#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gg2 h GLU 3 N 0.00 0.01 0.00 -1.46 3.07 -2.06 3.19 114.58 117.33 1gg2 h GLU 3 Ca 0.00 -0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 1gg2 h GLU 3 Cb 0.00 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.90 1gg2 h GLU 3 CO 0.00 0.01 -0.12 1.25 -1.40 0.00 0.00 179.01 178.75 1gg2 h LEU 4 N 0.01 0.00 -0.06 1.33 5.85 -2.05 -3.12 115.31 117.27 1gg2 h LEU 4 Ca 0.89 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 59.44 1gg2 h LEU 4 Cb 3.35 0.00 0.01 0.00 0.37 0.00 0.00 40.66 44.39 1gg2 h LEU 4 CO -0.16 0.12 -0.64 0.44 -0.34 0.00 0.00 178.44 177.86 1gg2 h ASP 5 N 0.00 0.67 -0.31 1.25 3.32 0.54 0.43 116.42 122.32 1gg2 h ASP 5 Ca -0.00 -0.69 0.07 0.00 0.02 0.00 0.00 57.03 56.42 1gg2 h ASP 5 Cb 0.69 -0.20 -0.08 0.00 0.22 0.00 0.00 39.33 39.96 1gg2 h ASP 5 CO 0.02 1.26 -0.35 1.56 -1.72 0.00 0.00 179.24 180.01 1gg2 h GLN 6 N 0.13 -0.31 -0.21 3.56 7.50 -1.47 1.25 115.11 125.56 1gg2 h GLN 6 Ca -0.06 0.02 0.00 0.00 0.50 0.00 0.00 58.65 59.11 1gg2 h GLN 6 Cb 1.31 0.07 -0.01 0.00 0.05 0.00 0.00 27.48 28.90 1gg2 h GLN 6 CO 0.13 -0.20 0.13 -0.07 -1.50 0.00 0.00 178.83 177.32 1gg2 h LEU 7 N -0.32 0.24 0.01 1.46 3.38 -1.54 0.49 115.31 119.03 1gg2 h LEU 7 Ca 0.14 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1gg2 h LEU 7 Cb 0.55 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1gg2 h LEU 7 CO -0.49 0.19 -0.01 0.03 0.09 0.00 0.00 178.44 178.26 1gg2 h ARG 8 N 0.27 -0.02 -0.37 1.13 3.08 0.24 0.34 114.38 119.05 1gg2 h ARG 8 Ca 0.08 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1gg2 h ARG 8 Cb -0.01 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1gg2 h ARG 8 CO -0.02 -0.00 0.18 0.37 -1.07 0.00 0.00 179.97 179.43 1gg2 h GLN 9 N -0.03 0.53 -0.33 0.04 4.15 0.17 -0.76 115.11 118.89 1gg2 h GLN 9 Ca -0.00 -0.08 -0.02 0.00 0.77 0.00 0.00 58.65 59.32 1gg2 h GLN 9 Cb 0.02 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.60 1gg2 h GLN 9 CO 0.00 0.47 0.13 0.93 -1.93 0.00 0.00 178.83 178.43 1gg2 h GLU 10 N 0.46 0.46 -0.08 1.69 5.08 0.22 -2.41 114.58 120.00 1gg2 h GLU 10 Ca 0.13 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1gg2 h GLU 10 Cb 0.11 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 1gg2 h GLU 10 CO -0.02 0.39 -0.02 0.00 -1.00 0.00 0.00 179.01 178.36 1gg2 h ALA 11 N 1.68 0.12 0.03 3.43 0.00 0.45 -2.79 119.26 122.18 1gg2 h ALA 11 Ca 0.11 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1gg2 h ALA 11 Cb 0.10 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1gg2 h ALA 11 CO -0.01 -0.16 -0.19 1.49 0.00 0.00 0.00 179.25 180.38 1gg2 h GLU 12 N -0.17 -0.31 -0.71 0.00 4.81 -0.84 -2.73 114.58 114.63 1gg2 h GLU 12 