#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gx0 s ILE 2 N 0.00 5.34 -0.15 1.12 -1.09 -0.69 -1.54 121.20 124.20 3gx0 s ILE 2 Ca 0.00 0.26 -0.21 0.00 -2.23 0.00 0.00 60.65 58.47 3gx0 s ILE 2 Cb 0.00 -3.53 -0.03 0.00 -1.58 0.00 0.00 42.46 37.32 3gx0 s ILE 2 CO 0.00 0.35 0.64 -1.81 -1.23 0.00 0.00 174.94 172.88 3gx0 s ASP 3 N 0.95 6.79 -0.30 3.58 1.01 0.48 -1.65 116.67 127.53 3gx0 s ASP 3 Ca 0.09 0.95 -0.09 0.00 0.71 0.00 0.00 52.55 54.22 3gx0 s ASP 3 Cb -0.13 -2.36 -0.01 0.00 1.01 0.00 0.00 42.92 41.42 3gx0 s ASP 3 CO 0.04 -0.19 0.13 -0.22 0.21 0.00 0.00 175.17 175.14 3gx0 s LEU 4 N 1.40 3.95 -0.23 1.23 2.96 -0.08 -0.83 118.68 127.07 3gx0 s LEU 4 Ca 0.31 -0.46 -0.28 0.00 -0.22 0.00 0.00 54.13 53.49 3gx0 s LEU 4 Cb -0.16 -1.98 0.01 0.00 0.50 0.00 0.00 46.19 44.55 3gx0 s LEU 4 CO 0.13 -0.16 0.99 -0.31 -1.32 0.00 0.00 176.35 175.68 3gx0 s TYR 5 N 1.61 3.33 -0.06 5.38 1.51 0.99 -0.74 117.35 129.37 3gx0 s TYR 5 Ca 0.05 1.39 -0.05 0.00 -1.01 0.00 0.00 57.07 57.45 3gx0 s TYR 5 Cb -0.17 -3.22 0.02 0.00 -0.11 0.00 0.00 41.96 38.48 3gx0 s TYR 5 CO 0.06 -0.46 0.15 0.12 -1.11 0.00 0.00 175.55 174.31 3gx0 s PHE 6 N 3.11 -0.17 0.06 2.71 5.36 -0.97 -2.62 117.98 125.46 3gx0 s PHE 6 Ca 0.42 0.42 0.04 0.00 -0.96 0.00 0.00 56.93 56.84 3gx0 s PHE 6 Cb -0.15 0.05 -0.03 0.00 -0.34 0.00 0.00 43.02 42.55 3gx0 s PHE 6 CO 0.06 -0.09 -0.11 0.00 -1.46 0.00 0.00 175.22 173.63 3gx0 s ALA 7 N 0.16 0.91 -0.67 11.12 0.00 -1.26 -1.32 121.76 130.69 3gx0 s ALA 7 Ca -0.01 -0.93 -0.27 0.00 0.00 0.00 0.00 51.96 50.75 3gx0 s ALA 7 Cb -0.02 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.10 3gx0 s ALA 7 CO -0.00 0.05 1.49 -2.14 0.00 0.00 0.00 175.76 175.16 3gx0 s PRO 8 N -1.85 3.03 0.23 0.00 0.02 -1.26 -4.30 135.00 130.86 3gx0 s PRO 8 Ca -0.04 0.14 -0.14 0.00 0.02 0.00 0.00 61.00 60.98 3gx0 s PRO 8 Cb -0.09 -4.24 0.00 0.00 0.02 0.00 0.00 34.50 30.19 3gx0 s PRO 8 CO 0.01 -2.31 0.47 0.95 -0.33 0.00 0.00 177.00 175.80 3gx0 s THR 9 N 6.87 0.01 0.22 0.99 -4.23 -1.26 -5.02 115.64 113.22 3gx0 s THR 9 Ca 0.48 -1.28 -0.08 0.00 -1.18 0.00 0.00 61.69 59.63 3gx0 s THR 9 Cb -0.10 -2.04 0.17 0.00 1.34 0.00 0.00 72.50 71.87 3gx0 s THR 9 CO 0.18 -0.06 1.84 -0.65 -0.54 0.00 0.00 174.62 175.40 3gx0 h PRO 10 N 2.27 0.85 -0.24 3.99 0.11 -1.89 -0.61 132.00 136.48 3gx0 h PRO 10 Ca -0.27 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.64 3gx0 h PRO 10 Cb 1.25 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3gx0 h PRO 10 CO 0.37 0.56 -0.48 -0.91 -0.21 0.00 0.00 178.00 177.33 3gx0 h ASN 11 N 0.88 0.70 -0.35 -2.05 2.35 -1.93 -2.13 115.58 113.06 3gx0 h ASN 11 Ca 0.32 -0.35 -0.07 0.00 -0.55 0.00 0.00 56.30 55.66 3gx0 h ASN 11 Cb 0.10 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 3gx0 h ASN 11 CO -0.14 1.07 -0.04 1.23 -1.65 0.00 0.00 177.43 177.89 3gx0 h GLY 12 N 0.98 0.69 2.00 2.83 0.00 -1.72 -3.14 103.07 104.71 3gx0 h GLY 12 Ca 0.03 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 3gx0 h GLY 12 CO 0.10 0.50 -0.04 0.45 0.00 0.00 0.00 176.54 177.55 3gx0 h HIS 13 N 0.44 0.00 -0.97 5.60 3.86 -0.78 -2.26 115.15 121.04 3gx0 h HIS 13 Ca 0.09 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.34 3gx0 h HIS 13 Cb 0.52 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.93 3gx0 h HIS 13 CO 0.04 0.04 0.63 0.87 0.86 0.00 0.00 177.93 180.37 3gx0 h LYS 14 N 0.00 1.17 0.09 2.45 1.57 -1.34 -2.30 116.57 118.22 3gx0 h LYS 14 Ca -0.00 -0.07 -0.25 0.00 -1.87 0.00 0.00 60.65 58.46 3gx0 h LYS 14 Cb 0.18 -0.26 0.02 0.00 0.08 0.00 0.00 32.23 32.25 3gx0 h LYS 14 CO 0.00 0.78 -1.03 0.82 -0.57 0.00 0.00 179.45 179.45 3gx0 h ILE 15 N 1.21 1.35 -0.72 1.86 1.08 -1.54 -2.60 117.51 118.15 3gx0 h ILE 15 Ca 0.39 -2.38 0.03 0.00 -0.39 0.00 0.00 64.86 62.51 3gx0 h ILE 15 Cb 0.03 2.75 -0.04 0.00 -3.07 0.00 0.00 36.82 36.48 3gx0 h ILE 15 CO -0.12 0.71 0.45 0.71 -0.69 0.00 0.00 178.15 179.21 3gx0 h THR 16 N 0.09 1.10 -0.20 -0.27 1.35 -1.54 -0.50 112.91 112.94 3gx0 h THR 16 Ca -0.16 -0.30 0.05 0.00 -0.55 0.00 0.00 66.41 65.45 3gx0 h THR 16 Cb 1.74 0.14 -0.07 0.00 -1.73 0.00 0.00 68.15 68.23 3gx0 h THR 16 CO 0.20 0.16 -0.42 -0.07 -0.25 0.00 0.00 175.52 175.14 3gx0 h LEU 17 N 0.88 -1.33 -0.39 3.87 3.38 -1.46 -0.69 115.31 119.57 3gx0 h LEU 17 Ca 0.29 0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.46 3gx0 h LEU 17 Cb 0.02 0.55 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 3gx0 h LEU 17 CO -0.11 -0.41 0.22 0.15 0.09 0.00 0.00 178.44 178.39 3gx0 h PHE 18 N -0.44 0.41 -0.66 1.13 3.04 -1.04 0.02 116.94 119.41 3gx0 h PHE 18 Ca 0.09 0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.03 3gx0 h PHE 18 Cb 0.61 -0.13 -0.03 0.00 2.56 0.00 0.00 35.95 38.96 3gx0 h PHE 18 CO -0.52 0.24 0.33 -0.07 -2.02 0.00 0.00 178.31 176.26 3gx0 h LEU 19 N 0.45 0.85 -0.18 0.59 3.38 -0.73 0.35 115.31 120.03 3gx0 h LEU 19 Ca 0.16 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3gx0 h LEU 19 Cb 0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3gx0 h LEU 19 CO -0.08 0.74 0.03 -0.33 0.09 0.00 0.00 178.44 178.88 3gx0 h GLU 20 N 0.91 0.30 -0.77 1.13 4.39 -0.99 -1.45 114.58 118.09 3gx0 h GLU 20 Ca 0.23 -0.08 0.01 0.00 0.34 0.00 0.00 59.36 59.86 3gx0 h GLU 20 Cb 0.10 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.68 3gx0 h GLU 20 CO -0.03 0.46 0.51 0.93 -1.16 0.00 0.00 179.01 179.72 3gx0 h GLU 21 N 0.08 1.00 0.00 2.33 4.39 -0.32 -2.67 114.58 119.39 3gx0 h GLU 21 Ca 0.05 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3gx0 h GLU 21 Cb 0.31 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 3gx0 h GLU 21 CO 0.00 0.66 -0.00 0.00 -1.16 0.00 0.00 179.01 178.51 3gx0 n ALA 22 N -2.31 2.32 -3.28 3.43 0.00 0.12 -4.94 120.51 115.85 3gx0 n ALA 22 Ca 0.08 -0.08 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 3gx0 n ALA 22 Cb 0.02 -1.47 0.07 0.00 0.00 0.00 0.00 19.45 18.07 3gx0 n ALA 22 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3gx0 n GLU 23 N -1.75 -5.96 -3.63 0.00 1.02 -0.62 -5.01 120.64 104.70 3gx0 n GLU 23 Ca 0.07 0.68 -0.37 0.00 -0.02 0.00 0.00 57.16 57.51 3gx0 n GLU 23 Cb 0.37 -5.24 -0.06 0.00 -0.02 0.00 0.00 31.44 26.49 3gx0 n GLU 23 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3gx0 s LEU 24 N -5.84 4.37 0.25 -4.62 1.43 -0.77 -5.06 118.68 108.43 3gx0 s LEU 24 Ca 0.25 0.64 -0.31 0.00 -1.03 0.00 0.00 54.13 53.69 3gx0 s LEU 24 Cb -0.11 -2.35 -0.11 0.00 0.03 0.00 0.00 46.19 43.65 3gx0 s LEU 24 CO 0.59 0.27 1.63 -1.81 0.23 0.00 0.00 176.35 177.26 3gx0 s ASP 25 N -0.51 6.41 0.11 2.29 1.01 -1.26 -4.79 116.67 119.92 3gx0 s ASP 25 Ca 0.18 2.88 -0.21 0.00 0.71 0.00 0.00 52.55 56.12 3gx0 s ASP 25 Cb -0.14 -2.62 0.05 0.00 1.01 0.00 0.00 42.92 41.23 3gx0 s ASP 25 CO 0.07 -0.92 0.51 -0.72 0.21 0.00 0.00 175.17 174.33 3gx0 s TYR 26 N 0.50 -0.40 0.23 4.23 1.13 -1.26 -1.70 117.35 120.07 3gx0 s TYR 26 Ca 0.68 0.24 0.10 0.00 -1.41 0.00 0.00 57.07 56.68 3gx0 s TYR 26 Cb -0.48 0.40 -0.05 0.00 -1.10 0.00 0.00 41.96 40.73 3gx0 s TYR 26 CO 0.41 -0.74 -0.19 -0.98 -2.51 0.00 0.00 175.55 171.54 3gx0 s ARG 27 N -3.34 1.50 -0.26 -3.49 1.70 -0.66 -4.93 118.95 109.46 3gx0 s ARG 27 Ca -0.00 -1.62 -0.15 0.00 -0.47 0.00 0.00 55.73 53.49 3gx0 s ARG 27 Cb 0.00 -1.55 -0.04 0.00 -0.57 0.00 0.00 34.95 32.79 3gx0 s ARG 27 CO -0.09 0.30 0.36 -0.51 -1.08 0.00 0.00 175.30 174.28 3gx0 s LEU 28 N -3.18 4.05 -0.59 -1.89 1.43 -1.26 -0.91 118.68 116.34 3gx0 s LEU 28 Ca 0.24 0.29 -0.12 0.00 -1.03 0.00 0.00 54.13 53.51 3gx0 s LEU 28 Cb -0.05 -2.41 0.15 0.00 0.03 0.00 0.00 46.19 43.91 3gx0 s LEU 28 CO 0.11 -0.17 0.50 -0.63 0.23 0.00 0.00 176.35 176.39 3gx0 s ILE 29 N 1.98 4.81 0.00 -0.59 1.01 0.08 -4.95 121.20 123.55 3gx0 s ILE 29 Ca 0.15 -1.94 -0.37 0.00 0.00 0.00 0.00 60.65 58.49 3gx0 s ILE 29 Cb -0.16 -4.09 -0.15 0.00 0.01 0.00 0.00 42.46 38.07 3gx0 s ILE 29 CO 0.10 -0.87 1.53 0.29 0.00 0.00 0.00 174.94 175.98 3gx0 n LYS 30 N 4.70 1.45 -4.29 2.79 4.76 -1.26 -2.28 118.16 124.01 3gx0 n LYS 30 Ca -0.04 0.52 -0.34 0.00 -2.87 0.00 0.00 58.31 55.59 3gx0 n LYS 30 Cb 0.42 -2.22 -0.13 0.00 -1.84 0.00 0.00 35.03 31.25 3gx0 n LYS 30 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3gx0 s VAL 31 N 1.59 3.50 -0.51 -0.18 1.01 -0.43 -4.84 120.40 120.54 3gx0 s VAL 31 Ca 0.87 -0.48 -0.19 0.00 0.00 0.00 0.00 61.98 62.18 3gx0 s VAL 31 Cb -0.90 -2.54 0.06 0.00 0.00 0.00 0.00 36.38 32.99 3gx0 s VAL 31 CO 0.50 0.47 0.64 -0.62 0.00 0.00 0.00 175.10 176.09 3gx0 s ASP 32 N 0.82 6.23 0.10 3.32 -1.08 -1.26 -4.53 116.67 120.27 3gx0 s ASP 32 Ca -0.02 -0.87 0.12 0.00 -0.52 0.00 0.00 52.55 51.27 3gx0 s ASP 32 Cb -0.15 -2.30 -0.14 0.00 -1.46 0.00 0.00 42.92 38.88 3gx0 s ASP 32 CO 0.01 -0.91 1.05 -0.07 0.52 0.00 0.00 175.17 175.78 3gx0 h LEU 33 N 9.78 0.00 -0.47 -1.34 3.38 -1.96 0.41 115.31 125.11 3gx0 h LEU 33 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3gx0 h LEU 33 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3gx0 h LEU 33 CO 0.97 0.79 0.00 0.61 0.09 0.00 0.00 178.44 180.90 3gx0 n GLY 34 N 1.38 -1.43 0.39 0.83 0.00 -1.26 -3.24 105.19 101.87 3gx0 n GLY 34 Ca -0.06 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.09 3gx0 n GLY 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gx0 n LYS 35 N -2.26 2.11 -1.67 1.61 5.02 -1.11 -4.98 118.16 116.89 3gx0 n LYS 35 Ca 0.03 -2.55 -0.13 0.00 -2.02 0.00 0.00 58.31 53.64 3gx0 n LYS 35 Cb 0.30 -1.57 -0.04 0.00 -0.02 0.00 0.00 35.03 33.70 3gx0 n LYS 35 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gx0 n GLY 36 N -0.91 0.84 0.53 0.72 0.00 -1.03 -4.90 105.19 100.45 3gx0 n GLY 36 Ca 0.16 -0.40 0.36 0.00 0.00 0.00 0.00 46.02 46.14 3gx0 n GLY 36 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3gx0 h GLY 37 N 0.00 0.25 1.72 -0.02 0.00 -0.45 -1.45 103.07 103.12 3gx0 h GLY 37 Ca -0.28 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.02 3gx0 h GLY 37 CO 0.38 -0.05 0.00 0.61 0.00 0.00 0.00 176.54 177.48 3gx0 n GLN 38 N -4.24 0.26 0.00 4.80 0.00 -1.26 -2.31 117.38 114.63 3gx0 n GLN 38 Ca 0.29 0.02 0.09 0.00 0.00 0.00 0.00 57.00 57.40 3gx0 n GLN 38 Cb 1.30 -1.50 0.06 0.00 0.00 0.00 0.00 30.24 30.10 3gx0 n GLN 38 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3gx0 n PHE 39 N -1.36 0.00 -1.69 2.61 3.72 -0.55 -4.51 117.46 115.68 3gx0 n PHE 39 Ca 0.11 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 57.07 3gx0 n PHE 39 Cb 0.26 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.76 3gx0 n PHE 39 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3gx0 n ARG 40 N 0.73 2.50 -0.27 -1.08 1.74 -0.98 -4.83 116.66 114.47 3gx0 n ARG 40 Ca 0.10 0.90 0.12 0.00 -0.77 0.00 0.00 57.85 58.20 3gx0 n ARG 40 Cb 0.44 -2.74 0.37 0.00 -1.02 0.00 0.00 32.46 29.52 3gx0 n ARG 40 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3gx0 h PRO 41 N 7.17 0.69 -0.00 5.56 0.11 -1.93 0.13 132.00 143.73 3gx0 h PRO 41 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3gx0 h PRO 41 Cb 1.23 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3gx0 h PRO 41 CO 0.93 0.46 -0.00 -0.85 -0.21 0.00 0.00 178.00 178.32 3gx0 n GLU 42 N -4.56 0.34 0.01 1.05 0.00 -1.26 -1.84 120.64 114.37 3gx0 n GLU 42 Ca 0.17 -0.00 -0.20 0.00 0.00 0.00 0.00 57.16 57.13 3gx0 n GLU 42 Cb 0.46 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 30.26 3gx0 n GLU 42 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 3gx0 h PHE 43 N 0.01 0.43 0.00 -1.84 3.57 -1.11 -3.36 116.94 114.64 3gx0 h PHE 43 Ca 0.00 -0.32 -0.01 0.00 3.53 0.00 0.00 57.97 61.17 3gx0 h PHE 43 Cb 0.33 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.05 3gx0 h PHE 43 CO 0.00 1.67 -0.07 -0.07 -2.23 0.00 0.00 178.31 177.61 3gx0 h LEU 44 N 0.06 0.00 -0.39 0.59 3.38 -0.90 0.56 115.31 118.62 3gx0 h LEU 44 Ca -0.40 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.39 3gx0 h LEU 44 Cb 2.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.78 3gx0 h LEU 44 CO 0.09 0.07 -0.78 -0.09 0.09 0.00 0.00 178.44 177.82 3gx0 h ARG 45 N 0.00 0.29 0.12 1.13 9.65 -1.54 -2.30 114.38 121.73 3gx0 h ARG 45 Ca -0.00 -0.26 -0.28 0.00 -1.10 0.00 0.00 59.98 58.34 3gx0 h ARG 45 Cb 0.34 0.06 0.03 0.00 -1.39 0.00 0.00 29.97 29.01 3gx0 h ARG 45 CO 0.01 0.93 -1.17 0.82 2.80 0.00 0.00 179.97 183.37 3gx0 h ILE 46 N 0.19 1.31 -2.41 1.20 2.04 -1.08 -3.42 117.51 115.33 3gx0 h ILE 46 Ca -0.04 -2.45 -0.59 0.00 1.00 0.00 0.00 64.86 62.79 3gx0 h ILE 46 Cb 1.37 2.76 -0.38 0.00 -0.74 0.00 0.00 36.82 39.82 3gx0 h ILE 46 CO 0.13 0.74 -0.95 -0.55 0.00 0.00 0.00 178.15 177.51 3gx0 s SER 47 N -7.34 1.76 0.62 1.72 0.15 0.18 -4.36 113.70 106.43 3gx0 s SER 47 Ca -0.10 -2.86 0.40 0.00 0.70 0.00 0.00 55.95 54.08 3gx0 s SER 47 Cb 0.05 -0.42 2.02 0.00 -1.71 0.00 0.00 66.02 65.95 3gx0 s SER 47 CO 0.92 -0.20 2.23 -0.65 1.20 0.00 0.00 173.24 176.73 3gx0 h PRO 48 N 5.95 0.00 -0.05 5.44 0.11 -1.65 -2.34 132.00 139.47 3gx0 h PRO 48 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 3gx0 h PRO 48 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 3gx0 h PRO 48 CO 0.35 0.01 0.00 -1.71 -0.21 0.00 0.00 178.00 176.43 3gx0 n ASN 49 N -3.15 0.30 -3.36 -2.05 5.15 -1.26 -4.93 115.26 105.96 3gx0 n ASN 49 Ca -0.02 -1.87 -0.24 0.00 -0.60 0.00 0.00 54.58 51.85 3gx0 n ASN 49 Cb 0.16 -0.03 0.02 0.00 -0.53 0.00 0.00 39.78 39.39 3gx0 n ASN 49 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 3gx0 n ASN 50 N -0.40 -4.75 -4.20 1.20 6.94 -0.88 -5.01 115.26 108.16 3gx0 n ASN 50 Ca 0.05 -0.43 -0.15 0.00 -0.02 0.00 0.00 54.58 54.03 3gx0 n ASN 50 Cb 0.06 -3.86 -0.11 0.00 -2.36 0.00 0.00 39.78 33.52 3gx0 n ASN 50 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3gx0 s LYS 51 N -6.03 0.91 0.21 -3.83 1.02 -1.26 -4.85 119.74 105.90 3gx0 s LYS 51 Ca 0.42 -1.20 0.05 0.00 0.02 0.00 0.00 55.97 55.26 3gx0 s LYS 51 Cb -0.21 -0.63 -0.03 0.00 -0.52 0.00 0.00 37.83 36.44 3gx0 s LYS 51 CO 0.52 0.10 0.24 0.96 -0.92 0.00 0.00 175.35 176.25 3gx0 s ILE 52 N -2.45 4.83 0.63 2.17 -5.25 -1.26 -4.45 121.20 115.43 3gx0 s ILE 52 Ca 0.07 -1.08 -0.13 0.00 -0.99 0.00 0.00 60.65 58.52 3gx0 s ILE 52 Cb -0.03 -3.55 -0.02 0.00 2.95 0.00 0.00 42.46 41.80 3gx0 s ILE 52 CO 0.01 -0.23 1.05 -2.16 -1.79 0.00 0.00 174.94 171.81 3gx0 s PRO 53 N -3.57 3.26 0.03 0.37 0.04 -1.26 -4.75 135.00 129.12 3gx0 s PRO 53 Ca 0.33 1.01 -0.04 0.00 0.04 0.00 0.00 61.00 62.34 3gx0 s PRO 53 Cb -0.09 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.40 3gx0 s PRO 53 CO 0.26 -0.84 0.05 0.00 0.04 0.00 0.00 177.00 176.51 3gx0 s ALA 54 N -2.82 0.01 0.18 8.56 0.00 -1.08 -3.48 121.76 123.13 3gx0 s ALA 54 Ca 0.60 -0.56 0.09 0.00 0.00 0.00 0.00 51.96 52.08 3gx0 s ALA 54 Cb -0.14 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 3gx0 s ALA 54 CO 0.46 -0.26 -0.18 0.96 0.00 0.00 0.00 175.76 176.74 3gx0 s ILE 55 N -2.18 1.88 -0.20 0.00 -4.36 -0.08 -0.01 121.20 116.25 3gx0 s ILE 55 Ca -0.09 -1.98 0.01 0.00 -0.26 0.00 0.00 60.65 58.34 3gx0 s ILE 55 Cb -0.04 -1.90 0.03 0.00 1.25 0.00 0.00 42.46 41.80 3gx0 s ILE 55 CO -0.03 -0.33 -0.15 -0.69 0.24 0.00 0.00 174.94 173.97 3gx0 s VAL 56 N -2.14 1.93 -0.43 8.37 1.01 -0.01 -1.71 120.40 127.42 3gx0 s VAL 56 Ca 0.17 -1.06 -0.22 0.00 0.00 0.00 0.00 61.98 60.88 3gx0 s VAL 56 Cb -0.05 -1.87 0.02 0.00 0.00 0.00 0.00 36.38 34.48 3gx0 s VAL 56 CO 0.07 0.34 0.70 -0.62 0.00 0.00 0.00 175.10 175.59 3gx0 s ASP 57 N 1.30 6.37 0.19 3.32 2.15 0.18 -0.38 116.67 129.80 3gx0 s ASP 57 Ca 0.01 -0.18 0.26 0.00 0.43 0.00 0.00 52.55 53.07 3gx0 s ASP 57 Cb -0.15 -2.35 0.85 0.00 -0.30 0.00 0.00 42.92 40.97 3gx0 s ASP 57 CO -0.10 -0.80 1.79 1.41 -0.17 0.00 0.00 175.17 177.29 3gx0 n HIS 58 N 6.40 0.86 -3.34 -5.34 8.25 -0.59 -1.07 115.22 120.39 3gx0 n HIS 58 Ca -0.00 0.25 -0.26 0.00 -0.26 0.00 0.00 57.72 57.45 3gx0 n HIS 58 Cb 0.48 -0.91 -0.08 0.00 1.12 0.00 0.00 29.99 30.60 3gx0 n HIS 58 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3gx0 n SER 59 N -2.20 2.62 -4.77 0.41 7.64 -1.26 -4.62 113.62 111.44 3gx0 n SER 59 Ca 0.06 -3.21 -0.38 0.00 1.01 0.00 0.00 58.87 56.35 3gx0 n SER 59 Cb 0.42 -0.66 -0.00 0.00 -1.01 0.00 0.00 64.21 62.96 3gx0 n SER 59 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3gx0 s PRO 60 N -2.08 3.81 0.53 1.43 0.04 -1.26 -4.88 135.00 132.60 3gx0 s PRO 60 Ca 0.38 1.95 0.27 0.00 0.04 0.00 0.00 61.00 63.64 3gx0 s PRO 60 Cb 0.16 -2.55 1.47 0.00 0.04 0.00 0.00 34.50 33.62 3gx0 s PRO 60 CO -0.04 -0.56 1.80 0.00 0.04 0.00 0.00 177.00 178.24 3gx0 h ALA 61 N 2.28 1.20 -0.00 8.56 0.00 -1.98 0.42 119.26 129.74 3gx0 h ALA 61 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3gx0 h ALA 61 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3gx0 h ALA 61 CO 0.61 -0.20 -0.05 -0.40 0.00 0.00 0.00 179.25 179.21 3gx0 n ASP 62 N -2.62 0.52 -1.54 0.00 5.68 -1.26 -4.94 116.55 112.39 3gx0 n ASP 62 Ca -0.02 -0.85 -0.18 0.00 -0.50 0.00 0.00 54.79 53.24 3gx0 n ASP 62 Cb 0.26 -0.05 -0.06 0.00 -1.14 0.00 0.00 41.12 40.13 3gx0 n ASP 62 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3gx0 n GLY 63 N 1.18 1.29 0.00 6.12 0.00 0.15 -5.01 105.19 108.92 3gx0 n GLY 63 Ca 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3gx0 n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gx0 n GLY 64 N -0.82 0.54 3.62 -0.02 0.00 -1.26 -5.00 105.19 102.26 3gx0 n GLY 64 Ca -0.19 -1.74 -0.30 0.00 0.00 0.00 0.00 46.02 43.79 3gx0 n GLY 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gx0 s GLU 65 N 1.23 0.46 0.71 1.61 0.41 -1.26 -4.70 118.70 117.17 3gx0 s GLU 65 Ca 0.00 1.16 -0.16 0.00 -0.41 0.00 0.00 54.97 55.56 3gx0 s GLU 65 Cb 0.00 -1.69 0.00 0.00 -1.78 0.00 0.00 34.13 30.66 3gx0 s GLU 65 CO 0.00 -2.89 0.98 -2.30 -0.49 0.00 0.00 175.26 170.56 3gx0 n PRO 66 N -4.37 0.54 -5.14 0.39 -0.02 -1.26 -4.69 135.00 120.45 3gx0 n PRO 66 Ca 0.08 0.24 -0.32 0.00 -2.02 0.00 0.00 63.50 61.48 3gx0 n PRO 66 Cb 0.53 -2.23 -0.17 0.00 -0.02 0.00 0.00 33.50 31.61 3gx0 n PRO 66 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3gx0 s LEU 67 N -3.12 2.10 -0.04 2.45 2.96 -0.23 -4.92 118.68 117.88 3gx0 s LEU 67 Ca 0.74 -0.56 -0.11 0.00 -0.22 0.00 0.00 54.13 53.97 3gx0 s LEU 67 Cb -0.35 -1.42 -0.05 0.00 0.50 0.00 0.00 46.19 44.87 3gx0 s LEU 67 CO 0.50 0.15 0.30 -0.44 -1.32 0.00 0.00 176.35 175.54 3gx0 s SER 68 N 0.41 6.63 -0.02 3.68 0.01 -1.26 0.49 113.70 123.64 3gx0 s SER 68 Ca -0.17 0.75 -0.03 0.00 1.31 0.00 0.00 55.95 57.81 3gx0 s SER 68 Cb -0.18 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 63.88 3gx0 s SER 68 CO 0.07 0.34 0.07 -0.22 0.41 0.00 0.00 173.24 173.91 3gx0 s LEU 69 N -1.16 1.77 0.49 2.44 2.96 -0.69 -5.00 118.68 119.49 3gx0 s LEU 69 Ca 0.21 0.01 0.03 0.00 -0.22 0.00 0.00 54.13 54.16 3gx0 s LEU 69 Cb -0.15 0.29 -0.02 0.00 0.50 0.00 0.00 46.19 46.81 3gx0 s LEU 69 CO 0.11 -0.11 0.04 0.72 -1.32 0.00 0.00 176.35 175.79 3gx0 s PHE 70 N -0.37 2.00 0.00 5.38 -0.71 -1.26 -0.91 117.98 122.12 3gx0 s PHE 70 Ca -0.04 -0.88 0.00 0.00 -1.04 0.00 0.00 56.93 54.97 3gx0 s PHE 70 Cb -0.03 -1.68 0.00 0.00 -1.21 0.00 0.00 43.02 40.10 3gx0 s PHE 70 CO 0.00 0.22 0.00 0.39 -1.34 0.00 0.00 175.22 174.49 3gx0 n GLU 71 N -1.25 -0.39 -0.35 1.99 -0.58 -1.23 -4.44 120.64 114.41 3gx0 n GLU 71 Ca -0.15 0.74 0.12 0.00 -0.42 0.00 0.00 57.16 57.46 3gx0 n GLU 71 Cb 0.67 -0.77 0.31 0.00 -0.57 0.00 0.00 31.44 31.08 3gx0 n GLU 71 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3gx0 h SER 72 N 0.31 0.80 -0.58 1.62 4.64 -1.90 0.48 113.55 118.93 3gx0 h SER 72 Ca 0.00 0.09 -0.07 0.00 -0.47 0.00 0.00 61.79 61.33 3gx0 h SER 72 Cb 0.00 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.01 3gx0 h SER 72 CO 0.00 0.32 0.08 1.23 -0.87 0.00 0.00 176.83 177.58 3gx0 h GLY 73 N 0.80 1.04 2.00 -0.77 0.00 -1.97 0.38 103.07 104.56 3gx0 h GLY 73 Ca 0.56 -0.71 -0.16 0.00 0.00 0.00 0.00 47.33 47.02 3gx0 h GLY 73 CO -0.35 0.66 -0.76 0.00 0.00 0.00 0.00 176.54 176.08 3gx0 h ALA 74 N 1.00 0.70 -0.04 3.60 0.00 -1.34 -1.76 119.26 121.43 3gx0 h ALA 74 Ca 0.17 -0.69 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 3gx0 h ALA 74 Cb 0.44 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3gx0 h ALA 74 CO 0.01 0.95 -0.00 0.82 0.00 0.00 0.00 179.25 181.03 3gx0 h ILE 75 N 0.00 1.26 -0.41 0.00 2.04 -0.67 0.13 117.51 119.87 3gx0 h ILE 75 Ca -0.01 -0.80 0.03 0.00 1.00 0.00 0.00 64.86 65.09 3gx0 h ILE 75 Cb 1.38 1.72 -0.03 0.00 -0.74 0.00 0.00 36.82 39.15 3gx0 h ILE 75 CO 0.10 0.21 0.21 -0.07 0.00 0.00 0.00 178.15 178.60 3gx0 h LEU 76 N -0.24 0.31 -0.29 1.44 3.38 -0.93 0.16 115.31 119.14 3gx0 h LEU 76 Ca 0.01 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3gx0 h LEU 76 Cb 0.35 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3gx0 h LEU 76 CO 0.00 0.22 0.16 0.25 0.09 0.00 0.00 178.44 179.17 3gx0 h LEU 77 N 0.42 0.36 -0.38 1.67 5.85 -1.29 0.30 115.31 122.24 3gx0 h LEU 77 Ca 0.17 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3gx0 h LEU 77 Cb 0.07 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3gx0 h LEU 77 CO -0.11 0.34 0.25 0.22 -0.34 0.00 0.00 178.44 178.80 3gx0 h TYR 78 N 0.36 0.48 -0.42 1.25 3.20 -0.70 0.12 116.97 121.26 3gx0 h TYR 78 Ca 0.10 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.86 3gx0 h TYR 78 Cb 0.05 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 3gx0 h TYR 78 CO -0.03 0.30 -0.21 -0.07 -1.64 0.00 0.00 178.16 176.51 3gx0 