0.00 0.00 46.02 44.00 3g18 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g18 h ALA 103 N 0.00 0.71 -0.39 4.61 0.00 -1.94 -2.66 119.26 119.59 3g18 h ALA 103 Ca 0.00 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 3g18 h ALA 103 Cb 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3g18 h ALA 103 CO 0.00 0.38 -0.13 0.38 0.00 0.00 0.00 179.25 179.88 3g18 h ASP 104 N 0.76 0.70 -0.42 0.00 3.04 -1.99 0.82 116.42 119.33 3g18 h ASP 104 Ca 0.17 -0.21 -0.07 0.00 -3.24 0.00 0.00 57.03 53.69 3g18 h ASP 104 Cb 0.29 -0.19 -0.02 0.00 -1.04 0.00 0.00 39.33 38.37 3g18 h ASP 104 CO -0.00 0.85 0.02 0.28 -2.04 0.00 0.00 179.24 178.35 3g18 h SER 105 N 0.64 0.76 -0.15 4.15 0.02 -1.78 -1.45 113.55 115.75 3g18 h SER 105 Ca 0.11 -0.18 -0.18 0.00 -0.84 0.00 0.00 61.79 60.71 3g18 h SER 105 Cb 0.59 -0.20 0.01 0.00 0.14 0.00 0.00 62.40 62.93 3g18 h SER 105 CO 0.04 0.82 -0.59 0.58 -1.14 0.00 0.00 176.83 176.53 3g18 h VAL 106 N 0.75 1.32 -0.58 2.27 2.07 -1.10 -3.21 116.25 117.77 3g18 h VAL 106 Ca 0.15 -1.84 -0.00 0.00 0.82 0.00 0.00 66.70 65.83 3g18 h VAL 106 Cb 0.42 2.03 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 3g18 h VAL 106 CO 0.02 0.57 0.36 -0.09 0.02 0.00 0.00 177.57 178.44 3g18 h ARG 107 N 0.34 0.78 -0.82 1.57 2.43 -0.61 -0.88 114.38 117.19 3g18 h ARG 107 Ca -0.03 -0.06 0.06 0.00 -0.81 0.00 0.00 59.98 59.13 3g18 h ARG 107 Cb 1.22 -0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 30.55 3g18 h ARG 107 CO 0.12 0.55 0.54 0.00 -1.51 0.00 0.00 179.97 179.67 3g18 h ALA 108 N 1.59 1.57 -0.18 2.80 0.00 -1.27 0.12 119.26 123.90 3g18 h ALA 108 Ca 0.21 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 3g18 h ALA 108 Cb -0.04 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 3g18 h ALA 108 CO -0.04 0.31 -0.29 0.00 0.00 0.00 0.00 179.25 179.23 3g18 h LEU 110 N 0.17 0.69 -0.19 0.00 3.38 -0.51 -1.85 115.31 117.00 3g18 h LEU 110 Ca 0.02 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 3g18 h LEU 110 Cb 0.87 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 3g18 h LEU 110 CO 0.07 0.60 0.10 0.78 0.09 0.00 0.00 178.44 180.08 3g18 h ASN 111 N 0.77 0.23 -0.59 -0.43 2.35 -0.72 -0.08 115.58 117.12 3g18 h ASN 111 Ca 0.19 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.79 3g18 h ASN 111 Cb 0.09 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 3g18 h ASN 111 CO -0.02 0.25 0.08 0.58 -1.65 0.00 0.00 177.43 176.67 3g18 h VAL 112 N 0.20 1.26 -0.47 2.81 2.07 -1.36 -0.53 116.25 120.22 3g18 h VAL 112 Ca 0.07 -1.01 -0.06 0.00 0.82 0.00 0.00 66.70 66.51 3g18 h VAL 112 Cb 0.06 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 3g18 h VAL 112 CO -0.01 0.37 0.04 0.00 0.02 0.00 0.00 177.57 177.99 3g18 h ALA 113 N 1.14 1.19 -0.19 1.67 0.00 -1.09 -0.27 119.26 121.70 3g18 h ALA 113 Ca 0.19 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3g18 h ALA 113 Cb 0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3g18 h ALA 113 CO 0.01 0.54 0.02 1.49 0.00 0.00 0.00 179.25 181.31 3g18 h GLU 114 N 0.71 0.33 -0.88 0.00 4.57 -0.49 0.10 114.58 118.92 3g18 h GLU 114 Ca 0.15 -0.09 -0.01 0.00 -1.18 0.00 0.00 59.36 58.22 3g18 h GLU 114 Cb 0.38 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.89 3g18 h GLU 114 CO 0.01 0.50 0.51 1.49 -1.18 0.00 0.00 179.01 180.34 3g18 h GLU 115 N 0.11 1.21 -0.15 1.92 4.81 -0.75 -3.14 114.58 118.59 3g18 h GLU 115 Ca 0.06 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3g18 h GLU 115 Cb 0.34 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.47 3g18 h GLU 115 CO 0.01 0.87 0.00 -1.33 -0.73 0.00 0.00 179.01 177.82 3g18 n MET 116 N -4.35 2.38 -2.56 1.92 2.81 -0.15 -4.98 117.12 112.20 3g18 n MET 116 Ca 0.10 -2.04 -0.12 0.00 -1.81 0.00 0.00 57.70 53.83 3g18 n MET 116 Cb 0.08 -1.48 0.01 0.00 -0.71 0.00 0.00 33.22 31.12 3g18 n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g18 n GLY 117 N 1.40 0.01 0.23 3.03 0.00 