Ca 0.02 0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.30 1gg2 h GLU 12 Cb 0.42 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.83 1gg2 h GLU 12 CO 0.01 -0.21 0.44 1.96 -0.73 0.00 0.00 179.01 180.49 1gg2 h GLN 13 N -0.32 0.84 -0.58 1.92 4.20 -1.52 -2.90 115.11 116.75 1gg2 h GLN 13 Ca 0.05 -0.05 0.09 0.00 0.06 0.00 0.00 58.65 58.80 1gg2 h GLN 13 Cb 0.38 -0.19 -0.07 0.00 0.30 0.00 0.00 27.48 27.90 1gg2 h GLN 13 CO -0.15 0.56 0.20 -0.07 -0.67 0.00 0.00 178.83 178.69 1gg2 h LEU 14 N 0.87 0.18 -1.07 1.46 3.38 -1.21 -1.14 115.31 117.78 1gg2 h LEU 14 Ca 0.29 0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.34 1gg2 h LEU 14 Cb 0.03 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1gg2 h LEU 14 CO -0.11 0.12 0.60 0.11 0.09 0.00 0.00 178.44 179.24 1gg2 h LYS 15 N 0.37 1.22 -0.32 1.13 1.57 -1.29 -2.25 116.57 117.01 1gg2 h LYS 15 Ca 0.29 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 58.90 1gg2 h LYS 15 Cb 0.36 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1gg2 h LYS 15 CO -0.30 0.82 -0.14 -0.91 -0.57 0.00 0.00 179.45 178.35 1gg2 h ASN 16 N 1.26 0.68 -0.59 0.86 2.35 -1.24 0.20 115.58 119.09 1gg2 h ASN 16 Ca 0.34 -0.40 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1gg2 h ASN 16 Cb -0.12 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.03 1gg2 h ASN 16 CO -0.07 0.93 0.38 1.56 -1.65 0.00 0.00 177.43 178.58 1gg2 h GLN 17 N 0.43 0.79 -0.06 0.81 4.20 -1.00 1.84 115.11 122.12 1gg2 h GLN 17 Ca 0.07 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1gg2 h GLN 17 Cb 0.67 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.27 1gg2 h GLN 17 CO 0.04 0.53 -0.02 0.82 -0.67 0.00 0.00 178.83 179.54 1gg2 h ILE 18 N 0.81 1.30 0.12 2.54 2.04 -1.10 0.44 117.51 123.66 1gg2 h ILE 18 Ca 0.22 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1gg2 h ILE 18 Cb -0.07 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1gg2 h ILE 18 CO -0.04 0.25 -0.29 -0.09 0.00 0.00 0.00 178.15 177.98 1gg2 h ARG 19 N -0.23 -0.43 -0.29 2.37 2.43 0.12 -0.95 114.38 117.39 1gg2 h ARG 19 Ca 0.01 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 1gg2 h ARG 19 Cb 0.41 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1gg2 h ARG 19 CO 0.01 -0.29 0.19 -0.44 -1.51 0.00 0.00 179.97 177.93 1gg2 h ASP 20 N -0.45 0.26 -0.43 -3.80 3.32 0.28 -0.61 116.42 114.98 1gg2 h ASP 20 Ca -0.01 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.96 1gg2 h ASP 20 Cb 0.43 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1gg2 h ASP 20 CO -0.13 0.18 -0.04 0.00 -1.72 0.00 0.00 179.24 177.54 1gg2 h ALA 21 N 1.83 0.59 0.57 3.45 0.00 0.24 0.61 119.26 126.56 1gg2 h ALA 21 Ca 0.12 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1gg2 