#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xg2 s ILE 2 N 0.00 4.55 0.50 1.39 -1.09 -1.26 -5.10 121.20 120.20 1xg2 s ILE 2 Ca 0.00 -0.75 -0.22 0.00 -2.23 0.00 0.00 60.65 57.45 1xg2 s ILE 2 Cb 0.00 -3.19 -0.06 0.00 -1.58 0.00 0.00 42.46 37.63 1xg2 s ILE 2 CO 0.00 0.13 1.24 0.00 -1.23 0.00 0.00 174.94 175.08 1xg2 s ALA 3 N -1.39 2.87 -0.19 9.38 0.00 -1.26 -4.93 121.76 126.25 1xg2 s ALA 3 Ca 0.29 1.09 0.17 0.00 0.00 0.00 0.00 51.96 53.52 1xg2 s ALA 3 Cb -0.12 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.56 1xg2 s ALA 3 CO 0.22 -0.98 1.21 -0.91 0.00 0.00 0.00 175.76 175.30 1xg2 h ASN 4 N 1.71 0.00 -3.82 0.00 2.35 -1.47 -3.47 115.58 110.88 1xg2 h ASN 4 Ca -0.50 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.12 1xg2 h ASN 4 Cb 1.27 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 39.40 1xg2 h ASN 4 CO 0.59 0.40 -0.29 0.00 -1.65 0.00 0.00 177.43 176.48 1xg2 s ALA 5 N -3.03 -0.91 -0.08 -0.83 0.00 -0.90 -5.02 121.76 111.00 1xg2 s ALA 5 Ca 0.01 1.06 0.04 0.00 0.00 0.00 0.00 51.96 53.07 1xg2 s ALA 5 Cb 0.08 -0.62 -0.01 0.00 0.00 0.00 0.00 23.12 22.57 1xg2 s ALA 5 CO 0.76 -0.18 -0.20 0.08 0.00 0.00 0.00 175.76 176.22 1xg2 s VAL 6 N 0.28 2.47 -0.15 0.00 1.01 -1.26 -0.90 120.40 121.85 1xg2 s VAL 6 Ca -0.01 -0.90 -0.03 0.00 0.00 0.00 0.00 61.98 61.04 1xg2 s VAL 6 Cb -0.03 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1xg2 s VAL 6 CO -0.00 0.56 -0.05 -0.69 0.00 0.00 0.00 175.10 174.92 1xg2 s VAL 7 N -0.05 3.79 -0.09 2.92 1.01 0.10 -0.77 120.40 127.31 1xg2 s VAL 7 Ca -0.05 -0.40 -0.23 0.00 0.00 0.00 0.00 61.98 61.30 1xg2 s VAL 7 Cb -0.14 -2.65 0.05 0.00 0.00 0.00 0.00 36.38 33.64 1xg2 s VAL 7 CO 0.04 0.50 0.53 0.00 0.00 0.00 0.00 175.10 176.18 1xg2 s ALA 8 N 0.28 -1.36 -0.20 5.51 0.00 -0.34 -0.42 121.76 125.23 1xg2 s ALA 8 Ca -0.04 1.11 0.18 0.00 0.00 0.00 0.00 51.96 53.22 1xg2 s ALA 8 Cb -0.14 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.73 1xg2 s ALA 8 CO 0.03 -0.30 1.18 1.96 0.00 0.00 0.00 175.76 178.63 1xg2 h GLN 9 N 3.98 0.00 -0.69 0.00 4.20 -1.85 -3.34 115.11 117.42 1xg2 h GLN 9 Ca -0.28 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.43 1xg2 h GLN 9 Cb 1.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.94 1xg2 h GLN 9 CO 0.32 0.25 0.00 -0.40 -0.67 0.00 0.00 178.83 178.33 1xg2 n ASP 10 N -2.98 3.13 0.00 1.46 5.68 -1.26 -4.92 116.55 117.66 1xg2 n ASP 10 Ca -0.02 -2.37 0.00 0.00 -0.50 0.00 0.00 54.79 51.90 1xg2 n ASP 10 Cb 0.70 -0.52 0.00 0.00 -1.14 0.00 0.00 41.12 40.16 1xg2 n ASP 10 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xg2 n GLY 11 N 0.52 0.67 0.29 6.12 0.00 -1.25 -4.88 105.19 106.66 1xg2 n GLY 11 Ca 0.14 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.30 1xg2 n GLY 11 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xg2 n THR 12 N -2.13 0.01 -3.32 2.61 -2.24 -1.26 -4.89 114.28 103.05 1xg2 n THR 12 Ca 0.00 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1xg2 n THR 12 Cb 0.02 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 1xg2 n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xg2 n GLY 13 N 1.10 3.29 0.08 3.38 0.00 -1.26 -5.00 105.19 106.77 1xg2 n GLY 13 Ca 0.21 -2.15 -0.05 0.00 0.00 0.00 0.00 46.02 44.03 1xg2 n GLY 13 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xg2 h ASP 14 N 0.00 0.00 -5.12 1.61 3.32 -1.29 -3.48 116.42 111.45 1xg2 h ASP 14 Ca 0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 1xg2 h ASP 14 Cb 0.00 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.38 1xg2 h ASP 14 CO 0.00 0.87 -0.55 -0.31 -1.72 0.00 0.00 179.24 177.53 1xg2 s TYR 15 N -2.75 0.27 -0.16 4.55 2.02 -0.73 -4.99 117.35 115.56 1xg2 s TYR 15 Ca 0.00 -0.65 0.18 0.00 -0.37 0.00 0.00 57.07 56.24 1xg2 s TYR 15 Cb 0.09 -0.19 -0.07 0.00 -0.40 0.00 0.00 41.96 41.39 1xg2 s TYR 15 CO 0.81 -0.38 0.95 0.37 -1.57 0.00 0.00 175.55 175.73 1xg2 h GLN 16 N 3.50 0.00 -5.59 -0.62 4.15 -1.88 -0.89 115.11 113.77 1xg2 h GLN 16 Ca -0.33 0.00 -0.45 0.00 0.77 0.00 0.00 58.65 58.64 1xg2 h GLN 16 Cb 1.18 0.00 -0.19 0.00 0.21 0.00 0.00 27.48 28.68 1xg2 h GLN 16 CO 0.54 0.21 -0.77 0.95 -1.93 0.00 0.00 178.83 177.83 1xg2 s THR 17 N -3.06 1.46 0.19 2.39 -4.23 -1.26 -4.51 115.64 106.62 1xg2 s THR 17 Ca -0.01 -1.72 -0.08 0.00 -1.18 0.00 0.00 61.69 58.69 1xg2 s THR 17 Cb 0.09 -1.58 0.06 0.00 1.34 0.00 0.00 72.50 72.41 1xg2 s THR 17 CO 0.80 -0.35 1.64 0.25 -0.54 0.00 0.00 174.62 176.42 1xg2 h LEU 18 N 3.55 1.01 -0.96 4.79 5.85 -1.98 -3.08 115.31 124.49 1xg2 h LEU 18 Ca -0.41 -0.30 0.07 0.00 0.84 0.00 0.00 57.88 58.08 1xg2 h LEU 18 Cb 1.20 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.89 1xg2 h LEU 18 CO 0.49 1.08 0.61 0.00 -0.34 0.00 0.00 178.44 180.29 1xg2 h ALA 19 N 1.01 1.35 -0.51 1.25 0.00 -1.96 -1.65 119.26 118.75 1xg2 h ALA 19 Ca 0.16 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1xg2 h ALA 19 Cb 0.59 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1xg2 h ALA 19 CO 0.04 0.37 0.14 0.93 0.00 0.00 0.00 179.25 180.73 1xg2 h GLU 20 N 1.10 0.81 -0.68 0.00 5.08 -1.97 -1.81 114.58 117.10 1xg2 h GLU 20 Ca 0.42 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.55 1xg2 h GLU 20 Cb 0.21 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1xg2 h GLU 20 CO -0.19 0.76 0.23 0.00 -1.00 0.00 0.00 179.01 178.82 1xg2 h ALA 21 N 1.01 0.89 -0.29 3.43 0.00 -1.38 -2.02 119.26 120.91 1xg2 h ALA 21 Ca 0.16 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1xg2 h ALA 21 Cb 0.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1xg2 h ALA 21 CO -0.00 0.55 0.10 0.28 0.00 0.00 0.00 179.25 180.19 1xg2 h VAL 22 N 0.99 1.19 -0.84 0.00 2.07 -1.17 -1.73 116.25 116.76 1xg2 h VAL 22 Ca 0.22 -0.60 0.06 0.00 0.82 0.00 0.00 66.70 67.20 1xg2 h VAL 22 Cb 0.28 1.04 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1xg2 h VAL 22 CO -0.01 0.20 0.55 0.00 0.02 0.00 0.00 177.57 178.33 1xg2 h ALA 23 N 0.94 1.58 0.00 1.67 0.00 -1.18 -2.06 119.26 120.22 1xg2 h ALA 23 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1xg2 h ALA 23 Cb 0.22 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1xg2 h ALA 23 CO -0.01 0.29 -0.14 0.00 0.00 0.00 0.00 179.25 179.39 1xg2 n ALA 24 N -2.42 2.67 -1.75 0.00 0.00 -0.77 -4.85 120.51 113.40 1xg2 n ALA 24 Ca 0.12 -0.17 -0.36 0.00 0.00 0.00 0.00 53.44 53.04 1xg2 n ALA 24 Cb 0.21 -1.37 0.02 0.00 0.00 0.00 0.00 19.45 18.31 1xg2 n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xg2 s ALA 25 N -3.00 2.59 0.63 0.00 0.00 -0.67 -4.98 121.76 116.33 1xg2 s ALA 25 Ca 0.13 0.93 -0.17 0.00 0.00 0.00 0.00 51.96 52.85 1xg2 s ALA 25 Cb 0.19 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.88 1xg2 s ALA 25 CO 0.58 -1.04 1.19 -1.25 0.00 0.00 0.00 175.76 175.23 1xg2 s PRO 26 N -3.35 2.77 -0.03 0.00 0.04 -1.26 -5.03 135.00 128.14 1xg2 s PRO 26 Ca 0.75 1.73 -0.16 0.00 0.04 0.00 0.00 61.00 63.36 1xg2 s PRO 26 Cb -0.28 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 1xg2 s PRO 26 CO 0.31 -1.34 0.45 -0.51 0.04 0.00 0.00 177.00 175.95 1xg2 s ASP 27 N -1.86 6.80 -1.46 6.66 1.01 -1.26 -4.38 116.67 122.18 1xg2 s ASP 27 Ca 0.75 0.95 -0.12 0.00 0.71 0.00 0.00 52.55 54.84 1xg2 s ASP 27 Cb -0.28 -2.28 0.05 0.00 1.01 0.00 0.00 42.92 41.43 1xg2 s ASP 27 CO 0.37 0.21 1.06 0.29 0.21 0.00 0.00 175.17 177.31 1xg2 n LYS 28 N 2.44 -6.52 -1.86 8.23 5.02 -0.29 -4.92 118.16 120.25 1xg2 n LYS 28 Ca -0.11 0.69 -0.42 0.00 -2.02 0.00 0.00 58.31 56.45 1xg2 n LYS 28 Cb 0.52 -5.65 -0.03 0.00 -0.02 0.00 0.00 35.03 29.85 1xg2 n LYS 28 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1xg2 s SER 29 N -3.33 6.50 0.00 4.39 0.15 -1.26 -4.90 113.70 115.24 1xg2 s SER 29 Ca 0.62 2.75 0.28 0.00 0.70 0.00 0.00 55.95 60.30 1xg2 s SER 29 Cb -0.30 -2.61 1.00 0.00 -1.71 0.00 0.00 66.02 62.41 1xg2 s SER 29 CO 0.79 -0.86 1.73 0.29 1.20 0.00 0.00 173.24 176.39 1xg2 n LYS 30 N 3.37 0.43 -4.37 5.44 5.02 -1.26 -4.63 118.16 122.16 1xg2 n LYS 30 Ca 0.12 -0.17 -0.19 0.00 -2.02 0.00 0.00 58.31 56.05 1xg2 n LYS 30 Cb 0.38 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.79 1xg2 n LYS 30 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1xg2 s THR 31 N -2.69 1.59 0.11 -0.18 -4.23 -1.26 -5.12 115.64 103.87 1xg2 s THR 31 Ca 0.22 -2.15 -0.31 0.00 -1.18 0.00 0.00 61.69 58.26 1xg2 s THR 31 Cb 0.19 -2.21 -0.09 0.00 1.34 0.00 0.00 72.50 71.73 1xg2 s THR 31 CO 0.54 -0.47 1.66 -0.60 -0.54 0.00 0.00 174.62 175.21 1xg2 s ARG 32 N -3.70 4.19 -0.14 3.99 3.52 -1.26 -4.85 118.95 120.70 1xg2 s ARG 32 Ca 0.25 2.39 -0.01 0.00 -0.13 0.00 0.00 55.73 58.24 1xg2 s ARG 32 Cb 0.02 -3.43 -0.02 0.00 -1.56 0.00 0.00 34.95 29.96 1xg2 s ARG 32 CO 0.08 -0.71 -0.11 -0.47 -0.81 0.00 0.00 175.30 173.28 1xg2 s TYR 33 N 2.10 2.85 -0.20 5.12 5.04 -0.37 -4.99 117.35 126.90 1xg2 s TYR 33 Ca 0.74 -0.62 -0.03 0.00 -2.44 0.00 0.00 57.07 54.71 1xg2 s TYR 33 Cb -0.42 -1.87 -0.01 0.00 0.35 0.00 0.00 41.96 40.00 1xg2 s TYR 33 CO 0.32 -0.21 -0.07 0.08 -1.34 0.00 0.00 175.55 174.33 1xg2 s VAL 34 N 0.42 3.23 -0.26 3.14 1.01 -1.26 -0.52 120.40 126.16 1xg2 s VAL 34 Ca -0.09 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.25 1xg2 s VAL 34 Cb -0.16 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 1xg2 s VAL 34 CO 0.05 0.45 0.12 -0.63 0.00 0.00 0.00 175.10 175.09 1xg2 s ILE 35 N 1.26 4.71 -0.22 2.22 1.01 0.60 -1.02 121.20 129.75 1xg2 s ILE 35 Ca 0.03 -0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.53 1xg2 s ILE 35 Cb -0.14 -3.23 -0.05 0.00 0.01 0.00 0.00 42.46 39.05 1xg2 s ILE 35 CO -0.03 0.29 0.14 -0.47 0.00 0.00 0.00 174.94 174.87 1xg2 s TYR 36 N 1.67 3.32 -0.33 3.97 5.04 -0.08 -0.82 117.35 130.12 1xg2 s TYR 36 Ca 0.07 0.21 -0.06 0.00 -2.44 0.00 0.00 57.07 54.85 1xg2 s TYR 36 Cb -0.16 -2.22 0.04 0.00 0.35 0.00 0.00 41.96 39.97 1xg2 s TYR 36 CO 0.07 0.11 0.09 0.08 -1.34 0.00 0.00 175.55 174.56 1xg2 s VAL 37 N 0.85 3.65 0.93 3.14 1.01 0.71 0.02 120.40 130.70 1xg2 s VAL 37 Ca 0.07 -1.19 -0.11 0.00 0.00 0.00 0.00 61.98 60.75 1xg2 s VAL 37 Cb -0.13 -3.08 0.15 0.00 0.00 0.00 0.00 36.38 33.32 1xg2 s VAL 37 CO 0.03 -0.18 1.10 -0.54 0.00 0.00 0.00 175.10 175.51 1xg2 s LYS 38 N 1.37 0.96 0.49 2.72 1.02 0.44 -2.90 119.74 123.84 1xg2 s LYS 38 Ca -0.02 1.17 -0.23 0.00 0.02 0.00 0.00 55.97 56.91 1xg2 s LYS 38 Cb -0.20 -1.75 -0.08 0.00 -0.52 0.00 0.00 37.83 35.29 1xg2 s LYS 38 CO 0.02 -2.55 1.14 2.89 -0.92 0.00 0.00 175.35 175.93 1xg2 n ARG 39 N -4.14 1.48 0.00 1.68 1.85 -1.26 -4.80 116.66 111.48 1xg2 n ARG 39 Ca 0.08 0.54 0.00 0.00 -1.00 0.00 0.00 57.85 57.47 1xg2 n ARG 39 Cb 0.53 -2.27 0.00 0.00 -1.05 0.00 0.00 32.46 29.67 1xg2 n ARG 39 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1xg2 n GLY 40 N 1.02 3.14 3.39 2.89 0.00 -0.48 -4.75 105.19 110.39 1xg2 n GLY 40 Ca 0.10 