#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xg3 s HIS 4 N 0.00 3.21 -0.24 -1.77 5.65 -1.26 -5.03 115.29 115.86 1xg3 s HIS 4 Ca 0.00 1.53 0.02 0.00 0.25 0.00 0.00 55.06 56.85 1xg3 s HIS 4 Cb 0.00 -3.51 0.06 0.00 -1.18 0.00 0.00 32.58 27.95 1xg3 s HIS 4 CO 0.00 -1.36 -0.08 0.45 -0.65 0.00 0.00 174.74 173.09 1xg3 s SER 5 N -0.72 3.99 0.25 9.88 0.15 -1.26 -5.00 113.70 120.99 1xg3 s SER 5 Ca 0.49 -1.21 -0.04 0.00 0.70 0.00 0.00 55.95 55.90 1xg3 s SER 5 Cb -0.36 -1.33 0.39 0.00 -1.71 0.00 0.00 66.02 63.01 1xg3 s SER 5 CO 0.47 -0.20 1.86 -0.65 1.20 0.00 0.00 173.24 175.91 1xg3 h PRO 6 N 7.89 1.01 -0.76 5.44 0.11 -1.89 -1.60 132.00 142.19 1xg3 h PRO 6 Ca -0.20 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 65.90 1xg3 h PRO 6 Cb 1.06 -0.23 -0.05 0.00 0.11 0.00 0.00 31.00 31.89 1xg3 h PRO 6 CO 0.44 0.67 0.46 0.78 -0.21 0.00 0.00 178.00 180.14 1xg3 h GLY 7 N 1.04 1.12 1.02 -0.55 0.00 -1.76 0.26 103.07 104.19 1xg3 h GLY 7 Ca 0.41 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 1xg3 h GLY 7 CO -0.19 0.24 0.44 1.70 0.00 0.00 0.00 176.54 178.73 1xg3 h LYS 8 N 0.86 1.13 -0.56 4.80 3.64 -1.44 -1.76 116.57 123.25 1xg3 h LYS 8 Ca 0.33 -0.14 -0.06 0.00 -1.27 0.00 0.00 60.65 59.51 1xg3 h LYS 8 Cb 0.13 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 1xg3 h LYS 8 CO -0.16 0.84 0.08 0.00 -2.27 0.00 0.00 179.45 177.95 1xg3 h ALA 9 N 1.23 1.10 -0.28 5.00 0.00 -0.60 -1.10 119.26 124.62 1xg3 h ALA 9 Ca 0.28 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1xg3 h ALA 9 Cb 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1xg3 h ALA 9 CO -0.04 0.59 0.12 0.35 0.00 0.00 0.00 179.25 180.26 1xg3 h PHE 10 N 0.84 0.42 -0.46 0.00 3.57 -0.46 -0.11 116.94 120.74 1xg3 h PHE 10 Ca 0.17 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 1xg3 h PHE 10 Cb 0.38 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 1xg3 h PHE 10 CO 0.02 0.41 0.09 0.00 -2.23 0.00 0.00 178.31 176.60 1xg3 h ARG 11 N 0.31 0.70 -0.54 1.11 3.08 -1.12 -2.02 114.38 115.90 1xg3 h ARG 11 Ca 0.09 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 1xg3 h ARG 11 Cb 0.16 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1xg3 h ARG 11 CO -0.01 0.66 0.06 0.00 -1.07 0.00 0.00 179.97 179.61 1xg3 h ALA 12 N 1.42 0.72 -0.59 0.04 0.00 -0.80 -2.67 119.26 117.38 1xg3 h ALA 12 Ca 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1xg3 h ALA 12 Cb 0.29 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1xg3 h ALA 12 CO 0.00 0.49 0.31 0.00 0.00 0.00 0.00 179.25 180.05 1xg3 h ALA 13 N 0.98 1.44 -0.59 0.00 0.00 -0.37 -2.46 119.26 118.26 1xg3 h ALA 13 Ca 0.16 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1xg3 h ALA 13 Cb 0.45 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1xg3 h ALA 13 CO 0.02 0.46 0.26 -0.07 0.00 0.00 0.00 179.25 179.91 1xg3 h LEU 14 N 0.82 0.76 -0.55 0.00 3.38 -1.05 -1.37 115.31 117.30 1xg3 h LEU 14 Ca 0.21 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 1xg3 h LEU 14 Cb 0.04 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1xg3 h LEU 14 CO -0.03 0.67 -0.38 0.71 0.09 0.00 0.00 178.44 179.49 1xg3 h THR 15 N 0.84 0.77 0.00 0.22 1.35 -1.29 -3.28 112.91 111.52 1xg3 h THR 15 Ca 0.20 -1.71 -0.15 0.00 -0.55 0.00 0.00 66.41 64.20 1xg3 h THR 15 Cb 0.13 2.11 -0.03 0.00 -1.73 0.00 0.00 68.15 68.63 1xg3 h THR 15 CO -0.02 0.38 -1.24 0.11 -0.25 0.00 0.00 175.52 174.50 1xg3 h LYS 16 N 0.00 0.00 -3.97 4.72 1.57 -1.15 -3.46 116.57 114.29 1xg3 h LYS 16 Ca -0.00 0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 58.34 1xg3 h LYS 16 Cb 1.08 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 33.03 1xg3 h LYS 16 CO 0.05 0.32 -0.78 -2.00 -0.57 0.00 0.00 179.45 176.47 1xg3 s GLU 17 N -2.95 0.90 -0.14 3.15 2.12 -0.56 -5.11 118.70 116.11 1xg3 s GLU 17 Ca -0.02 -0.07 -0.04 0.00 0.36 0.00 0.00 54.97 55.21 1xg3 s GLU 17 Cb 0.09 -1.02 0.06 0.00 0.26 0.00 0.00 34.13 33.52 1xg3 s GLU 17 CO 0.80 -0.18 0.17 1.21 -0.54 0.00 0.00 175.26 176.73 1xg3 s ASN 18 N 1.37 1.19 0.56 -1.70 3.84 -1.26 -2.65 114.94 116.29 1xg3 s ASN 18 Ca -0.04 0.01 -0.17 0.00 0.21 0.00 0.00 52.86 52.87 1xg3 s ASN 18 Cb -0.13 0.24 -0.05 0.00 -0.55 0.00 0.00 41.25 40.76 1xg3 s ASN 18 CO -0.03 -0.29 1.05 -2.16 -2.79 0.00 0.00 177.10 172.88 1xg3 s PRO 19 N 2.28 3.51 -0.17 0.43 0.04 -1.26 -4.92 135.00 134.92 1xg3 s PRO 19 Ca 0.04 1.23 -0.28 0.00 0.04 0.00 0.00 61.00 62.03 1xg3 s PRO 19 Cb -0.14 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.34 1xg3 s PRO 19 CO -0.08 -0.66 0.95 -1.17 0.04 0.00 0.00 177.00 176.08 1xg3 s LEU 20 N -4.17 4.17 -0.10 -3.56 0.20 0.15 -4.77 118.68 110.59 1xg3 s LEU 20 Ca 0.64 1.35 -0.27 0.00 0.69 0.00 0.00 54.13 56.54 1xg3 s LEU 20 Cb -0.16 -3.43 -0.02 0.00 -0.43 0.00 0.00 46.19 42.15 1xg3 s LEU 20 CO 0.32 -0.50 0.88 -1.10 -0.29 0.00 0.00 176.35 175.65 1xg3 s GLN 21 N 2.46 4.41 -0.17 1.98 -0.21 -1.26 -0.17 119.66 126.69 1xg3 s GLN 21 Ca 0.43 1.16 0.01 0.00 0.02 0.00 0.00 55.36 56.98 1xg3 s GLN 21 Cb -0.17 -3.52 0.03 0.00 1.00 0.00 0.00 33.01 30.35 1xg3 s GLN 21 CO 0.12 -0.20 -0.15 0.42 -2.12 0.00 0.00 175.29 173.37 1xg3 s ILE 22 N 1.64 1.71 -0.10 1.08 1.01 0.36 -4.41 121.20 122.50 1xg3 s ILE 22 Ca 0.43 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 60.25 1xg3 s ILE 22 Cb -0.18 -1.63 -0.03 0.00 0.01 0.00 0.00 42.46 40.62 1xg3 s ILE 22 CO 0.18 0.41 0.01 0.68 0.00 0.00 0.00 174.94 176.21 1xg3 s VAL 23 N 1.41 4.38 0.40 2.92 -7.23 -1.23 -1.45 120.40 119.60 1xg3 s VAL 23 Ca 0.03 -0.22 -0.25 0.00 -1.81 0.00 0.00 61.98 59.73 1xg3 s VAL 23 Cb -0.14 -2.86 -0.08 0.00 0.56 0.00 0.00 36.38 33.86 1xg3 s VAL 23 CO -0.11 0.59 1.20 -0.83 -0.31 0.00 0.00 175.10 175.64 1xg3 s GLY 24 N -0.70 2.89 -0.19 2.32 0.00 0.33 -1.03 107.32 110.94 1xg3 s GLY 24 Ca 0.11 1.04 -0.00 0.00 0.00 0.00 0.00 44.72 45.87 1xg3 s GLY 24 CO 0.02 1.57 -0.06 -0.51 0.00 0.00 0.00 173.10 174.12 1xg3 s THR 25 N -1.37 1.27 0.20 0.90 -4.23 -0.41 -4.73 115.64 107.28 1xg3 s THR 25 Ca 0.57 -0.82 0.28 0.00 -1.18 0.00 0.00 61.69 60.55 1xg3 s THR 25 Cb -0.33 -1.46 0.30 0.00 1.34 0.00 0.00 72.50 72.36 1xg3 s THR 25 CO 0.41 0.08 1.94 -0.29 -0.54 0.00 0.00 174.62 176.22 1xg3 h ILE 26 N 6.44 0.37 -3.30 2.99 6.09 -1.92 -3.44 117.51 124.74 1xg3 h ILE 26 Ca -0.23 -0.78 -0.08 0.00 -1.37 0.00 0.00 64.86 62.39 1xg3 h ILE 26 Cb 1.10 1.58 -0.02 0.00 0.47 0.00 0.00 36.82 39.95 1xg3 h ILE 26 CO 0.42 0.13 0.15 0.54 -3.07 0.00 0.00 178.15 176.31 1xg3 s ASN 27 N -5.99 0.23 0.22 2.19 2.20 -1.26 -4.90 114.94 107.63 1xg3 s ASN 27 Ca -0.00 -1.21 -0.08 0.00 -0.94 0.00 0.00 52.86 50.63 1xg3 s ASN 27 Cb 0.11 0.80 0.23 0.00 -2.00 0.00 0.00 41.25 40.38 1xg3 s ASN 27 CO 0.59 -1.57 1.87 0.00 -2.94 0.00 0.00 177.10 175.05 1xg3 h ALA 28 N 2.03 1.04 -0.16 3.54 0.00 -1.90 -2.32 119.26 121.50 1xg3 h ALA 28 Ca -0.31 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.60 1xg3 h ALA 28 Cb 1.25 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 1xg3 h ALA 28 CO 0.39 0.33 -0.02 -0.97 0.00 0.00 0.00 179.25 178.99 1xg3 h ASN 29 N 1.00 -0.10 0.45 0.00 -0.73 -1.97 -2.05 115.58 112.18 1xg3 h ASN 29 Ca 0.32 0.04 -0.04 0.00 1.87 0.00 0.00 56.30 58.49 1xg3 h ASN 29 Cb 0.00 0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.66 1xg3 h ASN 29 CO -0.11 -0.03 -0.19 0.45 -0.37 0.00 0.00 177.43 177.19 1xg3 h HIS 30 N 0.03 0.00 -0.57 0.67 3.86 -1.91 -1.29 115.15 115.94 1xg3 h HIS 30 Ca 0.08 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.19 1xg3 h HIS 30 Cb 0.10 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 1xg3 h HIS 30 CO -0.17 0.19 -0.04 0.00 0.86 0.00 0.00 177.93 178.76 1xg3 h ALA 31 N 1.81 0.84 -0.31 2.45 0.00 -0.83 0.29 119.26 123.52 1xg3 h ALA 31 Ca -0.00 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.47 1xg3 h ALA 31 Cb 0.46 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1xg3 h ALA 31 CO 0.02 0.66 -0.26 -0.07 0.00 0.00 0.00 179.25 179.61 1xg3 h LEU 32 N 0.93 0.63 -0.56 0.00 3.38 -0.68 -0.93 115.31 118.08 1xg3 h LEU 32 Ca 0.16 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 1xg3 h LEU 32 Cb 0.60 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1xg3 h LEU 32 CO 0.04 0.87 0.04 -0.07 0.09 0.00 0.00 178.44 179.41 1xg3 h LEU 33 N 0.54 0.94 -0.40 1.67 3.38 -0.84 -0.67 115.31 119.92 1xg3 h LEU 33 Ca 0.07 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1xg3 h LEU 33 Cb 0.73 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1xg3 h LEU 33 CO 0.06 0.99 0.16 0.00 0.09 0.00 0.00 178.44 179.74 1xg3 h ALA 34 N 0.98 0.52 -0.84 1.53 0.00 -0.71 -0.90 119.26 119.84 1xg3 h ALA 34 Ca 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1xg3 h ALA 34 Cb 0.49 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1xg3 h ALA 34 CO 0.02 0.12 0.47 0.37 0.00 0.00 0.00 179.25 180.23 1xg3 h GLN 35 N 0.51 1.16 0.00 0.00 4.15 -0.94 -1.62 115.11 118.37 1xg3 h GLN 35 Ca 0.13 -0.13 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 1xg3 h GLN 35 Cb 0.18 -0.23 -0.00 0.00 0.21 0.00 0.00 27.48 27.64 1xg3 h GLN 35 CO -0.01 0.85 -0.11 0.00 -1.93 0.00 0.00 178.83 177.62 1xg3 h ARG 36 N 1.16 0.00 -0.00 1.69 3.08 -0.76 -2.24 114.38 117.31 1xg3 h ARG 36 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1xg3 h ARG 36 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1xg3 h ARG 36 CO -0.05 0.11 -0.08 0.00 -1.07 0.00 0.00 179.97 178.89 1xg3 n ALA 37 N -2.17 2.65 0.00 0.04 0.00 -0.38 -4.93 120.51 115.72 1xg3 n ALA 37 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1xg3 n ALA 37 Cb 0.34 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1xg3 n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xg3 n GLY 38 N 1.32 0.55 3.75 0.00 0.00 -0.84 -5.08 105.19 104.89 1xg3 n GLY 38 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1xg3 n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xg3 s TYR 39 N -2.00 2.39 -1.42 1.61 2.02 -1.06 -4.96 117.35 113.92 1xg3 s TYR 39 Ca 0.00 1.47 0.15 0.00 -0.37 0.00 0.00 57.07 58.32 1xg3 s TYR 39 Cb 0.00 -3.59 0.02 0.00 -0.40 0.00 0.00 41.96 37.99 1xg3 s TYR 39 CO 0.00 -2.41 0.83 1.04 -1.57 0.00 0.00 175.55 173.43 1xg3 n GLN 40 N -1.31 1.67 -3.57 -0.62 1.13 -1.26 -4.66 117.38 108.76 1xg3 n GLN 40 Ca 0.12 -0.86 -0.16 0.00 -1.94 0.00 0.00 57.00 54.16 1xg3 n GLN 40 Cb 0.48 -1.24 -0.07 0.00 0.11 0.00 0.00 30.24 29.53 1xg3 n GLN 40 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xg3 s ALA 41 N -1.68 -1.72 0.32 -1.58 0.00 -1.26 -4.27 121.76 111.57 1xg3 s ALA 41 Ca 0.13 1.54 0.03 0.00 0.00 0.00 0.00 51.96 53.66 1xg3 s ALA 41 Cb 0.12 -0.43 -0.06 0.00 0.00 0.00 0.00 23.12 22.75 1xg3 s ALA 41 CO 0.34 -0.35 0.07 0.96 0.00 0.00 0.00 175.76 176.77 1xg3 s ILE 42 N -0.60 1.09 0.01 0.00 -4.36 -0.69 -3.54 121.20 113.10 1xg3 s ILE 42 Ca -0.07 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.35 1xg3 s ILE 42 Cb -0.02 -2.76 -0.01 0.00 1.25 0.00 0.00 42.46 40.92 1xg3 s ILE 42 CO 0.06 0.00 -0.11 -0.47 0.24 0.00 0.00 174.94 174.67 1xg3 s TYR 43 N -3.35 0.93 -0.53 1.37 5.04 -0.20 -1.16 117.35 119.46 1xg3 s TYR 43 Ca 0.36 -0.25 -0.08 0.00 -2.44 0.00 0.00 57.07 54.66 1xg3 s TYR 43 Cb 0.08 -0.58 0.14 0.00 0.35 0.00 0.00 41.96 41.95 1xg3 s TYR 43 CO 0.15 -0.01 0.39 -1.17 -1.34 0.00 0.00 175.55 173.58 1xg3 s LEU 44 N -0.63 5.69 0.13 6.97 0.20 -0.29 -1.29 118.68 129.46 1xg3 s LEU 44 Ca 0.02 -2.18 -0.31 0.00 0.69 0.00 0.00 54.13 52.35 1xg3 s LEU 44 Cb -0.06 -1.99 -0.08 0.00 -0.43 0.00 0.00 46.19 43.63 1xg3 s LEU 44 CO 0.00 -0.61 1.43 -0.55 -0.29 0.00 0.00 176.35 176.34 1xg3 s SER 45 N 2.18 6.76 0.23 3.68 0.15 -1.26 -2.12 113.70 123.32 1xg3 s SER 45 Ca 0.09 2.40 -0.03 0.00 0.70 0.00 0.00 55.95 59.12 1xg3 s SER 45 Cb -0.23 -2.59 0.25 0.00 -1.71 0.00 0.00 66.02 61.74 1xg3 s SER 45 CO -0.02 -0.69 1.67 1.23 1.20 0.00 0.00 173.24 176.62 1xg3 h GLY 46 N 6.77 0.78 1.60 9.45 0.00 -1.96 -0.36 103.07 119.35 1xg3 h GLY 46 Ca -0.42 -0.64 -0.07 0.00 0.00 0.00 0.00 47.33 46.20 1xg3 h GLY 46 CO 0.88 0.58 -0.12 -1.33 0.00 0.00 0.00 176.54 176.55 1xg3 h GLY 47 N 0.98 0.52 1.42 4.60 0.00 -1.97 -1.93 103.07 106.68 1xg3 h GLY 47 Ca 0.10 -0.35 -0.20 0.00 0.00 0.00 0.00 47.33 46.88 1xg3 h GLY 47 CO 0.05 0.33 -0.72 -1.33 0.00 0.00 0.00 176.54 174.86 1xg3 h GLY 48 N 0.91 0.63 0.97 4.60 0.00 -1.76 0.16 103.07 108.58 1xg3 h GLY 48 Ca 0.08 -0.87 -0.05 0.00 0.00 0.00 0.00 47.33 46.49 1xg3 h GLY 48 CO 0.03 0.78 0.08 -2.08 0.00 0.00 0.00 176.54 175.35 1xg3 h VAL 49 N 0.40 1.25 0.42 4.60 2.07 -0.88 0.48 116.25 124.59 1xg3 h VAL 49 Ca -0.03 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.57 1xg3 h VAL 49 Cb 1.32 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 1xg3 h VAL 49 CO 0.14 0.32 -0.20 0.00 0.02 0.00 0.00 177.57 177.84 1xg3 h ALA 50 N 0.96 -0.96 -0.25 1.67 0.00 -1.30 -1.49 119.26 117.90 1xg3 h ALA 50 Ca 0.14 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1xg3 h ALA 50 Cb 0.38 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1xg3 h ALA 50 CO 0.01 -0.92 -0.32 0.00 0.00 0.00 0.00 179.25 178.01 1xg3 h ALA 51 N -1.65 0.98 0.00 0.00 0.00 0.34 0.11 119.26 119.04 1xg3 h ALA 51 Ca -0.06 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 1xg3 h ALA 51 Cb 0.43 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1xg3 h ALA 51 CO 0.09 0.60 -0.44 0.78 0.00 0.00 0.00 179.25 180.29 1xg3 h GLY 52 N 1.05 0.00 1.70 0.00 0.00 -0.16 -3.06 103.07 102.60 1xg3 h GLY 52 Ca 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.24 1xg3 h GLY 52 CO 0.06 0.00 -0.57 1.76 0.00 0.00 0.00 176.54 177.79 1xg3 h SER 53 N -1.00 0.35 0.00 0.19 0.02 -1.15 -3.34 113.55 108.62 1xg3 h SER 53 Ca -0.01 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 1xg3 h SER 53 Cb 0.44 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1xg3 h SER 53 CO -0.00 0.84 -0.81 0.18 -1.14 0.00 0.00 176.83 175.90 1xg3 n LEU 54 N -3.91 0.46 -1.86 5.07 4.77 -0.61 -5.00 117.00 115.91 1xg3 n LEU 54 Ca -0.02 -0.39 -0.16 0.00 -0.03 0.00 0.00 56.01 55.41 1xg3 n LEU 54 Cb 0.60 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.68 1xg3 n LEU 54 CO 0.45 0.11 -0.17 0.61 -1.33 0.00 0.00 177.39 177.06 1xg3 n GLY 55 N 1.40 -0.27 3.37 -0.72 0.00 -0.13 -4.95 105.19 103.88 1xg3 n GLY 55 Ca 0.01 -0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 1xg3 n GLY 55 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xg3 s LEU 56 N -4.60 2.46 0.67 0.99 1.43 0.19 -4.92 118.68 114.90 1xg3 s LEU 56 Ca 0.03 -0.89 -0.14 0.00 -1.03 0.00 0.00 54.13 52.09 1xg3 s LEU 56 Cb -0.01 -0.94 0.00 0.00 0.03 0.00 0.00 46.19 45.27 1xg3 s LEU 56 CO 0.04 0.00 1.10 -2.16 0.23 0.00 0.00 176.35 175.56 1xg3 s PRO 57 N -2.90 2.80 -1.40 1.29 0.04 -1.26 -1.34 135.00 132.22 1xg3 s PRO 57 Ca 0.19 1.34 -0.14 0.00 0.04 0.00 0.00 61.00 62.42 1xg3 s PRO 57 Cb -0.06 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.54 1xg3 s PRO 57 CO 0.08 -1.24 2.25 -3.47 0.04 0.00 0.00 177.00 174.66 1xg3 n ASP 58 N -2.51 4.07 -2.28 6.66 2.03 -1.26 -4.59 116.55 118.67 1xg3 n ASP 58 Ca 0.10 -2.80 -0.15 0.00 0.52 0.00 0.00 54.79 52.46 1xg3 n ASP 58 Cb 0.52 -1.60 0.03 0.00 -0.72 0.00 0.00 41.12 39.36 1xg3 n ASP 58 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1xg3 n LEU 59 N 6.05 3.66 -1.69 -2.67 4.77 -1.26 -4.83 117.00 121.02 1xg3 n LEU 59 Ca 0.53 -4.09 -0.14 0.00 -0.03 0.00 0.00 56.01 52.28 1xg3 n LEU 59 Cb 0.38 -0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1xg3 n LEU 59 CO 0.91 1.70 -0.16 0.61 -1.33 0.00 0.00 177.39 179.12 1xg3 n GLY 60 N -0.67 -0.20 0.09 -0.72 0.00 -1.26 -4.87 105.19 97.56 1xg3 n GLY 60 Ca 0.30 -0.27 -0.06 0.00 0.00 0.00 0.00 46.02 45.99 1xg3 n GLY 60 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xg3 n ILE 61 N -4.03 1.33 -1.94 -0.61 5.41 -1.26 -4.94 119.36 113.32 1xg3 n ILE 61 Ca -0.16 -0.78 -0.36 0.00 1.00 0.00 0.00 62.75 62.46 1xg3 n ILE 61 Cb 0.62 -0.69 0.04 0.00 -0.71 0.00 0.00 39.64 38.91 1xg3 n ILE 61 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1xg3 s SER 62 N -5.69 5.04 0.33 4.38 1.04 -1.26 -5.04 113.70 112.50 1xg3 s SER 62 Ca -0.07 2.44 0.07 0.00 0.48 0.00 0.00 55.95 58.87 1xg3 s SER 62 Cb 0.08 -2.60 -0.02 0.00 0.10 0.00 0.00 66.02 63.57 1xg3 s SER 62 CO 0.83 -1.70 0.31 0.42 0.98 0.00 0.00 173.24 174.08 1xg3 s THR 63 N -1.57 3.64 0.18 2.02 -4.23 -1.26 -5.01 115.64 109.41 1xg3 s THR 63 Ca 0.78 -1.32 -0.13 0.00 -1.18 0.00 0.00 61.69 59.84 1xg3 s THR 63 Cb -0.32 -3.22 0.08 0.00 1.34 0.00 0.00 72.50 70.38 1xg3 s THR 63 CO 0.35 -0.18 1.75 0.25 -0.54 0.00 0.00 174.62 176.25 1xg3 h LEU 64 N 1.20 0.18 -0.97 4.79 5.85 -1.96 -1.92 115.31 122.48 1xg3 h LEU 64 Ca -0.45 0.06 0.14 0.00 0.84 0.00 0.00 57.88 58.46 1xg3 h LEU 64 Cb 1.25 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 42.23 1xg3 h LEU 64 CO 0.58 0.13 0.59 -0.78 -0.34 0.00 0.00 178.44 178.62 1xg3 h ASP 65 N 0.35 0.83 -0.66 1.25 3.58 -1.98 0.95 116.42 120.74 1xg3 h ASP 65 Ca 0.23 0.06 0.03 0.00 0.42 0.00 0.00 57.03 57.77 1xg3 h ASP 65 Cb 0.23 -0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.15 1xg3 h ASP 65 CO -0.23 0.40 0.41 0.44 -2.88 0.00 0.00 179.24 177.38 1xg3 h ASP 66 N 0.88 0.67 -0.14 2.28 3.32 -1.74 -0.62 116.42 121.07 1xg3 h ASP 66 Ca 0.50 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.49 1xg3 h ASP 66 Cb 0.59 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 1xg3 h ASP 66 CO -0.30 0.47 -0.17 0.58 -1.72 0.00 0.00 179.24 178.10 1xg3 h VAL 67 N 0.81 1.35 -1.00 -1.35 2.07 -1.05 -3.05 116.25 114.04 1xg3 h VAL 67 Ca 0.26 -1.36 0.09 0.00 0.82 0.00 0.00 66.70 66.51 1xg3 h VAL 67 Cb 0.01 1.92 -0.07 0.00 -1.52 0.00 0.00 31.29 31.63 1xg3 h VAL 67 CO -0.10 0.40 0.64 -0.07 0.02 0.00 0.00 177.57 178.45 1xg3 h LEU 68 N -0.02 0.98 -0.43 2.57 3.38 -0.64 0.45 115.31 121.59 1xg3 h LEU 68 Ca 0.02 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1xg3 h LEU 68 Cb 0.71 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1xg3 h LEU 68 CO 0.04 0.58 0.26 0.74 0.09 0.00 0.00 178.44 180.15 1xg3 h THR 69 N 1.08 1.06 -0.41 0.22 2.02 -1.05 -0.93 112.91 114.90 1xg3 h THR 69 Ca 0.46 -0.18 -0.10 0.00 0.77 0.00 0.00 66.41 67.36 1xg3 h THR 69 Cb 0.32 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1xg3 h THR 69 CO -0.21 0.10 -0.15 0.44 0.37 0.00 0.00 175.52 176.06 1xg3 h ASP 70 N 0.52 0.76 -0.29 4.18 3.32 -1.17 -1.80 116.42 121.94 1xg3 h ASP 70 Ca 0.17 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 1xg3 h ASP 70 Cb -0.01 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1xg3 h ASP 70 CO -0.07 0.92 0.18 0.40 -1.72 0.00 0.00 179.24 178.95 1xg3 h ILE 71 N 0.68 1.10 -0.55 0.35 2.04 -0.38 -1.64 117.51 119.11 1xg3 h ILE 71 Ca 0.11 -0.22 -0.06 0.00 1.00 0.00 0.00 64.86 65.68 1xg3 h ILE 71 Cb 0.64 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 1xg3 h ILE 71 CO 0.04 0.10 0.11 0.03 0.00 0.00 0.00 178.15 178.43 1xg3 h ARG 72 N 0.37 0.90 -0.35 2.37 3.08 -1.03 -0.25 114.38 119.48 1xg3 h ARG 72 Ca 0.10 -0.23 0.03 0.00 0.07 0.00 0.00 59.98 59.96 1xg3 h ARG 72 Cb 0.00 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 1xg3 h ARG 72 CO -0.02 0.86 0.15 0.00 -1.07 0.00 0.00 179.97 179.88 1xg3 h ARG 73 N 0.79 0.30 0.18 0.04 3.08 -1.17 0.60 114.38 118.20 1xg3 h ARG 73 Ca 0.17 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 1xg3 h ARG 73 Cb 0.38 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1xg3 h ARG 73 CO 0.01 0.20 -0.09 0.82 -1.07 0.00 0.00 179.97 179.84 1xg3 h ILE 74 N 0.31 0.93 0.00 2.04 2.04 -1.14 -3.30 117.51 118.39 1xg3 h ILE 74 Ca 0.15 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.17 1xg3 h ILE 74 Cb 0.10 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1xg3 h ILE 74 CO -0.13 0.18 0.00 0.71 0.00 0.00 0.00 178.15 178.91 1xg3 h THR 75 N -0.67 0.00 0.00 -0.27 1.35 -1.00 -0.18 112.91 112.13 1xg3 h THR 75 Ca -0.02 -0.57 -0.08 0.00 -0.55 0.00 0.00 66.41 65.19 1xg3 h THR 75 Cb 0.48 1.51 -0.01 0.00 -1.73 0.00 0.00 68.15 68.40 1xg3 h THR 75 CO 0.04 0.00 -0.37 0.44 -0.25 0.00 0.00 175.52 175.38 1xg3 h ASP 76 N 0.00 0.00 0.00 5.36 3.32 -0.95 -3.34 116.42 120.81 1xg3 h ASP 76 Ca 0.00 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 1xg3 h ASP 76 Cb 0.65 