h ALA 21 Cb 0.09 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.73 1gg2 h ALA 21 CO -0.02 0.42 -0.28 0.00 0.00 0.00 0.00 179.25 179.36 1gg2 h ARG 22 N 0.63 -0.74 -0.80 0.00 3.08 -0.13 -2.96 114.38 113.45 1gg2 h ARG 22 Ca 0.12 0.05 0.14 0.00 0.07 0.00 0.00 59.98 60.36 1gg2 h ARG 22 Cb 0.55 0.17 -0.14 0.00 0.08 0.00 0.00 29.97 30.62 1gg2 h ARG 22 CO 0.03 -0.44 -0.33 -0.22 -1.07 0.00 0.00 179.97 177.94 1gg2 h LYS 23 N -0.95 -0.06 -0.90 0.04 3.11 -1.05 0.33 116.57 117.08 1gg2 h LYS 23 Ca -0.08 0.00 0.16 0.00 -2.81 0.00 0.00 60.65 57.93 1gg2 h LYS 23 Cb 0.65 0.01 -0.07 0.00 -1.00 0.00 0.00 32.23 31.82 1gg2 h LYS 23 CO 0.13 -0.04 0.58 0.00 -2.81 0.00 0.00 179.45 177.31 1gg2 h ALA 24 N 1.32 1.91 0.00 5.00 0.00 -0.79 -0.41 119.26 126.29 1gg2 h ALA 24 Ca 0.31 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1gg2 h ALA 24 Cb 0.58 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1gg2 h ALA 24 CO -0.84 -0.18 -0.00 0.00 0.00 0.00 0.00 179.25 178.23 1gg2 n ALA 26 N -1.75 2.72 0.35 0.00 0.00 -0.16 -4.39 120.51 117.27 1gg2 n ALA 26 Ca 0.06 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.53 1gg2 n ALA 26 Cb 0.42 -1.62 0.50 0.00 0.00 0.00 0.00 19.45 18.74 1gg2 n ALA 26 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1gg2 n ASP 27 N 1.88 0.61 -3.77 0.00 5.75 -1.26 -4.84 116.55 114.92 1gg2 n ASP 27 Ca 0.02 0.68 -0.06 0.00 -0.01 0.00 0.00 54.79 55.42 1gg2 n ASP 27 Cb 0.25 -0.80 -0.02 0.00 -1.03 0.00 0.00 41.12 39.52 1gg2 n ASP 27 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gg2 s ALA 28 N -3.35 -1.48 0.13 2.12 0.00 -1.26 -5.18 121.76 112.74 1gg2 s ALA 28 Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 51.96 52.07 1gg2 s ALA 28 Cb 0.09 0.73 -0.04 0.00 0.00 0.00 0.00 23.12 23.89 1gg2 s ALA 28 CO 0.34 -1.01 -0.12 0.95 0.00 0.00 0.00 175.76 175.92 1gg2 s THR 29 N -3.56 3.21 0.21 0.00 -4.23 -1.26 -5.02 115.64 104.99 1gg2 s THR 29 Ca 0.11 -1.42 -0.10 0.00 -1.18 0.00 0.00 61.69 59.11 1gg2 s THR 29 Cb -0.03 -2.52 0.15 0.00 1.34 0.00 0.00 72.50 71.45 1gg2 s THR 29 CO 0.03 0.05 1.86 0.25 -0.54 0.00 0.00 174.62 176.27 1gg2 h LEU 30 N 3.47 0.78 -0.02 4.79 5.85 -1.96 -2.29 115.31 125.92 1gg2 h LEU 30 Ca -0.49 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.24 1gg2 h LEU 30 Cb 1.18 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 1gg2 h LEU 30 CO 0.51 0.54 -0.05 0.77 -0.34 0.00 0.00 178.44 179.88 1gg2 h SER 31 N 0.92 -0.14 0.01 1.25 4.64 -1.84 0.15 113.55 118.54 1gg2 h SER 31 Ca 0.29 0.02 0.01 0.00 -0.47 0.00 0.00 61.79 61.64 1gg2 h SER 31 Cb -0.01 0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.12 1gg2 h SER 31 CO -0.10 -0.07 -0.23 1.56 -0.87 0.00 