h LEU 79 N 0.52 0.91 -0.69 2.82 3.38 -0.47 -0.53 115.31 121.25 3gx0 h LEU 79 Ca 0.14 -0.41 0.05 0.00 0.09 0.00 0.00 57.88 57.76 3gx0 h LEU 79 Cb -0.06 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.39 3gx0 h LEU 79 CO -0.03 1.11 0.40 0.00 0.09 0.00 0.00 178.44 180.01 3gx0 h ALA 80 N 0.82 0.92 -0.64 1.53 0.00 -0.21 -0.88 119.26 120.81 3gx0 h ALA 80 Ca 0.09 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3gx0 h ALA 80 Cb 0.77 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 3gx0 h ALA 80 CO 0.06 0.10 0.21 0.93 0.00 0.00 0.00 179.25 180.55 3gx0 h GLU 81 N 0.74 0.97 -0.14 0.00 5.08 -0.58 -0.43 114.58 120.21 3gx0 h GLU 81 Ca 0.30 -0.18 -0.21 0.00 -1.00 0.00 0.00 59.36 58.27 3gx0 h GLU 81 Cb 0.15 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3gx0 h GLU 81 CO -0.16 0.82 -0.74 -0.22 -1.00 0.00 0.00 179.01 177.71 3gx0 h LYS 82 N 0.94 0.69 0.00 2.33 3.64 -0.68 -3.25 116.57 120.24 3gx0 h LYS 82 Ca 0.21 -0.54 -0.05 0.00 -1.27 0.00 0.00 60.65 58.99 3gx0 h LYS 82 Cb 0.25 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 3gx0 h LYS 82 CO -0.01 1.16 -0.98 1.79 -2.27 0.00 0.00 179.45 179.14 3gx0 h THR 83 N 0.47 0.20 0.00 1.00 1.35 -1.20 -3.48 112.91 111.25 3gx0 h THR 83 Ca -0.04 -1.36 0.00 0.00 -0.55 0.00 0.00 66.41 64.46 3gx0 h THR 83 Cb 1.35 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 69.54 3gx0 h THR 83 CO 0.15 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 176.14 3gx0 n GLY 84 N 1.24 0.34 3.59 5.82 0.00 -0.18 -5.04 105.19 110.95 3gx0 n GLY 84 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 3gx0 n GLY 84 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gx0 s LEU 85 N 0.00 3.11 -1.35 0.99 1.43 -1.14 -4.66 118.68 117.07 3gx0 s LEU 85 Ca 0.00 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 52.85 3gx0 s LEU 85 Cb 0.00 -1.84 0.00 0.00 0.03 0.00 0.00 46.19 44.38 3gx0 s LEU 85 CO 0.00 0.24 0.00 0.49 0.23 0.00 0.00 176.35 177.31 3gx0 n PHE 86 N 1.18 0.00 -3.50 0.29 3.72 -1.26 -4.32 117.46 113.57 3gx0 n PHE 86 Ca -0.14 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.21 3gx0 n PHE 86 Cb 0.52 -2.37 -0.07 0.00 -0.94 0.00 0.00 39.48 36.62 3gx0 n PHE 86 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 3gx0 s LEU 87 N -2.89 -0.86 0.62 4.37 2.96 -1.26 -0.51 118.68 121.12 3gx0 s LEU 87 Ca 0.00 0.89 -0.18 0.00 -0.22 0.00 0.00 54.13 54.62 3gx0 s LEU 87 Cb 0.00 1.61 -0.03 0.00 0.50 0.00 0.00 46.19 48.27 3gx0 s LEU 87 CO 0.00 -0.25 1.19 -0.24 -1.32 0.00 0.00 176.35 175.73 3gx0 n SER 88 N 5.40 1.70 -0.54 3.68 2.88 -1.26 -4.95 113.62 120.52 3gx0 n SER 88 Ca -0.07 0.83 0.11 0.00 -1.33 0.00 0.00 58.87 58.42 3gx0 n SER 88 Cb 0.50 -1.50 0.01 0.00 -0.75 0.00 0.00 64.21 62.47 3gx0 n SER 88 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 3gx0 n HIS 89 N -1.78 0.00 -2.77 0.66 8.25 -1.26 -4.45 115.22 113.88 3gx0 n HIS 89 Ca 0.15 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.19 3gx0 n HIS 89 Cb 0.47 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.55 3gx0 n HIS 89 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 3gx0 s GLU 90 N -2.43 4.49 0.29 -0.41 -6.30 -1.26 -4.95 118.70 108.13 3gx0 s GLU 90 Ca 0.20 1.31 0.01 0.00 -2.50 0.00 0.00 54.97 53.98 3gx0 s GLU 90 Cb 0.18 -3.48 0.69 0.00 0.00 0.00 0.00 34.13 31.52 3gx0 s GLU 90 CO 0.55 -0.11 1.63 1.15 0.02 0.00 0.00 175.26 178.50 3gx0 h THR 91 N 4.88 0.26 0.01 -1.70 2.02 -1.99 0.39 112.91 116.79 3gx0 h THR 91 Ca -0.38 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 3gx0 h THR 91 Cb 1.19 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 3gx0 h THR 91 CO 0.78 0.03 -0.00 0.03 0.37 0.00 0.00 175.52 176.72 3gx0 h ARG 92 N 0.15 -0.01 -0.93 6.66 3.08 -1.98 -2.24 114.38 119.10 3gx0 h ARG 92 Ca 0.55 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.60 3gx0 h ARG 92 Cb 1.10 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.11 3gx0 h ARG 92 CO -0.70 0.79 0.60 1.49 -1.07 0.00 0.00 179.97 181.07 3gx0 h GLU 93 N -0.86 1.23 0.05 0.04 4.81 -1.79 -1.01 114.58 117.05 3gx0 h GLU 93 Ca -0.00 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3gx0 h GLU 93 Cb 0.80 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.91 3gx0 h GLU 93 CO 0.00 0.83 -0.03 -0.09 -0.73 0.00 0.00 179.01 179.00 3gx0 h ARG 94 N 1.27 -0.07 -0.37 1.92 2.43 -0.97 -0.49 114.38 118.10 3gx0 h ARG 94 Ca 0.34 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.54 3gx0 h ARG 94 Cb -0.12 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 3gx0 h ARG 94 CO -0.07 -0.04 0.18 0.00 -1.51 0.00 0.00 179.97 178.54 3gx0 h ALA 95 N 0.87 0.46 -0.52 2.80 0.00 -1.24 -0.98 119.26 120.65 3gx0 h ALA 95 Ca -0.01 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3gx0 h ALA 95 Cb 0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3gx0 h ALA 95 CO 0.01 -0.18 0.25 0.00 0.00 0.00 0.00 179.25 179.33 3gx0 h ALA 96 N 1.20 0.67 -0.50 0.00 0.00 -1.00 -0.47 119.26 119.16 3gx0 h ALA 96 Ca 0.16 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.02 3gx0 h ALA 96 Cb 0.07 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 3gx0 h ALA 96 CO -0.11 0.23 0.16 1.15 0.00 0.00 0.00 179.25 180.68 3gx0 h THR 97 N 0.70 0.80 -0.18 0.00 2.02 -0.77 -2.73 112.91 112.75 3gx0 h THR 97 Ca 0.18 -0.11 -0.08 0.00 0.77 0.00 0.00 66.41 67.17 3gx0 h THR 97 Cb 0.11 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 3gx0 h THR 97 CO -0.02 0.06 -0.18 -0.07 0.37 0.00 0.00 175.52 175.67 3gx0 h LEU 98 N 0.32 0.47 -0.78 2.58 3.38 -0.74 -0.71 115.31 119.83 3gx0 h LEU 98 Ca 0.24 -0.48 0.13 0.00 0.09 0.00 0.00 57.88 57.86 3gx0 h LEU 98 Cb 0.28 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 40.76 3gx0 h LEU 98 CO -0.27 0.85 -0.34 -0.61 0.09 0.00 0.00 178.44 178.17 3gx0 h GLN 99 N 0.09 -0.07 -0.03 1.13 4.15 -1.06 0.24 115.11 119.55 3gx0 h GLN 99 Ca 0.03 0.01 -0.15 0.00 0.77 0.00 0.00 58.65 59.31 3gx0 h GLN 99 Cb 0.73 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.42 3gx0 h GLN 99 CO 0.05 -0.05 -0.64 -1.49 -1.93 0.00 0.00 178.83 174.76 3gx0 h TRP 100 N -0.08 0.17 0.49 3.99 4.06 -1.35 0.76 115.95 124.00 3gx0 h TRP 100 Ca 0.30 -0.07 -0.02 0.00 2.06 0.00 0.00 58.89 61.16 3gx0 h TRP 100 Cb 0.58 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 28.71 3gx0 h TRP 100 CO -0.73 0.74 -0.24 1.25 -3.56 0.00 0.00 178.44 175.90 3gx0 h LEU 101 N 0.09 -0.56 -1.22 -4.49 5.85 -0.13 -0.99 115.31 113.87 3gx0 h LEU 101 Ca -0.01 -0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.73 3gx0 h LEU 101 Cb 1.15 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.28 3gx0 h LEU 101 CO 0.09 -0.32 0.55 -0.26 -0.34 0.00 0.00 178.44 178.16 3gx0 h PHE 102 N -0.77 0.97 -0.60 1.25 0.04 -0.53 -1.75 116.94 115.56 3gx0 h PHE 102 Ca -0.07 0.02 0.07 0.00 2.80 0.00 0.00 57.97 60.79 3gx0 h PHE 102 Cb 0.55 -0.32 -0.06 0.00 2.20 0.00 0.00 35.95 38.32 3gx0 h PHE 102 CO -0.02 0.54 0.29 2.35 -0.60 0.00 0.00 178.31 180.88 3gx0 h TRP 103 N 0.99 0.53 -0.57 -0.55 7.01 -0.62 0.35 115.95 123.08 3gx0 h TRP 103 Ca 0.34 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.33 3gx0 