0.16 -5.03 105.19 104.99 3g18 n GLY 117 Ca 0.16 -0.32 -0.02 0.00 0.00 0.00 0.00 46.02 45.84 3g18 n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g18 n ARG 118 N -2.40 1.66 -4.21 1.61 5.12 -0.05 -5.04 116.66 113.34 3g18 n ARG 118 Ca -0.08 -0.22 -0.20 0.00 -1.93 0.00 0.00 57.85 55.42 3g18 n ARG 118 Cb 0.57 0.04 -0.12 0.00 -1.16 0.00 0.00 32.46 31.79 3g18 n ARG 118 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3g18 s GLU 119 N -2.13 0.93 -0.11 5.56 0.41 -0.72 -4.56 118.70 118.09 3g18 s GLU 119 Ca 0.01 -1.04 0.02 0.00 -0.41 0.00 0.00 54.97 53.55 3g18 s GLU 119 Cb -0.00 -1.03 -0.01 0.00 -1.78 0.00 0.00 34.13 31.31 3g18 s GLU 119 CO 0.01 0.23 -0.17 0.08 -0.49 0.00 0.00 175.26 174.92 3g18 s VAL 120 N -1.26 2.69 -0.18 2.63 1.01 -1.26 -1.57 120.40 122.46 3g18 s VAL 120 Ca 0.01 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.14 3g18 s VAL 120 Cb -0.10 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 3g18 s VAL 120 CO 0.03 0.54 0.01 -0.36 0.00 0.00 0.00 175.10 175.32 3g18 s PHE 121 N 0.20 3.11 -0.22 5.22 0.40 0.32 -4.12 117.98 122.89 3g18 s PHE 121 Ca -0.11 -0.20 -0.15 0.00 -0.60 0.00 0.00 56.93 55.87 3g18 s PHE 121 Cb -0.16 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.30 3g18 s PHE 121 CO 0.06 -0.02 0.38 -1.17 0.70 0.00 0.00 175.22 175.17 3g18 s LEU 122 N 0.53 4.13 -0.40 -0.37 2.96 -0.11 -0.64 118.68 124.78 3g18 s LEU 122 Ca -0.00 0.44 -0.24 0.00 -0.22 0.00 0.00 54.13 54.11 3g18 s LEU 122 Cb -0.14 -2.47 0.02 0.00 0.50 0.00 0.00 46.19 44.10 3g18 s LEU 122 CO 0.02 -0.10 0.84 -0.22 -1.32 0.00 0.00 176.35 175.58 3g18 s LEU 123 N 1.48 4.10 0.05 -0.68 2.96 -0.33 -1.09 118.68 125.16 3g18 s LEU 123 Ca 0.17 0.27 0.18 0.00 -0.22 0.00 0.00 54.13 54.53 3g18 s LEU 123 Cb -0.15 -3.10 -0.15 0.00 0.50 0.00 0.00 46.19 43.30 3g18 s LEU 123 CO 0.08 -0.86 0.76 0.35 -1.32 0.00 0.00 176.35 175.36 3g18 n THR 124 N 6.02 1.06 -3.55 3.68 -2.24 -0.71 -3.70 114.28 114.84 3g18 n THR 124 Ca 0.04 -0.68 -0.09 0.00 -2.27 0.00 0.00 64.05 61.06 3g18 n THR 124 Cb 0.48 -0.62 -0.02 0.00 -2.10 0.00 0.00 70.33 68.07 3g18 n THR 124 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3g18 s GLU 125 N -2.98 1.21 0.15 -0.78 2.12 -1.26 -4.24 118.70 112.92 3g18 s GLU 125 Ca -0.04 -0.52 0.05 0.00 0.36 0.00 0.00 54.97 54.83 3g18 s GLU 125 Cb 0.09 0.51 -0.04 0.00 0.26 0.00 0.00 34.13 34.94 3g18 s GLU 125 CO 0.82 -0.54 -0.12 -1.64 -0.54 0.00 0.00 175.26 173.24 3g18 s MET 126 N -3.53 1.09 0.00 4.30 -1.94 -1.26 -4.27 119.30 113.69 3g18 s MET 126 Ca 0.05 -1.42 0.14 0.00 -1.71 0.00 0.00 55.69 52.75 3g18 s MET 126 Cb -0.02 -0.76 0.08 0.00 2.01 0.00 0.00 34.83 36.15 3g18 s MET 126 CO -0.07 0.11 0.91 -1.13 -0.01 0.00 0.00 175.02 174.83 3g18 n SER 127 N -0.05 2.01 -4.78 3.03 3.41 -1.26 -4.81 113.62 111.17 3g18 n SER 127 Ca -0.11 -1.50 -0.32 0.00 -0.26 0.00 0.00 58.87 56.67 3g18 n SER 127 Cb 0.60 0.12 0.06 0.00 -0.26 0.00 0.00 64.21 64.73 3g18 n SER 127 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 3g18 s HIS 128 N -1.32 2.67 0.24 7.33 -3.43 -1.26 -4.92 115.29 114.60 3g18 s HIS 128 Ca 0.15 1.54 -0.07 0.00 -0.80 0.00 0.00 55.06 55.88 3g18 s HIS 128 Cb 0.12 -3.10 0.42 0.00 -1.43 0.00 0.00 32.58 28.59 3g18 s HIS 128 CO 0.22 -1.65 1.64 -1.35 -2.00 0.00 0.00 174.74 171.61 3g18 h PRO 129 N -0.37 0.12 0.00 -0.38 0.11 -2.05 -1.11 132.00 128.32 3g18 h PRO 129 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3g18 h PRO 129 Cb 1.24 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3g18 h PRO 129 CO 0.54 0.08 0.00 0.78 -0.21 0.00 0.00 178.00 179.18 3g18 h GLY 130 N 0.12 0.00 2.00 -0.55 0.00 -1.98 -2.52 103.07 100.14 3g18 h GLY 130 Ca 0.40 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.73 3g18 h GLY 130 CO -0.63 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 175.91 3g18 h ALA 131 N 2.01 1.09 0.00 3.60 0.00 -1.51 -2.29 119.26 122.17 3g18 h ALA 131 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3g18 h ALA 131 Cb 0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3g18 h ALA 131 CO 0.00 0.01 -0.28 0.93 0.00 0.00 0.00 179.25 179.91 3g18 h GLU 132 N 0.00 0.00 -0.07 0.00 5.08 -1.63 -0.34 114.58 117.61 3g18 h GLU 132 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3g18 h GLU 132 Cb 0.