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 1xg3 h ASP 76 CO 0.00 0.37 -1.42 0.55 -1.72 0.00 0.00 179.24 177.02 1xg3 n VAL 77 N -3.98 0.22 -4.30 -1.35 3.14 -1.10 -4.99 118.33 105.97 1xg3 n VAL 77 Ca -0.02 -0.24 -0.34 0.00 -2.96 0.00 0.00 64.34 60.79 1xg3 n VAL 77 Cb 0.42 -0.18 -0.13 0.00 -1.06 0.00 0.00 33.84 32.88 1xg3 n VAL 77 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1xg3 n SER 79 N 3.98 0.20 -4.77 0.00 3.41 -1.26 -4.43 113.62 110.75 1xg3 n SER 79 Ca -0.18 -0.77 -0.37 0.00 -0.26 0.00 0.00 58.87 57.29 1xg3 n SER 79 Cb 0.52 -0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.38 1xg3 n SER 79 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1xg3 s LEU 80 N -2.21 4.06 0.19 1.04 1.43 -1.26 -4.95 118.68 116.97 1xg3 s LEU 80 Ca 0.39 2.33 -0.30 0.00 -1.03 0.00 0.00 54.13 55.51 1xg3 s LEU 80 Cb 0.21 -4.18 -0.09 0.00 0.03 0.00 0.00 46.19 42.16 1xg3 s LEU 80 CO 0.41 -0.86 1.39 -2.16 0.23 0.00 0.00 176.35 175.36 1xg3 s PRO 81 N -2.59 4.32 -0.25 1.29 0.04 -1.26 -4.83 135.00 131.73 1xg3 s PRO 81 Ca 0.62 2.15 -0.06 0.00 0.04 0.00 0.00 61.00 63.75 1xg3 s PRO 81 Cb -0.29 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.05 1xg3 s PRO 81 CO 0.36 -0.38 0.04 -1.17 0.04 0.00 0.00 177.00 175.90 1xg3 s LEU 82 N 0.27 3.39 -0.08 -3.56 0.20 -1.26 -1.71 118.68 115.93 1xg3 s LEU 82 Ca 0.61 -0.37 -0.19 0.00 0.69 0.00 0.00 54.13 54.87 1xg3 s LEU 82 Cb -0.39 -1.87 -0.04 0.00 -0.43 0.00 0.00 46.19 43.46 1xg3 s LEU 82 CO 0.37 -0.07 0.54 -0.22 -0.29 0.00 0.00 176.35 176.68 1xg3 s LEU 83 N 1.55 4.33 -0.03 -0.68 2.96 -0.30 -0.51 118.68 125.99 1xg3 s LEU 83 Ca 0.05 0.97 0.06 0.00 -0.22 0.00 0.00 54.13 54.99 1xg3 s LEU 83 Cb -0.15 -2.81 -0.02 0.00 0.50 0.00 0.00 46.19 43.70 1xg3 s LEU 83 CO 0.02 0.02 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.17 1xg3 s VAL 84 N 0.37 2.50 -0.37 1.68 1.01 0.40 -1.14 120.40 124.85 1xg3 s VAL 84 Ca 0.29 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 61.04 1xg3 s VAL 84 Cb -0.16 -1.92 0.02 0.00 0.00 0.00 0.00 36.38 34.32 1xg3 s VAL 84 CO 0.13 0.58 1.12 -0.62 0.00 0.00 0.00 175.10 176.32 1xg3 s ASP 85 N -0.65 6.80 -0.09 3.32 -1.08 -0.90 -1.63 116.67 122.44 1xg3 s ASP 85 Ca 0.10 0.86 0.16 0.00 -0.52 0.00 0.00 52.55 53.14 1xg3 s ASP 85 Cb -0.10 -2.55 0.54 0.00 -1.46 0.00 0.00 42.92 39.35 1xg3 s ASP 85 CO -0.00 -1.04 1.45 0.00 0.52 0.00 0.00 175.17 176.10 1xg3 n ALA 86 N 7.31 2.74 -0.31 3.66 0.00 -0.50 -4.66 120.51 128.75 1xg3 n ALA 86 Ca 0.12 -1.62 0.00 0.00 0.00 0.00 0.00 53.44 51.95 1xg3 n ALA 86 Cb 0.48 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.18 1xg3 n ALA 86 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xg3 n ASP 87 N 0.54 0.00 -1.43 0.00 -0.08 -1.25 -1.10 116.55 113.23 1xg3 n ASP 87 Ca 0.20 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.58 1xg3 n ASP 87 Cb 0.73 0.00 0.33 0.00 2.34 0.00 0.00 41.12 44.52 1xg3 n ASP 87 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 1xg3 n ILE 88 N 0.00 1.59 0.00 5.18 -5.35 -1.26 -1.09 119.36 118.43 1xg3 n ILE 88 Ca 0.00 -1.17 0.00 0.00 -0.27 0.00 0.00 62.75 61.31 1xg3 n ILE 88 Cb 0.00 0.23 0.00 0.00 -1.74 0.00 0.00 39.64 38.13 1xg3 n ILE 88 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xg3 n GLY 89 N 1.14 0.63 3.44 3.28 0.00 -0.26 -4.73 105.19 108.70 1xg3 n GLY 89 Ca 0.24 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.08 1xg3 n GLY 89 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1xg3 n PHE 90 N -1.32 -2.22 0.00 1.61 3.72 -1.26 -3.84 117.46 114.15 1xg3 n PHE 90 Ca 0.00 0.83 0.00 0.00 -0.05 0.00 0.00 57.45 58.23 1xg3 n PHE 90 Cb 0.00 -4.37 0.00 0.00 -0.94 0.00 0.00 39.48 34.17 1xg3 n PHE 90 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xg3 n GLY 91 N -1.32 1.10 0.05 1.37 0.00 -1.26 -4.87 105.19 100.26 1xg3 n GLY 91 Ca -0.18 -1.12 0.13 0.00 0.00 0.00 0.00 46.02 44.84 1xg3 n GLY 91 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xg3 n SER 92 N 0.00 0.57 -3.79 1.61 7.64 -1.26 -4.90 113.62 113.50 1xg3 n SER 92 Ca 0.00 0.20 -0.21 0.00 1.01 0.00 0.00 58.87 59.87 1xg3 n SER 92 Cb 0.00 -0.13 -0.08 0.00 -1.01 0.00 0.00 64.21 62.99 1xg3 n SER 92 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1xg3 s SER 93 N -3.85 1.97 0.55 6.43 1.04 -1.26 -5.01 113.70 113.57 1xg3 s SER 93 Ca 0.09 -1.67 0.23 0.00 0.48 0.00 0.00 55.95 55.08 1xg3 s SER 93 Cb 0.15 0.50 1.54 0.00 0.10 0.00 0.00 66.02 68.31 1xg3 s SER 93 CO 0.66 -0.97 2.19 0.00 0.98 0.00 0.00 173.24 176.10 1xg3 h ALA 94 N 2.05 1.70 -0.54 5.32 0.00 -1.94 -0.74 119.26 125.12 1xg3 h ALA 94 Ca -0.31 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 1xg3 h ALA 94 Cb 1.25 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 1xg3 h ALA 94 CO 0.47 0.03 -0.02 0.74 0.00 0.00 0.00 179.25 180.47 1xg3 h PHE 95 N 0.00 1.06 -0.43 0.00 0.04 -1.98 0.17 116.94 115.80 1xg3 h PHE 95 Ca -0.00 -0.19 -0.09 0.00 2.80 0.00 0.00 57.97 60.49 1xg3 h PHE 95 Cb 0.04 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 37.91 1xg3 h PHE 95 CO 0.00 0.97 -0.08 -0.91 -0.60 0.00 0.00 178.31 177.69 1xg3 h ASN 96 N 0.84 0.81 -0.24 2.17 2.35 -1.49 -0.08 115.58 119.94 1xg3 h ASN 96 Ca 0.15 -0.35 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 1xg3 h ASN 96 Cb 0.56 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1xg3 h ASN 96 CO 0.03 0.97 0.16 0.58 -1.65 0.00 0.00 177.43 177.52 1xg3 h VAL 97 N 0.64 1.07 -0.44 2.81 2.07 -1.10 0.24 116.25 121.54 1xg3 h VAL 97 Ca 0.11 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1xg3 h VAL 97 Cb 0.61 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1xg3 h VAL 97 CO 0.04 0.07 0.24 0.00 0.02 0.00 0.00 177.57 177.94 1xg3 h ALA 98 N 1.08 0.57 -0.33 1.67 0.00 -0.83 -1.25 119.26 120.16 1xg3 h ALA 98 Ca 0.09 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1xg3 h ALA 98 Cb -0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1xg3 h ALA 98 CO -0.02 0.09 -0.02 -0.09 0.00 0.00 0.00 179.25 179.21 1xg3 h ARG 99 N 0.58 0.52 -0.31 0.00 2.43 -0.72 -1.71 114.38 115.15 1xg3 h ARG 99 Ca 0.16 -0.12 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 1xg3 h ARG 99 Cb 0.06 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1xg3 h ARG 99 CO -0.02 0.56 0.01 1.15 -1.51 0.00 0.00 179.97 180.15 1xg3 h THR 100 N 0.49 1.25 0.20 0.20 2.02 -0.48 -1.03 112.91 115.56 1xg3 h THR 100 Ca 0.10 -0.93 -0.00 0.00 0.77 0.00 0.00 66.41 66.35 1xg3 h THR 100 Cb 0.36 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 1xg3 h THR 100 CO 0.01 0.30 -0.13 0.58 0.37 0.00 0.00 175.52 176.65 1xg3 h VAL 101 N 0.35 0.72 -0.82 3.16 2.07 -0.85 -0.92 116.25 119.96 1xg3 h VAL 101 Ca 0.09 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 1xg3 h VAL 101 Cb 0.43 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 1xg3 h VAL 101 CO 0.01 0.00 0.50 0.11 0.02 0.00 0.00 177.57 178.21 1xg3 h LYS 102 N -0.33 1.11 -0.45 1.57 1.57 -1.29 -1.69 116.57 117.07 1xg3 h LYS 102 Ca -0.02 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1xg3 h LYS 102 Cb 0.28 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1xg3 h LYS 102 CO 0.01 0.78 0.17 0.77 -0.57 0.00 0.00 179.45 180.60 1xg3 h SER 103 N 1.12 0.63 -0.23 0.86 0.02 -1.02 -1.53 113.55 113.41 1xg3 h SER 103 Ca 0.29 -0.18 -0.09 0.00 -0.84 0.00 0.00 61.79 60.98 1xg3 h SER 103 Cb -0.05 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 1xg3 h SER 103 CO -0.06 0.64 -0.14 0.24 -1.14 0.00 0.00 176.83 176.37 1xg3 h MET 104 N 0.58 0.65 -0.16 3.45 2.86 -0.93 0.15 114.93 121.53 1xg3 h MET 104 Ca 0.15 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1xg3 h MET 104 Cb 0.22 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 1xg3 h MET 104 CO -0.01 0.76 0.06 0.82 1.06 0.00 0.00 176.91 179.60 1xg3 h ILE 105 N 0.59 1.17 0.00 -1.22 2.04 -1.14 -1.66 117.51 117.29 1xg3 h ILE 105 Ca 0.10 -0.52 -0.06 0.00 1.00 0.00 0.00 64.86 65.38 1xg3 h ILE 105 Cb 0.58 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1xg3 h ILE 105 CO 0.04 0.16 -0.29 0.50 0.00 0.00 0.00 178.15 178.56 1xg3 h LYS 106 N 0.09 0.00 0.00 2.37 3.64 -0.95 -1.44 116.57 120.28 1xg3 h LYS 106 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1xg3 h LYS 106 Cb 0.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1xg3 h LYS 106 CO -0.00 0.29 0.00 0.00 -2.27 0.00 0.00 179.45 177.47 1xg3 h ALA 107 N 1.71 1.00 0.00 5.00 0.00 -0.34 -3.47 119.26 123.17 1xg3 h ALA 107 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xg3 h ALA 107 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1xg3 h ALA 107 CO 0.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.70 1xg3 n GLY 108 N 0.17 0.98 3.77 0.00 0.00 -0.54 -3.96 105.19 105.61 1xg3 n GLY 108 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1xg3 n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xg3 s ALA 109 N -2.00 2.41 -0.13 4.61 0.00 -0.67 -4.76 121.76 121.21 1xg3 s ALA 109 Ca 0.00 0.53 0.18 0.00 0.00 0.00 0.00 51.96 52.68 1xg3 s ALA 109 Cb 0.00 -3.32 -0.19 0.00 0.00 0.00 0.00 23.12 19.61 1xg3 s ALA 109 CO 0.00 -1.40 0.62 0.00 0.00 0.00 0.00 175.76 174.99 1xg3 n ALA 110 N -2.60 2.06 -3.92 0.00 0.00 0.33 -4.57 120.51 111.81 1xg3 n ALA 110 Ca 0.10 -0.67 0.04 0.00 0.00 0.00 0.00 53.44 52.91 1xg3 n ALA 110 Cb 0.52 -0.78 0.01 0.00 0.00 0.00 0.00 19.45 19.20 1xg3 n ALA 110 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1xg3 s GLY 111 N -4.84 -0.24 0.16 0.00 0.00 -1.17 -1.68 107.32 99.53 1xg3 s GLY 111 Ca -0.05 0.28 -0.14 0.00 0.00 0.00 0.00 44.72 44.80 1xg3 s GLY 111 CO 0.83 5.00 0.40 0.48 0.00 0.00 0.00 173.10 179.82 1xg3 s LEU 112 N -3.70 0.49 -0.03 0.66 0.05 -0.01 -0.45 118.68 115.69 1xg3 s LEU 112 Ca 0.28 -0.53 0.07 0.00 0.05 0.00 0.00 54.13 54.00 1xg3 s LEU 112 Cb 0.01 1.74 -0.02 0.00 -2.05 0.00 0.00 46.19 45.88 1xg3 s LEU 112 CO -0.03 -0.93 -0.25 -1.38 -0.55 0.00 0.00 176.35 173.22 1xg3 s HIS 113 N -3.87 2.37 0.05 3.48 -3.43 -0.64 -0.38 115.29 112.87 1xg3 s HIS 113 Ca 0.08 -0.47 0.09 0.00 -0.80 0.00 0.00 55.06 53.96 1xg3 s HIS 113 Cb 0.01 -1.53 -0.03 0.00 -1.43 0.00 0.00 32.58 29.61 1xg3 s HIS 