h TRP 103 Cb 0.11 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 27.00 3gx0 h TRP 103 CO -0.00 0.22 0.21 0.37 -2.79 0.00 0.00 178.44 176.45 3gx0 h GLN 104 N 0.54 0.87 -0.10 2.65 -0.00 -0.49 0.06 115.11 118.64 3gx0 h GLN 104 Ca 0.28 -0.17 -0.21 0.00 -0.00 0.00 0.00 58.65 58.55 3gx0 h GLN 104 Cb 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 27.48 27.59 3gx0 h GLN 104 CO -0.21 0.76 -0.80 0.28 0.00 0.00 0.00 178.83 178.86 3gx0 h VAL 105 N 0.79 1.32 0.00 2.39 2.07 -0.65 -0.29 116.25 121.89 3gx0 h VAL 105 Ca 0.19 -2.10 -0.10 0.00 0.82 0.00 0.00 66.70 65.51 3gx0 h VAL 105 Cb 0.23 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.08 3gx0 h VAL 105 CO -0.01 0.65 -1.20 1.23 0.02 0.00 0.00 177.57 178.25 3gx0 h GLY 106 N 0.87 0.00 0.00 2.17 0.00 -0.34 -3.39 103.07 102.38 3gx0 h GLY 106 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3gx0 h GLY 106 CO 0.15 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.30 3gx0 n GLY 107 N 1.30 0.07 0.28 4.60 0.00 -0.01 -4.68 105.19 106.76 3gx0 n GLY 107 Ca -0.05 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.93 3gx0 n GLY 107 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3gx0 h LEU 108 N 0.00 -0.79 0.02 0.99 5.85 -1.41 0.17 115.31 120.14 3gx0 h LEU 108 Ca 0.00 0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 3gx0 h LEU 108 Cb 0.00 0.44 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3gx0 h LEU 108 CO 0.00 -0.25 -0.01 1.23 -0.34 0.00 0.00 178.44 179.07 3gx0 h GLY 109 N -0.10 -0.02 0.68 3.75 0.00 -1.31 -1.58 103.07 104.48 3gx0 h GLY 109 Ca 0.24 0.01 0.05 0.00 0.00 0.00 0.00 47.33 47.64 3gx0 h GLY 109 CO -0.59 -0.01 0.30 -2.55 0.00 0.00 0.00 176.54 173.69 3gx0 h PRO 110 N -0.82 0.55 -0.09 4.80 0.11 -1.75 -1.55 132.00 133.25 3gx0 h PRO 110 Ca -0.00 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.87 3gx0 h PRO 110 Cb 0.75 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.73 3gx0 h PRO 110 CO 0.00 0.36 -0.78 0.52 -0.21 0.00 0.00 178.00 177.90 3gx0 h MET 111 N 0.57 0.53 -0.07 1.05 2.86 -1.00 -2.07 114.93 116.79 3gx0 h MET 111 Ca 0.26 -0.45 -0.12 0.00 -2.06 0.00 0.00 59.70 57.34 3gx0 h MET 111 Cb 0.18 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 3gx0 h MET 111 CO -0.18 1.08 -0.49 -0.07 1.06 0.00 0.00 176.91 178.30 3gx0 h LEU 112 N 0.35 0.20 -0.65 1.22 4.07 -1.31 -2.07 115.31 117.12 3gx0 h LEU 112 Ca -0.05 -0.10 -0.02 0.00 0.08 0.00 0.00 57.88 57.80 3gx0 h LEU 112 Cb 1.38 -0.06 -0.03 0.00 1.08 0.00 0.00 40.66 43.03 3gx0 h LEU 112 CO 0.14 0.67 0.32 1.23 -1.08 0.00 0.00 178.44 179.72 3gx0 h GLY 113 N 1.37 1.00 0.99 0.83 0.00 -1.13 0.31 103.07 106.44 3gx0 h GLY 113 Ca 0.01 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 3gx0 h GLY 113 CO 0.07 0.46 0.17 1.46 0.00 0.00 0.00 176.54 178.71 3gx0 h GLN 114 N 0.89 0.87 0.04 4.80 1.08 -1.25 0.07 115.11 121.61 3gx0 h GLN 114 Ca 0.22 -0.19 0.03 0.00 -1.45 0.00 0.00 58.65 57.26 3gx0 h GLN 114 Cb 0.11 -0.13 -0.05 0.00 -0.05 0.00 0.00 27.48 27.36 3gx0 h GLN 114 CO -0.03 0.79 -0.36 -0.97 -0.95 0.00 0.00 178.83 177.31 3gx0 h ASN 115 N 0.78 -1.08 -0.72 1.46 -0.73 -1.10 -1.08 115.58 113.11 3gx0 h ASN 115 Ca 0.18 0.13 0.07 0.00 1.87 0.00 0.00 56.30 58.55 3gx0 h ASN 115 Cb 0.29 0.42 -0.05 0.00 0.27 0.00 0.00 38.32 39.25 3gx0 h ASN 115 CO -0.01 -0.43 0.47 0.45 -0.37 0.00 0.00 177.43 177.55 3gx0 h HIS 116 N -0.54 0.74 0.12 0.67 3.86 -0.12 -2.61 115.15 117.26 3gx0 h HIS 116 Ca 0.05 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.27 3gx0 h HIS 116 Cb 0.61 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.84 3gx0 h HIS 116 CO -0.36 0.39 -0.06 1.25 0.86 0.00 0.00 177.93 180.01 3gx0 h HIS 117 N 0.73 -0.15 0.00 2.45 -0.00 -0.42 -1.86 115.15 115.90 3gx0 h HIS 117 Ca 0.31 -0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.64 3gx0 h HIS 117 Cb 0.29 0.05 -0.01 0.00 -0.00 0.00 0.00 27.41 27.75 3gx0 h HIS 117 CO -0.00 0.19 -0.22 0.74 -0.00 0.00 0.00 177.93 178.64 3gx0 h PHE 118 N -0.51 0.00 0.00 5.26 0.04 -1.13 0.45 116.94 121.05 3gx0 h PHE 118 Ca -0.02 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.72 3gx0 h PHE 118 Cb 0.41 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.55 3gx0 h PHE 118 CO 0.04 0.22 -1.71 0.09 -0.60 0.00 0.00 178.31 176.35 3gx0 n ASN 119 N -3.46 0.30 -0.03 2.17 4.13 -0.99 -4.56 115.26 112.83 3gx0 n ASN 119 Ca -0.00 0.12 0.00 0.00 1.68 0.00 0.00 54.58 56.37 3gx0 n ASN 119 Cb 0.39 1.37 0.00 0.00 -1.54 0.00 0.00 39.78 40.00 3gx0 n ASN 119 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 3gx0 n HIS 120 N -2.45 0.00 0.00 3.10 8.25 -0.70 -4.96 115.22 118.45 3gx0 n HIS 120 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 3gx0 n HIS 120 Cb 0.62 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.73 3gx0 n HIS 120 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3gx0 n ALA 121 N 0.00 1.88 -1.64 -1.41 0.00 -0.71 -4.98 120.51 113.66 3gx0 n ALA 121 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 52.97 3gx0 n ALA 121 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 3gx0 n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gx0 n ALA 122 N -2.00 0.54 -0.14 0.00 0.00 0.07 -4.91 120.51 114.07 3gx0 n ALA 122 Ca 0.00 0.45 -0.04 0.00 0.00 0.00 0.00 53.44 53.85 3gx0 n ALA 122 Cb 0.00 -2.23 0.02 0.00 0.00 0.00 0.00 19.45 17.25 3gx0 n ALA 122 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3gx0 h PRO 123 N 4.66 -0.04 -6.67 0.00 0.13 -1.96 -3.44 132.00 124.68 3gx0 h PRO 123 Ca -0.45 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.02 3gx0 h PRO 123 Cb 1.29 0.01 -0.19 0.00 0.13 0.00 0.00 31.00 32.24 3gx0 h PRO 123 CO 0.79 -0.03 -0.81 1.14 -0.23 0.00 0.00 178.00 178.86 3gx0 s GLN 124 N -6.19 1.61 -0.17 0.86 -2.07 -1.26 -5.11 119.66 107.33 3gx0 s GLN 124 Ca -0.14 -1.40 -0.29 0.00 -1.82 0.00 0.00 55.36 51.70 3gx0 s GLN 124 Cb 0.16 -1.94 -0.01 0.00 -1.09 0.00 0.00 33.01 30.13 3gx0 s GLN 124 CO 0.71 0.43 1.15 0.99 -1.32 0.00 0.00 175.29 177.25 3gx0 s THR 125 N -1.47 4.47 -0.77 3.63 2.01 -1.26 -5.00 115.64 117.25 3gx0 s THR 125 Ca 0.20 1.78 0.03 0.00 0.31 0.00 0.00 61.69 64.00 3gx0 s THR 125 Cb -0.09 -4.15 0.19 0.00 0.01 0.00 0.00 72.50 68.46 3gx0 s THR 125 CO 0.10 -0.12 0.59 -0.63 -0.69 0.00 0.00 174.62 173.86 3gx0 s ILE 126 N 3.08 3.37 0.32 1.82 -1.09 -1.26 -4.99 121.20 122.44 3gx0 s ILE 126 Ca 0.50 -4.17 0.07 0.00 -2.23 0.00 0.00 60.65 54.82 3gx0 s ILE 126 Cb -0.19 -3.16 0.31 0.00 -1.58 0.00 0.00 42.46 37.84 3gx0 s ILE 126 CO 0.13 -1.03 1.80 -0.65 -1.23 0.00 0.00 174.94 173.96 3gx0 h PRO 127 N 5.57 0.74 -0.64 2.79 0.11 -1.99 0.10 132.00 138.69 3gx0 h PRO 127 Ca 0.15 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 66.26 3gx0 h PRO 127 Cb 0.77 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 31.66 3gx0 h PRO 127 CO 0.76 0.49 0.37 -0.92 -0.21 0.00 0.00 178.00 178.49 3gx0 h TYR 128 N 0.76 0.69 0.09 0.65 5.03 -1.99 -1.11 116.97 121.08 3gx0 h TYR 128 Ca 0.54 0.02 -0.28 0.00 2.58 0.00 0.00 58.73 61.59 3gx0 h TYR 128 Cb 0.85 -0.21 0.03 0.00 1.55 0.00 0.00 36.73 38.94 3gx0 h TYR 128 CO -0.00 