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 1xg2 n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xg2 s THR 41 N -2.00 3.59 -0.29 2.61 2.01 -1.26 -1.20 115.64 119.10 1xg2 s THR 41 Ca 0.00 -0.44 -0.02 0.00 0.31 0.00 0.00 61.69 61.55 1xg2 s THR 41 Cb 0.00 -2.61 0.05 0.00 0.01 0.00 0.00 72.50 69.95 1xg2 s THR 41 CO 0.00 0.45 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.05 1xg2 s TYR 42 N 1.04 3.23 -1.13 4.92 1.51 0.99 -4.98 117.35 122.92 1xg2 s TYR 42 Ca 0.01 -1.83 -0.15 0.00 -1.01 0.00 0.00 57.07 54.08 1xg2 s TYR 42 Cb -0.15 -2.09 0.15 0.00 -0.11 0.00 0.00 41.96 39.77 1xg2 s TYR 42 CO 0.00 -0.79 1.35 0.21 -1.11 0.00 0.00 175.55 175.22 1xg2 s LYS 43 N 1.26 3.94 0.03 -0.62 2.20 -1.26 -0.77 119.74 124.53 1xg2 s LYS 43 Ca -0.05 -2.31 -0.15 0.00 -0.36 0.00 0.00 55.97 53.11 1xg2 s LYS 43 Cb -0.19 -5.04 0.02 0.00 -1.51 0.00 0.00 37.83 31.11 1xg2 s LYS 43 CO -0.02 -1.79 0.33 -1.83 -0.36 0.00 0.00 175.35 171.68 1xg2 s GLU 44 N 2.02 0.81 -0.34 4.03 -1.05 -0.87 -4.97 118.70 118.32 1xg2 s GLU 44 Ca 0.40 -0.43 -0.11 0.00 -0.15 0.00 0.00 54.97 54.69 1xg2 s GLU 44 Cb -0.03 0.35 0.01 0.00 -0.44 0.00 0.00 34.13 34.02 1xg2 s GLU 44 CO -0.03 -0.26 0.19 -0.80 0.95 0.00 0.00 175.26 175.32 1xg2 s ASN 45 N -1.93 5.70 -0.04 0.83 -0.87 -1.26 -4.36 114.94 113.01 1xg2 s ASN 45 Ca -0.06 -0.73 0.02 0.00 -1.57 0.00 0.00 52.86 50.52 1xg2 s ASN 45 Cb -0.01 -2.03 -0.03 0.00 -0.02 0.00 0.00 41.25 39.15 1xg2 s ASN 45 CO -0.02 -0.29 -0.06 -0.69 -2.57 0.00 0.00 177.10 173.47 1xg2 s VAL 46 N 1.60 3.74 -0.06 1.60 1.01 0.08 -5.00 120.40 123.36 1xg2 s VAL 46 Ca 0.04 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.45 1xg2 s VAL 46 Cb -0.18 -2.58 0.01 0.00 0.00 0.00 0.00 36.38 33.63 1xg2 s VAL 46 CO 0.07 0.50 -0.15 -0.70 0.00 0.00 0.00 175.10 174.82 1xg2 s GLU 47 N -1.10 1.86 -0.42 2.72 2.12 -1.26 -1.28 118.70 121.34 1xg2 s GLU 47 Ca 0.15 -0.53 -0.04 0.00 0.36 0.00 0.00 54.97 54.92 1xg2 s GLU 47 Cb -0.11 -1.54 0.11 0.00 0.26 0.00 0.00 34.13 32.85 1xg2 s GLU 47 CO 0.04 0.11 0.23 0.08 -0.54 0.00 0.00 175.26 175.19 1xg2 s VAL 48 N 0.41 3.41 0.96 3.70 1.01 0.70 -4.96 120.40 125.64 1xg2 s VAL 48 Ca -0.11 -2.06 -0.15 0.00 0.00 0.00 0.00 61.98 59.66 1xg2 s VAL 48 Cb -0.14 -3.32 0.17 0.00 0.00 0.00 0.00 36.38 33.08 1xg2 s VAL 48 CO 0.04 -0.71 1.21 0.00 0.00 0.00 0.00 175.10 175.64 1xg2 s ALA 49 N 1.12 1.91 0.47 5.51 0.00 -1.26 -0.87 121.76 128.64 1xg2 s ALA 49 Ca 0.08 -0.86 0.19 0.00 0.00 0.00 0.00 51.96 51.37 1xg2 s ALA 49 Cb -0.23 -2.90 1.22 0.00 0.00 0.00 0.00 23.12 21.21 1xg2 s ALA 49 CO -0.04 -2.44 2.06 0.66 0.00 0.00 0.00 175.76 176.00 1xg2 h SER 50 N -1.65 0.00 1.49 0.00 4.64 -1.96 -0.73 113.55 115.35 1xg2 h SER 50 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1xg2 h SER 50 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1xg2 h SER 50 CO 0.50 0.12 0.00 -0.55 -0.87 0.00 0.00 176.83 176.03 1xg2 h ASN 51 N 0.00 0.00 -2.12 4.97 -1.07 -1.93 -3.40 115.58 112.04 1xg2 h ASN 51 Ca -0.00 0.00 -0.72 0.00 0.07 0.00 0.00 56.30 55.64 1xg2 h ASN 51 Cb 0.24 0.00 -0.17 0.00 -2.07 0.00 0.00 38.32 36.32 1xg2 h ASN 51 CO 0.02 0.00 1.32 -0.54 0.07 0.00 0.00 177.43 178.29 1xg2 s LYS 52 N -3.26 3.99 0.16 4.14 -0.14 -0.29 -1.14 119.74 123.20 1xg2 s LYS 52 Ca 0.07 -2.39 -0.08 0.00 -1.36 0.00 0.00 55.97 52.21 1xg2 s LYS 52 Cb 0.09 -5.07 -0.06 0.00 -1.68 0.00 0.00 37.83 31.11 1xg2 s LYS 52 CO 0.59 -1.80 0.44 -1.64 -0.76 0.00 0.00 175.35 172.18 1xg2 s MET 53 N 1.97 3.72 -1.50 1.68 -1.94 -1.26 -4.31 119.30 117.66 1xg2 s MET 53 Ca 0.42 0.10 -0.06 0.00 -1.71 0.00 0.00 55.69 54.44 1xg2 s MET 53 Cb -0.03 -2.82 0.02 0.00 2.01 0.00 0.00 34.83 34.02 1xg2 s MET 53 CO -0.01 0.44 0.65 0.09 -0.01 0.00 0.00 175.02 176.18 1xg2 n ASN 54 N 0.20 -5.70 -4.73 3.03 3.02 0.62 -4.33 115.26 107.37 1xg2 n ASN 54 Ca -0.03 -0.34 -0.38 0.00 -0.03 0.00 0.00 54.58 53.80 1xg2 n ASN 54 Cb 0.52 -4.60 -0.06 0.00 -0.61 0.00 0.00 39.78 35.03 1xg2 n ASN 54 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1xg2 s LEU 55 N -6.73 4.31 -0.21 3.41 0.20 -1.26 -1.23 118.68 117.17 1xg2 s LEU 55 Ca 0.36 0.88 -0.04 0.00 0.69 0.00 0.00 54.13 56.02 1xg2 s LEU 55 Cb -0.17 -2.73 -0.02 0.00 -0.43 0.00 0.00 46.19 42.85 1xg2 s LEU 55 CO 0.44 0.03 -0.03 -0.32 -0.29 0.00 0.00 176.35 176.18 1xg2 s MET 56 N 0.43 3.49 -0.26 1.98 -2.45 0.32 -1.24 119.30 121.57 1xg2 s MET 56 Ca 0.27 -0.58 -0.06 0.00 -1.25 0.00 0.00 55.69 54.07 1xg2 s MET 56 Cb -0.16 -3.03 -0.01 0.00 1.25 0.00 0.00 34.83 32.89 1xg2 s MET 56 CO 0.12 -0.08 0.04 0.42 1.05 0.00 0.00 175.02 176.57 1xg2 s ILE 57 N 1.21 3.89 -0.06 10.11 1.01 -0.06 -0.30 121.20 137.01 1xg2 s ILE 57 Ca 0.03 -0.49 0.02 0.00 0.00 0.00 0.00 60.65 60.21 1xg2 s ILE 57 Cb -0.14 -2.89 0.01 0.00 0.01 0.00 0.00 42.46 39.44 1xg2 s ILE 57 CO -0.00 0.25 -0.11 0.54 0.00 0.00 0.00 174.94 175.61 1xg2 s VAL 58 N 1.52 1.03 0.00 2.92 0.11 -0.00 -1.52 120.40 124.47 1xg2 s VAL 58 Ca 0.04 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 58.66 1xg2 s VAL 58 Cb -0.16 -0.95 0.00 0.00 -1.53 0.00 0.00 36.38 33.74 1xg2 s VAL 58 CO 0.01 0.33 0.00 0.61 -3.33 0.00 0.00 175.10 172.72 1xg2 n GLY 59 N 3.72 1.81 0.95 6.54 0.00 -0.45 -0.21 105.19 117.56 1xg2 n GLY 59 Ca -0.22 -2.08 0.07 0.00 0.00 0.00 0.00 46.02 43.78 1xg2 n GLY 59 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xg2 n ASP 60 N -1.98 2.75 0.00 1.61 -0.08 -1.14 -4.76 116.55 112.95 1xg2 n ASP 60 Ca 0.00 -2.10 0.00 0.00 -1.51 0.00 0.00 54.79 51.18 1xg2 n ASP 60 Cb 0.00 -0.36 0.00 0.00 2.34 0.00 0.00 41.12 43.10 1xg2 n ASP 60 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xg2 n GLY 61 N 1.11 4.00 0.24 0.27 0.00 -0.27 -4.75 105.19 105.80 1xg2 n GLY 61 Ca 0.16 -1.45 0.17 0.00 0.00 0.00 0.00 46.02 44.90 1xg2 n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xg2 h MET 62 N 0.00 0.00 0.00 1.61 -0.00 -1.76 -1.45 114.93 113.33 1xg2 h MET 62 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.65 1xg2 h MET 62 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.59 1xg2 h MET 62 CO 0.00 0.00 -1.68 0.66 -0.00 0.00 0.00 176.91 175.89 1xg2 n TYR 63 N -2.75 0.39 -0.05 -0.10 0.53 -1.26 -3.87 117.16 110.04 1xg2 n TYR 63 Ca -0.01 0.12 -0.14 0.00 -1.02 0.00 0.00 57.90 56.85 1xg2 n TYR 63 Cb 0.17 -0.74 -0.14 0.00 -1.03 0.00 0.00 39.34 37.60 1xg2 n TYR 63 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1xg2 n ALA 64 N -2.29 1.34 -3.62 -0.72 0.00 -0.62 -4.86 120.51 109.74 1xg2 n ALA 64 Ca -0.06 -0.93 -0.34 0.00 0.00 0.00 0.00 53.44 52.12 1xg2 n ALA 64 Cb 0.64 -0.51 -0.15 0.00 0.00 0.00 0.00 19.45 19.43 1xg2 n ALA 64 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1xg2 s THR 65 N -2.55 2.73 -0.06 0.00 2.01 -0.79 -1.39 115.64 115.60 1xg2 s THR 65 Ca -0.16 -0.73 0.02 0.00 0.31 0.00 0.00 61.69 61.14 1xg2 s THR 65 Cb 0.07 -2.18 0.01 0.00 0.01 0.00 0.00 72.50 70.41 1xg2 s THR 65 CO 0.77 0.50 -0.12 -0.89 -0.69 0.00 0.00 174.62 174.19 1xg2 s THR 66 N 1.10 1.12 -0.22 -0.82 2.01 -0.34 -0.61 115.64 117.88 1xg2 s THR 66 Ca 0.00 -0.47 -0.09 0.00 0.31 0.00 0.00 61.69 61.45 1xg2 s THR 66 Cb -0.14 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 1xg2 s THR 66 CO -0.04 0.35 0.11 -0.63 -0.69 0.00 0.00 174.62 173.72 1xg2 s ILE 67 N 0.68 4.95 0.06 1.82 -1.09 -0.03 -0.01 121.20 127.57 1xg2 s ILE 67 Ca -0.14 0.03 0.04 0.00 -2.23 0.00 0.00 60.65 58.35 1xg2 s ILE 67 Cb -0.16 -3.28 -0.03 0.00 -1.58 0.00 0.00 42.46 37.42 1xg2 s ILE 67 CO 0.04 0.39 -0.12 0.28 -1.23 0.00 0.00 174.94 174.30 1xg2 s THR 68 N 0.88 0.90 0.38 2.92 -1.32 0.05 -1.29 115.64 118.17 1xg2 s THR 68 Ca 0.05 -1.21 -0.16 0.00 -1.21 0.00 0.00 61.69 59.16 1xg2 s THR 68 Cb -0.13 -0.90 0.05 0.00 -1.51 0.00 0.00 72.50 70.01 1xg2 s THR 68 CO 0.03 -0.28 0.77 -0.83 -2.21 0.00 0.00 174.62 172.11 1xg2 s GLY 69 N -1.66 0.38 0.00 6.08 0.00 -0.98 -2.06 107.32 109.07 1xg2 s GLY 69 Ca -0.05 -0.75 0.04 0.00 0.00 0.00 0.00 44.72 43.96 1xg2 s GLY 69 CO 0.02 -0.32 0.88 -1.14 0.00 0.00 0.00 173.10 172.54 1xg2 n SER 70 N -1.35 0.06 -4.76 1.64 3.41 -1.26 -1.03 113.62 110.33 1xg2 n SER 70 Ca -0.08 -1.71 -0.36 0.00 -0.26 0.00 0.00 58.87 56.45 1xg2 n SER 70 Cb 0.60 -0.12 0.02 0.00 -0.26 0.00 0.00 64.21 64.46 1xg2 n SER 70 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1xg2 s LEU 71 N 0.00 3.78 0.07 1.04 1.43 -1.26 -4.47 118.68 119.26 1xg2 s LEU 71 Ca 0.05 2.41 -0.26 0.00 -1.03 0.00 0.00 54.13 55.30 1xg2 s LEU 71 Cb 0.06 -4.47 0.08 0.00 0.03 0.00 0.00 46.19 41.89 1xg2 s LEU 71 CO -0.02 -1.41 0.83 0.54 0.23 0.00 0.00 176.35 176.51 1xg2 s ASN 72 N -1.46 -0.37 0.18 2.29 2.20 -1.26 -4.43 114.94 112.09 1xg2 s ASN 72 Ca 0.73 -0.10 -0.05 0.00 -0.94 0.00 0.00 52.86 52.50 1xg2 s ASN 72 Cb -0.31 0.47 0.06 0.00 -2.00 0.00 0.00 41.25 39.47 1xg2 s ASN 72 CO 0.35 -0.78 1.47 0.58 -2.94 0.00 0.00 177.10 175.78 1xg2 h VAL 73 N 2.00 1.32 -0.75 3.54 2.07 -1.21 -1.55 116.25 121.67 1xg2 h VAL 73 Ca -0.25 -1.83 0.02 0.00 0.82 0.00 0.00 66.70 65.46 1xg2 h VAL 73 Cb 1.25 1.79 -0.04 0.00 -1.52 0.00 0.00 31.29 32.78 1xg2 h VAL 73 CO 0.31 0.57 0.50 0.58 0.02 0.00 0.00 177.57 179.55 1xg2 h VAL 74 N 0.45 1.15 -0.04 2.57 2.07 -1.80 -2.09 116.25 118.57 1xg2 h VAL 74 Ca 0.00 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1xg2 h VAL 74 Cb 1.14 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1xg2 h VAL 74 CO 0.11 0.18 0.00 0.47 0.02 0.00 0.00 177.57 178.35 1xg2 n ASP 75 N -4.44 1.23 0.00 0.57 8.00 -1.16 -4.91 116.55 115.85 1xg2 n ASP 75 Ca 0.09 -1.45 0.00 0.00 0.71 0.00 0.00 54.79 54.13 1xg2 n ASP 75 Cb 0.08 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 1xg2 n ASP 75 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xg2 n GLY 76 N 1.12 0.92 3.82 0.44 0.00 -0.79 -4.99 105.19 105.72 1xg2 n GLY 76 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1xg2 n GLY 76 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xg2 s SER 77 N -1.59 6.49 0.64 1.61 0.15 -0.59 -4.99 113.70 115.42 1xg2 s SER 77 Ca 0.00 1.75 -0.13 0.00 0.70 0.00 0.00 55.95 58.26 1xg2 s SER 77 Cb 0.00 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.76 1xg2 s SER 77 CO 0.00 -0.67 1.06 0.42 1.20 0.00 0.00 173.24 175.24 1xg2 s THR 78 N -2.28 3.91 0.17 6.45 -4.23 -1.26 -3.90 115.64 114.50 1xg2 s THR 78 Ca 0.63 0.77 -0.15 0.00 -1.18 0.00 0.00 61.69 61.76 1xg2 s THR 78 Cb -0.12 -3.39 0.09 0.00 1.34 0.00 0.00 72.50 70.42 1xg2 s THR 78 CO 0.24 -0.66 1.69 0.74 -0.54 0.00 0.00 174.62 176.09 1xg2 h THR 79 N -0.09 0.68 -0.77 3.99 2.02 -1.94 -1.46 112.91 115.34 1xg2 h THR 79 Ca -0.45 -0.04 0.06 0.00 0.77 0.00 0.00 66.41 66.75 1xg2 h THR 79 Cb 1.22 0.56 -0.06 0.00 -1.74 0.00 0.00 68.15 68.12 1xg2 h THR 79 CO 0.57 0.02 0.46 0.15 0.37 0.00 0.00 175.52 177.09 1xg2 h PHE 80 N 0.11 0.85 -0.30 3.16 3.04 -1.99 -2.29 116.94 119.52 1xg2 h PHE 80 