0.00 176.83 177.12 1gg2 h GLN 32 N -0.07 -0.28 0.00 4.77 4.20 -1.86 1.22 115.11 123.08 1gg2 h GLN 32 Ca 0.03 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1gg2 h GLN 32 Cb 0.11 0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1gg2 h GLN 32 CO -0.06 -0.19 0.03 -0.84 -0.67 0.00 0.00 178.83 177.10 1gg2 h ILE 33 N -0.29 0.00 0.00 2.54 -0.00 -1.35 -0.74 117.51 117.68 1gg2 h ILE 33 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.86 1gg2 h ILE 33 Cb 0.31 0.88 0.00 0.00 -0.00 0.00 0.00 36.82 38.01 1gg2 h ILE 33 CO -0.15 0.00 -1.83 0.35 -0.00 0.00 0.00 178.15 176.53 1gg2 n THR 34 N -2.92 0.08 0.03 0.16 -2.24 0.03 -4.42 114.28 104.99 1gg2 n THR 34 Ca -0.03 -0.48 0.19 0.00 -2.27 0.00 0.00 64.05 61.46 1gg2 n THR 34 Cb 0.09 0.01 0.44 0.00 -2.10 0.00 0.00 70.33 68.77 1gg2 n THR 34 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1gg2 h ASN 35 N 0.00 0.00 -1.01 3.42 -1.24 0.30 0.46 115.58 117.51 1gg2 h ASN 35 Ca 0.00 0.00 -0.66 0.00 0.71 0.00 0.00 56.30 56.35 1gg2 h ASN 35 Cb 0.97 0.00 -0.32 0.00 0.73 0.00 0.00 38.32 39.71 1gg2 h ASN 35 CO 0.00 0.00 0.57 0.59 -1.29 0.00 0.00 177.43 177.30 1gg2 n ASN 36 N -3.13 7.18 -4.56 1.15 5.03 -1.26 -4.98 115.26 114.69 1gg2 n ASN 36 Ca 0.12 -3.78 -0.26 0.00 0.87 0.00 0.00 54.58 51.52 1gg2 n ASN 36 Cb 1.11 -0.87 -0.09 0.00 -1.02 0.00 0.00 39.78 38.91 1gg2 n ASN 36 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1gg2 s ILE 37 N -4.81 3.12 -0.32 2.41 1.01 0.15 -5.07 121.20 117.69 1gg2 s ILE 37 Ca 0.62 -1.73 -0.29 0.00 0.00 0.00 0.00 60.65 59.24 1gg2 s ILE 37 Cb 0.49 -2.56 -0.01 0.00 0.01 0.00 0.00 42.46 40.39 1gg2 s ILE 37 CO -0.02 -0.14 1.50 -1.81 0.00 0.00 0.00 174.94 174.47 1gg2 s ASP 38 N -2.91 6.36 0.51 3.58 1.01 -1.26 -4.96 116.67 119.00 1gg2 s ASP 38 Ca 0.25 1.22 -0.23 0.00 0.71 0.00 0.00 52.55 54.50 1gg2 s ASP 38 Cb -0.08 -2.54 -0.06 0.00 1.01 0.00 0.00 42.92 41.25 1gg2 s ASP 38 CO 0.15 -1.34 1.29 -0.81 0.21 0.00 0.00 175.17 174.67 1gg2 n PRO 39 N 7.83 1.69 0.32 8.23 -0.04 -1.26 -4.83 135.00 146.94 1gg2 n PRO 39 Ca 0.18 0.62 0.15 0.00 -0.04 0.00 0.00 63.50 64.41 1gg2 n PRO 39 Cb 0.47 -2.47 0.82 0.00 -0.04 0.00 0.00 33.50 32.28 1gg2 n PRO 39 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1gg2 h VAL 40 N 1.55 0.00 0.00 0.52 2.07 -2.00 -3.47 116.25 114.92 1gg2 h VAL 40 Ca -0.50 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1gg2 h VAL 40 Cb 1.31 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1gg2 h VAL 40 CO 0.57 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.77 1gg2 n GLY 41 N -1.21 0.06 2.70 2.17 0.00 -1.26 -4.47 105.19 103.18 1gg2 n GLY 41 Ca -0.02 -0.99 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 1gg2 