0.35 -1.16 0.00 -1.32 0.00 0.00 178.16 176.03 3gx0 h ALA 129 N 1.32 0.02 -0.51 1.82 0.00 -1.29 0.38 119.26 120.99 3gx0 h ALA 129 Ca 0.28 -0.74 0.06 0.00 0.00 0.00 0.00 54.91 54.50 3gx0 h ALA 129 Cb 0.12 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 3gx0 h ALA 129 CO -0.15 0.66 0.23 0.82 0.00 0.00 0.00 179.25 180.80 3gx0 h ILE 130 N 0.26 0.90 -0.19 0.00 2.04 -1.16 -1.24 117.51 118.13 3gx0 h ILE 130 Ca -0.17 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 3gx0 h ILE 130 Cb 1.83 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 3gx0 h ILE 130 CO 0.22 0.08 0.03 -0.08 0.00 0.00 0.00 178.15 178.40 3gx0 h GLU 131 N 0.44 0.32 -0.35 2.37 4.57 -1.14 -1.39 114.58 119.40 3gx0 h GLU 131 Ca 0.24 -0.09 0.06 0.00 -1.18 0.00 0.00 59.36 58.38 3gx0 h GLU 131 Cb 0.19 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.70 3gx0 h GLU 131 CO -0.20 0.48 0.05 -0.09 -1.18 0.00 0.00 179.01 178.07 3gx0 h ARG 132 N 0.10 0.16 0.00 1.92 2.43 -0.62 -1.60 114.38 116.77 3gx0 h ARG 132 Ca 0.06 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3gx0 h ARG 132 Cb 0.32 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3gx0 h ARG 132 CO 0.00 0.10 0.00 1.88 -1.51 0.00 0.00 179.97 180.45 3gx0 h TYR 133 N 0.16 0.00 -0.01 2.20 0.05 -1.23 -2.93 116.97 115.20 3gx0 h TYR 133 Ca 0.17 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.81 3gx0 h TYR 133 Cb 0.21 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.96 3gx0 h TYR 133 CO -0.20 0.00 -0.52 0.37 -1.05 0.00 0.00 178.16 176.75 3gx0 h GLN 134 N 0.00 0.38 -0.88 4.88 5.75 -0.85 -1.94 115.11 122.46 3gx0 h GLN 134 Ca 0.00 -0.39 0.01 0.00 -0.15 0.00 0.00 58.65 58.12 3gx0 h GLN 134 Cb 0.92 0.11 -0.04 0.00 1.07 0.00 0.00 27.48 29.54 3gx0 h GLN 134 CO 0.00 1.06 0.58 0.28 -2.65 0.00 0.00 178.83 178.10 3gx0 h VAL 135 N -0.15 1.22 -0.31 2.39 2.07 -1.34 -2.53 116.25 117.60 3gx0 h VAL 135 Ca -0.06 -0.40 -0.10 0.00 0.82 0.00 0.00 66.70 66.95 3gx0 h VAL 135 Cb 1.23 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 3gx0 h VAL 135 CO 0.10 0.22 -0.23 -0.08 0.02 0.00 0.00 177.57 177.60 3gx0 h GLU 136 N 1.18 0.60 -0.39 1.57 4.57 -1.57 -1.32 114.58 119.22 3gx0 h GLU 136 Ca 0.33 -0.23 0.01 0.00 -1.18 0.00 0.00 59.36 58.29 3gx0 h GLU 136 Cb -0.12 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.41 3gx0 h GLU 136 CO -0.08 0.79 0.24 1.15 -1.18 0.00 0.00 179.01 179.93 3gx0 h THR 137 N 0.53 1.06 -0.64 0.32 2.02 -1.15 -1.09 112.91 113.96 3gx0 h THR 137 Ca 0.08 -0.17 -0.05 0.00 0.77 0.00 0.00 66.41 67.04 3gx0 h THR 137 Cb 0.69 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 3gx0 h THR 137 CO 0.05 0.09 0.20 1.56 0.37 0.00 0.00 175.52 177.79 3gx0 h GLN 138 N 0.48 0.99 -0.85 6.66 4.20 -1.09 0.66 115.11 126.18 3gx0 h GLN 138 Ca 0.15 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 3gx0 h GLN 138 Cb -0.01 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.58 3gx0 h GLN 138 CO -0.06 0.87 0.52 -0.09 -0.67 0.00 0.00 178.83 179.40 3gx0 h ARG 139 N 0.92 1.14 -0.40 1.46 2.43 -1.14 0.13 114.38 118.93 3gx0 h ARG 139 Ca 0.21 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 3gx0 h ARG 139 Cb 0.29 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 3gx0 h ARG 139 CO -0.01 0.79 -0.05 -0.07 -1.51 0.00 0.00 179.97 179.13 3gx0 h LEU 140 N 1.16 0.73 -1.22 3.80 4.07 -0.49 -0.62 115.31 122.74 3gx0 h LEU 140 Ca 0.30 -0.34 -0.07 0.00 0.08 0.00 0.00 57.88 57.86 3gx0 h LEU 140 Cb -0.06 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.47 3gx0 h LEU 140 CO -0.06 0.89 -0.32 1.88 -1.08 0.00 0.00 178.44 179.76 3gx0 h TYR 141 N 0.55 0.00 -0.31 1.13 0.05 -0.68 -0.15 116.97 117.56 3gx0 h TYR 141 Ca 0.11 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.71 3gx0 h TYR 141 Cb 0.55 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.29 3gx0 h TYR 141 CO 0.04 0.32 -0.49 1.25 -1.05 0.00 0.00 178.16 178.23 3gx0 h HIS 142 N 0.00 1.06 0.06 4.88 2.76 -0.29 -0.78 115.15 122.82 3gx0 h HIS 142 Ca -0.00 -0.35 -0.00 0.00 -2.20 0.00 0.00 60.37 57.81 3gx0 h HIS 142 Cb 0.72 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.48 3gx0 h HIS 142 CO 0.00 1.17 -0.03 0.28 -1.30 0.00 0.00 177.93 178.05 3gx0 h VAL 143 N 0.67 1.13 -0.16 5.26 2.07 -0.71 -0.17 116.25 124.34 3gx0 h VAL 143 Ca 0.03 -0.62 0.05 0.00 0.82 0.00 0.00 66.70 66.98 3gx0 h VAL 143 Cb 1.09 1.54 -0.07 0.00 -1.52 0.00 0.00 31.29 32.33 3gx0 h VAL 143 CO 0.11 0.16 -0.31 0.25 0.02 0.00 0.00 177.57 177.80 3gx0 h LEU 144 N -0.35 -0.97 -0.22 2.57 5.85 -1.06 -2.10 115.31 119.02 3gx0 h LEU 144 Ca -0.01 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 3gx0 h LEU 144 Cb 0.31 0.42 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 3gx0 h LEU 144 CO 0.01 -0.35 0.14 -1.13 -0.34 0.00 0.00 178.44 176.78 3gx0 h ASN 145 N -0.37 0.27 -0.78 1.25 -1.24 -1.05 -1.88 115.58 111.78 3gx0 h ASN 145 Ca 0.10 -0.04 0.14 0.00 0.71 0.00 0.00 56.30 57.21 3gx0 h ASN 145 Cb 0.53 -0.07 -0.14 0.00 0.73 0.00 0.00 38.32 39.37 3gx0 h ASN 145 CO -0.37 0.23 -0.32 0.50 -1.29 0.00 0.00 177.43 176.18 3gx0 h LYS 146 N 0.28 -0.07 -0.02 6.67 3.64 -0.77 0.13 116.57 126.44 3gx0 h LYS 146 Ca 0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3gx0 h LYS 146 Cb 0.01 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3gx0 h LYS 146 CO -0.02 -0.04 0.01 -0.09 -2.27 0.00 0.00 179.45 177.04 3gx0 h ARG 147 N -0.07 0.02 0.00 1.90 9.65 -1.13 -3.05 114.38 121.70 3gx0 h ARG 147 Ca 0.31 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.19 3gx0 h ARG 147 Cb 0.58 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.16 3gx0 h ARG 147 CO -0.82 0.03 0.00 -0.07 2.80 0.00 0.00 179.97 181.91 3gx0 h LEU 148 N 0.01 0.00 -1.37 3.80 3.38 -0.49 0.15 115.31 120.79 3gx0 h LEU 148 Ca 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3gx0 h LEU 148 Cb 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3gx0 h LEU 148 CO -0.00 0.00 -0.23 -0.33 0.09 0.00 0.00 178.44 177.97 3gx0 h GLU 149 N 0.00 0.00 0.00 1.13 4.39 -0.66 -3.33 114.58 116.11 3gx0 h GLU 149 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3gx0 h GLU 149 Cb 0.