Ca 0.21 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.19 1xg2 h PHE 80 Cb 0.30 -0.27 0.00 0.00 2.56 0.00 0.00 35.95 38.54 1xg2 h PHE 80 CO -0.28 0.42 0.00 0.54 -2.02 0.00 0.00 178.31 176.97 1xg2 n ARG 81 N -4.70 2.05 0.05 1.11 1.74 -1.05 -4.08 116.66 111.79 1xg2 n ARG 81 Ca 0.11 -1.59 0.13 0.00 -0.77 0.00 0.00 57.85 55.73 1xg2 n ARG 81 Cb 0.18 -1.42 0.43 0.00 -1.02 0.00 0.00 32.46 30.63 1xg2 n ARG 81 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1xg2 n SER 82 N 0.80 0.49 -4.71 0.55 3.41 -0.58 -4.87 113.62 108.73 1xg2 n SER 82 Ca 0.17 0.41 -0.43 0.00 -0.26 0.00 0.00 58.87 58.76 1xg2 n SER 82 Cb 0.43 -0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 63.88 1xg2 n SER 82 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xg2 n ALA 83 N -1.67 2.36 -0.01 7.33 0.00 -1.25 -4.20 120.51 123.08 1xg2 n ALA 83 Ca 0.06 0.41 -0.10 0.00 0.00 0.00 0.00 53.44 53.81 1xg2 n ALA 83 Cb 0.39 -2.46 -0.04 0.00 0.00 0.00 0.00 19.45 17.34 1xg2 n ALA 83 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1xg2 h THR 84 N 3.67 0.94 -3.59 0.00 2.02 -0.89 -3.42 112.91 111.65 1xg2 h THR 84 Ca -0.44 -0.03 -0.55 0.00 0.77 0.00 0.00 66.41 66.16 1xg2 h THR 84 Cb 1.22 0.86 -0.33 0.00 -1.74 0.00 0.00 68.15 68.16 1xg2 h THR 84 CO 0.92 0.01 -0.83 -0.22 0.37 0.00 0.00 175.52 175.77 1xg2 s LEU 85 N -10.26 1.80 -0.05 2.58 0.20 -0.79 -0.75 118.68 111.41 1xg2 s LEU 85 Ca -0.13 -0.35 0.03 0.00 0.69 0.00 0.00 54.13 54.37 1xg2 s LEU 85 Cb 0.08 -0.94 0.00 0.00 -0.43 0.00 0.00 46.19 44.91 1xg2 s LEU 85 CO 0.68 0.09 -0.14 0.00 -0.29 0.00 0.00 176.35 176.69 1xg2 s ALA 86 N 0.39 1.34 -0.03 5.97 0.00 -0.41 -1.11 121.76 127.91 1xg2 s ALA 86 Ca -0.11 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.32 1xg2 s ALA 86 Cb -0.14 -0.51 0.03 0.00 0.00 0.00 0.00 23.12 22.49 1xg2 s ALA 86 CO 0.04 0.19 0.01 0.00 0.00 0.00 0.00 175.76 176.00 1xg2 s ALA 87 N 0.33 0.31 0.00 0.00 0.00 -0.24 -0.21 121.76 121.94 1xg2 s ALA 87 Ca -0.09 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1xg2 s ALA 87 Cb -0.13 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.63 1xg2 s ALA 87 CO 0.03 -0.13 0.10 1.33 0.00 0.00 0.00 175.76 177.08 1xg2 n VAL 88 N 4.30 0.00 -1.96 0.00 0.24 -0.05 -0.60 118.33 120.25 1xg2 n VAL 88 Ca -0.24 -0.33 -0.42 0.00 -2.04 0.00 0.00 64.34 61.31 1xg2 n VAL 88 Cb 0.50 1.10 -0.03 0.00 -1.47 0.00 0.00 33.84 33.95 1xg2 n VAL 88 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1xg2 s GLY 89 N -0.46 1.55 0.24 7.63 0.00 -1.13 -4.09 107.32 111.05 1xg2 s GLY 89 Ca 0.00 1.05 -0.30 0.00 0.00 0.00 0.00 44.72 45.47 1xg2 s GLY 89 CO 0.00 3.02 1.03 -0.18 0.00 0.00 0.00 173.10 176.97 1xg2 n GLN 90 N 6.68 1.17 -1.00 2.90 7.27 -1.26 -2.36 117.38 130.78 1xg2 n GLN 90 Ca 0.17 0.41 0.00 0.00 0.07 0.00 0.00 57.00 57.65 1xg2 n GLN 90 Cb 0.42 -1.80 0.00 0.00 2.41 0.00 0.00 30.24 31.27 1xg2 n GLN 90 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1xg2 n GLY 91 N 1.59 0.55 3.61 1.69 0.00 -0.08 -0.28 105.19 112.27 1xg2 n GLY 91 Ca 0.12 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.67 1xg2 n GLY 91 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1xg2 n PHE 92 N -2.79 1.59 -4.59 1.61 7.35 -0.99 -4.33 117.46 115.31 1xg2 n PHE 92 Ca 0.00 0.60 -0.25 0.00 -0.76 0.00 0.00 57.45 57.04 1xg2 n PHE 92 Cb 0.03 -2.34 -0.17 0.00 0.35 0.00 0.00 39.48 37.35 1xg2 n PHE 92 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1xg2 s ILE 93 N -0.26 1.16 -0.07 -2.13 1.01 -0.37 -1.33 121.20 119.21 1xg2 s ILE 93 Ca 0.70 -0.49 0.05 0.00 0.00 0.00 0.00 60.65 60.91 1xg2 s ILE 93 Cb -0.76 -1.06 -0.00 0.00 0.01 0.00 0.00 42.46 40.64 1xg2 s ILE 93 CO 0.52 0.36 -0.23 -0.22 0.00 0.00 0.00 174.94 175.38 1xg2 s LEU 94 N 0.68 2.02 -0.10 2.97 2.96 -0.04 -0.88 118.68 126.28 1xg2 s LEU 94 Ca -0.14 -0.49 -0.19 0.00 -0.22 0.00 0.00 54.13 53.08 1xg2 s LEU 94 Cb -0.16 -1.29 0.05 0.00 0.50 0.00 0.00 46.19 45.29 1xg2 s LEU 94 CO 0.04 0.19 0.48 -1.58 -1.32 0.00 0.00 176.35 174.15 1xg2 s GLN 95 N 0.08 0.71 -1.36 1.98 0.74 -0.58 -0.41 119.66 120.83 1xg2 s GLN 95 Ca -0.09 0.32 -0.01 0.00 0.05 0.00 0.00 55.36 55.63 1xg2 s GLN 95 Cb -0.15 0.33 0.01 0.00 1.10 0.00 0.00 33.01 34.30 1xg2 s GLN 95 CO 0.05 -0.16 0.60 -0.25 -0.55 0.00 0.00 175.29 174.98 1xg2 n ASP 96 N 1.91 -0.97 -3.61 6.67 8.00 -0.80 -1.33 116.55 126.41 1xg2 n ASP 96 Ca -0.17 -0.90 -0.13 0.00 0.71 0.00 0.00 54.79 54.30 1xg2 n ASP 96 Cb 0.56 -3.63 -0.06 0.00 -0.02 0.00 0.00 41.12 37.97 1xg2 n ASP 96 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1xg2 s ILE 97 N -3.77 0.04 -0.13 0.53 2.07 -1.23 -1.11 121.20 117.60 1xg2 s ILE 97 Ca 0.04 -0.33 -0.03 0.00 -1.41 0.00 0.00 60.65 58.92 1xg2 s ILE 97 Cb -0.02 -0.97 -0.03 0.00 0.13 0.00 0.00 42.46 41.57 1xg2 s ILE 97 CO 0.84 -0.18 -0.03 0.00 -1.91 0.00 0.00 174.94 173.66 1xg2 s ILE 99 N -0.06 2.96 0.04 0.00 -1.09 -0.47 -0.86 121.20 121.72 1xg2 s ILE 99 Ca 0.02 -0.68 0.01 0.00 -2.23 0.00 0.00 60.65 57.78 1xg2 s ILE 99 Cb -0.13 -2.26 -0.03 0.00 -1.58 0.00 0.00 42.46 38.46 1xg2 s ILE 99 CO 0.02 0.51 -0.06 0.00 -1.23 0.00 0.00 174.94 174.18 1xg2 s GLN 100 N 0.68 0.50 -0.17 2.79 -2.07 -0.41 -1.48 119.66 119.50 1xg2 s GLN 100 Ca -0.06 -0.78 0.01 0.00 -1.82 0.00 0.00 55.36 52.70 1xg2 s GLN 100 Cb -0.15 -0.15 0.03 0.00 -1.09 0.00 0.00 33.01 31.64 1xg2 s GLN 100 CO 0.02 0.01 -0.14 1.21 -1.32 0.00 0.00 175.29 175.07 1xg2 s ASN 101 N -1.72 2.93 -0.04 12.60 3.84 -0.47 -2.32 114.94 129.76 1xg2 s ASN 101 Ca -0.09 -0.61 0.18 0.00 0.21 0.00 0.00 52.86 52.55 1xg2 s ASN 101 Cb -0.08 -1.24 0.59 0.00 -0.55 0.00 0.00 41.25 39.97 1xg2 s ASN 101 CO -0.01 -0.07 1.48 0.35 -2.79 0.00 0.00 177.10 176.07 1xg2 n THR 102 N 4.73 1.16 -0.31 -5.21 -2.24 -0.20 -4.41 114.28 107.79 1xg2 n THR 102 Ca -0.17 -0.92 0.05 0.00 -2.27 0.00 0.00 64.05 60.75 1xg2 n THR 102 Cb 0.49 0.27 0.20 0.00 -2.10 0.00 0.00 70.33 69.19 1xg2 n THR 102 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xg2 h ALA 103 N 4.06 1.30 0.00 6.98 0.00 -1.78 -3.49 119.26 126.34 1xg2 h ALA 103 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1xg2 h ALA 103 Cb 1.03 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1xg2 h ALA 103 CO 0.09 0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.85 1xg2 n GLY 104 N -1.33 0.37 0.27 0.00 0.00 -1.26 -4.50 105.19 98.74 1xg2 n GLY 104 Ca 0.16 -1.82 0.03 0.00 0.00 0.00 0.00 46.02 44.39 1xg2 n GLY 104 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xg2 h PRO 105 N 0.00 0.33 0.00 1.61 0.13 -1.94 -2.41 132.00 129.73 1xg2 h PRO 105 Ca 0.00 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1xg2 h PRO 105 Cb 0.00 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.07 1xg2 h PRO 105 CO 0.00 0.35 0.00 0.00 -0.23 0.00 0.00 178.00 178.12 1xg2 n ALA 106 N -2.49 1.76 0.65 -0.56 0.00 -1.26 -2.36 120.51 116.25 1xg2 n ALA 106 Ca 0.00 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.49 1xg2 n ALA 106 Cb 0.19 -1.27 0.28 0.00 0.00 0.00 0.00 19.45 18.65 1xg2 n ALA 106 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xg2 n LYS 107 N -1.49 2.17 0.00 0.00 4.76 -0.90 -4.95 118.16 117.74 1xg2 n LYS 107 Ca 0.04 -1.77 0.00 0.00 -2.87 0.00 0.00 58.31 53.71 1xg2 n LYS 107 Cb 0.19 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 31.93 1xg2 n LYS 107 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1xg2 n ASP 108 N 0.97 0.00 -4.67 4.39 8.00 -0.99 -2.83 116.55 121.42 1xg2 n ASP 108 Ca 0.18 0.00 -0.45 0.00 0.71 0.00 0.00 54.79 55.23 1xg2 n ASP 108 Cb 0.47 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.53 1xg2 n ASP 108 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xg2 n GLN 109 N 12.80 2.55 -3.28 -1.24 3.00 -1.26 -4.47 117.38 125.47 1xg2 n GLN 109 Ca 0.00 0.93 -0.08 0.00 -0.01 0.00 0.00 57.00 57.85 1xg2 n GLN 109 Cb 0.00 -2.82 -0.05 0.00 0.00 0.00 0.00 30.24 27.37 1xg2 n GLN 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1xg2 s ALA 110 N 3.79 -1.36 0.10 -1.58 0.00 -1.01 -1.21 121.76 120.49 1xg2 s ALA 110 Ca 0.89 0.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.70 1xg2 s ALA 110 Cb -0.56 -2.20 -0.06 0.00 0.00 0.00 0.00 23.12 20.30 1xg2 s ALA 110 CO 0.45 -1.86 0.94 0.08 0.00 0.00 0.00 175.76 175.37 1xg2 s VAL 111 N 2.36 4.53 -0.05 0.00 1.01 -1.25 -4.45 120.40 122.54 1xg2 s VAL 111 Ca 0.11 2.03 -0.00 0.00 0.00 0.00 0.00 61.98 64.12 1xg2 s VAL 111 Cb -0.12 -4.30 -0.00 0.00 0.00 0.00 0.00 36.38 31.96 1xg2 s VAL 111 CO -0.24 0.32 0.01 0.00 0.00 0.00 0.00 175.10 175.19 1xg2 h ALA 112 N 5.61 -0.01 -3.32 5.51 0.00 -1.06 -2.72 119.26 123.27 1xg2 h ALA 112 Ca -0.43 -0.00 -0.67 0.00 0.00 0.00 0.00 54.91 53.81 1xg2 h ALA 112 Cb 1.21 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 18.69 1xg2 h ALA 112 CO 0.72 -0.01 -0.84 -1.17 0.00 0.00 0.00 179.25 177.95 1xg2 s LEU 113 N -6.47 2.31 -0.14 0.00 2.96 -1.05 -1.39 118.68 114.90 1xg2 s LEU 113 Ca -0.00 -0.48 -0.01 0.00 -0.22 0.00 0.00 54.13 53.42 1xg2 s LEU 113 Cb 0.00 -1.48 -0.02 0.00 0.50 0.00 0.00 46.19 45.19 1xg2 s LEU 113 CO 0.00 0.15 -0.11 -0.60 -1.32 0.00 0.00 176.35 174.47 1xg2 s ARG 114 N 0.40 3.42 -0.13 1.98 3.52 -0.27 -0.94 118.95 126.93 1xg2 s ARG 114 Ca -0.15 -0.66 0.02 0.00 -0.13 0.00 0.00 55.73 54.81 1xg2 s ARG 114 Cb -0.17 -2.70 0.01 0.00 -1.56 0.00 0.00 34.95 30.53 1xg2 s ARG 114 CO 0.07 0.17 -0.18 0.08 -0.81 0.00 0.00 175.30 174.63 1xg2 s VAL 115 N 0.46 1.78 -0.20 7.11 1.01 -0.27 -1.08 120.40 129.22 1xg2 s VAL 115 Ca -0.08 -0.81 0.17 0.00 0.00 0.00 0.00 61.98 61.26 1xg2 s VAL 115 Cb -0.15 -1.60 0.46 0.00 0.00 0.00 0.00 36.38 35.09 1xg2 s VAL 115 CO 0.04 0.50 1.17 0.61 0.00 0.00 0.00 175.10 177.41 1xg2 n GLY 116 N 4.18 3.45 3.49 4.51 0.00 0.23 -0.86 105.19 120.19 1xg2 n GLY 116 Ca -0.19 -1.47 -0.35 0.00 0.00 0.00 0.00 46.02 44.00 1xg2 n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xg2 s ALA 117 N -2.75 3.16 0.42 4.61 0.00 -1.16 -4.57 121.76 121.48 1xg2 s ALA 117 Ca 0.37 -0.97 -0.24 0.00 0.00 0.00 0.00 51.96 51.12 1xg2 s ALA 117 Cb 0.37 -1.90 -0.08 0.00 0.00 0.00 0.00 23.12 21.50 1xg2 s ALA 117 CO -0.06 -0.17 1.10 0.34 0.00 0.00 0.00 175.76 176.97 1xg2 s ASP 118 N 1.03 6.55 -1.39 0.00 2.15 -1.26 -3.60 116.67 120.15 1xg2 s ASP 118 Ca 0.03 2.14 -0.04 0.00 0.43 0.00 0.00 52.55 55.12 1xg2 s ASP 118 Cb -0.14 -2.59 0.03 0.00 -0.30 0.00 0.00 42.92 39.91 1xg2 s ASP 118 CO 0.02 -0.64 0.73 0.23 -0.17 0.00 0.00 175.17 175.34 1xg2 n MET 119 N -0.20 -4.79 -3.86 4.34 2.81 -0.01 -0.90 117.12 114.52 1xg2 n MET 119 Ca 0.06 0.58 -0.32 0.00 -1.81 0.00 0.00 57.70 56.20 1xg2 n MET 119 Cb 0.49 -5.16 -0.04 0.00 -0.71 0.00 0.00 33.22 27.80 1xg2 n MET 119 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1xg2 s SER 120 N -4.07 6.40 -0.07 7.83 1.04 -1.06 -3.71 113.70 120.07 1xg2 s SER 120 Ca 0.19 0.38 0.03 