n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gg2 s ARG 42 N 0.00 0.59 0.02 1.61 0.52 -1.26 -4.62 118.95 115.82 1gg2 s ARG 42 Ca 0.00 -0.71 -0.15 0.00 -0.52 0.00 0.00 55.73 54.35 1gg2 s ARG 42 Cb 0.00 -1.89 -0.06 0.00 0.52 0.00 0.00 34.95 33.52 1gg2 s ARG 42 CO 0.00 -0.85 0.44 0.42 0.02 0.00 0.00 175.30 175.32 1gg2 s ILE 43 N 1.80 4.99 -0.09 1.52 -1.09 -1.01 -4.99 121.20 122.33 1gg2 s ILE 43 Ca 0.05 0.86 -0.13 0.00 -2.23 0.00 0.00 60.65 59.20 1gg2 s ILE 43 Cb -0.17 -3.73 -0.05 0.00 -1.58 0.00 0.00 42.46 36.93 1gg2 s ILE 43 CO -0.20 0.54 0.32 0.00 -1.23 0.00 0.00 174.94 174.37 1gg2 s GLN 44 N -1.19 3.99 0.09 2.79 -2.07 -1.26 -4.63 119.66 117.38 1gg2 s GLN 44 Ca 0.26 0.20 0.09 0.00 -1.82 0.00 0.00 55.36 54.09 1gg2 s GLN 44 Cb -0.17 -3.31 -0.03 0.00 -1.09 0.00 0.00 33.01 28.41 1gg2 s GLN 44 CO 0.15 0.50 -0.23 -1.64 -1.32 0.00 0.00 175.29 172.75 1gg2 s MET 45 N -0.37 1.33 0.06 9.60 -1.94 -1.26 -5.01 119.30 121.70 1gg2 s MET 45 Ca 0.20 -1.15 0.05 0.00 -1.71 0.00 0.00 55.69 53.07 1gg2 s MET 45 Cb -0.14 -1.60 -0.03 0.00 2.01 0.00 0.00 34.83 35.07 1gg2 s MET 45 CO 0.08 0.39 -0.13 1.03 -0.01 0.00 0.00 175.02 176.38 1gg2 s ARG 46 N -1.70 0.78 -0.09 2.03 0.52 -1.26 -4.92 118.95 114.31 1gg2 s ARG 46 Ca 0.09 -0.90 -0.30 0.00 -0.52 0.00 0.00 55.73 54.11 1gg2 s ARG 46 Cb -0.10 -0.76 -0.04 0.00 0.52 0.00 0.00 34.95 34.58 1gg2 s ARG 46 CO 0.04 0.17 1.43 0.99 0.02 0.00 0.00 175.30 177.95 1gg2 s THR 47 N -1.24 3.91 -0.16 0.02 2.01 -1.26 -2.07 115.64 116.85 1gg2 s THR 47 Ca -0.03 1.15 0.17 0.00 0.31 0.00 0.00 61.69 63.30 1gg2 s THR 47 Cb -0.10 -3.74 -0.25 0.00 0.01 0.00 0.00 72.50 68.42 1gg2 s THR 47 CO 0.02 -0.08 0.24 0.54 -0.69 0.00 0.00 174.62 174.65 1gg2 n ARG 48 N 6.51 0.67 -3.84 4.92 3.00 0.13 -4.98 116.66 123.08 1gg2 n ARG 48 Ca 0.15 0.04 -0.12 0.00 -0.01 0.00 0.00 57.85 57.91 1gg2 n ARG 48 Cb 0.44 -1.58 -0.11 0.00 0.00 0.00 0.00 32.46 31.21 1gg2 n ARG 48 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1gg2 s ARG 49 N -2.61 0.36 -0.09 5.56 6.06 -1.20 -5.00 118.95 122.03 1gg2 s ARG 49 Ca -0.09 -0.09 0.01 0.00 -2.50 0.00 0.00 55.73 53.06 1gg2 s ARG 49 Cb 0.07 0.16 0.02 0.00 0.06 0.00 0.00 34.95 35.26 1gg2 s ARG 49 CO 0.83 -0.08 -0.11 0.99 -2.50 0.00 0.00 175.30 174.44 1gg2 s THR 50 N -0.70 1.19 -0.42 4.11 2.01 -1.26 -1.23 115.64 119.35 1gg2 s THR 50 Ca -0.08 -0.45 -0.11 0.00 0.31 0.00 0.00 61.69 61.36 1gg2 s THR 50 Cb -0.05 -1.13 0.06 0.00 0.01 0.00 0.00 72.50 71.40 1gg2 s THR 50 CO 0.01 0.38 0.27 -0.76 -0.69 0.00 0.00 174.62 173.83 1gg2 s LEU 51 N 1.12 5.11 -0.07 4.42 1.43 0.77 -4.95 118.68 126.51 1gg2 s LEU 51 Ca -0.05 -1.31 -0.00 0.00 -1.03 0.00 0.00 54.13 51.73 1gg2 s LEU 51 Cb -0.14 