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 3g18 h GLU 132 CO 0.00 0.28 0.04 0.52 -1.00 0.00 0.00 179.01 178.85 3g18 h MET 133 N 0.00 0.11 0.00 2.33 2.86 -1.65 -3.42 114.93 115.16 3g18 h MET 133 Ca -0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3g18 h MET 133 Cb 0.57 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.21 3g18 h MET 133 CO 0.04 0.18 -0.35 1.19 1.06 0.00 0.00 176.91 179.03 3g18 n PHE 134 N -4.97 0.00 -0.02 -0.22 3.01 -1.24 -4.89 117.46 109.12 3g18 n PHE 134 Ca -0.06 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.28 3g18 n PHE 134 Cb 0.09 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.49 3g18 n PHE 134 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 3g18 h ILE 135 N 0.00 1.20 -0.60 4.37 2.04 -1.73 -3.08 117.51 119.71 3g18 h ILE 135 Ca 0.00 -0.61 0.09 0.00 1.00 0.00 0.00 64.86 65.34 3g18 h ILE 135 Cb 0.35 1.42 -0.07 0.00 -0.74 0.00 0.00 36.82 37.78 3g18 h ILE 135 CO 0.00 0.18 0.22 -0.61 0.00 0.00 0.00 178.15 177.93 3g18 h GLN 136 N -0.05 0.38 0.00 2.37 4.15 -1.31 -0.99 115.11 119.66 3g18 h GLN 136 Ca 0.03 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.43 3g18 h GLN 136 Cb 0.25 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.86 3g18 h GLN 136 CO 0.00 0.25 0.00 0.78 -1.93 0.00 0.00 178.83 177.93 3g18 h GLY 137 N 0.39 0.00 -0.32 2.39 0.00 -1.82 -2.91 103.07 100.81 3g18 h GLY 137 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 3g18 h GLY 137 CO -0.30 0.00 -0.67 0.00 0.00 0.00 0.00 176.54 175.57 3g18 n ALA 138 N -1.94 3.94 -0.07 3.60 0.00 -0.61 -4.68 120.51 120.75 3g18 n ALA 138 Ca 0.01 -0.53 -0.08 0.00 0.00 0.00 0.00 53.44 52.84 3g18 n ALA 138 Cb 0.25 -0.65 -0.02 0.00 0.00 0.00 0.00 19.45 19.04 3g18 n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g18 h ALA 139 N 2.78 -0.19 -0.86 0.00 0.00 -1.01 0.29 119.26 120.26 3g18 h ALA 139 Ca 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3g18 h ALA 139 Cb 0.50 0.61 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 3g18 h ALA 139 CO 0.00 -0.71 0.51 -0.44 0.00 0.00 0.00 179.25 178.61 3g18 h ASP 140 N -0.28 1.05 0.11 0.00 3.32 -1.83 -0.43 116.42 118.35 3g18 h ASP 140 Ca 0.15 -0.07 -0.13 0.00 0.02 0.00 0.00 57.03 56.99 3g18 h ASP 140 Cb 0.51 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 3g18 h ASP 140 CO -0.45 0.81 -0.45 -0.33 -1.72 0.00 0.00 179.24 177.11 3g18 h GLU 141 N 1.19 0.41 -0.49 3.56 4.39 -1.77 -1.11 114.58 120.77 3g18 h GLU 141 Ca 0.31 -0.22 -0.10 0.00 0.34 0.00 0.00 59.36 59.69 3g18 h GLU 141 Cb -0.03 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 3g18 h GLU 141 CO -0.06 0.78 -0.08 0.82 -1.16 0.00 0.00 179.01 179.32 3g18 h ILE 142 N 0.34 1.27 -0.54 3.13 2.04 -0.49 0.29 117.51 123.55 3g18 h ILE 142 Ca 0.02 -1.20 -0.01 0.00 1.00 0.00 0.00 64.86 64.67 3g18 h ILE 142 Cb 0.92 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 3g18 h ILE 142 CO 0.08 0.42 0.29 0.00 0.00 0.00 0.00 178.15 178.93 3g18 h ALA 143 N 0.90 0.70 -0.50 1.87 0.00 -0.85 -0.87 119.26 120.51 3g18 h ALA 143 Ca 0.13 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3g18 h ALA 143 Cb 0.62 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3g18 h ALA 143 CO 0.04 0.23 0.04 0.00 0.00 0.00 0.00 179.25 179.56 3g18 h ARG 144 N 0.73 0.81 -0.70 0.00 3.08 -0.98 -1.75 114.38 115.56 3g18 h ARG 144 Ca 0.19 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 3g18 h ARG 144 Cb 0.06 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 3g18 h ARG 144 CO -0.03 0.79 0.38 1.98 -1.07 0.00 0.00 179.97 182.02 