113 CO -0.06 -0.06 -0.25 -1.50 -2.00 0.00 0.00 174.74 170.88 1xg3 s ILE 114 N -0.54 2.01 0.48 -5.38 2.07 -0.38 -1.41 121.20 118.06 1xg3 s ILE 114 Ca 0.08 -1.36 0.04 0.00 -1.41 0.00 0.00 60.65 58.00 1xg3 s ILE 114 Cb -0.11 -1.73 -0.02 0.00 0.13 0.00 0.00 42.46 40.73 1xg3 s ILE 114 CO -0.00 0.30 0.10 -1.83 -1.91 0.00 0.00 174.94 171.60 1xg3 s GLU 115 N -1.27 2.17 -0.03 3.50 -1.05 -0.25 -1.00 118.70 120.77 1xg3 s GLU 115 Ca 0.11 -2.20 0.21 0.00 -0.15 0.00 0.00 54.97 52.94 1xg3 s GLU 115 Cb -0.10 -1.72 0.66 0.00 -0.44 0.00 0.00 34.13 32.54 1xg3 s GLU 115 CO 0.02 -0.31 1.56 -0.40 0.95 0.00 0.00 175.26 177.08 1xg3 n ASP 116 N -1.29 4.13 -4.78 0.83 5.68 -1.19 -4.68 116.55 115.25 1xg3 n ASP 116 Ca -0.11 -2.11 -0.32 0.00 -0.50 0.00 0.00 54.79 51.76 1xg3 n ASP 116 Cb 0.66 -0.51 0.07 0.00 -1.14 0.00 0.00 41.12 40.20 1xg3 n ASP 116 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xg3 s GLN 117 N -1.20 2.59 -0.17 0.11 -2.07 -1.26 -0.93 119.66 116.73 1xg3 s GLN 117 Ca 0.49 1.22 -0.22 0.00 -1.82 0.00 0.00 55.36 55.03 1xg3 s GLN 117 Cb 0.27 -1.94 -0.02 0.00 -1.09 0.00 0.00 33.01 30.23 1xg3 s GLN 117 CO 0.31 -1.39 0.69 0.08 -1.32 0.00 0.00 175.29 173.66 1xg3 s VAL 118 N -2.71 4.99 0.00 3.63 1.01 0.44 -4.61 120.40 123.15 1xg3 s VAL 118 Ca 0.63 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.93 1xg3 s VAL 118 Cb -0.18 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.20 1xg3 s VAL 118 CO 0.50 0.11 0.00 0.61 0.00 0.00 0.00 175.10 176.32 1xg3 n GLY 119 N 3.62 3.27 0.71 4.51 0.00 -1.26 -0.92 105.19 115.12 1xg3 n GLY 119 Ca 0.00 0.23 0.06 0.00 0.00 0.00 0.00 46.02 46.31 1xg3 n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xg3 n ALA 120 N 11.43 2.85 -0.34 4.61 0.00 -1.26 -4.85 120.51 132.96 1xg3 n ALA 120 Ca 0.00 -2.65 -0.02 0.00 0.00 0.00 0.00 53.44 50.76 1xg3 n ALA 120 Cb 0.00 -0.47 0.12 0.00 0.00 0.00 0.00 19.45 19.10 1xg3 n ALA 120 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1xg3 h LYS 121 N 0.68 1.25 -0.36 0.00 1.57 -1.33 -0.43 116.57 117.96 1xg3 h LYS 121 Ca -0.06 -0.11 -0.17 0.00 -1.87 0.00 0.00 60.65 58.45 1xg3 h LYS 121 Cb 1.28 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 1xg3 h LYS 121 CO 0.03 0.87 -0.43 0.00 -0.57 0.00 0.00 179.45 179.34 1xg3 h ARG 122 N 1.27 0.92 -0.45 3.15 2.47 -1.76 -0.82 114.38 119.15 1xg3 h ARG 122 Ca 0.33 -0.51 0.04 0.00 -1.26 0.00 0.00 59.98 58.59 1xg3 h ARG 122 Cb -0.07 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.26 1xg3 h ARG 122 CO -0.06 1.16 0.30 0.77 0.56 0.00 0.00 179.97 182.69 1xg3 h SER 123 N 0.74 0.40 -0.14 7.04 0.02 -1.78 0.16 113.55 119.99 1xg3 h SER 123 Ca 0.05 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1xg3 h SER 123 Cb 1.02 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.47 1xg3 h SER 123 CO 0.10 0.27 0.00 0.61 -1.14 0.00 0.00 176.83 176.68 1xg3 n GLY 124 N -1.50 -0.21 2.33 -3.77 0.00 -0.21 -4.92 105.19 96.91 1xg3 n GLY 124 Ca 0.05 -0.24 -0.15 0.00 0.00 0.00 0.00 46.02 45.68 1xg3 n GLY 124 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xg3 n HIS 125 N -0.06 -0.53 -2.77 1.61 -0.00 0.56 -4.99 115.22 109.03 1xg3 n HIS 125 Ca 0.11 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.41 1xg3 n HIS 125 Cb 0.18 -3.05 -0.04 0.00 -0.00 0.00 0.00 29.99 27.09 1xg3 n HIS 125 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1xg3 s ARG 126 N -4.36 4.57 0.21 -0.41 0.52 -0.35 -4.95 118.95 114.17 1xg3 s ARG 126 Ca 0.00 1.34 0.19 0.00 -0.52 0.00 0.00 55.73 56.74 1xg3 s ARG 126 Cb 0.00 -3.44 0.02 0.00 0.52 0.00 0.00 34.95 32.05 1xg3 s ARG 126 CO 0.00 0.03 1.15 -1.00 0.02 0.00 0.00 175.30 175.50 1xg3 h PRO 127 N 6.52 0.00 -6.14 3.54 0.13 -1.94 -3.42 132.00 130.69 1xg3 h PRO 127 Ca -0.41 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.03 1xg3 h PRO 127 Cb 1.21 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.16 1xg3 h PRO 127 CO 0.74 0.21 -0.68 -0.80 -0.23 0.00 0.00 178.00 177.24 1xg3 s ASN 128 N -5.88 4.73 -1.61 1.44 0.01 -1.26 -4.57 114.94 107.79 1xg3 s ASN 128 Ca 0.01 -0.01 -0.16 0.00 -0.71 0.00 0.00 52.86 51.99 1xg3 s ASN 128 Cb 0.08 -1.20 0.12 0.00 0.41 0.00 0.00 41.25 40.66 1xg3 s ASN 128 CO 0.77 0.36 0.90 0.29 -1.51 0.00 0.00 177.10 177.90 1xg3 n LYS 129 N 2.13 -4.50 0.00 -0.60 5.02 -1.26 -4.85 118.16 114.10 1xg3 n LYS 129 Ca -0.18 0.50 0.06 0.00 -2.02 0.00 0.00 58.31 56.67 1xg3 n LYS 129 Cb 0.53 -5.31 0.02 0.00 -0.02 0.00 0.00 35.03 30.24 1xg3 n LYS 129 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xg3 n ALA 130 N -4.55 2.74 -3.15 7.82 0.00 -1.26 -4.85 120.51 117.26 1xg3 n ALA 130 Ca 0.05 -0.51 -0.27 0.00 0.00 0.00 0.00 53.44 52.71 1xg3 n ALA 130 Cb 0.51 -0.41 -0.16 0.00 0.00 0.00 0.00 19.45 19.39 1xg3 n ALA 130 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1xg3 s ILE 131 N -1.30 1.49 0.98 0.00 1.01 -1.26 -0.42 121.20 121.69 1xg3 s ILE 131 Ca 0.11 -0.71 -0.12 0.00 0.00 0.00 0.00 60.65 59.93 1xg3 s ILE 131 Cb 0.10 -1.30 0.18 0.00 0.01 0.00 0.00 42.46 41.44 1xg3 s ILE 131 CO 0.23 0.43 1.08 0.68 0.00 0.00 0.00 174.94 177.37 1xg3 s VAL 132 N 0.30 2.33 0.78 2.92 -7.23 -0.10 -4.83 120.40 114.57 1xg3 s VAL 132 Ca -0.11 0.11 -0.11 0.00 -1.81 0.00 0.00 61.98 60.06 1xg3 s VAL 132 Cb -0.14 -2.46 0.06 0.00 0.56 0.00 0.00 36.38 34.40 1xg3 s VAL 132 CO 0.04 -0.14 1.10 -0.94 -0.31 0.00 0.00 175.10 174.85 1xg3 s SER 133 N -3.16 4.42 0.30 4.85 1.04 -1.26 -4.81 113.70 115.08 1xg3 s SER 133 Ca 0.65 1.86 0.03 0.00 0.48 0.00 0.00 55.95 58.97 1xg3 s SER 133 Cb -0.20 -2.53 0.62 0.00 0.10 0.00 0.00 66.02 64.01 1xg3 s SER 133 CO 0.59 -2.09 1.86 0.11 0.98 0.00 0.00 173.24 174.68 1xg3 h LYS 134 N -1.12 0.90 -0.54 4.02 1.57 -1.99 -1.39 116.57 118.02 1xg3 h LYS 134 Ca -0.44 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.18 1xg3 h LYS 134 Cb 1.23 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 1xg3 h LYS 134 CO 0.51 0.59 -0.08 0.93 -0.57 0.00 0.00 179.45 180.83 1xg3 h GLU 135 N 0.92 1.00 -0.63 3.15 3.07 -1.99 -0.85 114.58 119.26 1xg3 h GLU 135 Ca 0.47 -0.36 -0.09 0.00 -0.50 0.00 0.00 59.36 58.88 1xg3 h GLU 135 Cb 0.50 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 1xg3 h GLU 135 CO -0.23 1.04 0.04 0.93 -1.40 0.00 0.00 179.01 179.39 1xg3 h GLU 136 N 0.88 1.08 -0.30 2.33 5.08 -1.65 -1.27 114.58 120.72 1xg3 h GLU 136 Ca 0.14 -0.32 -0.12 0.00 -1.00 0.00 0.00 59.36 58.05 1xg3 h GLU 136 Cb 0.64 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1xg3 h GLU 136 CO 0.04 1.03 -0.32 1.98 -1.00 0.00 0.00 179.01 180.74 1xg3 h MET 137 N 1.00 0.65 -0.83 2.33 4.05 -1.16 -2.00 114.93 118.97 1xg3 h MET 137 Ca 0.18 -0.30 0.00 0.00 -0.28 0.00 0.00 59.70 59.31 1xg3 h MET 137 Cb 0.52 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.27 1xg3 h MET 137 CO 0.02 0.89 0.53 0.28 0.23 0.00 0.00 176.91 178.87 1xg3 h VAL 138 N 0.56 1.22 -0.73 -5.77 2.07 -0.78 0.11 116.25 112.93 1xg3 h VAL 138 Ca 0.06 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 1xg3 h VAL 138 Cb 0.82 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1xg3 h VAL 138 CO 0.07 0.22 0.28 0.44 0.02 0.00 0.00 177.57 178.59 1xg3 h ASP 139 N 1.13 1.02 -0.49 0.57 3.32 -0.65 0.65 116.42 121.98 1xg3 h ASP 139 Ca 0.30 -0.18 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 1xg3 h ASP 139 Cb -0.10 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.16 1xg3 h ASP 139 CO -0.06 0.93 0.14 0.03 -1.72 0.00 0.00 179.24 178.55 1xg3 h ARG 140 N 1.05 0.77 -0.38 3.56 3.08 -0.59 -1.67 114.38 120.21 1xg3 h ARG 140 Ca 0.24 -0.18 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 1xg3 h ARG 140 Cb 0.24 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1xg3 h ARG 140 CO -0.02 0.74 0.12 0.82 -1.07 0.00 0.00 179.97 180.56 1xg3 h ILE 141 N 0.66 1.21 -0.83 2.04 2.04 -0.40 -2.07 117.51 120.16 1xg3 h ILE 141 Ca 0.16 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.30 1xg3 h ILE 141 Cb 0.30 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 1xg3 h ILE 141 CO -0.00 0.24 0.45 0.03 0.00 0.00 0.00 178.15 178.87 1xg3 h ARG 142 N 0.47 1.16 -0.69 2.37 3.08 -0.77 0.03 114.38 120.03 1xg3 h ARG 142 Ca 0.12 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1xg3 h ARG 142 Cb 0.26 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 1xg3 h ARG 142 CO -0.00 0.86 0.41 0.00 -1.07 0.00 0.00 179.97 180.17 1xg3 h ALA 143 N 1.24 0.88 -0.14 0.04 0.00 -1.15 -0.49 119.26 119.64 1xg3 h ALA 143 Ca 0.29 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1xg3 h ALA 143 Cb 0.04 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 1xg3 h ALA 143 CO -0.05 0.36 -0.06 0.00 0.00 0.00 0.00 179.25 179.51 1xg3 h ALA 144 N 1.21 0.20 -0.49 0.00 0.00 -0.93 -2.20 119.26 117.05 1xg3 h ALA 144 Ca 0.25 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1xg3 h ALA 144 Cb -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1xg3 h ALA 144 CO -0.05 -0.02 0.24 0.28 0.00 0.00 0.00 179.25 179.70 1xg3 h VAL 145 N -0.04 1.19 0.00 0.00 2.07 -0.87 -2.51 116.25 116.09 1xg3 h VAL 145 Ca 0.03 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 1xg3 h VAL 145 Cb 0.51 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1xg3 h VAL 145 CO 0.02 0.21 -0.10 0.44 0.02 0.00 0.00 177.57 178.16 1xg3 h ASP 146 N 0.65 0.00 1.37 0.57 3.32 -1.10 -2.70 116.42 118.52 1xg3 h ASP 146 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1xg3 h ASP 146 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1xg3 h ASP 146 CO -0.02 0.10 -0.03 0.00 -1.72 0.00 0.00 179.24 177.56 1xg3 n ALA 147 N -2.18 2.33 -1.68 3.45 0.00 -0.83 -4.88 120.51 116.73 1xg3 n ALA 147 Ca -0.01 -0.05 -0.48 0.00 0.00 0.00 0.00 53.44 52.90 1xg3 n ALA 147 Cb 0.29 -1.45 -0.05 0.00 0.00 0.00 0.00 19.45 18.24 1xg3 n ALA 147 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xg3 n LYS 148 N -2.13 2.10 0.02 0.00 5.02 -1.02 -4.53 118.16 117.61 1xg3 n LYS 148 Ca 0.06 0.76 0.11 0.00 -2.02 0.00 0.00 58.31 57.22 1xg3 n LYS 148 Cb 0.42 -2.57 -0.12 0.00 -0.02 0.00 0.00 35.03 32.74 1xg3 n LYS 148 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1xg3 n THR 149 N 