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 44.01 1gg2 s LEU 51 CO -0.02 -0.51 -0.04 0.00 0.23 0.00 0.00 176.35 176.01 1gg2 s ARG 52 N 1.51 2.85 0.00 1.70 1.04 -1.26 -1.82 118.95 122.97 1gg2 s ARG 52 Ca 0.03 -0.49 0.00 0.00 -1.04 0.00 0.00 55.73 54.23 1gg2 s ARG 52 Cb -0.22 -2.68 0.00 0.00 -2.04 0.00 0.00 34.95 30.01 1gg2 s ARG 52 CO 0.04 0.68 0.00 0.41 -0.04 0.00 0.00 175.30 176.39 1gg2 n GLY 53 N 2.14 0.08 3.84 3.88 0.00 -1.26 -5.09 105.19 108.79 1gg2 n GLY 53 Ca -0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 1gg2 n GLY 53 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1gg2 s HIS 54 N 0.00 3.42 -0.24 1.61 3.76 -1.26 -5.01 115.29 117.58 1gg2 s HIS 54 Ca 0.00 1.24 -0.12 0.00 -0.15 0.00 0.00 55.06 56.02 1gg2 s HIS 54 Cb 0.00 -2.54 -0.10 0.00 1.11 0.00 0.00 32.58 31.05 1gg2 s HIS 54 CO 0.00 0.14 -0.31 1.28 -0.85 0.00 0.00 174.74 175.00 1gg2 n LEU 55 N -0.18 1.69 0.00 0.89 4.77 -1.26 -4.81 117.00 118.11 1gg2 n LEU 55 Ca 0.02 0.29 -0.22 0.00 -0.03 0.00 0.00 56.01 56.08 1gg2 n LEU 55 Cb 0.53 -0.71 0.15 0.00 -2.33 0.00 0.00 43.42 41.07 1gg2 n LEU 55 CO 0.42 0.46 0.66 0.00 -1.33 0.00 0.00 177.39 177.60 1gg2 n ALA 56 N -4.09 -1.14 -1.77 -1.18 0.00 -1.26 -4.73 120.51 106.34 1gg2 n ALA 56 Ca -0.46 -1.29 -0.40 0.00 0.00 0.00 0.00 53.44 51.29 1gg2 n ALA 56 Cb 0.82 -0.06 0.01 0.00 0.00 0.00 0.00 19.45 20.21 1gg2 n ALA 56 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1gg2 s LYS 57 N -5.17 3.81 -0.07 0.00 1.02 -1.24 -3.96 119.74 114.13 1gg2 s LYS 57 Ca 0.56 2.29 -0.14 0.00 0.02 0.00 0.00 55.97 58.71 1gg2 s LYS 57 Cb -0.01 -2.69 -0.05 0.00 -0.52 0.00 0.00 37.83 34.55 1gg2 s LYS 57 CO 0.39 -0.67 0.35 0.42 -0.92 0.00 0.00 175.35 174.92 1gg2 s ILE 58 N -1.23 5.18 -0.05 2.17 1.01 -0.02 -1.73 121.20 126.53 1gg2 s ILE 58 Ca 0.59 0.69 0.13 0.00 0.00 0.00 0.00 60.65 62.07 1gg2 s ILE 58 Cb -0.41 -3.66 -0.20 0.00 0.01 0.00 0.00 42.46 38.20 1gg2 s ILE 58 CO 0.53 0.51 0.31 -1.22 0.00 0.00 0.00 174.94 175.06 1gg2 n TYR 59 N 2.48 0.00 -3.60 3.97 4.02 0.64 -4.19 117.16 120.49 1gg2 n TYR 59 Ca -0.14 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.67 1gg2 n TYR 59 Cb 0.52 -0.29 -0.02 0.00 -0.02 0.00 0.00 39.34 39.54 1gg2 n TYR 59 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1gg2 s ALA 60 N -2.89 -1.57 -0.14 -0.72 0.00 -1.18 -4.54 121.76 110.72 1gg2 s ALA 60 Ca -0.04 0.36 -0.29 0.00 0.00 0.00 0.00 51.96 51.99 1gg2 s ALA 60 Cb 0.09 0.73 0.07 0.00 0.00 0.00 0.00 23.12 24.01 1gg2 s ALA 60 CO 0.55 -0.86 0.71 0.00 0.00 0.00 0.00 175.76 176.16 1gg2 s MET 61 N -3.57 0.96 -0.05 0.00 0.23 -1.26 -0.77 119.30 114.85 1gg2 s MET 61 Ca 0.06 0.55 -0.02 0.00 -1.03 0.00 0.00 55.69 55.26 1gg2 s MET 61 Cb -0.02 