0.00 0.48 0.00 0.00 55.95 57.02 1xg2 s SER 120 Cb -0.09 -2.01 0.01 0.00 0.10 0.00 0.00 66.02 64.03 1xg2 s SER 120 CO 0.83 0.19 -0.14 -0.69 0.98 0.00 0.00 173.24 174.40 1xg2 s VAL 121 N -1.46 1.29 -0.29 5.02 1.01 -0.44 -1.44 120.40 124.09 1xg2 s VAL 121 Ca 0.33 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.72 1xg2 s VAL 121 Cb -0.13 -1.15 0.05 0.00 0.00 0.00 0.00 36.38 35.15 1xg2 s VAL 121 CO 0.24 0.39 -0.03 -0.63 0.00 0.00 0.00 175.10 175.07 1xg2 s ILE 122 N 0.52 2.82 -0.13 2.22 1.09 0.09 -0.87 121.20 126.94 1xg2 s ILE 122 Ca -0.13 -1.41 0.01 0.00 -1.10 0.00 0.00 60.65 58.02 1xg2 s ILE 122 Cb -0.15 -2.62 0.02 0.00 -1.06 0.00 0.00 42.46 38.65 1xg2 s ILE 122 CO 0.04 -0.07 -0.17 0.21 -0.10 0.00 0.00 174.94 174.85 1xg2 s ASN 123 N 1.23 2.74 -1.33 3.58 3.04 0.46 -0.99 114.94 123.67 1xg2 s ASN 123 Ca -0.06 -0.51 -0.03 0.00 0.04 0.00 0.00 52.86 52.30 1xg2 s ASN 123 Cb -0.20 -1.24 0.02 0.00 -1.54 0.00 0.00 41.25 38.29 1xg2 s ASN 123 CO -0.02 0.01 0.85 0.54 -3.04 0.00 0.00 177.10 175.44 1xg2 n ARG 124 N 4.35 -5.61 -4.27 0.43 1.74 -0.63 -2.43 116.66 110.24 1xg2 n ARG 124 Ca -0.19 0.68 -0.24 0.00 -0.77 0.00 0.00 57.85 57.33 1xg2 n ARG 124 Cb 0.51 -5.42 -0.07 0.00 -1.02 0.00 0.00 32.46 26.45 1xg2 n ARG 124 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xg2 s ARG 126 N -3.45 2.85 -0.23 0.00 3.52 -0.68 -0.67 118.95 120.29 1xg2 s ARG 126 Ca 0.30 -0.94 -0.04 0.00 -0.13 0.00 0.00 55.73 54.92 1xg2 s ARG 126 Cb -0.07 -2.77 -0.00 0.00 -1.56 0.00 0.00 34.95 30.54 1xg2 s ARG 126 CO 0.19 -0.32 -0.04 0.42 -0.81 0.00 0.00 175.30 174.74 1xg2 s ILE 127 N 1.28 3.30 -0.13 4.11 -1.09 0.38 -1.37 121.20 127.68 1xg2 s ILE 127 Ca 0.01 -0.58 -0.01 0.00 -2.23 0.00 0.00 60.65 57.84 1xg2 s ILE 127 Cb -0.15 -2.53 0.04 0.00 -1.58 0.00 0.00 42.46 38.24 1xg2 s ILE 127 CO -0.09 0.38 -0.01 -0.62 -1.23 0.00 0.00 174.94 173.38 1xg2 s ASP 128 N 1.46 2.31 0.00 3.58 3.68 -0.55 -1.26 116.67 125.88 1xg2 s ASP 128 Ca 0.05 -0.45 0.00 0.00 2.13 0.00 0.00 52.55 54.28 1xg2 s ASP 128 Cb -0.15 -0.64 0.00 0.00 -1.45 0.00 0.00 42.92 40.68 1xg2 s ASP 128 CO -0.03 -0.21 0.00 0.00 0.13 0.00 0.00 175.17 175.05 1xg2 n ALA 129 N 5.03 0.00 -2.00 3.66 0.00 -1.12 -1.37 120.51 124.72 1xg2 n ALA 129 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1xg2 n ALA 129 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1xg2 n ALA 129 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1xg2 n TYR 130 N 0.00 0.00 -2.76 0.00 4.02 -1.26 -3.79 117.16 113.37 1xg2 n TYR 130 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 1xg2 n TYR 130 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.29 1xg2 n TYR 130 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 1xg2 s GLN 131 N 0.40 4.48 -0.92 -0.72 0.74 -1.26 -0.23 119.66 122.15 1xg2 s GLN 131 Ca 0.00 1.31 -0.04 0.00 0.05 0.00 0.00 55.36 56.68 1xg2 s GLN 131 Cb 0.00 -3.49 0.00 0.00 1.10 0.00 0.00 33.01 30.62 1xg2 s GLN 131 CO 0.00 -0.14 0.56 -0.25 -0.55 0.00 0.00 175.29 174.91 1xg2 n ASP 132 N 4.35 -4.61 -0.19 6.67 9.92 -0.38 -2.39 116.55 129.91 1xg2 n ASP 132 Ca 0.06 -0.26 -0.02 0.00 -0.53 0.00 0.00 54.79 54.04 1xg2 n ASP 132 Cb 0.50 -3.34 0.04 0.00 -0.64 0.00 0.00 41.12 37.69 1xg2 n ASP 132 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1xg2 h THR 133 N -1.28 0.36 -3.68 -3.53 2.02 -1.68 -3.34 112.91 101.78 1xg2 h THR 133 Ca -0.35 0.00 -0.63 0.00 0.77 0.00 0.00 66.41 66.20 1xg2 h THR 133 Cb 1.23 0.36 -0.38 0.00 -1.74 0.00 0.00 68.15 67.62 1xg2 h THR 133 CO 0.36 0.00 -0.78 -0.22 0.37 0.00 0.00 175.52 175.25 1xg2 s LEU 134 N -10.80 3.09 -1.02 2.58 2.96 0.09 -0.66 118.68 114.92 1xg2 s LEU 134 Ca -0.14 -1.39 -0.15 0.00 -0.22 0.00 0.00 54.13 52.23 1xg2 s LEU 134 Cb 0.18 -1.32 0.19 0.00 0.50 0.00 0.00 46.19 45.73 1xg2 s LEU 134 CO 0.72 -0.25 1.13 -0.47 -1.32 0.00 0.00 176.35 176.16 1xg2 s TYR 135 N 1.26 3.59 -1.16 5.38 6.14 -0.11 -1.53 117.35 130.91 1xg2 s TYR 135 Ca -0.04 -1.98 -0.19 0.00 0.64 0.00 0.00 57.07 55.51 1xg2 s TYR 135 Cb -0.19 -4.10 0.08 0.00 0.42 0.00 0.00 41.96 38.17 1xg2 s TYR 135 CO -0.07 -1.25 1.54 0.00 0.64 0.00 0.00 175.55 176.41 1xg2 s ALA 136 N 1.07 3.21 -0.05 3.97 0.00 -0.36 -1.11 121.76 128.49 1xg2 s ALA 136 Ca 0.32 -2.74 -0.24 0.00 0.00 0.00 0.00 51.96 49.29 1xg2 s ALA 136 Cb -0.06 -4.48 -0.19 0.00 0.00 0.00 0.00 23.12 18.38 1xg2 s ALA 136 CO -0.07 -3.31 1.03 1.25 0.00 0.00 0.00 175.76 174.67 1xg2 h HIS 137 N 8.39 -0.09 -2.40 0.00 2.76 -1.20 -2.31 115.15 120.30 1xg2 h HIS 137 Ca 0.32 -0.00 0.17 0.00 -2.20 0.00 0.00 60.37 58.65 1xg2 h HIS 137 Cb 0.93 0.03 -0.07 0.00 1.55 0.00 0.00 27.41 29.85 1xg2 h HIS 137 CO 1.31 0.45 0.48 -1.54 -1.30 0.00 0.00 177.93 177.33 1xg2 s SER 138 N -5.67 -0.15 0.20 3.26 1.04 -1.23 -1.46 113.70 109.68 1xg2 s SER 138 Ca -0.15 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 55.82 1xg2 s SER 138 Cb 0.00 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1xg2 s SER 138 CO 0.59 -0.95 0.00 0.00 0.98 0.00 0.00 173.24 173.86 1xg2 n GLN 139 N -0.50 -1.09 -3.40 4.02 1.13 -1.26 -4.14 117.38 112.14 1xg2 n GLN 139 Ca -0.06 0.72 -0.37 0.00 -1.94 0.00 0.00 57.00 55.35 1xg2 n GLN 139 Cb 0.60 -1.33 -0.07 0.00 0.11 0.00 0.00 30.24 29.55 1xg2 n GLN 139 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1xg2 s ARG 140 N -1.30 4.26 0.02 -1.09 0.52 -1.26 -1.20 118.95 118.91 1xg2 s ARG 140 Ca 0.00 0.26 0.01 0.00 -0.52 0.00 0.00 55.73 55.49 1xg2 s ARG 140 Cb 0.00 -3.46 -0.01 0.00 0.52 0.00 0.00 34.95 31.99 1xg2 s ARG 140 CO 0.00 0.12 -0.05 -0.65 0.02 0.00 0.00 175.30 174.74 1xg2 s GLN 141 N 0.80 0.36 -0.08 3.54 -0.21 -0.38 -0.83 119.66 122.86 1xg2 s GLN 141 Ca 0.21 -0.44 0.01 0.00 0.02 0.00 0.00 55.36 55.16 1xg2 s GLN 141 Cb -0.14 -0.18 0.02 0.00 1.00 0.00 0.00 33.01 33.71 1xg2 s GLN 141 CO 0.07 0.03 -0.08 0.12 -2.12 0.00 0.00 175.29 173.32 1xg2 s PHE 142 N -0.82 1.26 -0.15 0.91 5.36 -0.52 -2.15 117.98 121.88 1xg2 s PHE 142 Ca -0.06 -0.50 -0.01 0.00 -0.96 0.00 0.00 56.93 55.39 1xg2 s PHE 142 Cb -0.06 -1.02 -0.01 0.00 -0.34 0.00 0.00 43.02 41.59 1xg2 s PHE 142 CO -0.00 -0.34 -0.12 0.71 -1.46 0.00 0.00 175.22 174.01 1xg2 s TYR 143 N 1.13 2.83 -0.01 10.12 1.51 -0.35 -0.73 117.35 131.85 1xg2 s TYR 143 Ca -0.06 -0.73 0.01 0.00 -1.01 0.00 0.00 57.07 55.27 1xg2 s TYR 143 Cb -0.14 -1.89 0.01 0.00 -0.11 0.00 0.00 41.96 39.83 1xg2 s TYR 143 CO -0.01 -0.29 -0.01 0.50 -1.11 0.00 0.00 175.55 174.63 1xg2 s ARG 144 N 0.56 0.20 -1.38 -0.62 6.06 -0.16 -0.66 118.95 122.95 1xg2 s ARG 144 Ca -0.08 -0.02 -0.07 0.00 -2.50 0.00 0.00 55.73 53.06 1xg2 s ARG 144 Cb -0.16 -0.26 0.04 0.00 0.06 0.00 0.00 34.95 34.64 1xg2 s ARG 144 CO 0.03 -0.01 0.49 -0.25 -2.50 0.00 0.00 175.30 173.06 1xg2 n ASP 145 N 3.38 -4.69 -4.62 -2.12 10.43 -1.06 -1.61 116.55 116.27 1xg2 n ASP 145 Ca -0.17 -0.29 -0.24 0.00 2.57 0.00 0.00 54.79 56.65 1xg2 n ASP 145 Cb 0.56 -3.84 -0.09 0.00 1.84 0.00 0.00 41.12 39.59 1xg2 n ASP 145 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 1xg2 s SER 146 N -2.64 4.17 -0.18 -2.24 0.01 -1.25 -3.39 113.70 108.17 1xg2 s SER 146 Ca 0.32 -0.95 -0.01 0.00 1.31 0.00 0.00 55.95 56.62 1xg2 s SER 146 Cb -0.16 -0.55 -0.00 0.00 0.21 0.00 0.00 66.02 65.52 1xg2 s SER 146 CO 0.40 -0.18 -0.11 -0.47 0.41 0.00 0.00 173.24 173.28 1xg2 s TYR 147 N -2.49 2.86 -0.13 2.43 5.04 0.16 -0.82 117.35 124.39 1xg2 s TYR 147 Ca 0.34 -0.98 0.02 0.00 -2.44 0.00 0.00 57.07 54.00 1xg2 s TYR 147 Cb -0.01 -1.96 0.01 0.00 0.35 0.00 0.00 41.96 40.35 1xg2 s TYR 147 CO 0.19 -0.48 -0.17 0.08 -1.34 0.00 0.00 175.55 173.83 1xg2 s VAL 148 N 1.00 1.69 0.04 3.14 1.01 -0.58 -0.47 120.40 126.23 1xg2 s VAL 148 Ca -0.01 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.28 1xg2 s VAL 148 Cb -0.15 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.67 1xg2 s VAL 148 CO -0.02 0.48 -0.18 0.28 0.00 0.00 0.00 175.10 175.67 1xg2 s THR 149 N 1.03 1.42 0.00 3.92 -1.32 -0.39 -1.11 115.64 119.19 1xg2 s THR 149 Ca -0.04 -1.09 0.00 0.00 -1.21 0.00 0.00 61.69 59.34 1xg2 s THR 149 Cb -0.15 -1.25 0.00 0.00 -1.51 0.00 0.00 72.50 69.60 1xg2 s THR 149 CO -0.04 0.13 0.00 0.61 -2.21 0.00 0.00 174.62 173.11 1xg2 n GLY 150 N 1.90 0.79 0.00 6.08 0.00 -1.01 -2.77 105.19 110.18 1xg2 n GLY 150 Ca -0.17 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1xg2 n GLY 150 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xg2 n THR 151 N 0.00 0.00 -3.26 2.61 -2.24 0.69 -1.89 114.28 110.19 1xg2 n THR 151 Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 1xg2 n THR 151 Cb 0.00 -0.23 -0.08 0.00 -2.10 0.00 0.00 70.33 67.92 1xg2 n THR 151 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1xg2 s VAL 152 N 0.00 5.05 -1.26 2.28 1.01 -1.25 -1.34 120.40 124.90 1xg2 s VAL 152 Ca 0.00 0.57 -0.01 0.00 0.00 0.00 0.00 61.98 62.54 1xg2 s VAL 152 Cb 0.00 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1xg2 s VAL 152 CO 0.00 -0.06 0.90 0.47 0.00 0.00 0.00 175.10 176.40 1xg2 n ASP 153 N 5.62 -1.98 0.00 3.32 8.00 -0.19 -1.25 116.55 130.07 1xg2 n ASP 153 Ca -0.05 -0.70 0.14 0.00 0.71 0.00 0.00 54.79 54.89 1xg2 n ASP 153 Cb 0.49 -4.69 0.57 0.00 -0.02 0.00 0.00 41.12 37.48 1xg2 n ASP 153 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1xg2 n PHE 154 N -4.24 0.02 -3.92 1.24 1.16 -0.85 -3.35 117.46 107.52 1xg2 n PHE 154 Ca -0.27 0.01 -0.30 0.00 -1.87 0.00 0.00 57.45 55.01 1xg2 n PHE 154 Cb 0.66 -0.48 -0.16 0.00 -1.61 0.00 0.00 39.48 37.90 1xg2 n PHE 154 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1xg2 s ILE 155 N -3.00 1.46 0.10 1.97 1.01 -0.19 -0.73 121.20 121.82 1xg2 s ILE 155 Ca 0.14 -1.26 -0.04 0.00 0.00 0.00 0.00 60.65 59.48 1xg2 s ILE 155 Cb 0.19 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.84 1xg2 s ILE 155 CO 0.55 -0.18 0.10 0.72 0.00 0.00 0.00 174.94 176.13 1xg2 s PHE 156 N 1.41 0.48 -1.31 3.97 -0.12 -0.58 -1.35 117.98 120.47 1xg2 s PHE 156 Ca -0.03 -0.92 0.00 0.00 -0.05 0.00 0.00 56.93 55.93 1xg2 s PHE 156 Cb -0.19 -0.26 0.00 0.00 -0.63 0.00 0.00 43.02 41.94 1xg2 s PHE 156 CO -0.08 -0.51 0.00 0.41 -0.05 0.00 0.00 175.22 174.99 1xg2 n GLY 157 N -0.04 0.64 2.41 1.99 0.00 -1.20 -1.23 105.19 107.77 1xg2 n GLY 157 Ca -0.11 -2.17 0.01 0.00 0.00 0.00 0.00 46.02 43.75 1xg2 n GLY 157 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1xg2 n ASN 158 N 0.00 1.09 -4.73 1.61 5.15 -0.54 -0.13 115.26 117.72 1xg2 n ASN 158 Ca 0.00 -2.03 -0.31 0.00 -0.60 0.00 0.00 54.58 51.64 1xg2 n ASN 158 Cb 0.00 -0.31 0.12 0.00 -0.53 0.00 0.00 39.78 39.06 1xg2 n ASN 158 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1xg2 s ALA 159 N -2.36 1.82 -0.41 5.20 0.00 -0.90 -4.45 121.76 120.65 1xg2 s ALA 159 Ca 0.27 0.24 -0.20 0.00 0.00 0.00 0.00 51.96 52.26 1xg2 s ALA 159 Cb 0.34 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 20.19 1xg2 