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 3gx0 h GLU 149 CO 0.00 0.23 -0.72 0.09 -1.16 0.00 0.00 179.01 177.45 3gx0 n ASN 150 N -3.55 0.78 -3.78 1.42 3.02 0.46 -4.98 115.26 108.63 3gx0 n ASN 150 Ca -0.01 -0.70 -0.13 0.00 -0.03 0.00 0.00 54.58 53.72 3gx0 n ASN 150 Cb 0.38 1.08 -0.10 0.00 -0.61 0.00 0.00 39.78 40.52 3gx0 n ASN 150 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3gx0 s SER 151 N -2.35 -0.22 0.27 6.41 0.15 -0.78 -5.06 113.70 112.11 3gx0 s SER 151 Ca 0.04 0.33 -0.00 0.00 0.70 0.00 0.00 55.95 57.02 3gx0 s SER 151 Cb 0.09 0.46 0.36 0.00 -1.71 0.00 0.00 66.02 65.22 3gx0 s SER 151 CO 0.52 -0.23 1.74 1.55 1.20 0.00 0.00 173.24 178.01 3gx0 h PRO 152 N 4.99 0.67 -5.48 5.44 0.13 -1.81 -3.39 132.00 132.56 3gx0 h PRO 152 Ca -0.28 -0.21 -0.50 0.00 -0.87 0.00 0.00 66.00 64.15 3gx0 h PRO 152 Cb 1.19 -0.06 -0.14 0.00 0.13 0.00 0.00 31.00 32.12 3gx0 h PRO 152 CO 0.36 0.76 -0.66 -1.58 -0.23 0.00 0.00 178.00 176.65 3gx0 s TRP 153 N -4.78 1.99 0.30 1.56 0.52 -1.08 -4.98 118.94 112.47 3gx0 s TRP 153 Ca -0.08 -0.73 0.04 0.00 0.02 0.00 0.00 56.10 55.34 3gx0 s TRP 153 Cb 0.14 -1.18 0.47 0.00 -1.15 0.00 0.00 33.47 31.75 3gx0 s TRP 153 CO 0.80 0.25 1.75 -0.07 0.02 0.00 0.00 176.95 179.71 3gx0 h LEU 154 N 2.22 0.43 -0.67 2.99 3.38 -1.87 -3.08 115.31 118.71 3gx0 h LEU 154 Ca -0.40 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.43 3gx0 h LEU 154 Cb 1.24 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3gx0 h LEU 154 CO 0.68 0.67 -0.15 0.61 0.09 0.00 0.00 178.44 180.34 3gx0 n GLY 155 N -0.45 -0.38 0.00 0.83 0.00 -1.26 -4.70 105.19 99.24 3gx0 n GLY 155 Ca -0.00 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.60 3gx0 n GLY 155 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gx0 n GLY 156 N 1.27 0.50 0.00 -0.02 0.00 -1.17 -4.30 105.19 101.48 3gx0 n GLY 156 Ca 0.15 -1.48 0.15 0.00 0.00 0.00 0.00 46.02 44.84 3gx0 n GLY 156 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3gx0 n GLU 157 N 0.00 0.48 -4.74 1.61 -0.58 -1.26 -2.64 120.64 113.52 3gx0 n GLU 157 Ca 0.00 -0.01 -0.29 0.00 -0.42 0.00 0.00 57.16 56.44 3gx0 n GLU 157 Cb 0.00 -1.50 -0.14 0.00 -0.57 0.00 0.00 31.44 29.23 3gx0 n GLU 157 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 3gx0 s ASN 158 N -2.52 3.06 0.38 1.62 0.01 -1.26 -4.84 114.94 111.39 3gx0 s ASN 158 Ca 0.30 -0.61 -0.28 0.00 -0.71 0.00 0.00 52.86 51.56 3gx0 s ASN 158 Cb 0.20 -0.26 -0.10 0.00 0.41 0.00 0.00 41.25 41.50 3gx0 s ASN 158 CO 0.45 0.22 1.44 -0.47 -1.51 0.00 0.00 177.10 177.24 3gx0 s TYR 159 N -0.87 2.65 0.37 2.20 5.04 -1.26 -4.57 117.35 120.91 3gx0 s TYR 159 Ca 0.11 1.23 -0.05 0.00 -2.44 0.00 0.00 57.07 55.92 3gx0 s TYR 159 Cb -0.10 -3.94 0.02 0.00 0.35 0.00 0.00 41.96 38.29 3gx0 s TYR 159 CO 0.03 -2.77 0.56 -1.54 -1.34 0.00 0.00 175.55 170.49 3gx0 s SER 160 N -0.27 0.80 0.58 4.32 1.04 -1.26 -4.67 113.70 114.24 3gx0 s SER 160 Ca 0.53 -1.46 0.39 0.00 0.48 0.00 0.00 55.95 55.89 3gx0 s SER 160 Cb -0.45 0.73 2.06 0.00 0.10 0.00 0.00 66.02 68.46 3gx0 s SER 160 CO 0.60 -1.43 2.18 0.16 0.98 0.00 0.00 173.24 175.74 3gx0 h ILE 161 N 2.06 0.00 -0.16 -1.02 3.07 -1.15 -1.76 117.51 118.55 3gx0 h ILE 161 Ca -0.29 -0.04 -0.04 0.00 1.55 0.00 0.00 64.86 66.04 3gx0 h ILE 161 Cb 1.24 0.92 -0.00 0.00 -0.27 0.00 0.00 36.82 38.71 3gx0 h ILE 161 CO 0.39 0.00 -0.05 0.00 -1.05 0.00 0.00 178.15 177.45 3gx0 h ALA 162 N 2.01 0.22 -0.24 0.16 0.00 -1.84 0.15 119.26 119.72 3gx0 h ALA 162 Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 3gx0 h ALA 162 Cb 0.05 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3gx0 h ALA 162 CO 0.00 -0.01 0.03 -0.44 0.00 0.00 0.00 179.25 178.83 3gx0 h ASP 163 N 0.01 0.40 -0.72 0.00 3.32 -1.81 -2.16 116.42 115.45 3gx0 h ASP 163 Ca 0.04 -0.27 0.04 0.00 0.02 0.00 0.00 57.03 56.85 3gx0 h ASP 163 Cb 0.49 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.88 3gx0 h ASP 163 CO 0.02 0.57 0.45 0.40 -1.72 0.00 0.00 179.24 178.95 3gx0 h ILE 164 N 0.21 1.08 -0.69 0.35 2.04 -1.32 -0.19 117.51 118.98 3gx0 h ILE 164 Ca 0.07 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 3gx0 h ILE 164 Cb 0.35 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 3gx0 h ILE 164 CO 0.01 0.16 0.31 0.00 0.00 0.00 0.00 178.15 178.62 3gx0 h ALA 165 N 1.32 1.24 0.05 1.87 0.00 -0.88 -3.22 119.26 119.63 3gx0 h ALA 165 Ca 0.30 -0.16 -0.26 0.00 0.00 0.00 0.00 54.91 54.79 3gx0 h ALA 165 Cb 0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3gx0 h ALA 165 CO -0.12 0.57 -1.28 0.00 0.00 0.00 0.00 179.25 178.42 3gx0 h TRP 167 N 0.03 -0.54 -0.19 0.00 7.01 -1.05 -1.27 115.95 119.93 3gx0 h TRP 167 Ca -0.13 0.02 0.06 0.00 2.11 0.00 0.00 58.89 60.94 3gx0 h TRP 167 Cb 1.90 0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 29.19 3gx0 h TRP 167 CO 0.02 -0.29 0.18 -1.35 -2.79 0.00 0.00 178.44 174.21 3gx0 h PRO 168 N -0.35 0.00 -0.09 2.65 0.11 -1.78 0.20 132.00 132.73 3gx0 h PRO 168 Ca 0.05 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.93 3gx0 h PRO 168 Cb 0.41 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.53 3gx0 h PRO 168 CO -0.17 0.00 -0.84 -1.49 -0.21 0.00 0.00 178.00 175.29 3gx0 h TRP 169 N 0.00 0.93 -0.26 0.65 4.06 -1.50 -3.05 115.95 116.78 3gx0 h TRP 169 Ca 0.09 -0.44 -0.12 0.00 2.06 0.00 0.00 58.89 60.48 3gx0 h TRP 169 Cb 0.45 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.47 3gx0 h TRP 169 CO 0.00 1.26 -0.36 0.28 -3.56 0.00 0.00 178.44 176.06 3gx0 h VAL 170 N 0.43 1.29 0.00 1.49 2.07 -0.45 -2.85 116.25 118.23 3gx0 h VAL 170 Ca -0.07 -1.49 0.00 0.00 0.82 0.00 0.00 66.70 65.96 3gx0 h VAL 170 Cb 1.47 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.72 3gx0 h VAL 170 CO 0.16 0.47 0.00 -3.20 0.02 0.00 0.00 177.57 175.03 3gx0 n ASN 171 N -4.05 0.03 -1.72 0.57 2.85 0.54 -0.93 115.26 112.56 3gx0 n ASN 171 Ca -0.01 0.51 0.04 0.00 -0.11 0.00 0.00 54.58 55.01 3gx0 n ASN 171 Cb 0.49 -0.52 0.35 0.00 1.24 0.00 0.00 39.78 41.34 3gx0 n ASN 171 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3gx0 n ALA 172 N -1.51 3.92 -0.11 5.20 0.00 -1.08 -4.65 120.51 122.28 3gx0 n ALA 172 Ca 0.01 -2.15 0.11 0.00 0.00 0.00 0.00 53.44 51.42 3gx0 n ALA 172 Cb 0.08 -1.07 0.47 0.00 0.00 0.00 0.00 19.45 18.93 3gx0 n ALA 172 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 3gx0 h TRP 173 N 3.17 0.51 -0.08 0.00 5.08 -1.15 -1.28 115.95 122.20 3gx0 h TRP 173 Ca 0.07 0.01 -0.01 0.00 1.08 0.00 0.00 58.89 60.05 3gx0 h TRP 173 Cb 1.97 -0.17 -0.00 0.00 -3.00 0.00 0.00 29.16 27.96 3gx0 h TRP 173 CO 1.04 0.24 0.02 0.00 -1.28 0.00 0.00 178.44 178.46 3gx0 h THR 174 N 0.48 1.04 0.00 0.12 1.03 -1.83 0.13 112.91 113.88 3gx0 h THR 174 Ca 0.30 -0.13 0.00 0.00 -0.01 0.00 0.00 66.41 66.57 3gx0 h THR 174 Cb 0.53 0.95 0.00 0.00 -1.07 0.00 0.00 68.15 68.56 3gx0 h THR 174 CO -0.09 0.05 0.00 0.54 -0.01 0.00 0.00 175.52 176.01 3gx0 n ARG 175 N -4.50 0.56 -0.02 0.00 5.12 -0.48 -4.02 116.66 113.32 3gx0 n ARG 175 Ca -0.02 0.02 0.06 0.00 -1.93 0.00 0.00 57.85 55.98 3gx0 n ARG 175 Cb 0.11 -1.50 0.06 0.00 -1.16 0.00 0.00 32.46 29.97 3gx0 n ARG 175 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 3gx0 n GLN 176 N -1.19 0.94 -3.67 5.56 6.02 0.03 -4.77 117.38 120.30 3gx0 n GLN 176 Ca 0.16 -1.33 -0.21 0.00 -0.01 0.00 0.00 57.00 55.62 3gx0 n GLN 176 Cb 0.18 -1.24 0.04 0.00 1.02 0.00 0.00 30.24 30.23 3gx0 n GLN 176 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3gx0 n ARG 177 N 0.68 -5.06 -4.79 -1.09 1.74 -1.22 -4.99 116.66 101.93 3gx0 n ARG 177 Ca 0.08 0.65 -0.33 0.00 -0.77 0.00 0.00 57.85 57.48 3gx0 n ARG 177 Cb 0.32 -5.25 -0.15 0.00 -1.02 0.00 0.00 32.46 26.36 3gx0 n ARG 177 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gx0 s ILE 178 N -3.63 2.82 -0.51 0.55 -1.09 -1.22 -5.08 121.20 113.03 3gx0 s ILE 178 Ca 0.01 -0.74 -0.23 0.00 -2.23 0.00 0.00 60.65 57.46 3gx0 s ILE 178 Cb -0.00 -2.17 0.04 0.00 -1.58 0.00 0.00 42.46 38.74 3gx0 s ILE 178 CO 0.80 0.53 0.84 -0.62 -1.23 0.00 0.00 174.94 175.26 3gx0 s ASP 179 N 0.45 6.35 0.54 3.58 2.15 -1.26 -4.68 116.67 123.79 3gx0 s ASP 179 Ca -0.11 -0.35 0.21 0.00 0.43 0.00 0.00 52.55 52.72 3gx0 s ASP 179 Cb -0.16 -2.40 1.41 0.00 -0.30 0.00 0.00 42.92 41.47 3gx0 s ASP 179 CO 0.05 -1.07 2.13 0.25 -0.17 0.00 0.00 175.17 176.36 3gx0 h LEU 180 N 10.50 0.00 -1.41 -1.34 5.85 -1.94 0.11 115.31 127.08 3gx0 h LEU 180 Ca -0.26 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.46 3gx0 h LEU 180 Cb 1.