4.43 0.15 -3.98 -0.18 -2.24 -1.26 -4.71 114.28 106.49 1xg3 n THR 149 Ca 0.21 -0.46 -0.34 0.00 -2.27 0.00 0.00 64.05 61.18 1xg3 n THR 149 Cb 0.28 -0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.37 1xg3 n THR 149 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xg3 s ASP 150 N -4.57 4.47 0.59 3.42 -1.08 -1.26 -5.00 116.67 113.23 1xg3 s ASP 150 Ca -0.05 -1.12 0.28 0.00 -0.52 0.00 0.00 52.55 51.15 1xg3 s ASP 150 Cb 0.13 -1.64 1.65 0.00 -1.46 0.00 0.00 42.92 41.60 1xg3 s ASP 150 CO 0.87 -0.18 2.10 1.55 0.52 0.00 0.00 175.17 180.04 1xg3 h PRO 151 N 7.95 0.00 -0.00 4.34 0.13 -2.00 -1.16 132.00 141.25 1xg3 h PRO 151 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1xg3 h PRO 151 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1xg3 h PRO 151 CO 0.54 0.00 -0.24 -0.25 -0.23 0.00 0.00 178.00 177.81 1xg3 n ASP 152 N -3.83 0.55 -4.75 1.44 8.00 -1.26 -4.87 116.55 111.83 1xg3 n ASP 152 Ca 0.02 -0.41 -0.38 0.00 0.71 0.00 0.00 54.79 54.72 1xg3 n ASP 152 Cb 0.32 0.01 0.04 0.00 -0.02 0.00 0.00 41.12 41.48 1xg3 n ASP 152 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1xg3 s PHE 153 N -2.70 2.27 -0.18 1.24 5.36 -0.44 -3.94 117.98 119.59 1xg3 s PHE 153 Ca 0.21 1.37 -0.08 0.00 -0.96 0.00 0.00 56.93 57.47 1xg3 s PHE 153 Cb 0.19 -3.81 -0.04 0.00 -0.34 0.00 0.00 43.02 39.02 1xg3 s PHE 153 CO 0.56 -2.92 0.07 0.08 -1.46 0.00 0.00 175.22 171.54 1xg3 s VAL 154 N -1.30 4.83 -0.36 3.12 1.01 -0.68 -4.97 120.40 122.05 1xg3 s VAL 154 Ca 0.72 -0.02 -0.09 0.00 0.00 0.00 0.00 61.98 62.59 1xg3 s VAL 154 Cb -0.40 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 32.83 1xg3 s VAL 154 CO 0.48 0.46 0.15 -0.63 0.00 0.00 0.00 175.10 175.56 1xg3 s ILE 155 N 0.38 4.15 -0.11 2.22 -1.09 -1.26 -0.83 121.20 124.66 1xg3 s ILE 155 Ca 0.03 -1.02 -0.03 0.00 -2.23 0.00 0.00 60.65 57.40 1xg3 s ILE 155 Cb -0.12 -3.34 -0.03 0.00 -1.58 0.00 0.00 42.46 37.38 1xg3 s ILE 155 CO 0.00 -0.22 0.02 -0.32 -1.23 0.00 0.00 174.94 173.19 1xg3 s MET 156 N 1.47 3.23 -0.15 2.79 -2.45 0.48 -0.69 119.30 123.98 1xg3 s MET 156 Ca 0.00 -0.39 -0.06 0.00 -1.25 0.00 0.00 55.69 53.99 1xg3 s MET 156 Cb -0.19 -2.90 -0.04 0.00 1.25 0.00 0.00 34.83 32.95 1xg3 s MET 156 CO 0.05 0.60 0.07 0.00 1.05 0.00 0.00 175.02 176.79 1xg3 s ALA 157 N -0.60 3.49 -0.03 4.11 0.00 -0.65 -1.24 121.76 126.84 1xg3 s ALA 157 Ca 0.10 -0.73 0.07 0.00 0.00 0.00 0.00 51.96 51.40 1xg3 s ALA 157 Cb -0.12 -1.86 -0.02 0.00 0.00 0.00 0.00 23.12 21.12 1xg3 s ALA 157 CO 0.02 0.34 -0.24 0.50 0.00 0.00 0.00 175.76 176.38 1xg3 s ARG 158 N -0.12 2.24 -0.12 0.00 3.52 -0.17 -0.01 118.95 124.29 1xg3 s ARG 158 Ca 0.07 -0.89 -0.10 0.00 -0.13 0.00 0.00 55.73 54.69 1xg3 s ARG 158 Cb -0.12 -2.12 0.04 0.00 -1.56 0.00 0.00 34.95 31.19 1xg3 s ARG 158 CO 0.01 0.54 0.31 -0.08 -0.81 0.00 0.00 175.30 175.27 1xg3 s THR 159 N -0.56 -0.01 -0.21 4.11 -1.32 -0.67 -3.18 115.64 113.80 1xg3 s THR 159 Ca 0.08 0.04 0.14 0.00 -1.21 0.00 0.00 61.69 60.74 1xg3 s THR 159 Cb -0.11 -0.44 0.48 0.00 -1.51 0.00 0.00 72.50 70.92 1xg3 s THR 159 CO -0.00 0.01 1.38 -0.90 -2.21 0.00 0.00 174.62 172.91 1xg3 n ASP 160 N 3.30 3.11 0.12 8.08 3.85 -1.26 0.08 116.55 133.82 1xg3 n ASP 160 Ca -0.16 -3.30 0.20 0.00 -0.71 0.00 0.00 54.79 50.81 1xg3 n ASP 160 Cb 0.57 -0.55 0.74 0.00 -1.35 0.00 0.00 41.12 40.52 1xg3 n ASP 160 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1xg3 h ALA 161 N 1.21 2.03 -0.82 2.12 0.00 -1.95 -0.57 119.26 121.29 1xg3 h ALA 161 Ca 0.07 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.07 1xg3 h ALA 161 Cb 1.43 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 19.17 1xg3 h ALA 161 CO 0.23 -0.65 0.46 1.25 0.00 0.00 0.00 179.25 180.54 1xg3 h LEU 162 N 0.00 0.64 -0.61 0.00 5.85 -1.81 0.49 115.31 119.88 1xg3 h LEU 162 Ca 0.18 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1xg3 h LEU 162 Cb 1.09 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1xg3 h LEU 162 CO -0.00 0.36 0.00 0.00 -0.34 0.00 0.00 178.44 178.46 1xg3 n ALA 163 N -2.38 1.48 0.00 1.25 0.00 -0.22 -2.25 120.51 118.38 1xg3 n ALA 163 Ca 0.14 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1xg3 n ALA 163 Cb 0.29 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1xg3 n ALA 163 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xg3 n VAL 164 N -2.00 0.00 0.56 0.00 0.31 -0.63 -4.86 118.33 111.70 1xg3 n VAL 164 Ca 0.02 0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.40 1xg3 n VAL 164 Cb 0.16 -0.59 -0.03 0.00 -0.91 0.00 0.00 33.84 32.47 1xg3 n VAL 164 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1xg3 n GLU 165 N -1.95 2.44 0.00 5.55 1.02 0.16 -5.08 120.64 122.78 1xg3 n GLU 165 Ca 0.00 -0.38 0.00 0.00 -0.02 0.00 0.00 57.16 56.76 1xg3 n GLU 165 Cb 0.39 -1.12 0.00 0.00 -0.02 0.00 0.00 31.44 30.69 1xg3 n GLU 165 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xg3 n GLY 166 N 1.12 1.37 0.19 0.62 0.00 -0.96 -4.39 105.19 103.14 1xg3 n GLY 166 Ca 0.04 -1.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.13 1xg3 n GLY 166 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1xg3 h LEU 167 N 0.00 -0.43 -0.53 0.99 6.46 -1.90 -1.89 115.31 118.02 1xg3 h LEU 167 Ca 0.00 0.07 0.08 0.00 -0.12 0.00 0.00 57.88 57.91 1xg3 h LEU 167 Cb 0.00 0.19 -0.07 0.00 -0.73 0.00 0.00 40.66 40.05 1xg3 h LEU 167 CO 0.00 -0.20 0.17 0.44 -0.62 0.00 0.00 178.44 178.23 1xg3 h ASP 168 N -0.22 0.14 -0.66 1.25 3.32 -1.98 0.13 116.42 118.40 1xg3 h ASP 168 Ca 0.06 0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.13 1xg3 h ASP 168 Cb 0.30 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 1xg3 h ASP 168 CO -0.17 0.10 0.19 0.00 -1.72 0.00 0.00 179.24 177.64 1xg3 h ALA 169 N 1.37 1.05 -0.35 3.45 0.00 -1.72 -0.85 119.26 122.21 1xg3 h ALA 169 Ca 0.26 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1xg3 h ALA 169 Cb 0.32 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1xg3 h ALA 169 CO -0.29 0.63 0.15 0.00 0.00 0.00 0.00 179.25 179.74 1xg3 h ALA 170 N 1.19 0.45 -0.61 0.00 0.00 -0.47 -0.34 119.26 119.48 1xg3 h ALA 170 Ca 0.22 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1xg3 h ALA 170 Cb 0.32 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1xg3 h ALA 170 CO -0.00 0.04 0.22 0.82 0.00 0.00 0.00 179.25 180.33 1xg3 h ILE 171 N 0.42 1.24 -0.78 0.00 2.04 -0.81 -0.82 117.51 118.80 1xg3 h ILE 171 Ca 0.12 -0.78 -0.02 0.00 1.00 0.00 0.00 64.86 65.17 1xg3 h ILE 171 Cb 0.17 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 1xg3 h ILE 171 CO -0.01 0.30 0.39 -0.08 0.00 0.00 0.00 178.15 178.75 1xg3 h GLU 172 N 0.87 1.10 -0.11 2.37 4.81 -0.92 -0.60 114.58 122.11 1xg3 h GLU 172 Ca 0.20 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1xg3 h GLU 172 Cb 0.25 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 1xg3 h GLU 172 CO -0.01 0.84 0.03 0.00 -0.73 0.00 0.00 179.01 179.14 1xg3 h ARG 173 N 1.09 0.17 -0.64 1.92 3.08 -0.77 -2.41 114.38 116.83 1xg3 h ARG 173 Ca 0.27 -0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.36 1xg3 h ARG 173 Cb 0.09 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.05 1xg3 h ARG 173 CO -0.04 0.33 0.30 0.00 -1.07 0.00 0.00 179.97 179.49 1xg3 h ALA 174 N 0.84 0.85 -0.81 0.04 0.00 -0.81 0.22 119.26 119.60 1xg3 h ALA 174 Ca 0.04 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1xg3 h ALA 174 Cb 0.23 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1xg3 h ALA 174 CO -0.00 -0.08 0.34 1.96 0.00 0.00 0.00 179.25 181.47 1xg3 h GLN 175 N 0.54 1.20 -0.59 0.00 4.20 -1.04 -0.56 115.11 118.86 1xg3 h GLN 175 Ca 0.31 -0.21 -0.10 0.00 0.06 0.00 0.00 58.65 58.71 1xg3 h GLN 175 Cb 0.30 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 1xg3 h GLN 175 CO -0.25 0.96 -0.04 0.00 -0.67 0.00 0.00 178.83 178.83 1xg3 h ALA 176 N 1.19 0.81 -0.55 3.87 0.00 -0.76 -1.16 119.26 122.66 1xg3 h ALA 176 Ca 0.27 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1xg3 h ALA 176 Cb 0.19 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1xg3 h ALA 176 CO -0.03 0.68 0.18 1.88 0.00 0.00 0.00 179.25 181.97 1xg3 h TYR 177 N 0.97 0.87 -0.43 0.00 0.05 -0.05 -0.98 116.97 117.40 1xg3 h TYR 177 Ca 0.16 -0.08 -0.14 0.00 0.05 0.00 0.00 58.73 58.73 1xg3 h TYR 177 Cb 0.61 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 38.08 1xg3 h TYR 177 CO 0.04 0.73 -0.26 0.28 -1.05 0.00 0.00 178.16 177.90 1xg3 h VAL 178 N 0.76 1.27 -0.46 -2.88 2.07 -1.05 -1.74 116.25 114.23 1xg3 h VAL 178 Ca 0.18 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 66.27 1xg3 h VAL 178 Cb 0.26 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1xg3 h VAL 178 CO -0.01 0.48 0.27 -0.08 0.02 0.00 0.00 177.57 178.26 1xg3 h GLU 179 N 0.78 0.62 0.00 1.57 4.81 -0.94 -1.03 114.58 120.39 1xg3 h GLU 179 Ca 0.09 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1xg3 h GLU 179 Cb 0.83 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1xg3 h GLU 179 CO 0.07 0.44 0.00 0.00 -0.73 0.00 0.00 179.01 178.79 1xg3 n ALA 180 N -2.47 2.22 0.00 2.92 0.00 -0.40 -4.86 120.51 117.92 1xg3 n ALA 180 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1xg3 n ALA 180 Cb 0.08 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1xg3 n ALA 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xg3 n GLY 181 N 0.78 1.21 3.72 0.00 0.00 -0.39 -4.47 105.19 106.04 1xg3 n GLY 181 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1xg3 n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xg3 n ALA 182 N 0.00 2.87 0.08 4.61 0.00 -0.69 -4.89 120.51 122.48 1xg3 n ALA 182 Ca 0.00 0.40 0.05 0.00 0.00 0.00 0.00 53.44 53.89 1xg3 n ALA 182 Cb 0.00 -2.53 -0.03 0.00 0.00 0.00 0.00 19.45 16.89 1xg3 n ALA 182 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1xg3 h GLU 183 N 6.70 0.00 -3.88 0.00 5.08 -1.24 -3.40 114.58 117.83 1xg3 h GLU 183 Ca -0.43 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.83 1xg3 h GLU 183 Cb 1.20 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.31 1xg3 h GLU 183 CO 0.95 0.18 -0.41 -1.64 -1.00 0.00 0.00 179.01 177.10 1xg3 s MET 184 N -3.11 0.85 -0.03 2.33 -1.94 -1.23 -4.38 119.30 111.79 1xg3 s MET 184 Ca -0.01 -1.02 0.06 0.00 -1.71 0.00 0.00 55.69 53.02 1xg3 s MET 184 Cb 0.09 0.33 -0.01 0.00 2.01 0.00 0.00 34.83 37.24 1xg3 s MET 184 CO 0.79 -0.26 -0.22 -1.17 -0.01 0.00 0.00 175.02 174.15 1xg3 s LEU 185 N -2.88 2.03 -0.59 -0.03 2.96 -0.32 -1.63 118.68 118.22 1xg3 s LEU 185 Ca 0.07 -0.42 0.04 0.00 -0.22 0.00 0.00 54.13 53.60 1xg3 s LEU 185 Cb 0.05 -1.17 0.15 0.00 0.50 0.00 0.00 46.19 45.72 1xg3 s LEU 185 CO -0.10 0.26 0.36 0.12 -1.32 0.00 0.00 176.35 175.67 1xg3 s PHE 186 N -0.39 3.22 -0.13 5.38 2.19 0.98 -1.01 117.98 128.21 1xg3 s PHE 186 Ca 0.05 -3.18 -0.27 0.00 0.33 0.00 0.00 56.93 53.86 1xg3 s PHE 186 Cb -0.10 -2.66 -0.02 0.00 -1.31 0.00 0.00 43.02 38.93 1xg3 s PHE 186 CO 0.00 -0.66 0.88 -1.25 1.83 0.00 0.00 175.22 176.02 1xg3 s PRO 187 N -0.75 4.36 0.32 10.12 0.04 -1.26 -1.66 135.00 146.17 1xg3 s PRO 187 Ca 0.21 1.13 0.03 0.00 0.04 0.00 0.00 61.00 62.41 1xg3 s PRO 187 Cb -0.16 -3.55 -0.03 0.00 0.04 0.00 0.00 34.50 30.81 1xg3 s PRO 187 CO -0.08 -0.28 0.49 -1.21 0.04 0.00 0.00 177.00 175.97 1xg3 s GLU 188 N 1.95 3.38 -0.95 4.56 0.41 0.11 -4.53 118.70 123.64 1xg3 s GLU 188 Ca 0.42 -0.57 0.00 0.00 -0.41 0.00 0.00 54.97 54.41 1xg3 s GLU 188 Cb -0.17 -2.74 0.00 0.00 -1.78 0.00 0.00 34.13 29.43 1xg3 s GLU 188 CO 0.15 0.19 0.00 0.00 -0.49 0.00 0.00 175.26 175.11 1xg3 n ALA 189 N -1.68 -0.18 -2.60 5.21 0.00 -1.26 -4.58 120.51 115.43 1xg3 n ALA 189 Ca -0.05 0.13 -0.41 0.00 0.00 0.00 0.00 53.44 53.11 1xg3 n ALA 189 Cb 0.57 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.76 1xg3 n ALA 189 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1xg3 s ILE 190 N -2.38 4.80 -0.23 0.00 1.01 -1.26 -4.84 121.20 118.30 1xg3 s ILE 190 Ca 0.00 1.96 0.07 0.00 0.00 0.00 0.00 60.65 62.68 1xg3 s ILE 190 Cb 0.00 -4.27 -0.09 0.00 0.01 0.00 0.00 42.46 38.11 1xg3 s ILE 190 CO 0.00 0.22 0.25 0.35 0.00 0.00 0.00 174.94 175.76 1xg3 n THR 191 N 3.57 0.00 -5.25 2.92 -2.24 -1.26 -4.24 114.28 107.79 1xg3 n THR 191 Ca 0.04 -0.29 -0.31 0.00 -2.27 0.00 0.00 64.05 61.23 1xg3 n THR 191 Cb 0.51 0.80 -0.16 0.00 -2.10 0.00 0.00 70.33 69.38 1xg3 n THR 191 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1xg3 s GLU 192 N -1.90 2.05 0.22 -0.78 2.02 -1.26 -4.57 118.70 114.48 1xg3 s GLU 192 Ca 0.01 -0.94 -0.08 0.00 0.02 0.00 0.00 54.97 53.98 1xg3 s GLU 192 Cb 0.05 -2.01 0.28 0.00 0.10 0.00 0.00 34.13 32.55 1xg3 s GLU 192 CO 0.29 0.55 1.81 -0.07 0.02 0.00 0.00 175.26 177.86 1xg3 h LEU 193 N 5.43 0.59 -1.77 1.80 3.38 -1.98 -2.18 115.31 120.58 1xg3 h LEU 193 Ca -0.43 0.03 0.16 0.00 0.09 0.00 0.00 57.88 57.73 1xg3 h LEU 193 Cb 1.12 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.75 1xg3 h LEU 193 CO 0.47 0.37 0.46 0.00 0.09 0.00 0.00 178.44 179.83 1xg3 h ALA 194 N 1.38 2.32 -0.15 1.53 0.00 -1.96 -0.87 119.26 121.51 1xg3 h ALA 194 Ca 0.33 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.13 1xg3 h ALA 194 Cb 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1xg3 h ALA 194 CO -0.20 -0.50 -0.34 0.52 0.00 0.00 0.00 179.25 178.73 1xg3 h MET 195 N 0.22 0.30 -0.54 0.00 2.86 -1.81 -1.66 114.93 114.29 1xg3 h MET 195 Ca 0.33 -0.12 -0.05 0.00 -2.06 0.00 0.00 59.70 57.79 1xg3 h MET 195 Cb 0.97 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.60 1xg3 h MET 195 CO -0.07 0.60 0.14 1.88 1.06 0.00 0.00 176.91 180.53 1xg3 h TYR 196 N 0.26 0.90 -0.63 -0.22 0.05 -1.22 -2.16 116.97 113.96 1xg3 h TYR 196 Ca 0.03 -0.10 0.00 0.00 0.05 0.00 0.00 58.73 58.71 1xg3 h TYR 196 Cb 0.72 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 38.18 1xg3 h TYR 196 CO 0.01 0.78 0.40 -0.09 -1.05 0.00 0.00 178.16 178.21 1xg3 h ARG 197 N 0.76 0.84 -0.82 4.88 1.12 -1.34 -0.88 114.38 118.95 1xg3 h ARG 197 Ca 0.17 -0.07 0.07 0.00 -1.11 0.00 0.00 59.98 59.04 1xg3 h ARG 197 Cb 0.32 -0.18 -0.06 0.00 -0.01 0.00 0.00 29.97 30.04 1xg3 h ARG 197 CO 0.00 0.58 0.49 1.96 -3.11 0.00 0.00 179.97 179.90 1xg3 h GLN 198 N 0.85 0.86 -0.26 0.20 4.20 -0.96 -0.27 115.11 119.73 1xg3 h GLN 198 Ca 0.23 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.79 1xg3 h GLN 198 Cb -0.06 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.53 1xg3 h GLN 198 CO -0.05 0.57 -0.22 0.74 -0.67 0.00 0.00 178.83 179.20 1xg3 h PHE 199 N 0.88 0.71 -0.53 2.96 0.04 -0.94 -1.11 116.94 118.96 1xg3 h PHE 199 Ca 0.37 -0.21 0.05 0.00 2.80 0.00 0.00 57.97 60.98 1xg3 h PHE 199 Cb 0.22 -0.15 -0.05 0.00 2.20 0.00 0.00 35.95 38.17 1xg3 h PHE 199 CO -0.05 0.91 0.27 0.00 -0.60 0.00 0.00 178.31 178.84 1xg3 h ALA 200 N 0.69 0.68 -0.63 2.45 0.00 -0.75 -1.21 119.26 120.49 1xg3 h ALA 200 Ca 0.04 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1xg3 h ALA 200 Cb 0.77 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1xg3 h ALA 200 CO 0.06 -0.08 0.08 -0.44 0.00 0.00 0.00 179.25 178.87 1xg3 h ASP 201 N 0.52 1.00 -0.09 0.00 3.32 -0.99 -0.90 116.42 119.28 1xg3 h ASP 201 Ca 0.23 -0.24 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 1xg3 h ASP 201 Cb 0.14 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1xg3 h ASP 201 CO -0.16 1.00 -0.30 0.00 -1.72 0.00 0.00 179.24 178.06 1xg3 h ALA 202 N 1.11 0.98 0.00 3.45 0.00 -0.38 -3.36 119.26 121.06 1xg3 h ALA 202 Ca 0.19 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1xg3 h ALA 202 Cb 0.44 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1xg3 h ALA 202 CO 0.01 0.60 -1.43 1.33 0.00 0.00 0.00 179.25 179.77 1xg3 n VAL 203 N -4.09 0.05 -3.21 0.00 0.24 -0.53 -4.86 118.33 105.92 1xg3 n VAL 203 Ca -0.01 -0.22 -0.23 0.00 -2.04 0.00 0.00 64.34 61.84 1xg3 n VAL 203 Cb 0.45 0.21 0.04 0.00 -1.47 0.00 0.00 33.84 33.06 1xg3 n VAL 203 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xg3 n GLN 204 N -1.86 -5.15 -4.20 7.34 6.02 -0.35 -4.99 117.38 114.19 1xg3 n GLN 204 Ca -0.03 0.81 -0.12 0.00 -0.01 0.00 0.00 57.00 57.65 1xg3 n GLN 204 Cb 0.28 -5.68 -0.10 0.00 1.02 0.00 0.00 30.24 25.76 1xg3 n GLN 204 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1xg3 s VAL 205 N -3.17 0.90 0.17 5.09 -7.23 -1.26 -5.11 120.40 109.79 1xg3 s VAL 205 Ca 0.38 -1.99 -0.33 0.00 -1.81 0.00 0.00 61.98 58.23 1xg3 s VAL 205 Cb -0.18 -1.76 -0.15 0.00 0.56 0.00 0.00 36.38 34.85 1xg3 s VAL 205 CO 0.47 -0.82 1.21 -2.65 -0.31 0.00 0.00 175.10 173.01 1xg3 n PRO 206 N -0.11 1.28 -4.49 4.82 -0.02 -1.26 -4.72 135.00 130.50 1xg3 n PRO 206 Ca -0.11 0.46 -0.34 0.00 -2.02 0.00 0.00 63.50 61.48 1xg3 n PRO 206 Cb 0.61 -1.99 -0.11 0.00 -0.02 0.00 0.00 33.50 31.98 1xg3 n PRO 206 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1xg3 s ILE 207 N -0.10 3.88 -0.14 4.25 -1.09 -1.26 -1.17 121.20 125.57 1xg3 s ILE 207 Ca 0.74 -0.39 -0.05 0.00 -2.23 0.00 0.00 60.65 58.72 1xg3 s ILE 207 Cb -0.83 -2.65 -0.03 0.00 -1.58 0.00 0.00 42.46 37.37 1xg3 s ILE 207 CO 0.51 0.55 0.02 -0.22 -1.23 0.00 0.00 174.94 174.57 1xg3 s LEU 208 N -0.30 3.60 -0.21 2.97 0.20 -0.18 -1.05 118.68 123.70 1xg3 s LEU 208 Ca 0.05 0.05 -0.05 0.00 0.69 0.00 0.00 54.13 54.87 1xg3 s LEU 208 Cb -0.13 -1.87 -0.02 0.00 -0.43 0.00 0.00 46.19 43.74 1xg3 s LEU 208 CO 0.02 0.24 -0.01 0.00 -0.29 0.00 0.00 176.35 176.32 1xg3 s ALA 209 N -0.03 2.98 -0.67 5.97 0.00 -0.04 -4.13 121.76 125.84 1xg3 s ALA 209 Ca 0.04 -1.04 -0.22 0.00 0.00 0.00 0.00 51.96 50.74 1xg3 s ALA 209 Cb -0.13 -1.77 0.08 0.00 0.00 0.00 0.00 23.12 21.30 1xg3 s ALA 209 CO 0.02 -0.23 0.95 1.21 0.00 0.00 0.00 175.76 177.70 1xg3 s ASN 210 N 1.15 6.19 -1.07 0.00 2.47 -1.26 -0.29 114.94 122.14 1xg3 s ASN 210 Ca 0.03 -1.08 -0.02 0.00 0.42 0.00 0.00 52.86 52.21 1xg3 s ASN 210 Cb -0.14 -2.41 0.30 0.00 -1.45 0.00 0.00 41.25 37.54 1xg3 s ASN 210 CO 0.01 -1.40 1.87 -0.38 -3.72 0.00 0.00 177.10 173.48 1xg3 n ILE 211 N 5.88 5.98 -2.33 -5.21 2.08 0.41 -4.91 119.36 121.25 1xg3 n ILE 211 Ca -0.03 -5.79 -0.29 0.00 0.56 0.00 0.00 62.75 57.19 1xg3 n ILE 211 Cb 0.45 -1.64 -0.00 0.00 -0.75 0.00 0.00 39.64 37.70 1xg3 n ILE 211 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1xg3 s THR 212 N -3.88 4.79 0.52 1.39 -1.32 -1.26 -4.67 115.64 111.22 1xg3 s THR 212 Ca 0.40 0.58 -0.05 0.00 -1.21 0.00 0.00 61.69 61.41 1xg3 s THR 212 Cb 0.18 -3.84 -0.02 0.00 -1.51 0.00 0.00 72.50 67.31 1xg3 s THR 212 CO -0.11 -0.93 0.83 -1.61 -2.21 0.00 0.00 174.62 170.59 1xg3 s GLU 213 N -4.79 3.33 -1.70 7.08 8.01 -1.26 -4.35 118.70 125.03 1xg3 s GLU 213 Ca 0.52 0.13 0.00 0.00 0.01 0.00 0.00 54.97 55.63 1xg3 s GLU 213 Cb -0.11 -2.34 0.00 0.00 -4.31 0.00 0.00 34.13 27.38 1xg3 s GLU 213 CO 0.46 -0.38 0.00 1.19 0.01 0.00 0.00 175.26 176.54 1xg3 n PHE 214 N -2.38 -0.76 -3.06 1.61 3.72 -1.26 -4.96 117.46 110.36 1xg3 n PHE 214 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1xg3 n PHE 214 Cb 0.56 -3.44 0.00 0.00 -0.94 0.00 0.00 39.48 35.66 1xg3 n PHE 214 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xg3 n GLY 215 N -0.72 6.22 0.14 1.37 0.00 -1.26 -5.06 105.19 105.87 1xg3 n GLY 215 Ca -0.20 -2.07 -0.20 0.00 0.00 0.00 0.00 46.02 43.55 1xg3 n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xg3 h ALA 216 N 0.73 0.03 -2.57 4.61 0.00 -1.93 -3.45 119.26 116.68 1xg3 h ALA 216 Ca 0.00 -0.83 -0.53 0.00 0.00 0.00 0.00 54.91 53.55 1xg3 h ALA 216 Cb 0.00 0.08 0.03 0.00 0.00 0.00 0.00 17.79 17.90 1xg3 h ALA 216 CO 0.00 0.80 0.78 0.99 0.00 0.00 0.00 179.25 181.82 1xg3 s THR 217 N -2.80 3.06 0.86 0.00 2.01 -1.26 -4.85 115.64 112.67 1xg3 s THR 217 Ca -0.07 0.76 -0.10 0.00 0.31 0.00 0.00 61.69 62.59 1xg3 s THR 217 Cb 0.06 -3.49 0.11 0.00 0.01 0.00 0.00 72.50 69.19 1xg3 s THR 217 CO 0.91 0.06 1.11 -2.84 -0.69 0.00 0.00 174.62 173.18 1xg3 s PRO 218 N 1.09 1.49 -1.42 4.92 0.02 -1.26 -4.87 135.00 134.97 1xg3 s PRO 218 Ca 0.66 1.30 -0.14 0.00 0.02 0.00 0.00 61.00 62.84 1xg3 s PRO 218 Cb -0.39 -1.80 0.05 0.00 0.02 0.00 0.00 34.50 32.38 1xg3 s PRO 218 CO 0.31 -2.22 2.12 1.28 -0.33 0.00 0.00 177.00 178.16 1xg3 n LEU 219 N -3.93 6.53 -4.77 -5.54 4.77 -1.26 -4.94 117.00 107.87 1xg3 n LEU 219 Ca 0.10 -4.14 -0.40 0.00 -0.03 0.00 0.00 56.01 51.54 1xg3 n LEU 219 Cb 0.53 -1.66 0.01 0.00 -2.33 0.00 0.00 43.42 39.97 