s ALA 159 CO -0.08 -2.19 0.62 0.00 0.00 0.00 0.00 175.76 174.11 1xg2 s ALA 160 N -2.84 3.38 -0.05 0.00 0.00 -0.34 -1.85 121.76 120.06 1xg2 s ALA 160 Ca 0.63 -1.14 -0.02 0.00 0.00 0.00 0.00 51.96 51.43 1xg2 s ALA 160 Cb -0.19 -3.24 0.03 0.00 0.00 0.00 0.00 23.12 19.72 1xg2 s ALA 160 CO 0.57 -1.65 0.11 0.54 0.00 0.00 0.00 175.76 175.33 1xg2 s VAL 161 N 2.74 -0.04 -0.13 0.00 0.11 -0.77 -1.26 120.40 121.06 1xg2 s VAL 161 Ca 0.22 0.13 0.01 0.00 -2.93 0.00 0.00 61.98 59.42 1xg2 s VAL 161 Cb -0.14 -0.18 -0.01 0.00 -1.53 0.00 0.00 36.38 34.52 1xg2 s VAL 161 CO 0.17 0.06 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.15 1xg2 s VAL 162 N 0.82 2.68 -0.24 2.04 1.01 -0.91 -0.91 120.40 124.89 1xg2 s VAL 162 Ca -0.06 -0.78 -0.10 0.00 0.00 0.00 0.00 61.98 61.03 1xg2 s VAL 162 Cb -0.09 -2.11 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 1xg2 s VAL 162 CO -0.04 0.53 0.14 -0.36 0.00 0.00 0.00 175.10 175.37 1xg2 s PHE 163 N 0.51 3.26 -0.07 5.22 0.40 -0.08 -1.21 117.98 126.01 1xg2 s PHE 163 Ca -0.11 0.09 0.01 0.00 -0.60 0.00 0.00 56.93 56.33 1xg2 s PHE 163 Cb -0.16 -2.26 0.02 0.00 0.51 0.00 0.00 43.02 41.13 1xg2 s PHE 163 CO 0.04 -0.02 -0.08 -1.14 0.70 0.00 0.00 175.22 174.72 1xg2 s GLN 164 N 1.16 1.32 -1.52 0.44 0.74 0.17 -0.76 119.66 121.20 1xg2 s GLN 164 Ca 0.07 -0.26 -0.13 0.00 0.05 0.00 0.00 55.36 55.08 1xg2 s GLN 164 Cb -0.14 -1.22 0.08 0.00 1.10 0.00 0.00 33.01 32.84 1xg2 s GLN 164 CO 0.05 -0.07 0.98 1.63 -0.55 0.00 0.00 175.29 177.33 1xg2 n LYS 165 N 4.12 -5.55 -4.03 1.67 4.76 -1.01 -2.65 118.16 115.47 1xg2 n LYS 165 Ca -0.21 0.60 -0.26 0.00 -2.87 0.00 0.00 58.31 55.57 1xg2 n LYS 165 Cb 0.51 -5.48 -0.04 0.00 -1.84 0.00 0.00 35.03 28.17 1xg2 n LYS 165 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1xg2 s GLN 167 N -3.19 3.35 -0.40 0.00 -0.21 -0.00 -1.07 119.66 118.14 1xg2 s GLN 167 Ca 0.32 -0.72 -0.13 0.00 0.02 0.00 0.00 55.36 54.85 1xg2 s GLN 167 Cb -0.10 -3.67 0.03 0.00 1.00 0.00 0.00 33.01 30.27 1xg2 s GLN 167 CO 0.25 -0.45 0.26 -0.51 -2.12 0.00 0.00 175.29 172.72 1xg2 s LEU 168 N 1.65 4.97 -0.31 2.90 1.43 0.46 -1.52 118.68 128.26 1xg2 s LEU 168 Ca 0.05 -1.02 -0.00 0.00 -1.03 0.00 0.00 54.13 52.13 1xg2 s LEU 168 Cb -0.17 -2.09 0.07 0.00 0.03 0.00 0.00 46.19 44.03 1xg2 s LEU 168 CO 0.08 -0.44 0.01 -0.69 0.23 0.00 0.00 176.35 175.54 1xg2 s VAL 169 N 1.60 2.79 0.22 -1.59 1.01 -0.27 -1.58 120.40 122.59 1xg2 s VAL 169 Ca 0.03 -1.63 -0.30 0.00 0.00 0.00 0.00 61.98 60.08 1xg2 s VAL 169 Cb -0.20 -2.70 -0.08 0.00 0.00 0.00 0.00 36.38 33.39 1xg2 s VAL 169 CO 0.08 -0.23 1.00 0.00 0.00 0.00 0.00 175.10 175.95 1xg2 s ALA 170 N 1.17 3.34 0.48 5.51 0.00 -0.51 -2.41 121.76 129.34 1xg2 s ALA 170 Ca -0.02 0.70 0.04 0.00 0.00 0.00 0.00 51.96 52.67 1xg2 s ALA 170 Cb -0.20 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 1xg2 s ALA 170 CO -0.03 0.03 0.07 -0.98 0.00 0.00 0.00 175.76 174.85 1xg2 s ARG 171 N -0.90 2.14 -0.11 0.00 1.70 -0.79 -1.01 118.95 119.98 1xg2 s ARG 171 Ca 0.44 -2.22 -0.29 0.00 -0.47 0.00 0.00 55.73 53.19 1xg2 s ARG 171 Cb -0.27 -1.68 -0.03 0.00 -0.57 0.00 0.00 34.95 32.39 1xg2 s ARG 171 CO 0.34 -0.28 1.45 0.21 -1.08 0.00 0.00 175.30 175.94 1xg2 s LYS 172 N -3.88 4.21 0.07 3.89 2.20 -1.26 -4.78 119.74 120.19 1xg2 s LYS 172 Ca 0.21 1.92 -0.00 0.00 -0.36 0.00 0.00 55.97 57.74 1xg2 s LYS 172 Cb 0.04 -3.86 0.01 0.00 -1.51 0.00 0.00 37.83 32.51 1xg2 s LYS 172 CO 0.11 -0.77 0.10 -0.35 -0.36 0.00 0.00 175.35 174.08 1xg2 n PRO 173 N 6.82 0.51 -1.48 4.03 -0.04 -1.26 -5.01 135.00 138.58 1xg2 n PRO 173 Ca 0.15 -0.26 -0.29 0.00 -0.04 0.00 0.00 63.50 63.06 1xg2 n PRO 173 Cb 0.44 -0.07 0.13 0.00 -0.04 0.00 0.00 33.50 33.95 1xg2 n PRO 173 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1xg2 s GLY 174 N -2.68 1.59 0.20 0.55 0.00 -1.26 -4.94 107.32 100.78 1xg2 s GLY 174 Ca 0.07 -0.37 -0.32 0.00 0.00 0.00 0.00 44.72 44.09 1xg2 s GLY 174 CO 0.04 0.14 1.37 1.17 0.00 0.00 0.00 173.10 175.83 1xg2 n LYS 175 N -3.72 1.79 -0.83 2.90 4.81 -1.26 -1.79 118.16 120.06 1xg2 n LYS 175 Ca 0.07 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 1xg2 n LYS 175 Cb 0.58 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 33.35 1xg2 n LYS 175 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1xg2 n TYR 176 N 2.06 0.00 -2.02 5.64 0.53 -1.26 -4.99 117.16 117.11 1xg2 n TYR 176 Ca 0.14 0.00 -0.32 0.00 -1.02 0.00 0.00 57.90 56.70 1xg2 n TYR 176 Cb 0.29 -0.74 0.00 0.00 -1.03 0.00 0.00 39.34 37.86 1xg2 n TYR 176 CO 0.00 0.00 0.00 -0.65 -1.02 0.00 0.00 176.86 175.19 1xg2 s GLN 177 N -0.57 3.61 -0.11 -0.72 -0.21 -0.74 -5.07 119.66 115.86 1xg2 s GLN 177 Ca 0.00 0.88 0.02 0.00 0.02 0.00 0.00 55.36 56.28 1xg2 s GLN 177 Cb 0.00 -2.08 0.01 0.00 1.00 0.00 0.00 33.01 31.94 1xg2 s GLN 177 CO 0.00 -0.56 -0.16 -0.65 -2.12 0.00 0.00 175.29 171.81 1xg2 s GLN 178 N -4.70 2.26 0.31 2.91 -0.21 -1.26 -4.48 119.66 114.49 1xg2 s GLN 178 Ca 0.57 -0.58 -0.28 0.00 0.02 0.00 0.00 55.36 55.10 1xg2 s GLN 178 Cb -0.11 -1.91 -0.09 0.00 1.00 0.00 0.00 33.01 31.90 1xg2 s GLN 178 CO 0.45 -0.05 1.05 -0.80 -2.12 0.00 0.00 175.29 173.82 1xg2 s ASN 179 N 0.94 7.21 -0.14 5.90 0.01 -0.15 -4.59 114.94 124.12 1xg2 s ASN 179 Ca -0.07 2.13 -0.02 0.00 -0.71 0.00 0.00 52.86 54.18 1xg2 s ASN 179 Cb -0.15 -2.61 0.04 0.00 0.41 0.00 0.00 41.25 38.94 1xg2 s ASN 179 CO -0.01 -0.17 0.01 -0.04 -1.51 0.00 0.00 177.10 175.38 1xg2 s MET 180 N -1.71 0.74 0.16 -0.60 -1.94 -0.45 -0.81 119.30 114.69 1xg2 s MET 180 Ca 0.48 -0.20 -0.16 0.00 -1.71 0.00 0.00 55.69 54.10 1xg2 s MET 180 Cb -0.27 -1.61 0.03 0.00 2.01 0.00 0.00 34.83 34.99 1xg2 s MET 180 CO 0.35 -0.47 1.81 0.28 -0.01 0.00 0.00 175.02 176.98 1xg2 h VAL 181 N 6.41 1.13 -3.71 -6.03 2.07 -1.28 -0.32 116.25 114.52 1xg2 h VAL 181 Ca -0.19 -0.26 -0.60 0.00 0.82 0.00 0.00 66.70 66.48 1xg2 h VAL 181 Cb 1.12 0.50 -0.21 0.00 -1.52 0.00 0.00 31.29 31.19 1xg2 h VAL 181 CO 0.31 0.12 -0.83 0.42 0.02 0.00 0.00 177.57 177.62 1xg2 s THR 182 N -6.08 1.96 -0.41 2.57 -4.23 -0.45 -1.02 115.64 107.98 1xg2 s THR 182 Ca -0.13 -1.73 0.03 0.00 -1.18 0.00 0.00 61.69 58.68 1xg2 s THR 182 Cb 0.11 -1.80 0.16 0.00 1.34 0.00 0.00 72.50 72.32 1xg2 s THR 182 CO 0.73 -0.08 0.32 0.00 -0.54 0.00 0.00 174.62 175.06 1xg2 s ALA 183 N -1.37 1.36 0.04 3.99 0.00 -0.46 -2.32 121.76 123.00 1xg2 s ALA 183 Ca 0.12 -2.37 -0.30 0.00 0.00 0.00 0.00 51.96 49.40 1xg2 s ALA 183 Cb -0.09 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.38 1xg2 s ALA 183 CO 0.06 -2.00 0.99 -1.14 0.00 0.00 0.00 175.76 173.68 1xg2 s GLN 184 N 0.21 4.59 -0.42 0.00 -0.44 -1.25 -3.22 119.66 119.13 1xg2 s GLN 184 Ca 0.30 1.47 0.04 0.00 -2.50 0.00 0.00 55.36 54.67 1xg2 s GLN 184 Cb -0.01 -3.42 0.45 0.00 -1.64 0.00 0.00 33.01 28.40 1xg2 s GLN 184 CO -0.16 0.02 1.45 0.41 0.50 0.00 0.00 175.29 177.51 1xg2 n GLY 185 N 2.69 6.23 3.65 2.59 0.00 0.81 -3.65 105.19 117.51 1xg2 n GLY 185 Ca 0.05 -2.56 -0.43 0.00 0.00 0.00 0.00 46.02 43.08 1xg2 n GLY 185 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xg2 s ARG 186 N -3.67 4.15 0.10 1.61 3.52 -1.26 -4.68 118.95 118.72 1xg2 s ARG 186 Ca 0.55 1.70 0.20 0.00 -0.13 0.00 0.00 55.73 58.06 1xg2 s ARG 186 Cb 0.44 -3.84 -0.11 0.00 -1.56 0.00 0.00 34.95 29.88 1xg2 s ARG 186 CO 0.01 -0.83 0.83 2.41 -0.81 0.00 0.00 175.30 176.91 1xg2 n THR 187 N 5.58 0.73 -3.72 4.11 -1.04 -1.26 -1.17 114.28 117.50 1xg2 n THR 187 Ca 0.15 -0.60 -0.16 0.00 -2.04 0.00 0.00 64.05 61.40 1xg2 n THR 187 Cb 0.45 -0.42 -0.16 0.00 -1.82 0.00 0.00 70.33 68.38 1xg2 n THR 187 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1xg2 s ASP 188 N -5.36 0.35 0.01 8.00 -1.08 -1.26 -4.42 116.67 112.91 1xg2 s ASP 188 Ca -0.03 0.19 0.16 0.00 -0.52 0.00 0.00 52.55 52.35 1xg2 s ASP 188 Cb 0.10 0.06 0.68 0.00 -1.46 0.00 0.00 42.92 42.31 1xg2 s ASP 188 CO 0.82 -0.18 1.51 -0.81 0.52 0.00 0.00 175.17 177.03 1xg2 n PRO 189 N 4.63 0.01 0.01 4.34 -0.04 -1.26 -2.03 135.00 140.66 1xg2 n PRO 189 Ca -0.18 0.24 0.13 0.00 -0.04 0.00 0.00 63.50 63.65 1xg2 n PRO 189 Cb 0.50 -1.52 0.50 0.00 -0.04 0.00 0.00 33.50 32.95 1xg2 n PRO 189 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1xg2 n ASN 190 N -1.53 0.21 -4.70 3.54 5.03 -1.26 -4.82 115.26 111.73 1xg2 n ASN 190 Ca 0.04 0.32 -0.42 0.00 0.87 0.00 0.00 54.58 55.39 1xg2 n ASN 190 Cb 0.19 -0.33 -0.03 0.00 -1.02 0.00 0.00 39.78 38.59 1xg2 n ASN 190 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1xg2 s GLN 191 N -3.01 4.49 -1.35 3.52 -0.21 -0.86 -4.96 119.66 117.26 1xg2 s GLN 191 Ca 0.13 1.33 -0.06 0.00 0.02 0.00 0.00 55.36 56.78 1xg2 s GLN 191 Cb 0.18 -3.49 0.10 0.00 1.00 0.00 0.00 33.01 30.79 1xg2 s GLN 191 CO 0.58 -0.15 2.44 0.00 -2.12 0.00 0.00 175.29 176.04 1xg2 n ALA 192 N 4.35 6.87 -2.54 6.09 0.00 -1.26 -4.91 120.51 129.10 1xg2 n ALA 192 Ca 0.06 -4.03 -0.25 0.00 0.00 0.00 0.00 53.44 49.22 1xg2 n ALA 192 Cb 0.50 -2.84 -0.10 0.00 0.00 0.00 0.00 19.45 17.01 1xg2 n ALA 192 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1xg2 s THR 193 N -0.78 1.45 0.00 0.00 -4.23 -1.26 -4.71 115.64 106.11 1xg2 s THR 193 Ca 0.55 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.06 1xg2 s THR 193 Cb 0.18 -2.79 0.00 0.00 1.34 0.00 0.00 72.50 71.23 1xg2 s THR 193 CO -0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 1xg2 n GLY 194 N -0.85 2.46 3.39 3.99 0.00 -0.77 -4.87 105.19 108.53 1xg2 n GLY 194 Ca -0.05 -1.34 -0.33 0.00 0.00 0.00 0.00 46.02 44.30 1xg2 n GLY 194 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xg2 s THR 195 N -1.99 3.30 -0.11 2.61 2.01 -0.54 -1.84 115.64 119.09 1xg2 s THR 195 Ca 0.00 -0.56 0.03 0.00 0.31 0.00 0.00 61.69 61.47 1xg2 s THR 195 Cb 0.00 -2.42 0.01 0.00 0.01 0.00 0.00 72.50 70.09 1xg2 s THR 195 CO 0.00 0.50 -0.20 -0.55 -0.69 0.00 0.00 174.62 173.68 1xg2 s SER 196 N 0.56 2.77 -0.19 3.53 0.15 -0.09 -1.37 113.70 119.07 1xg2 s SER 196 Ca -0.06 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.09 1xg2 s SER 196 Cb -0.15 -1.27 0.02 0.00 -1.71 0.00 0.00 66.02 62.91 1xg2 s SER 196 CO 0.03 0.10 -0.17 -0.63 1.20 0.00 0.00 173.24 173.76 1xg2 s ILE 197 N 0.62 2.24 -0.02 6.45 1.01 -0.10 -0.90 121.20 130.50 1xg2 s ILE 197 Ca -0.13 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.60 1xg2 s ILE 197 Cb -0.17 -1.98 0.02 0.00 0.01 0.00 0.00 42.46 40.35 1xg2 s ILE 197 CO 0.04 0.49 -0.00 -1.58 0.00 0.00 0.00 174.94 173.89 1xg2 s GLN 198 N 1.30 0.26 -1.45 2.79 0.74 0.06 -0.38 119.66 122.98 1xg2 s GLN 198 Ca 0.04 0.06 -0.08 0.00 0.05 0.00 0.00 55.36 55.44 1xg2 s GLN 198 Cb -0.14 -0.42 0.04 0.00 1.10 0.00 0.00 33.01 33.59 1xg2 s GLN 198 CO -0.11 -0.11 0.67 1.19 -0.55 0.00 0.00 175.29 176.38 1xg2 n PHE 199 N 3.99 -2.04 -3.50 1.67 0.99 -1.01 -2.60 117.46 114.97 1xg2 n PHE 199 Ca -0.25 0.60 -0.20 0.00 -0.00 0.00 0.00 