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.11 3gx0 h LEU 180 CO 1.03 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 179.13 3gx0 h ALA 181 N 1.92 1.00 0.00 1.25 0.00 -1.98 -1.05 119.26 120.41 3gx0 h ALA 181 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3gx0 h ALA 181 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3gx0 h ALA 181 CO -0.00 0.00 0.00 -1.33 0.00 0.00 0.00 179.25 177.92 3gx0 n MET 182 N -2.45 0.20 -3.47 0.00 2.81 0.03 -4.00 117.12 110.25 3gx0 n MET 182 Ca -0.00 0.36 -0.26 0.00 -1.81 0.00 0.00 57.70 55.99 3gx0 n MET 182 Cb 0.13 -1.84 -0.09 0.00 -0.71 0.00 0.00 33.22 30.71 3gx0 n MET 182 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3gx0 n TYR 183 N -2.21 1.51 -0.34 2.03 4.01 -0.40 -4.99 117.16 116.77 3gx0 n TYR 183 Ca 0.03 -3.85 0.07 0.00 -0.16 0.00 0.00 57.90 53.98 3gx0 n TYR 183 Cb 0.28 -0.34 0.23 0.00 -0.31 0.00 0.00 39.34 39.19 3gx0 n TYR 183 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3gx0 h PRO 184 N 4.74 0.87 -0.68 -0.72 0.13 -1.71 0.13 132.00 134.77 3gx0 h PRO 184 Ca 0.17 -0.05 -0.08 0.00 -0.87 0.00 0.00 66.00 65.17 3gx0 h PRO 184 Cb 0.79 -0.20 -0.03 0.00 0.13 0.00 0.00 31.00 31.70 3gx0 h PRO 184 CO 0.61 0.58 0.11 0.00 -0.23 0.00 0.00 178.00 179.07 3gx0 h ALA 185 N 1.53 0.90 -0.43 -0.56 0.00 -1.91 0.83 119.26 119.61 3gx0 h ALA 185 Ca 0.48 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 3gx0 h ALA 185 Cb 0.51 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3gx0 h ALA 185 CO -0.28 0.66 0.09 0.28 0.00 0.00 0.00 179.25 180.00 3gx0 h VAL 186 N 1.04 1.24 -0.52 0.00 2.07 -1.57 -1.22 116.25 117.29 3gx0 h VAL 186 Ca 0.21 -0.84 0.02 0.00 0.82 0.00 0.00 66.70 66.90 3gx0 h VAL 186 Cb 0.44 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 3gx0 h VAL 186 CO 0.01 0.30 0.31 0.50 0.02 0.00 0.00 177.57 178.71 3gx0 h LYS 187 N 0.57 0.61 -0.41 1.57 3.64 -0.44 0.29 116.57 122.40 3gx0 h LYS 187 Ca 0.13 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.35 3gx0 h LYS 187 Cb 0.35 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3gx0 h LYS 187 CO 0.00 0.40 -0.25 -0.91 -2.27 0.00 0.00 179.45 176.43 3gx0 h ASN 188 N 0.63 0.86 -0.26 4.20 2.35 -0.64 -2.16 115.58 120.55 3gx0 h ASN 188 Ca 0.21 -0.33 -0.11 0.00 -0.55 0.00 0.00 56.30 55.52 3gx0 h ASN 188 Cb 0.01 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 3gx0 h ASN 188 CO -0.09 1.06 -0.22 -0.25 -1.65 0.00 0.00 177.43 176.28 3gx0 h TRP 189 N 0.72 0.83 -0.70 1.19 7.01 -0.95 0.78 115.95 124.83 3gx0 h TRP 189 Ca 0.09 -0.18 -0.02 0.00 2.11 0.00 0.00 58.89 60.89 3gx0 h TRP 189 Cb 0.78 -0.20 -0.03 0.00 -2.10 0.00 0.00 29.16 27.61 3gx0 h TRP 189 CO 0.04 0.89 0.37 1.25 -2.79 0.00 0.00 178.44 178.21 3gx0 h HIS 190 N 0.64 0.97 0.12 2.65 2.76 -0.22 -2.00 115.15 120.06 3gx0 h HIS 190 Ca 0.09 -0.03 -0.28 0.00 -2.20 0.00 0.00 60.37 57.96 3gx0 h HIS 190 Cb 0.72 -0.31 0.01 0.00 1.55 0.00 0.00 27.41 29.38 3gx0 h HIS 190 CO 0.04 0.69 -1.21 1.49 -1.30 0.00 0.00 177.93 177.64 3gx0 h GLU 191 N 0.96 0.39 -0.83 5.26 4.57 -1.05 -1.22 114.58 122.67 3gx0 h GLU 191 Ca 0.24 -0.58 0.09 0.00 -1.18 0.00 0.00 59.36 57.93 3gx0 h GLU 191 Cb 0.05 0.20 -0.07 0.00 -0.16 0.00 0.00 28.75 28.77 3gx0 h GLU 191 CO -0.04 1.25 0.49 -0.09 -1.18 0.00 0.00 179.01 179.44 3gx0 h ARG 192 N 0.15 0.81 0.05 1.92 2.43 -0.68 -1.90 114.38 117.16 3gx0 h ARG 192 Ca -0.15 -0.05 -0.23 0.00 -0.81 0.00 0.00 59.98 58.74 3gx0 h ARG 192 Cb 1.90 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 31.25 3gx0 h ARG 192 CO 0.21 0.54 -1.07 0.82 -1.51 0.00 0.00 179.97 178.96 3gx0 h ILE 193 N 0.84 1.58 -0.77 1.20 2.04 -1.20 -2.86 117.51 118.34 3gx0 h ILE 193 Ca 0.39 -3.11 0.10 0.00 1.00 0.00 0.00 64.86 63.24 3gx0 h ILE 193 Cb 0.32 2.81 -0.05 0.00 -0.74 0.00 0.00 36.82 39.16 3gx0 h ILE 193 CO -0.23 0.90 0.51 -0.09 0.00 0.00 0.00 178.15 179.24 3gx0 h ARG 194 N 0.05 0.66 -0.08 2.37 2.43 -0.87 -2.71 114.38 116.23 3gx0 h ARG 194 Ca -0.07 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 3gx0 h ARG 194 Cb 1.79 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 31.20 3gx0 h ARG 194 CO 0.16 0.44 0.00 -1.13 -1.51 0.00 0.00 179.97 177.93 3gx0 n SER 195 N -4.50 1.80 -4.75 -3.80 3.41 -0.75 -4.29 113.62 100.74 3gx0 n SER 195 Ca 0.13 -1.64 -0.41 0.00 -0.26 0.00 0.00 58.87 56.69 3gx0 n SER 195 Cb 0.34 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.22 3gx0 n SER 195 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3gx0 s ARG 196 N -1.91 4.41 0.38 4.33 0.52 -1.02 -4.94 118.95 120.72 3gx0 s ARG 196 Ca 0.35 2.08 0.12 0.00 -0.52 0.00 0.00 55.73 57.77 3gx0 s ARG 196 Cb 0.20 -3.14 0.92 0.00 0.52 0.00 0.00 34.95 33.44 3gx0 s ARG 196 CO 0.31 -0.16 1.87 -1.35 0.02 0.00 0.00 175.30 175.99 3gx0 h PRO 197 N 4.37 0.56 -0.11 3.54 0.11 -1.90 -2.18 132.00 136.39 3gx0 h PRO 197 Ca -0.47 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.46 3gx0 h PRO 197 Cb 1.22 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 3gx0 h PRO 197 CO 0.71 0.37 -0.60 0.00 -0.21 0.00 0.00 178.00 178.28 3gx0 h ALA 198 N 1.61 0.77 -0.05 -0.75 0.00 -1.92 -0.30 119.26 118.63 3gx0 h ALA 198 Ca 0.45 -0.54 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3gx0 h ALA 198 Cb 0.86 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3gx0 h ALA 198 CO -0.20 0.71 0.02 1.15 0.00 0.00 0.00 179.25 180.94 3gx0 h THR 199 N 0.27 1.12 -0.56 0.00 2.02 -1.71 0.38 112.91 114.44 3gx0 h THR 199 Ca -0.00 -0.35 0.11 0.00 0.77 0.00 0.00 66.41 66.93 3gx0 h THR 199 Cb 1.12 1.27 -0.11 0.00 -1.74 0.00 0.00 68.15 68.69 3gx0 h THR 199 CO 0.10 0.10 -0.17 1.23 0.37 0.00 0.00 175.52 177.15 3gx0 h GLY 200 N -0.06 0.34 0.83 2.16 0.00 -1.12 0.86 103.07 106.08 3gx0 h GLY 200 Ca 0.02 0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.60 3gx0 h GLY 200 CO -0.00 -0.22 0.28 1.46 0.00 0.00 0.00 176.54 178.06 3gx0 h GLN 201 N -0.03 0.54 0.00 4.80 1.08 -0.67 -2.24 115.11 118.58 3gx0 h GLN 201 Ca 0.27 -0.03 -0.05 0.00 -1.45 0.00 0.00 58.65 57.38 3gx0 h GLN 201 Cb 0.44 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.74 3gx0 h GLN 201 CO -0.60 0.35 -0.26 0.00 -0.95 0.00 0.00 178.83 177.38 3gx0 h ALA 202 N 1.23 1.51 -0.00 3.87 0.00 -0.07 -2.64 119.26 123.16 3gx0 h ALA 202 Ca 0.20 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3gx0 h ALA 202 Cb 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3gx0 h ALA 202 CO -0.11 0.33 -0.02 1.28 0.00 0.00 0.00 179.25 180.73 3gx0 n LEU 203 N -4.14 0.06 -0.94 0.00 4.32 0.22 -4.99 117.00 111.52 3gx0 n LEU 203 Ca -0.02 0.24 0.12 0.00 -0.02 0.00 0.00 56.01 56.33 3gx0 n LEU 203 Cb 0.32 -0.26 0.12 0.00 -1.62 0.00 0.00 43.42 41.97 3gx0 n LEU 203 CO 0.37 0.01 0.64 0.18 -1.22 0.00 0.00 177.39 177.37