1xg3 n LEU 219 CO 0.52 0.97 1.03 -0.36 -1.33 0.00 0.00 177.39 178.22 1xg3 s PHE 220 N 3.18 2.54 0.57 -1.77 0.08 -1.26 -5.02 117.98 116.30 1xg3 s PHE 220 Ca 0.48 1.31 -0.05 0.00 0.12 0.00 0.00 56.93 58.79 1xg3 s PHE 220 Cb 0.12 -3.84 0.00 0.00 -0.57 0.00 0.00 43.02 38.73 1xg3 s PHE 220 CO -0.06 -2.69 0.87 0.95 -0.10 0.00 0.00 175.22 174.19 1xg3 s THR 221 N -1.23 3.82 0.33 0.64 -4.23 -1.26 -4.90 115.64 108.80 1xg3 s THR 221 Ca 0.61 -0.00 0.02 0.00 -1.18 0.00 0.00 61.69 61.14 1xg3 s THR 221 Cb -0.42 -3.50 0.19 0.00 1.34 0.00 0.00 72.50 70.11 1xg3 s THR 221 CO 0.53 -0.50 1.90 0.71 -0.54 0.00 0.00 174.62 176.72 1xg3 h THR 222 N -0.09 1.19 -0.42 3.99 1.35 -1.99 -0.38 112.91 116.56 1xg3 h THR 222 Ca -0.46 -0.63 -0.02 0.00 -0.55 0.00 0.00 66.41 64.75 1xg3 h THR 222 Cb 1.25 0.65 -0.02 0.00 -1.73 0.00 0.00 68.15 68.30 1xg3 h THR 222 CO 0.60 0.24 0.20 0.44 -0.25 0.00 0.00 175.52 176.75 1xg3 h ASP 223 N 0.70 0.56 -0.47 5.36 3.32 -1.97 0.20 116.42 124.12 1xg3 h ASP 223 Ca 0.16 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1xg3 h ASP 223 Cb 0.19 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1xg3 h ASP 223 CO -0.01 0.54 0.20 -0.33 -1.72 0.00 0.00 179.24 177.92 1xg3 h GLU 224 N 0.54 0.70 -0.60 3.56 5.08 -1.79 -2.10 114.58 119.97 1xg3 h GLU 224 Ca 0.14 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1xg3 h GLU 224 Cb 0.14 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1xg3 h GLU 224 CO -0.02 0.62 0.26 -0.07 -1.00 0.00 0.00 179.01 178.81 1xg3 h LEU 225 N 0.62 0.79 -0.75 1.33 3.38 -0.82 -2.31 115.31 117.55 1xg3 h LEU 225 Ca 0.16 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 1xg3 h LEU 225 Cb 0.17 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1xg3 h LEU 225 CO -0.01 0.69 0.21 -0.09 0.09 0.00 0.00 178.44 179.33 1xg3 h ARG 226 N 0.86 1.15 0.00 1.13 2.43 -0.56 -1.70 114.38 117.69 1xg3 h ARG 226 Ca 0.21 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1xg3 h ARG 226 Cb 0.14 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1xg3 h ARG 226 CO -0.02 0.99 0.00 0.66 -1.51 0.00 0.00 179.97 180.09 1xg3 h SER 227 N 1.10 0.00 -0.63 -3.80 4.64 -0.82 -1.33 113.55 112.71 1xg3 h SER 227 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1xg3 h SER 227 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1xg3 h SER 227 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1xg3 n ALA 228 N -2.00 2.61 -2.13 5.18 0.00 -0.71 -4.96 120.51 118.51 1xg3 n ALA 228 Ca -0.01 -1.42 -0.15 0.00 0.00 0.00 0.00 53.44 51.85 1xg3 n ALA 228 Cb 0.14 -0.87 -0.02 0.00 0.00 0.00 0.00 19.45 18.70 1xg3 n ALA 228 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1xg3 n HIS 229 N 1.21 -0.60 -2.69 0.00 -0.00 -0.50 -3.15 115.22 109.50 1xg3 n HIS 229 Ca 0.23 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.53 1xg3 n HIS 229 Cb 0.70 -3.12 -0.03 0.00 -0.00 0.00 0.00 29.99 27.54 1xg3 n HIS 229 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1xg3 s VAL 230 N -2.74 4.80 0.04 1.59 1.01 -0.79 -4.69 120.40 119.62 1xg3 s VAL 230 Ca 0.00 2.03 0.10 0.00 0.00 0.00 0.00 61.98 64.10 1xg3 s VAL 230 Cb 0.00 -4.30 -0.17 0.00 0.00 0.00 0.00 36.38 31.91 1xg3 s VAL 230 CO 0.00 0.11 1.19 0.00 0.00 0.00 0.00 175.10 176.40 1xg3 h ALA 231 N 6.90 0.48 -2.85 5.51 0.00 -1.43 -3.37 119.26 124.50 1xg3 h ALA 231 Ca -0.38 -0.92 -0.15 0.00 0.00 0.00 0.00 54.91 53.47 1xg3 h ALA 231 Cb 1.20 -0.03 -0.23 0.00 0.00 0.00 0.00 17.79 18.73 1xg3 h ALA 231 CO 0.79 1.19 -0.40 0.00 0.00 0.00 0.00 179.25 180.83 1xg3 s MET 232 N -2.74 0.45 -0.20 0.00 0.23 -0.77 -0.68 119.30 115.59 1xg3 s MET 232 Ca 0.00 0.00 -0.03 0.00 -1.03 0.00 0.00 55.69 54.63 1xg3 s MET 232 Cb 0.09 0.20 -0.01 0.00 -1.53 0.00 0.00 34.83 33.58 1xg3 s MET 232 CO 0.81 -0.10 -0.05 0.00 -2.03 0.00 0.00 175.02 173.65 1xg3 s ALA 233 N -0.68 2.82 -0.12 3.16 0.00 0.76 -0.86 121.76 126.84 1xg3 s ALA 233 Ca -0.08 -1.07 -0.04 0.00 0.00 0.00 0.00 51.96 50.77 1xg3 s ALA 233 Cb -0.04 -1.61 -0.04 0.00 0.00 0.00 0.00 23.12 21.43 1xg3 s ALA 233 CO 0.02 -0.23 0.03 -1.17 0.00 0.00 0.00 175.76 174.41 1xg3 s LEU 234 N 1.13 3.69 -0.57 0.00 2.96 0.61 -0.48 118.68 126.01 1xg3 s LEU 234 Ca 0.02 0.13 0.05 0.00 -0.22 0.00 0.00 54.13 54.10 1xg3 s LEU 234 Cb -0.15 -1.88 0.18 0.00 0.50 0.00 0.00 46.19 44.85 1xg3 s LEU 234 CO -0.01 0.30 0.46 -1.22 -1.32 0.00 0.00 176.35 174.56 1xg3 n TYR 235 N 2.67 1.47 -0.26 5.38 4.01 -0.53 -0.45 117.16 129.47 1xg3 n TYR 235 Ca -0.18 -3.87 0.03 0.00 -0.16 0.00 0.00 57.90 53.71 1xg3 n TYR 235 Cb 0.53 -0.26 0.16 0.00 -0.31 0.00 0.00 39.34 39.46 1xg3 n TYR 235 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1xg3 h PRO 236 N 5.30 0.59 0.00 -0.72 0.13 -1.87 0.95 132.00 136.38 1xg3 h PRO 236 Ca 0.20 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1xg3 h PRO 236 Cb 0.81 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.81 1xg3 h PRO 236 CO 0.58 0.39 0.00 1.28 -0.23 0.00 0.00 178.00 180.02 1xg3 n LEU 237 N -4.87 0.81 -0.24 1.56 4.77 -1.26 -4.09 117.00 113.68 1xg3 n LEU 237 Ca 0.12 -0.81 -0.09 0.00 -0.03 0.00 0.00 56.01 55.20 1xg3 n LEU 237 Cb 0.31 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1xg3 n LEU 237 CO 0.24 0.20 0.54 0.28 -1.33 0.00 0.00 177.39 177.32 1xg3 h SER 238 N 0.00 -1.68 -0.69 -1.43 0.02 -1.90 0.18 113.55 108.06 1xg3 h SER 238 Ca 0.00 0.27 -0.05 0.00 -0.84 0.00 0.00 61.79 61.16 1xg3 h SER 238 Cb 0.69 0.75 -0.03 0.00 0.14 0.00 0.00 62.40 63.95 1xg3 h SER 238 CO 0.00 -0.33 0.22 0.00 -1.14 0.00 0.00 176.83 175.58 1xg3 h ALA 239 N 0.53 0.90 -0.46 3.77 0.00 -1.88 -3.04 119.26 119.09 1xg3 h ALA 239 Ca 0.17 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.93 1xg3 h ALA 239 Cb 0.55 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 1xg3 h ALA 239 CO -0.74 0.57 0.15 0.35 0.00 0.00 0.00 179.25 179.58 1xg3 h PHE 240 N 1.00 0.25 -0.71 0.00 3.57 -1.52 0.53 116.94 120.07 1xg3 h PHE 240 Ca 0.22 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.75 1xg3 h PHE 240 Cb 0.30 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.96 1xg3 h PHE 240 CO 0.02 0.08 0.47 0.00 -2.23 0.00 0.00 178.31 176.65 1xg3 h ARG 241 N 0.31 0.94 -0.41 1.11 3.08 -0.92 -0.70 114.38 117.78 1xg3 h ARG 241 Ca 0.22 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 60.10 1xg3 h ARG 241 Cb 0.23 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1xg3 h ARG 241 CO -0.24 0.63 -0.18 0.00 -1.07 0.00 0.00 179.97 179.11 1xg3 h ALA 242 N 1.26 0.90 -0.45 0.04 0.00 -1.34 -2.72 119.26 116.95 1xg3 h ALA 242 Ca 0.26 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 1xg3 h ALA 242 Cb -0.10 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1xg3 h ALA 242 CO -0.06 0.63 -0.08 0.00 0.00 0.00 0.00 179.25 179.74 1xg3 h MET 243 N 0.70 0.80 -0.46 0.00 -0.00 -0.28 -2.10 114.93 113.60 1xg3 h MET 243 Ca 0.10 -0.26 -0.11 0.00 -0.00 0.00 0.00 59.70 59.44 1xg3 h MET 243 Cb 0.69 -0.07 -0.01 0.00 -0.00 0.00 0.00 31.60 32.20 1xg3 h MET 243 CO 0.05 0.86 -0.13 -0.91 -0.00 0.00 0.00 176.91 176.79 1xg3 h ASN 244 N 0.73 0.91 -0.56 -0.10 2.35 -1.03 -0.31 115.58 117.58 1xg3 h ASN 244 Ca 0.13 -0.37 -0.05 0.00 -0.55 0.00 0.00 56.30 55.46 1xg3 h ASN 244 Cb 0.57 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.66 1xg3 h ASN 244 CO 0.03 1.07 0.14 -0.09 -1.65 0.00 0.00 177.43 176.93 1xg3 h ARG 245 N 0.74 0.89 -0.49 0.81 9.65 -1.34 0.14 114.38 124.77 1xg3 h ARG 245 Ca 0.11 -0.21 -0.08 0.00 -1.10 0.00 0.00 59.98 58.71 1xg3 h ARG 245 Cb 0.68 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 29.12 1xg3 h ARG 245 CO 0.05 0.83 -0.01 0.00 2.80 0.00 0.00 179.97 183.64 1xg3 h ALA 246 N 1.02 1.06 -0.25 2.80 0.00 -1.24 -0.68 119.26 121.96 1xg3 h ALA 246 Ca 0.17 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 1xg3 h ALA 246 Cb 0.34 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1xg3 h ALA 246 CO 0.00 0.59 -0.35 0.00 0.00 0.00 0.00 179.25 179.49 1xg3 h ALA 247 N 1.22 0.37 -0.80 0.00 0.00 -0.79 -2.52 119.26 116.75 1xg3 h ALA 247 Ca 0.15 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1xg3 h ALA 247 Cb 0.48 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1xg3 h ALA 247 CO 0.02 0.44 0.52 1.49 0.00 0.00 0.00 179.25 181.72 1xg3 h GLU 248 N 0.39 1.05 -0.48 0.00 4.81 -0.79 -0.82 114.58 118.74 1xg3 h GLU 248 Ca 0.03 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1xg3 h GLU 248 Cb 0.94 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 1xg3 h GLU 248 CO 0.08 0.71 0.15 1.25 -0.73 0.00 0.00 179.01 180.47 1xg3 h HIS 249 N 1.08 0.77 -0.48 0.92 2.76 -0.95 -0.95 115.15 118.31 1xg3 h HIS 249 Ca 0.29 -0.08 -0.02 0.00 -2.20 0.00 0.00 60.37 58.36 1xg3 h HIS 249 Cb -0.11 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 28.61 1xg3 h HIS 249 CO 0.00 0.68 0.21 0.28 -1.30 0.00 0.00 177.93 177.79 1xg3 h VAL 250 N 0.64 1.20 -0.40 5.26 2.07 -0.95 -1.54 116.25 122.52 1xg3 h VAL 250 Ca 0.15 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1xg3 h VAL 250 Cb 0.27 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1xg3 h VAL 250 CO -0.01 0.23 0.26 1.88 0.02 0.00 0.00 177.57 179.95 1xg3 h TYR 251 N 0.63 0.51 -0.15 1.57 0.05 -0.89 -1.72 116.97 116.97 1xg3 h TYR 251 Ca 0.16 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.94 1xg3 h TYR 251 Cb 0.16 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.72 1xg3 h TYR 251 CO -0.00 0.34 0.07 -0.91 -1.05 0.00 0.00 178.16 176.61 1xg3 h ASN 252 N 0.54 0.20 -0.67 3.88 2.35 -0.96 -1.90 115.58 119.02 1xg3 h ASN 252 Ca 0.15 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 1xg3 h ASN 252 Cb -0.04 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 1xg3 h ASN 252 CO -0.03 0.27 0.37 0.58 -1.65 0.00 0.00 177.43 176.97 1xg3 h VAL 253 N 0.12 1.21 -0.69 2.81 2.07 -1.23 0.31 116.25 120.85 1xg3 h VAL 253 Ca 0.05 -0.51 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 1xg3 h VAL 253 Cb 0.12 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.19 1xg3 h VAL 253 CO -0.01 0.22 0.29 0.25 0.02 0.00 0.00 177.57 178.35 1xg3 h LEU 254 N 0.91 0.91 -0.29 2.57 5.85 -1.23 0.21 