57.45 57.60 1xg2 n PHE 199 Cb 0.51 -3.97 -0.02 0.00 -1.00 0.00 0.00 39.48 35.00 1xg2 n PHE 199 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1xg2 s ASN 201 N -4.15 4.95 -0.38 0.00 2.47 -0.24 -1.25 114.94 116.34 1xg2 s ASN 201 Ca 0.47 -1.02 -0.09 0.00 0.42 0.00 0.00 52.86 52.63 1xg2 s ASN 201 Cb -0.07 -1.79 0.05 0.00 -1.45 0.00 0.00 41.25 37.99 1xg2 s ASN 201 CO 0.29 -0.24 0.20 -0.63 -3.72 0.00 0.00 177.10 173.01 1xg2 s ILE 202 N 1.37 4.29 0.23 -5.21 1.01 0.18 -0.40 121.20 122.66 1xg2 s ILE 202 Ca -0.01 -1.11 0.01 0.00 0.00 0.00 0.00 60.65 59.53 1xg2 s ILE 202 Cb -0.18 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 1xg2 s ILE 202 CO 0.00 -0.32 0.15 0.27 0.00 0.00 0.00 174.94 175.04 1xg2 s ILE 203 N 1.48 0.04 0.01 2.92 -4.36 -0.61 -0.70 121.20 119.97 1xg2 s ILE 203 Ca 0.01 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.33 1xg2 s ILE 203 Cb -0.21 -2.51 -0.05 0.00 1.25 0.00 0.00 42.46 40.95 1xg2 s ILE 203 CO 0.04 0.00 0.29 0.00 0.24 0.00 0.00 174.94 175.52 1xg2 s ALA 204 N -4.01 3.82 0.96 2.27 0.00 -1.26 -1.42 121.76 122.11 1xg2 s ALA 204 Ca 0.39 -0.52 -0.12 0.00 0.00 0.00 0.00 51.96 51.71 1xg2 s ALA 204 Cb 0.06 -2.11 0.16 0.00 0.00 0.00 0.00 23.12 21.23 1xg2 s ALA 204 CO 0.15 0.62 1.09 -1.54 0.00 0.00 0.00 175.76 176.08 1xg2 s SER 205 N -1.64 2.91 0.44 0.00 1.04 -0.18 -4.81 113.70 111.46 1xg2 s SER 205 Ca 0.28 1.49 0.14 0.00 0.48 0.00 0.00 55.95 58.33 1xg2 s SER 205 Cb -0.13 -2.16 0.98 0.00 0.10 0.00 0.00 66.02 64.81 1xg2 s SER 205 CO 0.16 -2.99 1.98 0.77 0.98 0.00 0.00 173.24 174.13 1xg2 h SER 206 N -1.79 0.02 1.73 7.02 4.64 -1.99 -1.73 113.55 121.43 1xg2 h SER 206 Ca -0.52 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 1xg2 h SER 206 Cb 1.30 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1xg2 h SER 206 CO 0.54 0.20 -0.01 -2.24 -0.87 0.00 0.00 176.83 174.44 1xg2 h ASP 207 N 0.02 0.00 0.29 4.97 2.03 -1.95 -3.31 116.42 118.46 1xg2 h ASP 207 Ca 0.00 -0.00 -0.33 0.00 -0.73 0.00 0.00 57.03 55.97 1xg2 h ASP 207 Cb 0.33 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.81 1xg2 h ASP 207 CO 0.02 0.00 -1.85 0.25 -1.03 0.00 0.00 179.24 176.63 1xg2 h LEU 208 N 0.00 0.26 -0.83 0.15 5.85 -1.76 -3.41 115.31 115.57 1xg2 h LEU 208 Ca 0.00 -0.57 0.18 0.00 0.84 0.00 0.00 57.88 58.32 1xg2 h LEU 208 Cb 0.87 -0.09 -0.11 0.00 0.37 0.00 0.00 40.66 41.70 1xg2 h LEU 208 CO 0.00 1.51 0.35 -0.08 -0.34 0.00 0.00 178.44 179.88 1xg2 h GLU 209 N 0.05 0.43 0.00 1.25 4.81 -1.42 -0.42 114.58 119.28 1xg2 h GLU 209 Ca -0.36 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1xg2 h GLU 209 Cb 2.03 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 31.31 1xg2 h GLU 209 CO 0.09 0.29 0.00 -1.35 -0.73 0.00 0.00 179.01 177.31 1xg2 h PRO 210 N 0.44 0.00 -0.14 0.92 0.11 -1.80 -3.31 132.00 128.24 1xg2 h PRO 210 Ca 0.48 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.47 1xg2 h PRO 210 Cb 0.81 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 31.77 1xg2 h PRO 210 CO -0.46 0.00 -0.67 1.33 -0.21 0.00 0.00 178.00 177.99 1xg2 n VAL 211 N -2.87 1.85 -0.32 3.15 0.24 -0.20 -4.82 118.33 115.37 1xg2 n VAL 211 Ca 0.01 -3.01 0.10 0.00 -2.04 0.00 0.00 64.34 59.40 1xg2 n VAL 211 Cb 0.29 -0.11 0.31 0.00 -1.47 0.00 0.00 33.84 32.86 1xg2 n VAL 211 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1xg2 h LEU 212 N 1.25 0.79 -0.85 1.34 3.38 -1.57 -1.69 115.31 117.96 1xg2 h LEU 212 Ca 0.01 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1xg2 h LEU 212 Cb 1.25 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 1xg2 h LEU 212 CO 0.14 0.39 -0.24 0.11 0.09 0.00 0.00 178.44 178.94 1xg2 h LYS 213 N 0.83 0.00 0.09 1.13 1.79 -1.90 -3.09 116.57 115.42 1xg2 h LYS 213 Ca 0.49 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.68 1xg2 h LYS 213 Cb 0.65 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.28 1xg2 h LYS 213 CO -0.25 0.24 -1.39 1.49 -1.08 0.00 0.00 179.45 178.45 1xg2 h GLU 214 N 0.00 0.18 -4.27 3.15 4.81 -1.71 -3.44 114.58 113.30 1xg2 h GLU 214 Ca -0.00 -0.31 -0.63 0.00 -0.13 0.00 0.00 59.36 58.29 1xg2 h GLU 214 Cb 0.86 0.12 -0.39 0.00 0.63 0.00 0.00 28.75 29.96 1xg2 h GLU 214 CO 0.03 1.05 -0.75 -0.06 -0.73 0.00 0.00 179.01 178.55 1xg2 s PHE 215 N -2.64 2.80 0.57 0.92 0.08 -0.88 -4.87 117.98 113.97 1xg2 s PHE 215 Ca -0.06 -2.30 -0.15 0.00 0.12 0.00 0.00 56.93 54.54 1xg2 s PHE 215 Cb 0.08 -2.21 -0.05 0.00 -0.57 0.00 0.00 43.02 40.27 1xg2 s PHE 215 CO 0.85 -0.88 1.02 -1.25 -0.10 0.00 0.00 175.22 174.86 1xg2 s PRO 216 N 1.24 3.60 -0.07 0.24 0.04 -1.25 -4.63 135.00 134.17 1xg2 s PRO 216 Ca 0.06 0.98 0.02 0.00 0.04 0.00 0.00 61.00 62.10 1xg2 s PRO 216 Cb -0.18 -2.08 0.02 0.00 0.04 0.00 0.00 34.50 32.29 1xg2 s PRO 216 CO -0.13 -0.56 -0.11 0.99 0.04 0.00 0.00 177.00 177.23 1xg2 s THR 217 N -2.73 1.11 0.21 1.26 2.01 -1.22 -0.98 115.64 115.30 1xg2 s THR 217 Ca 0.59 -0.44 0.09 0.00 0.31 0.00 0.00 61.69 62.24 1xg2 s THR 217 Cb -0.12 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 71.31 1xg2 s THR 217 CO 0.40 0.35 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.32 1xg2 s TYR 218 N 0.84 2.69 0.31 4.92 1.51 0.01 -1.07 117.35 126.56 1xg2 s TYR 218 Ca -0.11 -0.20 0.05 0.00 -1.01 0.00 0.00 57.07 55.79 1xg2 s TYR 218 Cb -0.15 -1.27 0.52 0.00 -0.11 0.00 0.00 41.96 40.94 1xg2 s TYR 218 CO 0.02 0.55 1.78 -0.07 -1.11 0.00 0.00 175.55 176.71 1xg2 h LEU 219 N 2.55 0.40 -7.20 -1.29 3.38 -1.13 -1.06 115.31 110.96 1xg2 h LEU 219 Ca -0.46 -0.12 0.32 0.00 0.09 0.00 0.00 57.88 57.71 1xg2 h LEU 219 Cb 1.22 -0.11 -0.13 0.00 0.09 0.00 0.00 40.66 41.73 1xg2 h LEU 219 CO 0.57 0.63 0.83 -0.83 0.09 0.00 0.00 178.44 179.73 1xg2 s GLY 220 N -4.02 -0.41 0.01 0.83 0.00 -1.26 -1.34 107.32 101.14 1xg2 s GLY 220 Ca -0.06 0.76 -0.00 0.00 0.00 0.00 0.00 44.72 45.42 1xg2 s GLY 220 CO 0.77 0.15 -0.02 1.09 0.00 0.00 0.00 173.10 175.10 1xg2 s ARG 221 N -2.42 0.24 -1.04 2.90 1.70 -0.98 -1.27 118.95 118.08 1xg2 s ARG 221 Ca 0.14 -0.45 -0.22 0.00 -0.47 0.00 0.00 55.73 54.73 1xg2 s ARG 221 Cb 0.05 0.08 0.06 0.00 -0.57 0.00 0.00 34.95 34.57 1xg2 s ARG 221 CO -0.04 -0.04 1.46 -1.25 -1.08 0.00 0.00 175.30 174.35 1xg2 s PRO 222 N -1.09 3.63 0.25 3.89 0.04 -1.26 -3.95 135.00 136.51 1xg2 s PRO 222 Ca -0.12 -1.24 -0.04 0.00 0.04 0.00 0.00 61.00 59.65 1xg2 s PRO 222 Cb -0.07 -5.35 0.40 0.00 0.04 0.00 0.00 34.50 29.51 1xg2 s PRO 222 CO -0.01 -2.19 1.84 2.35 0.04 0.00 0.00 177.00 179.03 1xg2 h TRP 223 N 9.55 0.99 -2.62 0.56 7.01 -1.85 -3.43 115.95 126.16 1xg2 h TRP 223 Ca 0.22 0.03 -0.50 0.00 2.11 0.00 0.00 58.89 60.75 1xg2 h TRP 223 Cb 1.00 -0.31 -0.14 0.00 -2.10 0.00 0.00 29.16 27.61 1xg2 h TRP 223 CO 1.29 0.45 -0.64 0.15 -2.79 0.00 0.00 178.44 176.90 1xg2 s LYS 224 N -6.03 1.63 0.29 2.65 -0.14 -1.24 -5.01 119.74 111.89 1xg2 s LYS 224 Ca -0.12 -1.87 0.01 0.00 -1.36 0.00 0.00 55.97 52.63 1xg2 s LYS 224 Cb 0.19 -1.08 0.44 0.00 -1.68 0.00 0.00 37.83 35.70 1xg2 s LYS 224 CO 0.79 -0.07 1.78 1.49 -0.76 0.00 0.00 175.35 178.59 1xg2 h GLU 225 N 2.16 0.61 -0.80 1.68 4.81 -1.83 -2.31 114.58 118.90 1xg2 h GLU 225 Ca -0.41 -0.17 -0.52 0.00 -0.13 0.00 0.00 59.36 58.13 1xg2 h GLU 225 Cb 1.24 -0.07 -0.29 0.00 0.63 0.00 0.00 28.75 30.26 1xg2 h GLU 225 CO 0.70 0.69 0.19 0.66 -0.73 0.00 0.00 179.01 180.52 1xg2 n TYR 226 N -4.20 2.64 -1.56 0.92 4.02 -0.32 -2.95 117.16 115.71 1xg2 n TYR 226 Ca 0.01 -2.38 -0.51 0.00 -0.01 0.00 0.00 57.90 55.01 1xg2 n TYR 226 Cb 0.32 -0.89 -0.05 0.00 -0.02 0.00 0.00 39.34 38.70 1xg2 n TYR 226 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1xg2 n SER 227 N -0.93 1.03 -3.60 7.72 2.88 -0.87 -4.45 113.62 115.39 1xg2 n SER 227 Ca 0.51 1.14 -0.24 0.00 -1.33 0.00 0.00 58.87 58.95 1xg2 n SER 227 Cb 0.95 -1.15 -0.16 0.00 -0.75 0.00 0.00 64.21 63.10 1xg2 n SER 227 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1xg2 s ARG 228 N -0.18 0.07 -0.07 -1.46 3.52 -1.26 -0.77 118.95 118.81 1xg2 s ARG 228 Ca 0.78 0.03 -0.04 0.00 -0.13 0.00 0.00 55.73 56.37 1xg2 s ARG 228 Cb -0.94 -1.55 0.03 0.00 -1.56 0.00 0.00 34.95 30.93 1xg2 s ARG 228 CO 0.52 -0.62 0.16 0.99 -0.81 0.00 0.00 175.30 175.54 1xg2 s THR 229 N 2.18 -0.02 -0.03 4.11 2.01 -0.53 -1.46 115.64 121.89 1xg2 s THR 229 Ca 0.03 0.09 0.02 0.00 0.31 0.00 0.00 61.69 62.14 1xg2 s THR 229 Cb -0.15 -0.25 0.01 0.00 0.01 0.00 0.00 72.50 72.11 1xg2 s THR 229 CO -0.09 0.04 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.11 1xg2 s VAL 230 N 0.67 0.70 -0.21 3.82 1.01 -0.47 -1.37 120.40 124.55 1xg2 s VAL 230 Ca -0.05 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1xg2 s VAL 230 Cb -0.06 -0.64 0.02 0.00 0.00 0.00 0.00 36.38 35.70 1xg2 s VAL 230 CO -0.03 0.23 -0.14 -0.69 0.00 0.00 0.00 175.10 174.47 1xg2 s VAL 231 N 0.27 2.40 0.03 2.92 1.01 -0.46 -0.92 120.40 125.65 1xg2 s VAL 231 Ca -0.04 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 60.92 1xg2 s VAL 231 Cb -0.09 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 1xg2 s VAL 231 CO 0.00 0.36 -0.04 0.00 0.00 0.00 0.00 175.10 175.43 1xg2 s MET 232 N 1.29 0.38 -1.73 2.72 0.23 0.49 -2.38 119.30 120.30 1xg2 s MET 232 Ca 0.02 -0.71 -0.19 0.00 -1.03 0.00 0.00 55.69 53.78 1xg2 s MET 232 Cb -0.15 0.07 0.17 0.00 -1.53 0.00 0.00 34.83 33.39 1xg2 s MET 232 CO -0.09 -0.05 0.73 0.39 -2.03 0.00 0.00 175.02 173.98 1xg2 n GLU 233 N 1.39 -2.70 -4.42 3.16 -0.58 0.11 -2.55 120.64 115.05 1xg2 n GLU 233 Ca -0.23 0.33 -0.24 0.00 -0.42 0.00 0.00 57.16 56.60 1xg2 n GLU 233 Cb 0.56 -4.99 -0.11 0.00 -0.57 0.00 0.00 31.44 26.33 1xg2 n GLU 233 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1xg2 s SER 234 N -3.34 3.29 -0.15 1.62 0.01 -1.26 -2.40 113.70 111.47 1xg2 s SER 234 Ca 0.72 -0.95 -0.20 0.00 1.31 0.00 0.00 55.95 56.83 1xg2 s SER 234 Cb -0.40 -0.25 -0.03 0.00 0.21 0.00 0.00 66.02 65.55 1xg2 s SER 234 CO 0.95 0.03 0.58 -0.47 0.41 0.00 0.00 173.24 174.74 1xg2 s TYR 235 N -2.22 3.45 -0.23 2.43 5.04 -0.38 -0.65 117.35 124.79 1xg2 s TYR 235 Ca 0.24 0.95 -0.02 0.00 -2.44 0.00 0.00 57.07 55.80 1xg2 s TYR 235 Cb -0.06 -2.71 0.01 0.00 0.35 0.00 0.00 41.96 39.55 1xg2 s TYR 235 CO 0.11 -0.02 -0.07 -0.51 -1.34 0.00 0.00 175.55 173.72 1xg2 s LEU 236 N 1.32 2.94 1.01 6.97 1.02 0.04 -0.65 118.68 131.33 1xg2 s LEU 236 Ca 0.29 -0.65 -0.13 0.00 0.02 0.00 0.00 54.13 53.66 1xg2 s LEU 236 Cb -0.16 -1.67 0.19 0.00 0.02 0.00 0.00 46.19 44.57 1xg2 s LEU 236 CO 0.12 -0.07 1.10 -0.83 0.02 0.00 0.00 176.35 176.68 1xg2 s GLY 237 N 1.39 1.56 0.14 -3.19 0.00 0.12 -0.77 107.32 106.57 1xg2 s GLY 237 Ca 0.03 -0.42 0.15 0.00 0.00 0.00 0.00 44.72 44.49 1xg2 s GLY 237 CO -0.05 0.21 1.47 0.61 0.00 0.00 0.00 173.10 175.33 1xg2 n GLY 238 N -1.19 -0.93 0.29 0.20 0.00 -1.26 -2.40 105.19 99.91 1xg2 n GLY 238 Ca 0.05 0.06 0.16 0.00 0.00 0.00 0.00 46.02 46.29 1xg2 n