0.46 0.03 0.00 -1.53 0.00 0.00 34.83 33.77 1gg2 s MET 61 CO -0.05 -0.23 0.08 -1.58 -2.03 0.00 0.00 175.02 171.21 1gg2 s HIS 62 N -0.55 -0.02 0.40 3.16 2.46 0.22 -4.82 115.29 116.14 1gg2 s HIS 62 Ca -0.06 0.32 -0.25 0.00 0.47 0.00 0.00 55.06 55.54 1gg2 s HIS 62 Cb -0.02 -0.34 -0.08 0.00 -0.13 0.00 0.00 32.58 32.01 1gg2 s HIS 62 CO 0.06 -0.18 1.18 -1.58 -2.47 0.00 0.00 174.74 171.75 1gg2 s TRP 63 N 1.84 3.05 0.40 3.88 0.52 -1.26 -1.17 118.94 126.19 1gg2 s TRP 63 Ca -0.00 1.54 -0.18 0.00 0.02 0.00 0.00 56.10 57.48 1gg2 s TRP 63 Cb -0.12 -3.42 -0.10 0.00 -1.15 0.00 0.00 33.47 28.68 1gg2 s TRP 63 CO -0.04 -1.39 0.88 0.20 0.02 0.00 0.00 176.95 176.62 1gg2 s GLY 64 N -1.09 2.33 0.16 0.98 0.00 0.17 -4.73 107.32 105.14 1gg2 s GLY 64 Ca 0.57 0.25 0.09 0.00 0.00 0.00 0.00 44.72 45.63 1gg2 s GLY 64 CO 0.40 0.50 1.23 -1.30 0.00 0.00 0.00 173.10 173.92 1gg2 n THR 65 N -0.64 1.29 1.77 0.90 -2.24 -1.26 -0.11 114.28 113.99 1gg2 n THR 65 Ca 0.06 0.62 0.10 0.00 -2.27 0.00 0.00 64.05 62.56 1gg2 n THR 65 Cb 0.54 -1.62 0.54 0.00 -2.10 0.00 0.00 70.33 67.69 1gg2 n THR 65 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1gg2 n ASP 66 N -1.81 0.51 -1.02 3.42 5.75 -1.26 -4.80 116.55 117.33 1gg2 n ASP 66 Ca -0.01 -1.46 -0.11 0.00 -0.01 0.00 0.00 54.79 53.21 1gg2 n ASP 66 Cb 0.11 -0.03 -0.05 0.00 -1.03 0.00 0.00 41.12 40.12 1gg2 n ASP 66 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1gg2 n SER 67 N -0.47 -3.97 0.02 -1.12 7.64 0.85 -4.69 113.62 111.88 1gg2 n SER 67 Ca 0.16 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.30 1gg2 n SER 67 Cb 0.15 -3.29 0.00 0.00 -1.01 0.00 0.00 64.21 60.06 1gg2 n SER 67 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1gg2 n ARG 68 N -1.21 0.00 -3.24 1.43 0.63 -1.26 -4.95 116.66 108.06 1gg2 n ARG 68 Ca -0.11 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.44 1gg2 n ARG 68 Cb 0.45 -0.45 -0.06 0.00 0.45 0.00 0.00 32.46 32.84 1gg2 n ARG 68 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1gg2 s LEU 69 N -6.31 4.53 0.04 6.15 1.43 -1.26 -1.15 118.68 122.12 1gg2 s LEU 69 Ca 0.00 1.30 -0.00 0.00 -1.03 0.00 0.00 54.13 54.39 1gg2 s LEU 69 Cb 0.00 -2.94 -0.03 0.00 0.03 0.00 0.00 46.19 43.25 1gg2 s LEU 69 CO 0.00 0.26 -0.04 -1.48 0.23 0.00 0.00 176.35 175.32 1gg2 s LEU 70 N -1.04 2.40 0.06 1.79 0.05 -0.11 0.43 118.68 122.26 1gg2 s LEU 70 Ca 0.30 -0.81 0.04 0.00 0.05 0.00 0.00 54.13 53.71 1gg2 s LEU 70 Cb -0.20 0.12 -0.04 0.00 -2.05 0.00 0.00 46.19 44.02 1gg2 s LEU 70 CO 0.20 -0.47 -0.01 -0.69 -0.55 0.00 0.00 176.35 174.83 1gg2 s VAL 71 N -2.94 3.97 -0.02 1.48 1.01 -0.32 0.87 120.40 124.46 1gg2 s VAL 71 Ca -0.01 -0.90 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 