115.31 124.24 1xg3 h LEU 254 Ca 0.23 -0.12 -0.20 0.00 0.84 0.00 0.00 57.88 58.63 1xg3 h LEU 254 Cb 0.03 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 1xg3 h LEU 254 CO -0.04 0.80 -0.83 -0.09 -0.34 0.00 0.00 178.44 177.94 1xg3 h ARG 255 N 0.99 0.40 0.05 1.25 9.65 -0.76 0.25 114.38 126.20 1xg3 h ARG 255 Ca 0.23 -0.38 -0.16 0.00 -1.10 0.00 0.00 59.98 58.57 1xg3 h ARG 255 Cb 0.16 0.09 0.02 0.00 -1.39 0.00 0.00 29.97 28.85 1xg3 h ARG 255 CO -0.02 1.03 -0.67 1.96 2.80 0.00 0.00 179.97 185.07 1xg3 h GLN 256 N 0.25 0.37 0.00 0.20 4.20 -0.77 -3.38 115.11 115.97 1xg3 h GLN 256 Ca -0.05 -0.46 -0.13 0.00 0.06 0.00 0.00 58.65 58.06 1xg3 h GLN 256 Cb 1.44 0.15 -0.02 0.00 0.30 0.00 0.00 27.48 29.34 1xg3 h GLN 256 CO 0.14 1.15 -1.43 0.39 -0.67 0.00 0.00 178.83 178.41 1xg3 n GLU 257 N -4.19 0.62 -0.97 1.46 -0.58 0.72 -4.99 120.64 112.71 1xg3 n GLU 257 Ca -0.12 0.16 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 1xg3 n GLU 257 Cb 0.72 -1.78 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 1xg3 n GLU 257 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xg3 n GLY 258 N 1.36 0.45 3.53 0.62 0.00 0.08 -5.00 105.19 106.24 1xg3 n GLY 258 Ca -0.09 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 1xg3 n GLY 258 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1xg3 s THR 259 N -2.00 0.00 -1.52 2.61 -1.32 -1.25 -5.05 115.64 107.12 1xg3 s THR 259 Ca 0.00 0.00 0.19 0.00 -1.21 0.00 0.00 61.69 60.67 1xg3 s THR 259 Cb 0.00 -1.00 0.61 0.00 -1.51 0.00 0.00 72.50 70.60 1xg3 s THR 259 CO 0.00 0.00 1.52 0.00 -2.21 0.00 0.00 174.62 173.93 1xg3 n GLN 260 N 0.27 3.04 -0.26 7.08 0.00 -1.26 -4.22 117.38 122.04 1xg3 n GLN 260 Ca -0.11 -2.64 0.06 0.00 0.00 0.00 0.00 57.00 54.32 1xg3 n GLN 260 Cb 0.60 -1.62 0.20 0.00 0.00 0.00 0.00 30.24 29.41 1xg3 n GLN 260 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 1xg3 h LYS 261 N 3.82 0.29 0.00 2.61 1.57 -1.97 -1.74 116.57 121.15 1xg3 h LYS 261 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1xg3 h LYS 261 Cb 1.09 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.34 1xg3 h LYS 261 CO 0.07 0.19 0.00 -1.13 -0.57 0.00 0.00 179.45 178.01 1xg3 n SER 262 N -5.13 0.00 -0.03 0.86 3.41 -1.26 -3.04 113.62 108.43 1xg3 n SER 262 Ca 0.15 -0.24 0.02 0.00 -0.26 0.00 0.00 58.87 58.54 1xg3 n SER 262 Cb 0.48 -0.18 0.02 0.00 -0.26 0.00 0.00 64.21 64.27 1xg3 n SER 262 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1xg3 n VAL 263 N -1.18 0.96 -0.26 -3.33 0.24 -0.67 -4.69 118.33 109.40 1xg3 n VAL 263 Ca 0.12 -1.02 0.03 0.00 -2.04 0.00 0.00 64.34 61.42 1xg3 n VAL 263 Cb 0.12 0.46 0.25 0.00 -1.47 0.00 0.00 33.84 33.20 1xg3 n VAL 263 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1xg3 h ILE 264 N 0.67 1.12 0.00 1.34 1.08 -1.44 -0.71 117.51 119.57 1xg3 h ILE 264 Ca 0.00 -0.35 0.00 0.00 -0.39 0.00 0.00 64.86 64.12 1xg3 h ILE 264 Cb 0.68 0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.44 1xg3 h ILE 264 CO 0.00 0.19 0.00 -0.90 -0.69 0.00 0.00 178.15 176.75 1xg3 n ASP 265 N -4.45 0.00 -0.49 1.72 5.75 -1.26 -1.35 116.55 116.46 1xg3 n ASP 265 Ca 0.11 0.31 0.12 0.00 -0.01 0.00 0.00 54.79 55.33 1xg3 n ASP 265 Cb 0.13 -0.39 0.21 0.00 -1.03 0.00 0.00 41.12 40.04 1xg3 n ASP 265 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1xg3 n THR 266 N -1.39 0.00 -3.67 2.12 -2.24 -0.28 -4.96 114.28 103.85 1xg3 n THR 266 Ca 0.04 -0.26 -0.36 0.00 -2.27 0.00 0.00 64.05 61.20 1xg3 n THR 266 Cb 0.10 0.91 -0.06 0.00 -2.10 0.00 0.00 70.33 69.19 1xg3 n THR 266 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1xg3 s MET 267 N -2.33 3.68 0.20 -0.78 -1.94 -0.46 -5.06 119.30 112.61 1xg3 s MET 267 Ca 0.25 0.09 -0.30 0.00 -1.71 0.00 0.00 55.69 54.02 1xg3 s MET 267 Cb 0.19 -3.11 -0.09 0.00 2.01 0.00 0.00 34.83 33.83 1xg3 s MET 267 CO 0.47 0.66 1.41 -1.14 -0.01 0.00 0.00 175.02 176.42 1xg3 s GLN 268 N -1.51 4.30 0.80 2.03 0.74 -1.26 -4.98 119.66 119.78 1xg3 s GLN 268 Ca 0.26 2.20 -0.12 0.00 0.05 0.00 0.00 55.36 57.75 1xg3 s GLN 268 Cb -0.14 -3.16 0.07 0.00 1.10 0.00 0.00 33.01 30.88 1xg3 s GLN 268 CO 0.14 -0.40 1.14 0.95 -0.55 0.00 0.00 175.29 176.57 1xg3 s THR 269 N 0.37 2.49 0.20 -0.34 -4.23 -1.26 -4.87 115.64 108.00 1xg3 s THR 269 Ca 0.61 0.16 -0.11 0.00 -1.18 0.00 0.00 61.69 61.17 1xg3 s THR 269 Cb -0.40 -3.08 0.12 0.00 1.34 0.00 0.00 72.50 70.48 1xg3 s THR 269 CO 0.38 -0.21 1.84 -0.09 -0.54 0.00 0.00 174.62 176.01 1xg3 h ARG 270 N -1.04 0.79 -0.17 3.99 2.43 -1.99 -1.49 114.38 116.90 1xg3 h ARG 270 Ca -0.47 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 58.55 1xg3 h ARG 270 Cb 1.30 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 1xg3 h ARG 270 CO 0.64 0.53 -0.35 -0.97 -1.51 0.00 0.00 179.97 178.31 1xg3 h ASN 271 N 0.82 0.36 -0.58 -3.80 -0.73 -1.98 0.64 115.58 110.31 1xg3 h ASN 271 Ca 0.26 -0.14 -0.08 0.00 1.87 0.00 0.00 56.30 58.21 1xg3 h ASN 271 Cb -0.00 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.46 1xg3 h ASN 271 CO -0.09 0.69 0.07 -0.33 -0.37 0.00 0.00 177.43 177.40 1xg3 h GLU 272 N 0.30 1.00 -0.07 6.67 5.08 -1.79 0.11 114.58 125.87 1xg3 h GLU 272 Ca 0.04 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.12 1xg3 h GLU 272 Cb 0.76 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.89 1xg3 h GLU 272 CO 0.06 0.94 0.01 1.25 -1.00 0.00 0.00 179.01 180.27 1xg3 h LEU 273 N 0.93 0.11 -0.83 1.33 5.85 -0.79 -2.17 115.31 119.75 1xg3 h LEU 273 Ca 0.18 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.70 1xg3 h LEU 273 Cb 0.44 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 1xg3 h LEU 273 CO 0.01 0.33 0.52 1.88 -0.34 0.00 0.00 178.44 180.84 1xg3 h TYR 274 N -0.11 0.98 -0.50 1.25 0.05 -0.54 -1.64 116.97 116.46 1xg3 h TYR 274 Ca 0.02 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.77 1xg3 h TYR 274 Cb 0.26 -0.32 -0.02 0.00 1.01 0.00 0.00 36.73 37.66 1xg3 h TYR 274 CO 0.01 0.54 0.08 0.93 -1.05 0.00 0.00 178.16 178.67 1xg3 h GLU 275 N 1.00 0.78 -0.74 4.88 5.08 -0.70 -0.02 114.58 124.87 1xg3 h GLU 275 Ca 0.34 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.49 1xg3 h GLU 275 Cb 0.06 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 1xg3 h GLU 275 CO -0.13 0.73 0.31 0.77 -1.00 0.00 0.00 179.01 179.70 1xg3 h SER 276 N 0.74 0.99 -0.64 1.42 0.02 -0.65 -2.96 113.55 112.47 1xg3 h SER 276 Ca 0.16 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1xg3 h SER 276 Cb 0.34 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1xg3 h SER 276 CO 0.01 0.86 0.00 2.30 -1.14 0.00 0.00 176.83 178.86 1xg3 n ILE 277 N -4.30 1.41 -3.73 3.27 -5.35 -0.87 -4.89 119.36 104.89 1xg3 n ILE 277 Ca 0.07 -1.12 -0.26 0.00 -0.27 0.00 0.00 62.75 61.17 1xg3 n ILE 277 Cb 0.17 0.32 0.05 0.00 -1.74 0.00 0.00 39.64 38.43 1xg3 n ILE 277 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1xg3 n ASN 278 N 1.24 -4.85 -0.06 7.28 4.05 -0.63 -4.92 115.26 117.36 1xg3 n ASN 278 Ca 0.24 -0.68 -0.08 0.00 0.45 0.00 0.00 54.58 54.51 1xg3 n ASN 278 Cb 0.73 -4.45 -0.01 0.00 1.23 0.00 0.00 39.78 37.28 1xg3 n ASN 278 CO 0.00 0.00 0.00 0.22 -3.05 0.00 0.00 177.26 174.43 1xg3 h TYR 279 N -2.30 0.13 -0.88 1.20 5.03 -1.32 -3.20 116.97 115.62 1xg3 h TYR 279 Ca -0.58 0.01 0.00 0.00 2.58 0.00 0.00 58.73 60.74 1xg3 h TYR 279 Cb 1.37 -0.02 -0.04 0.00 1.55 0.00 0.00 36.73 39.58 1xg3 h TYR 279 CO 0.52 0.05 0.56 1.88 -1.32 0.00 0.00 178.16 179.85 1xg3 h TYR 280 N 0.18 1.14 0.00 -3.82 0.05 -1.91 -1.86 116.97 110.75 1xg3 h TYR 280 Ca 0.11 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.88 1xg3 h TYR 280 Cb 0.10 -0.38 -0.00 0.00 1.01 0.00 0.00 36.73 37.45 1xg3 h TYR 280 CO -0.14 0.74 -0.11 1.96 -1.05 0.00 0.00 178.16 179.56 1xg3 h GLN 281 N 1.21 0.00 0.00 4.88 4.20 -1.96 -1.57 115.11 121.87 1xg3 h GLN 281 Ca 0.32 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.03 1xg3 h GLN 281 Cb -0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.69 1xg3 h GLN 281 CO -0.06 0.11 -0.00 1.88 -0.67 0.00 0.00 178.83 180.09 1xg3 h TYR 282 N 0.00 -0.00 -0.61 2.96 -1.99 -1.44 -3.32 116.97 112.57 1xg3 h TYR 282 Ca -0.00 -0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.78 1xg3 h TYR 282 Cb 0.27 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.96 1xg3 h TYR 282 CO 0.00 0.56 0.40 1.49 -0.00 0.00 0.00 178.16 180.61 1xg3 h GLU 283 N -1.00 0.62 -0.68 4.88 4.81 -1.25 -1.76 114.58 120.20 1xg3 h GLU 283 Ca -0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1xg3 h GLU 283 Cb 0.56 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1xg3 h GLU 283 CO 0.00 0.41 0.29 1.49 -0.73 0.00 0.00 179.01 180.47 1xg3 h GLU 284 N 0.64 0.98 -0.63 1.92 4.81 -1.44 -1.49 114.58 119.37 1xg3 h GLU 284 Ca 0.26 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1xg3 h GLU 284 Cb 0.21 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.38 1xg3 h GLU 284 CO -0.07 0.78 0.28 0.87 -0.73 0.00 0.00 179.01 180.14 1xg3 h LYS 285 N 0.97 0.90 -0.20 1.92 1.57 -1.42 -1.78 116.57 118.53 1xg3 h LYS 285 Ca 0.23 -0.13 -0.11 0.00 -1.87 0.00 0.00 60.65 58.77 1xg3 h LYS 285 Cb 0.15 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1xg3 h LYS 285 CO -0.02 0.72 -0.36 -0.07 -0.57 0.00 0.00 179.45 179.14 1xg3 h LEU 286 N 0.90 0.46 -1.15 2.94 3.38 -1.20 -2.90 115.31 117.73 1xg3 h LEU 286 Ca 0.22 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1xg3 h LEU 286 Cb 0.13 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1xg3 h LEU 286 CO -0.03 0.79 -0.33 0.44 0.09 0.00 0.00 178.44 179.40 1xg3 h ASP 287 N 0.37 0.00 -0.79 -0.43 3.32 -0.59 -3.23 116.42 115.08 1xg3 h ASP 287 Ca 0.04 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.58 1xg3 h ASP 287 Cb 0.81 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.07 1xg3 h ASP 287 CO 0.07 0.33 0.21 0.59 -1.72 0.00 0.00 179.24 178.71 1xg3 n ASN 288 N -3.62 5.24 0.00 6.45 3.02 -0.74 -5.11 115.26 120.50 1xg3 n ASN 288 Ca -0.01 -3.76 0.12 0.00 -0.03 0.00 0.00 54.58 50.91 1xg3 n ASN 288 Cb 0.45 -0.72 0.71 0.00 -0.61 0.00 0.00 39.78 39.60 1xg3 n ASN 288 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82