3g18 h MET 145 N 0.76 0.98 -0.45 0.04 4.05 -0.39 -0.78 114.93 119.14 3g18 h MET 145 Ca 0.15 -0.12 0.02 0.00 -0.28 0.00 0.00 59.70 59.48 3g18 h MET 145 Cb 0.40 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 30.98 3g18 h MET 145 CO 0.01 0.74 0.26 0.78 0.23 0.00 0.00 176.91 178.93 3g18 h GLY 146 N 0.97 0.63 0.92 1.39 0.00 -0.51 -1.13 103.07 105.34 3g18 h GLY 146 Ca 0.25 -0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.42 3g18 h GLY 146 CO -0.04 0.16 0.64 -2.08 0.00 0.00 0.00 176.54 175.22 3g18 h VAL 147 N 0.52 1.17 0.00 4.60 2.07 -0.71 -0.05 116.25 123.85 3g18 h VAL 147 Ca 0.18 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.28 3g18 h VAL 147 Cb 0.03 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.64 3g18 h VAL 147 CO -0.09 0.22 0.00 0.47 0.02 0.00 0.00 177.57 178.19 3g18 n ASP 148 N -4.44 0.00 0.00 0.57 8.00 -0.36 -2.40 116.55 117.93 3g18 n ASP 148 Ca 0.13 -1.79 0.00 0.00 0.71 0.00 0.00 54.79 53.84 3g18 n ASP 148 Cb 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 3g18 n ASP 148 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3g18 n LEU 149 N -0.59 1.00 -0.19 0.64 4.77 -0.14 -4.99 117.00 117.51 3g18 n LEU 149 Ca 0.04 -1.00 -0.03 0.00 -0.03 0.00 0.00 56.01 54.99 3g18 n LEU 149 Cb 0.02 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 3g18 n LEU 149 CO 0.03 0.25 -0.02 0.61 -1.33 0.00 0.00 177.39 176.93 3g18 n GLY 150 N -0.02 0.58 3.75 -0.72 0.00 -0.90 -4.99 105.19 102.89 3g18 n GLY 150 Ca 0.00 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 3g18 n GLY 150 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g18 s VAL 151 N -2.03 2.38 -0.43 1.61 1.01 -0.56 -4.91 120.40 117.47 3g18 s VAL 151 Ca 0.00 0.32 0.04 0.00 0.00 0.00 0.00 61.98 62.34 3g18 s VAL 151 Cb 0.00 -3.21 0.03 0.00 0.00 0.00 0.00 36.38 33.20 3g18 s VAL 151 CO 0.00 0.05 0.59 0.29 0.00 0.00 0.00 175.10 176.03 3g18 n LYS 152 N 2.25 -0.26 -4.25 2.72 4.76 -1.26 -4.69 118.16 117.42 3g18 n LYS 152 Ca 0.07 -0.68 -0.21 0.00 -2.87 0.00 0.00 58.31 54.62 3g18 n LYS 152 Cb 0.39 -1.05 -0.16 0.00 -1.84 0.00 0.00 35.03 32.36 3g18 n LYS 152 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3g18 s ASN 153 N -0.33 1.10 0.06 4.39 0.01 -1.26 -0.60 114.94 118.32 3g18 s ASN 153 Ca 0.04 -0.16 0.03 0.00 -0.71 0.00 0.00 52.86 52.06 3g18 s ASN 153 Cb 0.03 -0.52 -0.03 0.00 0.41 0.00 0.00 41.25 41.14 3g18 s ASN 153 CO 0.05 -0.03 -0.09 -0.31 -1.51 0.00 0.00 177.10 175.20 3g18 s TYR 154 N 0.85 0.86 -0.17 2.20 1.51 0.15 -0.93 117.35 121.82 3g18 s TYR 154 Ca -0.12 -0.55 0.01 0.00 -1.01 0.00 0.00 57.07 55.41 3g18 s TYR 154 Cb -0.15 -0.50 0.02 0.00 -0.11 0.00 0.00 41.96 41.22 3g18 s TYR 154 CO 0.01 -0.05 -0.20 0.08 -1.11 0.00 0.00 175.55 174.28 3g18 s VAL 155 N -1.69 2.09 0.13 0.71 1.01 -0.25 -1.36 120.40 121.04 3g18 s VAL 155 Ca -0.04 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 60.99 3g18 s VAL 155 Cb -0.08 -1.86 -0.00 0.00 0.00 0.00 0.00 36.38 34.44 3g18 s VAL 155 CO 0.00 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.26 3g18 n GLY 156 N 4.42 4.03 0.00 4.51 0.00 -0.90 -1.73 105.19 115.52 3g18 n GLY 156 Ca -0.21 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.57 3g18 n GLY 156 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3g18 n PRO 157 N -0.32 0.06 0.00 1.61 -0.04 -1.26 -4.17 135.00 130.87 3g18 n PRO 157 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 3g18 n PRO 157 Cb 0.17 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.63 3g18 n PRO 157 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3g18 n SER 158 N -1.81 0.00 0.00 3.54 2.88 -1.26 -4.47 113.62 112.50 3g18 n SER 158 Ca 0.00 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.56 3g18 n SER 158 Cb 0.00 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 63.55 3g18 n SER 158 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3g18 n THR 159 N -1.10 1.47 -3.74 2.46 -2.24 -1.26 -4.22 114.28 105.65 3g18 n THR 159 Ca 0.00 0.37 -0.29 0.00 -2.27 0.00 0.00 64.05 61.85 3g18 n THR 159 Cb 0.00 -1.30 -0.15 0.00 -2.10 0.00 0.00 70.33 66.78 3g18 n THR 159 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3g18 s ARG 160 N -2.85 0.73 0.24 -0.78 0.52 -1.26 -5.02 118.95 110.52 3g18 s ARG 160 Ca 0.03 -0.93 -0.05 0.00 -0.52 0.00 0.00 55.73 54.26 3g18 s ARG 160 Cb 0.03 -2.01 0.42 0.00 0.52 0.00 0.00 34.95 33.91 3g18 s ARG 160 CO 0.07 -0.91 1.75 -1.35 0.02 0.00 0.00 175.30 174.88 3g18 h PRO 161 N 8.12 0.50 0.00 3.54 0.11 -1.99 -1.20 132.00 141.08 3g18 h PRO 161 Ca -0.15 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.93 3g18 h PRO 161 Cb 1.04 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 3g18 h PRO 161 CO 0.44 0.33 -0.00 1.05 -0.21 0.00 0.00 178.00 179.61 3g18 h GLU 162 N 0.51 0.00 0.08 1.05 9.09 -1.96 -1.06 114.58 122.30 3g18 h GLU 162 Ca 0.39 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.56 3g18 h GLU 162 Cb 0.54 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.63 3g18 h GLU 162 CO -0.35 0.00 -1.14 0.00 0.05 0.00 0.00 179.01 177.57 3g18 h ARG 163 N 0.00 0.19 -0.32 1.06 2.47 -1.64 -2.65 114.38 113.48 3g18 h ARG 163 Ca -0.00 -0.31 -0.13 0.00 -1.26 0.00 0.00 59.98 58.28 3g18 h ARG 163 Cb 0.08 0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 3g18 h ARG 163 CO 0.00 1.14 -0.33 -0.07 0.56 0.00 0.00 179.97 181.27 3g18 h LEU 164 N 0.06 0.74 -0.55 3.04 4.07 -1.17 -0.23 115.31 121.26 3g18 h LEU 164 Ca -0.09 -0.31 -0.07 0.00 0.08 0.00 0.00 57.88 57.49 3g18 h LEU 164 Cb 1.88 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 43.39 3g18 h LEU 164 CO 0.18 1.01 0.06 -1.28 -1.08 0.00 0.00 178.44 177.32 3g18 h SER 165 N 0.60 0.91 -0.57 -0.43 0.87 -1.48 -0.79 113.55 112.66 3g18 h SER 165 Ca 0.06 -0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 60.33 3g18 h SER 165 Cb 0.85 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.54 3g18 h SER 165 CO 0.07 0.96 0.27 -0.09 -0.53 0.00 0.00 176.83 177.52 3g18 h ARG 166 N 0.83 0.82 -0.53 2.24 9.65 -1.20 -1.75 114.38 124.44 3g18 h ARG 166 Ca 0.16 -0.12 -0.01 0.00 -1.10 0.00 0.00 59.98 58.91 3g18 h ARG 166 Cb 0.46 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 28.87 3g18 h ARG 166 CO 0.02 0.67 0.27 1.25 2.80 0.00 0.00 179.97 184.97 3g18 h LEU 167 N 0.77 0.67 -1.42 3.80 6.46 -0.73 -2.60 115.31 122.27 3g18 h LEU 167 Ca 0.20 -0.11 -0.01 0.00 -0.12 0.00 0.00 57.88 57.83 3g18 h LEU 167 Cb 0.12 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 39.85 3g18 h LEU 167 CO -0.02 0.59 0.24 0.03 -0.62 0.00 0.00 178.44 178.66 3g18 h ARG 168 N 0.70 0.64 -0.16 1.25 2.47 -0.82 0.23 114.38 118.69 3g18 h ARG 168 Ca 0.18 -0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 58.82 3g18 h ARG 168 Cb 0.08 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.26 3g18 h ARG 168 CO -0.03 0.48 -0.00 1.49 0.56 0.00 0.00 179.97 182.47 3g18 h GLU 169 N 0.65 0.22 0.01 0.04 4.57 -0.93 0.43 114.58 119.57 3g18 h GLU 169 Ca 0.17 -0.03 -0.16 0.00 -1.18 0.00 0.00 59.36 58.16 3g18 h GLU 169 Cb 0.04 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 3g18 h GLU 169 CO -0.03 0.25 -0.87 0.82 -1.18 0.00 0.00 179.01 178.00 3g18 h ILE 170 N 0.22 1.21 0.00 2.32 2.04 -1.13 -3.39 117.51 118.78 3g18 h ILE 170 Ca 0.05 -2.25 0.00 0.00 1.00 0.00 0.00 64.86 63.66 3g18 h ILE 170 Cb 0.16 2.