GLY 238 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1xg2 h LEU 239 N 0.00 0.00 -9.01 0.99 -0.00 -1.92 -3.43 115.31 101.94 1xg2 h LEU 239 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 57.88 57.31 1xg2 h LEU 239 Cb 0.16 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.78 1xg2 h LEU 239 CO 0.00 0.03 0.99 -0.63 -0.00 0.00 0.00 178.44 178.83 1xg2 s ILE 240 N -4.41 4.08 0.22 0.15 -1.09 -1.01 -3.39 121.20 115.74 1xg2 s ILE 240 Ca -0.04 1.23 -0.31 0.00 -2.23 0.00 0.00 60.65 59.30 1xg2 s ILE 240 Cb 0.14 -4.03 -0.15 0.00 -1.58 0.00 0.00 42.46 36.84 1xg2 s ILE 240 CO 0.54 -0.37 1.15 -3.20 -1.23 0.00 0.00 174.94 171.82 1xg2 n ASN 241 N 7.57 1.51 -0.35 3.58 5.15 -0.24 -4.83 115.26 127.66 1xg2 n ASN 241 Ca 0.15 1.15 0.25 0.00 -0.60 0.00 0.00 54.58 55.53 1xg2 n ASN 241 Cb 0.46 -1.27 0.52 0.00 -0.53 0.00 0.00 39.78 38.96 1xg2 n ASN 241 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1xg2 h PRO 242 N 3.06 0.34 0.00 1.20 0.11 -1.91 0.26 132.00 135.06 1xg2 h PRO 242 Ca -0.42 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.64 1xg2 h PRO 242 Cb 1.33 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1xg2 h PRO 242 CO 0.68 0.23 -0.13 0.00 -0.21 0.00 0.00 178.00 178.57 1xg2 h ALA 243 N 1.66 1.46 0.00 -0.75 0.00 -1.90 -2.99 119.26 116.73 1xg2 h ALA 243 Ca 0.66 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1xg2 h ALA 243 Cb 1.69 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1xg2 h ALA 243 CO -0.38 0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.45 1xg2 n GLY 244 N -0.87 1.70 3.12 0.00 0.00 0.90 -1.86 105.19 108.17 1xg2 n GLY 244 Ca -0.02 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 1xg2 n GLY 244 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xg2 s TRP 245 N -0.07 0.80 0.12 1.61 0.52 -1.26 -0.54 118.94 120.13 1xg2 s TRP 245 Ca 0.00 -0.69 0.10 0.00 0.02 0.00 0.00 56.10 55.53 1xg2 s TRP 245 Cb 0.00 -0.47 -0.04 0.00 -1.15 0.00 0.00 33.47 31.81 1xg2 s TRP 245 CO 0.00 -0.10 -0.25 0.00 0.02 0.00 0.00 176.95 176.62 1xg2 s ALA 246 N -2.40 2.17 0.56 0.98 0.00 -0.40 -4.84 121.76 117.83 1xg2 s ALA 246 Ca 0.01 -1.40 -0.20 0.00 0.00 0.00 0.00 51.96 50.37 1xg2 s ALA 246 Cb -0.03 -0.33 -0.04 0.00 0.00 0.00 0.00 23.12 22.72 1xg2 s ALA 246 CO -0.02 0.47 1.26 -1.21 0.00 0.00 0.00 175.76 176.26 1xg2 s GLU 247 N -2.04 3.09 -0.16 0.00 2.02 -1.26 -4.11 118.70 116.23 1xg2 s GLU 247 Ca 0.12 1.98 -0.18 0.00 0.02 0.00 0.00 54.97 56.91 1xg2 s GLU 247 Cb -0.10 -2.10 -0.15 0.00 0.10 0.00 0.00 34.13 31.88 1xg2 s GLU 247 CO 0.06 -1.15 0.25 2.35 0.02 0.00 0.00 175.26 176.78 1xg2 h TRP 248 N 1.20 0.00 -1.45 1.61 2.91 -1.84 -3.46 115.95 114.93 1xg2 h TRP 248 Ca -0.50 0.00 -0.19 0.00 1.13 0.00 0.00 58.89 59.32 1xg2 h TRP 248 Cb 1.30 0.00 -0.25 0.00 -0.51 0.00 0.00 29.16 29.70 1xg2 h TRP 248 CO 0.47 0.87 -0.55 0.34 -1.03 0.00 0.00 178.44 178.53 1xg2 s ASP 249 N -6.29 -0.28 1.48 2.65 3.68 -1.26 -5.07 116.67 111.58 1xg2 s ASP 249 Ca -0.20 -1.01 0.00 0.00 2.13 0.00 0.00 52.55 53.47 1xg2 s ASP 249 Cb 0.02 1.33 0.00 0.00 -1.45 0.00 0.00 42.92 42.82 1xg2 s ASP 249 CO 0.46 -0.23 0.00 0.61 0.13 0.00 0.00 175.17 176.14 1xg2 n GLY 250 N 4.49 3.52 0.77 2.66 0.00 -1.26 -1.98 105.19 113.39 1xg2 n GLY 250 Ca 0.10 0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.23 1xg2 n GLY 250 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1xg2 n ASP 251 N 5.18 2.26 -4.65 1.61 5.68 -1.26 -4.82 116.55 120.55 1xg2 n ASP 251 Ca 0.00 -1.94 -0.52 0.00 -0.50 0.00 0.00 54.79 51.83 1xg2 n ASP 251 Cb 0.00 -0.25 -0.06 0.00 -1.14 0.00 0.00 41.12 39.67 1xg2 n ASP 251 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 1xg2 n PHE 252 N 0.73 1.95 -0.36 2.11 7.35 -0.84 -2.66 117.46 125.73 1xg2 n PHE 252 Ca 0.15 0.43 0.00 0.00 -0.76 0.00 0.00 57.45 57.27 1xg2 n PHE 252 Cb 0.37 -2.46 0.00 0.00 0.35 0.00 0.00 39.48 37.74 1xg2 n PHE 252 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1xg2 n ALA 253 N 4.15 0.00 0.26 3.13 0.00 -1.26 -4.70 120.51 122.09 1xg2 n ALA 253 Ca 0.21 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.79 1xg2 n ALA 253 Cb 0.21 -0.09 0.70 0.00 0.00 0.00 0.00 19.45 20.27 1xg2 n ALA 253 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1xg2 h LEU 254 N 0.00 0.00 0.00 0.00 3.38 -1.83 0.12 115.31 116.98 1xg2 h LEU 254 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1xg2 h LEU 254 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1xg2 h LEU 254 CO 0.00 0.12 -1.36 0.29 0.09 0.00 0.00 178.44 177.58 1xg2 n LYS 255 N -3.45 0.62 -0.01 1.13 5.02 -1.26 -1.67 118.16 118.54 1xg2 n LYS 255 Ca -0.01 0.10 0.07 0.00 -2.02 0.00 0.00 58.31 56.44 1xg2 n LYS 255 Cb 0.28 -1.76 -0.11 0.00 -0.02 0.00 0.00 35.03 33.42 1xg2 n LYS 255 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1xg2 n THR 256 N -2.68 0.04 -0.97 -0.18 -2.24 -0.56 -4.33 114.28 103.36 1xg2 n THR 256 Ca -0.05 -0.34 -0.31 0.00 -2.27 0.00 0.00 64.05 61.08 1xg2 n THR 256 Cb 0.67 0.13 0.14 0.00 -2.10 0.00 0.00 70.33 69.17 1xg2 n THR 256 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1xg2 s LEU 257 N -4.05 2.77 -0.27 3.22 0.05 0.30 -4.56 118.68 116.15 1xg2 s LEU 257 Ca -0.05 1.94 -0.01 0.00 0.05 0.00 0.00 54.13 56.06 1xg2 s LEU 257 Cb 0.09 -4.43 0.08 0.00 -2.05 0.00 0.00 46.19 39.88 1xg2 s LEU 257 CO 0.60 -2.68 0.06 -0.47 -0.55 0.00 0.00 176.35 173.32 1xg2 s TYR 258 N -2.77 1.57 -0.16 3.48 6.14 0.05 -4.32 117.35 121.34 1xg2 s TYR 258 Ca 0.64 -1.48 -0.01 0.00 0.64 0.00 0.00 57.07 56.87 1xg2 s TYR 258 Cb -0.20 -1.49 -0.01 0.00 0.42 0.00 0.00 41.96 40.68 1xg2 s TYR 258 CO 0.57 -0.79 -0.12 0.71 0.64 0.00 0.00 175.55 176.56 1xg2 s TYR 259 N 1.67 2.83 0.07 4.97 2.02 -0.50 -1.46 117.35 126.94 1xg2 s TYR 259 Ca 0.05 -0.92 0.05 0.00 -0.37 0.00 0.00 57.07 55.88 1xg2 s TYR 259 Cb -0.17 -1.92 -0.03 0.00 -0.40 0.00 0.00 41.96 39.44 1xg2 s TYR 259 CO -0.18 -0.42 -0.15 0.20 -1.57 0.00 0.00 175.55 173.43 1xg2 s GLY 260 N 0.83 0.88 -0.05 0.71 0.00 -0.47 -0.51 107.32 108.71 1xg2 s GLY 260 Ca -0.04 -0.99 0.03 0.00 0.00 0.00 0.00 44.72 43.72 1xg2 s GLY 260 CO 0.00 -1.00 -0.12 -0.54 0.00 0.00 0.00 173.10 171.44 1xg2 s GLU 261 N -1.64 1.52 -0.14 2.90 2.02 -0.90 -1.35 118.70 121.10 1xg2 s GLU 261 Ca -0.01 -0.41 -0.02 0.00 0.02 0.00 0.00 54.97 54.55 1xg2 s GLU 261 Cb -0.10 -1.30 0.05 0.00 0.10 0.00 0.00 34.13 32.88 1xg2 s GLU 261 CO 0.02 0.07 0.02 0.12 0.02 0.00 0.00 175.26 175.51 1xg2 s PHE 262 N 0.49 0.90 -1.45 1.61 5.36 -1.00 -0.70 117.98 123.18 1xg2 s PHE 262 Ca -0.10 -0.58 -0.11 0.00 -0.96 0.00 0.00 56.93 55.17 1xg2 s PHE 262 Cb -0.14 -0.95 0.05 0.00 -0.34 0.00 0.00 43.02 41.65 1xg2 s PHE 262 CO 0.03 -0.50 1.08 -1.33 -1.46 0.00 0.00 175.22 173.03 1xg2 n MET 263 N 5.09 -6.69 -1.76 10.12 2.81 -1.26 -0.71 117.12 124.71 1xg2 n MET 263 Ca -0.08 0.71 -0.30 0.00 -1.81 0.00 0.00 57.70 56.21 1xg2 n MET 263 Cb 0.48 -5.68 0.05 0.00 -0.71 0.00 0.00 33.22 27.36 1xg2 n MET 263 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1xg2 s ASN 264 N -3.30 5.34 0.25 7.83 0.01 -1.26 -3.36 114.94 120.45 1xg2 s ASN 264 Ca 0.63 1.28 0.01 0.00 -0.71 0.00 0.00 52.86 54.07 1xg2 s ASN 264 Cb -0.30 -2.12 -0.04 0.00 0.41 0.00 0.00 41.25 39.20 1xg2 s ASN 264 CO 0.77 -1.43 0.15 0.54 -1.51 0.00 0.00 177.10 175.62 1xg2 s ASN 265 N -4.15 0.80 0.00 -1.22 2.20 0.18 -4.91 114.94 107.85 1xg2 s ASN 265 Ca 0.58 -1.47 0.00 0.00 -0.94 0.00 0.00 52.86 51.04 1xg2 s ASN 265 Cb -0.12 0.36 0.00 0.00 -2.00 0.00 0.00 41.25 39.49 1xg2 s ASN 265 CO 0.53 -0.85 0.00 0.61 -2.94 0.00 0.00 177.10 174.45 1xg2 n GLY 266 N -0.41 1.45 0.31 0.45 0.00 -1.26 -0.78 105.19 104.96 1xg2 n GLY 266 Ca 0.02 -2.00 0.20 0.00 0.00 0.00 0.00 46.02 44.24 1xg2 n GLY 266 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xg2 h PRO 267 N 0.00 0.00 -0.58 1.61 0.11 -1.79 -2.20 132.00 129.15 1xg2 h PRO 267 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1xg2 h PRO 267 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1xg2 h PRO 267 CO 0.00 0.01 0.00 0.41 -0.21 0.00 0.00 178.00 178.21 1xg2 n GLY 268 N -0.71 2.13 0.05 -0.55 0.00 0.05 -4.58 105.19 101.57 1xg2 n GLY 268 Ca -0.02 -0.78 0.12 0.00 0.00 0.00 0.00 46.02 45.34 1xg2 n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xg2 n ALA 269 N 1.60 3.01 -1.74 4.61 0.00 -0.83 -4.85 120.51 122.30 1xg2 n ALA 269 Ca 0.22 -0.26 -0.42 0.00 0.00 0.00 0.00 53.44 52.99 1xg2 n ALA 269 Cb 0.62 -1.18 -0.01 0.00 0.00 0.00 0.00 19.45 18.88 1xg2 n ALA 269 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xg2 n GLY 270 N 1.38 1.21 0.46 0.00 0.00 -1.26 -4.91 105.19 102.07 1xg2 n GLY 270 Ca 0.04 0.42 0.05 0.00 0.00 0.00 0.00 46.02 46.53 1xg2 n GLY 270 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xg2 n THR 271 N 1.63 0.51 0.35 2.61 -2.24 -1.26 -4.68 114.28 111.20 1xg2 n THR 271 Ca 0.07 -0.75 0.14 0.00 -2.27 0.00 0.00 64.05 61.24 1xg2 n THR 271 Cb 0.37 0.84 0.57 0.00 -2.10 0.00 0.00 70.33 70.01 1xg2 n THR 271 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1xg2 h SER 272 N 1.78 0.00 -0.09 3.42 4.64 -1.92 -2.68 113.55 118.70 1xg2 h SER 272 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xg2 h SER 272 Cb 0.55 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1xg2 h SER 272 CO 0.00 0.00 -0.01 0.29 -0.87 0.00 0.00 176.83 176.24 1xg2 n LYS 273 N -2.64 1.86 -1.08 4.77 5.02 -1.26 -5.05 118.16 119.78 1xg2 n LYS 273 Ca 0.02 -2.69 -0.31 0.00 -2.02 0.00 0.00 58.31 53.31 1xg2 n LYS 273 Cb 0.28 -1.63 0.12 0.00 -0.02 0.00 0.00 35.03 33.78 1xg2 n LYS 273 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1xg2 s ARG 274 N -2.87 1.81 0.68 1.97 1.81 -1.01 -3.57 118.95 117.76 1xg2 s ARG 274 Ca 0.36 1.26 -0.17 0.00 -1.72 0.00 0.00 55.73 55.47 1xg2 s ARG 274 Cb 0.30 -1.84 -0.05 0.00 -0.45 0.00 0.00 34.95 32.92 1xg2 s ARG 274 CO 0.05 -1.99 0.58 1.33 -0.68 0.00 0.00 175.30 174.59 1xg2 n VAL 275 N -3.77 2.08 -1.09 3.52 0.24 -0.78 -4.92 118.33 113.62 1xg2 n VAL 275 Ca 0.10 -0.43 0.01 0.00 -2.04 0.00 0.00 64.34 61.99 1xg2 n VAL 275 Cb 0.53 -0.77 0.27 0.00 -1.47 0.00 0.00 33.84 32.40 1xg2 n VAL 275 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1xg2 n LYS 276 N -0.66 3.11 -1.77 7.34 5.02 -1.26 -4.95 118.16 124.99 1xg2 n LYS 276 Ca 0.11 -3.01 -0.41 0.00 -2.02 0.00 0.00 58.31 52.98 1xg2 n LYS 276 Cb 0.49 -1.99 0.01 0.00 -0.02 0.00 0.00 35.03 33.52 1xg2 n LYS 276 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1xg2 n TRP 277 N -0.44 2.86 -0.21 2.13 8.01 -1.26 -4.87 117.44 123.66 1xg2 n TRP 277 Ca 0.30 0.45 0.16 0.00 -1.31 0.00 0.00 57.50 57.11 1xg2 n TRP 277 Cb 1.10 -2.50 0.49 0.00 -2.01 0.00 0.00 31.31 28.39 1xg2 n TRP 277 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.69 175.33 1xg2 h PRO 278 N 2.69 0.44 0.00 -0.99 0.11 -1.91 -1.54 132.00 130.80 1xg2 h PRO 278 Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1xg2 h PRO 278 Cb 1.25 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1xg2 h PRO 278 CO 0.63 0.29 0.00 0.41 -0.21 0.00 0.00 178.00 179.12 1xg2 n GLY 279 N -1.51 -1.35 3.76 -0.55 0.00 -0.67 -4.77 105.19 100.10 1xg2 n GLY 279 Ca 0.17 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1xg2 n GLY 279 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1xg2 s TYR 280 N -2.86 3.60 -0.07 1.61 5.04 -0.58 -1.41 117.35 122.66 1xg2 s TYR 280 Ca 0.17 0.93 -0.01 0.00 -2.44 0.00 0.00 57.07 55.72 1xg2 s TYR 280 Cb 0.18 -2.45 0.03 0.00 0.35 0.00 0.00 41.96 40.06 1xg2 s TYR 280 CO 0.47 0.35 -0.01 -1.01 -1.34 0.00 0.00 175.55 174.01 1xg2 s HIS 281 N -0.03 0.76 -0.44 4.97 3.76 0.33 -4.81 115.29 119.83 1xg2 s HIS 281 Ca 0.25 -0.23 -0.29 0.00 -0.15 0.00 0.00 55.06 54.63 1xg2 s HIS 281 Cb -0.16 -0.84 0.02 0.00 1.11 0.00 0.00 32.58 32.72 1xg2 s HIS 281 CO 0.11 -0.34 1.24 0.08 -0.85 0.00 0.00 174.74 174.99 1xg2 s VAL 282 N 1.85 4.11 -0.25 -0.90 1.01 -1.26 -2.13 120.40 122.83 1xg2 s VAL 282 Ca 0.04 1.14 -0.20 0.00 0.00 0.00 0.00 61.98 62.96 1xg2 s VAL 282 Cb -0.12 -4.44 -0.02 0.00 0.00 0.00 0.00 36.38 31.80 1xg2 s VAL 282 CO -0.05 -0.88 0.62 -0.63 0.00 0.00 0.00 175.10 174.16 1xg2 s ILE 283 N 4.77 4.99 -0.07 2.22 1.01 0.12 -4.90 121.20 129.34 1xg2 s ILE 283 Ca 0.53 1.12 0.12 0.00 0.00 0.00 0.00 60.65 62.42 1xg2 s ILE 283 Cb -0.10 -3.93 -0.18 0.00 0.01 0.00 0.00 42.46 38.27 1xg2 s ILE 283 CO 0.31 0.04 0.16 0.35 0.00 0.00 0.00 174.94 175.80 1xg2 n THR 284 N 5.15 0.42 -2.95 2.92 -2.24 -1.26 -4.36 114.28 111.95 1xg2 n THR 284 Ca -0.01 -0.41 -0.42 0.00 -2.27 0.00 0.00 64.05 60.95 1xg2 n THR 284 Cb 0.49 -0.24 -0.05 0.00 -2.10 0.00 0.00 70.33 68.43 1xg2 n THR 284 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xg2 s ASP 285 N -4.00 6.64 0.50 3.42 3.68 -1.26 -4.95 116.67 120.70 1xg2 s ASP 285 Ca -0.05 0.61 0.21 0.00 2.13 0.00 0.00 52.55 55.44 1xg2 s ASP 285 Cb 0.06 -2.40 1.27 0.00 -1.45 0.00 0.00 42.92 40.39 1xg2 s ASP 285 CO 0.52 -0.63 2.01 -0.65 0.13 0.00 0.00 175.17 176.55 1xg2 h PRO 286 N 8.17 0.12 0.00 4.34 0.11 -2.00 -0.81 132.00 141.94 1xg2 h PRO 286 Ca -0.24 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.83 1xg2 h PRO 286 Cb 1.10 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1xg2 h PRO 286 CO 0.88 0.08 -0.12 0.00 -0.21 0.00 0.00 178.00 178.64 1xg2 h ALA 287 N 1.76 1.45 0.00 -0.75 0.00 -2.00 -1.46 119.26 118.26 1xg2 h ALA 287 Ca 0.23 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1xg2 h ALA 287 Cb 0.75 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1xg2 h ALA 287 CO -0.03 0.15 -0.34 0.87 0.00 0.00 0.00 179.25 179.90 1xg2 h LYS 288 N 0.00 0.00 0.00 0.00 1.57 -1.56 -3.27 116.57 113.32 1xg2 h LYS 288 Ca -0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 1xg2 h LYS 288 Cb 0.28 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1xg2 h LYS 288 CO 0.02 0.00 -0.84 0.00 -0.57 0.00 0.00 179.45 178.06 1xg2 h ALA 289 N 2.05 0.67 -0.61 3.86 0.00 -1.34 -3.40 119.26 120.49 1xg2 h ALA 289 Ca 0.00 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 1xg2 h ALA 289 Cb 0.98 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1xg2 h ALA 289 CO 0.00 0.60 0.36 0.52 0.00 0.00 0.00 179.25 180.74 1xg2 h MET 290 N 0.00 0.82 0.00 0.00 2.86 -1.34 -1.91 114.93 115.36 1xg2 h MET 290 Ca -0.06 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1xg2 h MET 290 Cb 1.38 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.86 1xg2 h MET 290 CO 0.05 0.58 0.13 -1.35 1.06 0.00 0.00 176.91 177.37 1xg2 h PRO 291 N 0.84 0.00 -0.62 -0.22 0.11 -1.78 -2.28 132.00 128.04 1xg2 h PRO 291 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 1xg2 h PRO 291 Cb -0.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.08 1xg2 h PRO 291 CO -0.04 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.94 1xg2 n PHE 292 N -2.52 0.90 -2.10 0.65 3.72 -0.72 -3.16 117.46 114.23 1xg2 n PHE 292 Ca -0.02 -0.52 -0.28 0.00 -0.05 0.00 0.00 57.45 56.58 1xg2 n PHE 292 Cb 0.17 -0.03 0.05 0.00 -0.94 0.00 0.00 39.48 38.73 1xg2 n PHE 292 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1xg2 s THR 293 N -1.10 3.18 0.22 4.37 -4.23 -0.86 -4.77 115.64 112.45 1xg2 s THR 293 Ca 0.43 0.16 -0.07 0.00 -1.18 0.00 0.00 61.69 61.02 1xg2 s THR 293 Cb 0.23 -3.34 0.17 0.00 1.34 0.00 0.00 72.50 70.90 1xg2 s THR 293 CO 0.28 -0.41 1.81 0.58 -0.54 0.00 0.00 174.62 176.34 1xg2 h VAL 294 N -0.54 0.94 -0.63 2.29 2.07 -1.79 0.63 116.25 119.22 1xg2 h VAL 294 Ca -0.45 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 66.85 1xg2 h VAL 294 Cb 1.27 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 1xg2 h VAL 294 CO 0.63 0.13 0.38 0.00 0.02 0.00 0.00 177.57 178.73 1xg2 h ALA 295 N 1.39 0.82 0.07 1.67 0.00 -1.76 -1.63 119.26 119.81 1xg2 h ALA 295 Ca 0.33 -0.01 -0.37 0.00 0.00 0.00 0.00 54.91 54.86 1xg2 h ALA 295 Cb 0.25 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1xg2 h ALA 295 CO -0.21 0.12 -2.17 1.63 0.00 0.00 0.00 179.25 178.62 1xg2 n LYS 296 N -4.73 0.71 0.10 0.00 4.76 -0.96 -3.03 118.16 115.00 1xg2 n LYS 296 Ca 0.06 0.21 -0.20 0.00 -2.87 0.00 0.00 58.31 55.51 1xg2 n LYS 296 Cb 0.09 -1.64 -0.15 0.00 -1.84 0.00 0.00 35.03 31.50 1xg2 n LYS 296 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1xg2 h LEU 297 N 0.04 0.57 -2.82 -0.35 5.85 -0.84 -3.38 115.31 114.39 1xg2 h LEU 297 Ca -0.47 -0.69 0.00 0.00 0.84 0.00 0.00 57.88 57.56 1xg2 h LEU 297 Cb 2.00 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.84 1xg2 h LEU 297 CO 0.02 1.56 -0.02 2.30 -0.34 0.00 0.00 178.44 181.96 1xg2 n ILE 298 N -3.57 1.16 -4.23 4.05 -5.35 -1.13 -4.83 119.36 105.46 1xg2 n ILE 298 Ca -0.16 -1.28 -0.34 0.00 -0.27 0.00 0.00 62.75 60.70 1xg2 n ILE 298 Cb 1.06 0.31 -0.04 0.00 -1.74 0.00 0.00 39.64 39.23 1xg2 n ILE 298 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xg2 n GLN 299 N -0.74 -2.50 -0.28 6.28 3.00 -0.99 -4.80 117.38 117.36 1xg2 n GLN 299 Ca 0.05 0.30 -0.06 0.00 -0.01 0.00 0.00 57.00 57.29 1xg2 n GLN 299 Cb 0.41 -4.71 0.08 0.00 0.00 0.00 0.00 30.24 26.01 1xg2 n GLN 299 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.06 177.84 1xg2 h GLY 300 N -1.51 1.26 0.84 1.08 0.00 -1.47 -2.98 103.07 100.29 1xg2 h GLY 300 Ca -0.61 -0.69 0.04 0.00 0.00 0.00 0.00 47.33 46.07 1xg2 h GLY 300 CO 0.76 0.65 0.55 -1.33 0.00 0.00 0.00 176.54 177.17 1xg2 h GLY 301 N 1.15 1.27 1.41 4.60 0.00 -1.87 1.26 103.07 110.89 1xg2 h GLY 301 Ca 0.26 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.17 1xg2 h GLY 301 CO -0.02 0.34 0.25 1.48 0.00 0.00 0.00 176.54 178.59 1xg2 h SER 302 N 1.06 0.00 0.00 0.19 4.64 -1.90 -3.03 113.55 114.51 1xg2 h SER 302 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 1xg2 h SER 302 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1xg2 h SER 302 CO -0.13 0.00 -0.12 -2.67 -0.87 0.00 0.00 176.83 173.04 1xg2 n TRP 303 N -2.45 0.00 0.05 4.77 4.27 -0.73 -4.90 117.44 118.46 1xg2 n TRP 303 Ca -0.01 0.00 -0.11 0.00 -3.89 0.00 0.00 57.50 53.49 1xg2 n TRP 303 Cb 0.29 0.00 0.01 0.00 -1.36 0.00 0.00 31.31 30.25 1xg2 n TRP 303 CO 0.00 0.00 0.00 -0.07 -2.29 0.00 0.00 177.69 175.33 1xg2 h LEU 304 N 0.00 0.53 -1.73 5.67 3.38 0.17 -3.28 115.31 120.05 1xg2 h LEU 304 Ca 0.00 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.63 1xg2 h LEU 304 Cb 0.00 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1xg2 h LEU 304 CO 0.00 1.11 0.21 0.08 0.09 0.00 0.00 178.44 179.93 1xg2 h ARG 305 N 0.29 0.36 0.00 1.13 0.11 -1.75 -1.02 114.38 113.50 1xg2 h ARG 305 Ca -0.04 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.02 1xg2 h ARG 305 Cb 1.35 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 32.35 1xg2 h ARG 305 CO 0.13 0.24 0.00 0.43 0.10 0.00 0.00 179.97 180.87 1xg2 n SER 306 N -4.49 0.00 0.13 0.08 7.64 -1.24 -3.30 113.62 112.45 1xg2 n SER 306 Ca 0.02 0.04 0.02 0.00 1.01 0.00 0.00 58.87 59.96 1xg2 n SER 306 Cb 0.11 -0.34 0.01 0.00 -1.01 0.00 0.00 64.21 62.98 1xg2 n SER 306 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1xg2 h THR 307 N 0.00 0.81 0.00 0.44 1.35 -1.33 -3.48 112.91 110.70 1xg2 h THR 307 Ca 0.00 -2.18 0.00 0.00 -0.55 0.00 0.00 66.41 63.68 1xg2 h THR 307 Cb 0.33 2.37 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 1xg2 h THR 307 CO 0.00 0.46 0.00 0.61 -0.25 0.00 0.00 175.52 176.34 1xg2 n GLY 308 N 1.24 2.59 3.76 5.82 0.00 -1.21 -5.05 105.19 112.34 1xg2 n GLY 308 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1xg2 n GLY 308 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xg2 s VAL 309 N -2.16 2.59 0.29 1.61 0.11 -1.26 -5.00 120.40 116.59 1xg2 s VAL 309 Ca 0.00 0.42 -0.29 0.00 -2.93 0.00 0.00 61.98 59.17 1xg2 s VAL 309 Cb 0.00 -3.20 -0.10 0.00 -1.53 0.00 0.00 36.38 31.56 1xg2 s VAL 309 CO 0.00 -0.03 1.14 0.00 -3.33 0.00 0.00 175.10 172.88 1xg2 s ALA 310 N -1.48 3.43 -0.02 1.54 0.00 -1.26 -4.91 121.76 119.05 1xg2 s ALA 310 Ca 0.71 0.97 -0.17 0.00 0.00 0.00 0.00 51.96 53.47 1xg2 s ALA 310 Cb -0.33 -3.36 0.03 0.00 0.00 0.00 0.00 23.12 19.46 1xg2 s ALA 310 CO 0.38 -0.26 0.36 1.52 0.00 0.00 0.00 175.76 177.77 1xg2 s TYR 311 N -1.12 -0.25 -0.21 0.00 1.13 -1.26 -4.99 117.35 110.65 1xg2 s TYR 311 Ca 0.46 0.39 -0.12 0.00 -1.41 0.00 0.00 57.07 56.38 1xg2 s TYR 311 Cb -0.33 0.14 -0.05 0.00 -1.10 0.00 0.00 41.96 40.62 1xg2 s TYR 311 CO 0.43 -0.43 0.24 0.08 -2.51 0.00 0.00 175.55 173.37 1xg2 s VAL 312 N -1.33 5.32 0.11 -3.49 1.01 -1.26 -5.01 120.40 115.74 1xg2 s VAL 312 Ca -0.13 0.38 -0.05 0.00 0.00 0.00 0.00 61.98 62.17 1xg2 s VAL 312 Cb -0.04 -3.58 -0.22 0.00 0.00 0.00 0.00 36.38 32.54 1xg2 s VAL 312 CO 0.05 0.34 1.24 -0.78 0.00 0.00 0.00 175.10 175.95 1xg2 h ASP 313 N 7.22 0.54 -0.08 3.32 3.58 -1.98 -3.41 116.42 125.61 1xg2 h ASP 313 Ca -0.38 -0.48 0.00 0.00 0.42 0.00 0.00 57.03 56.59 1xg2 h ASP 313 Cb 1.16 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.04 1xg2 h ASP 313 CO 0.70 1.30 0.00 0.61 -2.88 0.00 0.00 179.24 178.98 1xg2 n GLY 314 N 1.16 4.05 0.08 -0.78 0.00 -1.26 -2.18 105.19 106.25 1xg2 n GLY 314 Ca -0.08 -1.85 -0.11 0.00 0.00 0.00 0.00 46.02 43.98 1xg2 n GLY 314 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xg2 h LEU 315 N 0.00 0.17 -8.72 0.99 3.38 -1.95 -3.44 115.31 105.74 1xg2 h LEU 315 Ca 0.00 -0.19 -0.70 0.00 0.09 0.00 0.00 57.88 57.08 1xg2 h LEU 315 Cb 0.00 -0.06 -0.28 0.00 0.09 0.00 0.00 40.66 40.42 1xg2 h LEU 315 CO 0.00 1.15 -0.86 -0.31 0.09 0.00 0.00 178.44 178.51 1xg2 s TYR 316 N -2.68 2.43 -2.00 1.13 1.51 -1.26 -4.94 117.35 111.53 1xg2 s TYR 316 Ca -0.02 -0.36 0.21 0.00 -1.01 0.00 0.00 57.07 55.89 1xg2 s TYR 316 Cb 0.09 -1.51 1.26 0.00 -0.11 0.00 0.00 41.96 41.68 1xg2 s TYR 316 CO 0.84 0.05 1.64 -3.47 -1.11 0.00 0.00 175.55 173.50