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.88 3g18 h ILE 170 CO 0.00 0.44 -0.19 2.30 0.00 0.00 0.00 178.15 180.70 3g18 n ILE 171 N -4.45 0.26 0.00 -0.67 -5.35 -0.03 -4.93 119.36 104.18 3g18 n ILE 171 Ca -0.24 -0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.09 3g18 n ILE 171 Cb 0.64 -0.34 0.00 0.00 -1.74 0.00 0.00 39.64 38.19 3g18 n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3g18 n GLY 172 N 1.41 -0.05 0.05 3.28 0.00 0.14 -4.39 105.19 105.63 3g18 n GLY 172 Ca 0.06 -1.84 0.12 0.00 0.00 0.00 0.00 46.02 44.36 3g18 n GLY 172 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3g18 n GLN 173 N 0.00 0.18 -0.05 1.61 1.13 -1.26 -4.31 117.38 114.68 3g18 n GLN 173 Ca 0.00 -0.10 -0.15 0.00 -1.94 0.00 0.00 57.00 54.81 3g18 n GLN 173 Cb 0.00 -1.50 -0.14 0.00 0.11 0.00 0.00 30.24 28.71 3g18 n GLN 173 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 3g18 n ASP 174 N -1.32 1.35 -4.64 1.08 9.92 -1.26 -4.97 116.55 116.70 3g18 n ASP 174 Ca 0.07 0.16 -0.35 0.00 -0.53 0.00 0.00 54.79 54.15 3g18 n ASP 174 Cb 0.33 -0.20 0.11 0.00 -0.64 0.00 0.00 41.12 40.72 3g18 n ASP 174 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 3g18 n SER 175 N -3.18 0.65 -4.72 -2.24 7.64 -1.26 -4.88 113.62 105.64 3g18 n SER 175 Ca -0.31 0.62 -0.40 0.00 1.01 0.00 0.00 58.87 59.80 3g18 n SER 175 Cb 1.06 -1.45 -0.05 0.00 -1.01 0.00 0.00 64.21 62.77 3g18 n SER 175 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 3g18 s PHE 176 N -1.96 3.58 -0.07 1.43 5.36 0.24 -4.97 117.98 121.59 3g18 s PHE 176 Ca 0.73 1.27 0.02 0.00 -0.96 0.00 0.00 56.93 57.99 3g18 s PHE 176 Cb -0.32 -2.82 0.02 0.00 -0.34 0.00 0.00 43.02 39.56 3g18 s PHE 176 CO 0.51 0.08 -0.10 -1.17 -1.46 0.00 0.00 175.22 173.08 3g18 s LEU 177 N 0.82 1.54 0.07 6.12 2.96 -1.26 -0.67 118.68 128.26 3g18 s LEU 177 Ca 0.38 -0.27 0.09 0.00 -0.22 0.00 0.00 54.13 54.11 3g18 s LEU 177 Cb -0.18 -0.75 -0.03 0.00 0.50 0.00 0.00 46.19 45.73 3g18 s LEU 177 CO 0.19 0.00 -0.24 0.27 -1.32 0.00 0.00 176.35 175.25 3g18 s ILE 178 N 0.80 1.93 -0.06 6.68 -4.36 -0.46 0.42 121.20 126.15 3g18 s ILE 178 Ca -0.12 -1.42 0.02 0.00 -0.26 0.00 0.00 60.65 58.88 3g18 s ILE 178 Cb -0.15 -1.68 0.01 0.00 1.25 0.00 0.00 42.46 41.88 3g18 s ILE 178 CO 0.02 0.19 -0.12 -0.44 0.24 0.00 0.00 174.94 174.83 3g18 s SER 179 N -1.47 1.69 0.00 4.36 0.01 -0.92 -2.12 113.70 115.24 3g18 s SER 179 Ca 0.10 -0.28 0.00 0.00 1.31 0.00 0.00 55.95 57.08 3g18 s SER 179 Cb -0.10 -0.70 0.00 0.00 0.21 0.00 0.00 66.02 65.44 3g18 s SER 179 CO 0.03 0.05 0.00 -2.65 0.41 0.00 0.00 173.24 171.08 3g18 n PRO 180 N 3.66 0.00 0.00 12.44 -0.02 -1.26 -0.56 135.00 149.27 3g18 n PRO 180 Ca -0.22 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.26 3g18 n PRO 180 Cb 0.52 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.63 3g18 n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g18 n GLY 190 N 1.37 0.04 0.20 -1.23 0.00 -1.26 -4.68 105.19 99.64 3g18 n GLY 190 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3g18 n GLY 190 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3g18 h GLU 191 N 0.00 0.00 -0.79 1.61 4.81 -2.02 -3.09 114.58 115.11 3g18 h GLU 191 Ca 0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 3g18 h GLU 191 Cb 0.00 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.34 3g18 h GLU 191 CO 0.00 0.28 0.39 1.15 -0.73 0.00 0.00 179.01 180.10 3g18 h THR 192 N 0.00 1.24 0.00 0.32 2.02 -1.96 -1.83 112.91 112.71 3g18 h THR 192 Ca -0.00 -0.68 0.00 0.00 0.77 0.00 0.00 66.41 66.50 3g18 h THR 192 Cb 0.92 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 3g18 h THR 192 CO 0.04 0.29 0.00 0.18 0.37 0.00 0.00 175.52 176.40 3g18 n LEU 193 N -4.32 0.00 0.14 2.58 4.77 -1.17 -0.37 117.00 118.63 3g18 n LEU 193 Ca 0.08 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.17 3g18 n LEU 193 Cb 0.13 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.27 3g18 n LEU 193 CO 0.39 0.00 0.27 0.03 -1.33 0.00 0.00 177.39 176.75 3g18 h ARG 194 N 0.00 0.00 0.00 3.23 3.08 -1.48 -3.40 114.38 115.81 3g18 h ARG 194 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3g18 h ARG 194 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3g18 h ARG 194 CO 0.00 0.02 -0.96 1.19 -1.07 0.00 0.00 179.97 179.15 3g18 n PHE 195 N -2.83 0.00 -3.29 3.04 3.01 -0.65 -5.05 117.46 111.70 3g18 n PHE 195 Ca 0.01 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.15 3g18 n PHE 195 Cb 0.56 0.01 -0.06 0.00 -0.01 0.00 0.00 39.48 39.97 3g18 n PHE 195 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3g18 s ALA 196 N -1.97 3.45 -0.25 4.37 0.00 0.50 -4.84 121.76 123.02 3g18 s ALA 196 Ca 0.00 -0.13 0.19 0.00 0.00 0.00 0.00 51.96 52.03 3g18 s ALA 196 Cb 0.00 -2.59 0.10 0.00 0.00 0.00 0.00 23.12 20.63 3g18 s ALA 196 CO 0.00 0.43 1.31 -0.44 0.00 0.00 0.00 175.76 177.06 3g18 h ASP 197 N 2.40 0.00 -5.01 0.00 3.32 -0.35 -3.39 116.42 113.40 3g18 h ASP 197 Ca -0.47 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.50 3g18 h ASP 197 Cb 1.17 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.54 3g18 h ASP 197 CO 0.67 0.26 0.01 0.00 -1.72 0.00 0.00 179.24 178.46 3g18 s ALA 198 N -3.11 -1.32 0.10 3.45 0.00 -1.17 -4.74 121.76 114.96 3g18 s ALA 198 Ca 0.03 0.74 0.06 0.00 0.00 0.00 0.00 51.96 52.79 3g18 s ALA 198 Cb 0.07 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 3g18 s ALA 198 CO 0.74 -0.41 -0.04 0.96 0.00 0.00 0.00 175.76 177.02 3g18 s ILE 199 N -1.82 3.76 -0.19 0.00 -4.36 -0.53 -2.17 121.20 115.90 3g18 s ILE 199 Ca -0.09 -1.10 -0.06 0.00 -0.26 0.00 0.00 60.65 59.15 3g18 s ILE 199 Cb -0.01 -2.78 -0.03 0.00 1.25 0.00 0.00 42.46 40.88 3g18 s ILE 199 CO 0.03 0.12 0.02 -0.63 0.24 0.00 0.00 174.94 174.72 3g18 s ILE 200 N -1.27 4.33 -0.04 8.37 1.01 0.28 -0.64 121.20 133.23 3g18 s ILE 200 Ca 0.24 -0.19 0.03 0.00 0.00 0.00 0.00 60.65 60.73 3g18 s ILE 200 Cb -0.11 -2.95 0.00 0.00 0.01 0.00 0.00 42.46 39.41 3g18 s ILE 200 CO 0.16 0.45 -0.14 -0.69 0.00 0.00 0.00 174.94 174.72 3g18 s VAL 201 N 0.66 1.18 0.00 2.92 1.01 -0.03 -4.60 120.40 121.54 3g18 s VAL 201 Ca 0.01 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.43 3g18 s VAL 201 Cb -0.14 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.21 3g18 s VAL 201 CO 0.02 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.08 3g18 n GLY 202 N 3.31 0.55 0.35 4.51 0.00 -1.26 -0.64 105.19 112.01 3g18 n GLY 202 Ca -0.19 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.77 3g18 n GLY 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g18 n ARG 203 N 0.00 -0.30 0.26 1.61 5.12 -1.26 -0.43 116.66 121.66 3g18 n ARG 203 Ca 0.00 1.32 0.13 0.00 -1.93 0.00 0.00 57.85 57.37 3g18 n ARG 203 Cb 0.00 -1.95 0.57 0.00 -1.16 0.00 0.00 32.46 29.91 3g18 n ARG 203 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 3g18 h SER 204 N 0.00 0.00 0.00 0.55 0.87 -1.98 -2.24 113.55 110.76 3g18 h SER 204 Ca 0.21 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.75 3g18 h SER 204 Cb 0.43 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.39 3g18 h SER 204 CO -0.84 0.00 -0.71 -0.38 -0.53 0.00 0.00 176.83 174.37 3g18 n ILE 205 N -2.92 1.36 0.98 2.23 5.41 0.43 -4.38 119.36 122.47 3g18 n ILE 205 Ca 0.02 0.21 0.08 0.00 1.00 0.00 0.00 62.75 64.06 3g18 n ILE 205 Cb 0.66 -2.03 0.48 0.00 -0.71 0.00 0.00 39.64 38.03 3g18 n ILE 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3g18 n TYR 206 N -4.06 0.00 0.30 1.39 0.18 -0.84 -2.44 117.16 111.70 3g18 n TYR 206 Ca -0.10 0.00 0.03 0.00 1.88 0.00 0.00 57.90 59.71 3g18 n TYR 206 Cb 0.35 -0.08 -0.03 0.00 -0.38 0.00 0.00 39.34 39.20 3g18 n TYR 206 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3g18 n LEU 207 N -1.08 0.35 -4.78 -3.48 4.77 -0.85 -5.03 117.00 106.91 3g18 n LEU 207 Ca 0.11 -0.52 -0.35 0.00 -0.03 0.00 0.00 56.01 55.23 3g18 n LEU 207 Cb 0.08 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.17 3g18 n LEU 207 CO 0.10 0.08 0.77 0.00 -1.33 0.00 0.00 177.39 177.02 3g18 s ALA 208 N -1.57 2.68 0.26 -1.18 0.00 -1.02 -4.93 121.76 116.00 3g18 s ALA 208 Ca 0.03 0.77 -0.03 0.00 0.00 0.00 0.00 51.96 52.72 3g18 s ALA 208 Cb 0.05 -3.34 0.37 0.00 0.00 0.00 0.00 23.12 20.19 3g18 s ALA 208 CO 0.26 -0.80 1.89 -0.44 0.00 0.00 0.00 175.76 176.67 3g18 h ASP 209 N 1.07 1.05 -3.22 0.00 3.32 -1.96 -3.30 116.42 113.37 3g18 h ASP 209 Ca -0.50 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 55.95 3g18 h ASP 209 Cb 1.26 -0.22 -0.40 0.00 0.22 0.00 0.00 39.33 40.18 3g18 h ASP 209 CO 0.57 0.69 -0.76 0.21 -1.72 0.00 0.00 179.24 178.23 3g18 s ASN 210 N -5.94 3.44 0.57 6.45 2.47 -1.26 -4.98 114.94 115.69 3g18 s ASN 210 Ca -0.13 -2.84 0.27 0.00 0.42 0.00 0.00 52.86 50.59 3g18 s ASN 210 Cb 0.19 -0.99 1.52 0.00 -1.45 0.00 0.00 41.25 40.52 3g18 s ASN 210 CO 0.81 -0.23 2.01 1.55 -3.72 0.00 0.00 177.10 177.53 3g18 h PRO 211 N 6.40 0.00 -0.32 0.43 0.13 -1.75 -1.14 132.00 135.75 3g18 h PRO 211 Ca 0.06 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 3g18 h PRO 211 Cb 0.90 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.02 3g18 h PRO 211 CO 0.49 0.00 0.18 0.00 -0.23 0.00 0.00 178.00 178.44 3g18 h ALA 212 N 1.68 0.41 -0.13 -0.56 0.00 -1.90 -0.35 119.26 118.41 3g18 h ALA 212 Ca 0.17 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.84 3g18 h ALA 212 Cb 0.82 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3g18 h ALA 212 CO -0.00 -0.07 -0.63 0.00 0.00 0.00 0.00 179.25 178.55 3g18 h ALA 213 N 1.05 0.67 -0.12 0.00 0.00 -1.60 -2.51 119.26 116.75 3g18 h ALA 213 Ca 0.11 -0.55 0.01 0.00 0.00 0.00 0.00 54.91 54.48 3g18 h ALA 213 Cb 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3g18 h ALA 213 CO -0.02 0.72 0.03 0.00 0.00 0.00 0.00 179.25 179.98 3g18 h ALA 214 N 0.97 0.12 -0.16 0.00 0.00 -1.00 0.18 119.26 119.38 3g18 h ALA 214 Ca -0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g18 h ALA 214 Cb 1.18 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3g18 h ALA 214 CO 0.11 -0.43 0.09 0.00 0.00 0.00 0.00 179.25 179.03 3g18 h ALA 215 N 1.08 0.21 -0.59 0.00 0.00 -1.06 -2.31 119.26 116.59 3g18 h ALA 215 Ca 0.05 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.95 3g18 h ALA 215 Cb 0.04 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3g18 h ALA 215 CO -0.06 -0.27 0.39 0.00 0.00 0.00 0.00 179.25 179.31 3g18 h ALA 216 N 0.99 1.72 0.47 0.00 0.00 -1.16 -1.83 119.26 119.45 3g18 h ALA 216 Ca 0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3g18 h ALA 216 Cb 0.06 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3g18 h ALA 216 CO -0.01 0.21 -0.22 0.78 0.00 0.00 0.00 179.25 180.00 3g18 h GLY 217 N 0.66 -0.65 2.00 0.00 0.00 -0.11 -1.58 103.07 103.38 3g18 h GLY 217 Ca 0.24 0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.79 3g18 h GLY 217 CO -0.07 -0.24 -0.11 0.16 0.00 0.00 0.00 176.54 176.29 3g18 h ILE 218 N -0.83 0.89 -0.34 2.60 3.07 -1.27 -1.94 117.51 119.69 3g18 h ILE 218 Ca -0.06 -0.41 -0.17 0.00 1.55 0.00 0.00 64.86 65.77 3g18 h ILE 218 Cb 0.57 1.23 -0.00 0.00 -0.27 0.00 0.00 36.82 38.34 3g18 h ILE 218 CO 0.11 0.11 -0.46 0.40 -1.05 0.00 0.00 178.15 177.25 3g18 h ILE 219 N 0.00 1.27 -0.01 0.16 2.04 -1.21 -2.48 117.51 117.27 3g18 h ILE 219 Ca -0.00 -1.64 -0.01 0.00 1.00 0.00 0.00 64.86 64.20 3g18 h ILE 219 Cb 0.22 1.50 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 3g18 h ILE 219 CO 0.01 0.54 -0.06 -0.08 0.00 0.00 0.00 178.15 178.56 3g18 h GLU 220 N 0.71 0.02 0.00 2.37 4.81 -0.51 0.83 114.58 122.81 3g18 h GLU 220 Ca 0.04 -0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.15 3g18 h GLU 220 Cb 1.06 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 3g18 h GLU 220 CO 0.11 0.08 -0.54 1.03 -0.73 0.00 0.00 179.01 178.97 3g18 h SER 221 N 0.02 0.00 0.57 1.04 0.87 -1.14 -3.03 113.55 111.89 3g18 h SER 221 Ca 0.00 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.32 3g18 h SER 221 Cb 0.12 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.08 3g18 h SER 221 CO 0.01 0.54 -1.07 0.40 -0.53 0.00 0.00 176.83 176.18 3g18 h ILE 222 N 0.00 1.49 0.00 2.23 2.04 -0.48 -3.47 117.51 119.32 3g18 h ILE 222 Ca -0.01 -2.84 0.00 0.00 1.00 0.00 0.00 64.86 63.02 3g18 h ILE 222 Cb 1.09 2.70 0.00 0.00 -0.74 0.00 0.00 36.82 39.87 3g18 h ILE 222 CO 0.07 0.83 0.00 0.29 0.00 0.00 0.00 178.15 179.34