1gg2 s VAL 71 Cb 0.01 -2.85 0.01 0.00 0.00 0.00 0.00 36.38 33.54 1gg2 s VAL 71 CO -0.06 0.20 0.06 -0.94 0.00 0.00 0.00 175.10 174.36 1gg2 s SER 72 N -2.06 -0.05 -0.10 3.32 1.04 -0.25 -0.61 113.70 114.99 1gg2 s SER 72 Ca 0.23 0.11 0.02 0.00 0.48 0.00 0.00 55.95 56.79 1gg2 s SER 72 Cb -0.12 0.10 -0.02 0.00 0.10 0.00 0.00 66.02 66.09 1gg2 s SER 72 CO 0.15 -0.03 -0.16 0.00 0.98 0.00 0.00 173.24 174.18 1gg2 s ALA 73 N 0.17 2.53 0.14 5.32 0.00 0.05 -0.73 121.76 129.24 1gg2 s ALA 73 Ca -0.01 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.06 1gg2 s ALA 73 Cb -0.02 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.00 1gg2 s ALA 73 CO -0.00 0.34 -0.10 0.45 0.00 0.00 0.00 175.76 176.44 1gg2 s SER 74 N 0.05 1.76 -0.04 0.00 0.15 -1.14 -0.26 113.70 114.22 1gg2 s SER 74 Ca -0.06 -0.97 0.01 0.00 0.70 0.00 0.00 55.95 55.63 1gg2 s SER 74 Cb -0.15 -0.01 0.09 0.00 -1.71 0.00 0.00 66.02 64.24 1gg2 s SER 74 CO 0.05 -0.31 0.80 0.00 1.20 0.00 0.00 173.24 174.98 1gg2 n GLN 75 N -0.05 1.36 -0.19 5.44 6.02 -0.71 -2.85 117.38 126.40 1gg2 n GLN 75 Ca -0.11 -0.37 0.08 0.00 -0.01 0.00 0.00 57.00 56.59 1gg2 n GLN 75 Cb 0.60 -1.44 0.24 0.00 1.02 0.00 0.00 30.24 30.66 1gg2 n GLN 75 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1gg2 n ASP 76 N 0.15 2.36 -0.00 1.08 5.75 -1.26 -4.81 116.55 119.81 1gg2 n ASP 76 Ca 0.05 -1.93 -0.00 0.00 -0.01 0.00 0.00 54.79 52.89 1gg2 n ASP 76 Cb 0.46 -0.26 -0.00 0.00 -1.03 0.00 0.00 41.12 40.29 1gg2 n ASP 76 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gg2 n GLY 77 N 1.23 0.42 3.07 6.12 0.00 -1.13 -4.96 105.19 109.93 1gg2 n GLY 77 Ca 0.16 -0.80 -0.18 0.00 0.00 0.00 0.00 46.02 45.20 1gg2 n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gg2 s LYS 78 N -1.46 0.76 -0.30 1.61 3.01 -1.25 -0.37 119.74 121.74 1gg2 s LYS 78 Ca 0.00 -0.53 -0.07 0.00 -1.01 0.00 0.00 55.97 54.36 1gg2 s LYS 78 Cb 0.00 -0.71 0.01 0.00 -1.01 0.00 0.00 37.83 36.11 1gg2 s LYS 78 CO 0.00 0.18 0.09 -0.51 0.51 0.00 0.00 175.35 175.62 1gg2 s LEU 79 N -0.73 3.88 -0.17 3.17 1.43 -0.81 -2.90 118.68 122.56 1gg2 s LEU 79 Ca 0.01 -0.70 -0.07 0.00 -1.03 0.00 0.00 54.13 52.34 1gg2 s LEU 79 Cb -0.06 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.23 1gg2 s LEU 79 CO 0.00 -0.20 0.04 -0.63 0.23 0.00 0.00 176.35 175.80 1gg2 s ILE 80 N 1.51 4.63 -0.27 -0.59 1.01 0.09 -0.59 121.20 126.98 1gg2 s ILE 80 Ca 0.03 -0.09 -0.10 0.00 0.00 0.00 0.00 60.65 60.48 1gg2 s ILE 80 Cb -0.17 -3.07 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 1gg2 s ILE 80 CO 0.03 0.47 0.15 -0.63 0.00 0.00 0.00 174.94 174.96 1gg2 s ILE 81 N 0.31 4.98 0.25 2.92 1.01 -0.81 -1.09 121.20 128.78 1gg2 s ILE 81 Ca 0.02 0.04 0.07 0.00 0.00 0.00 0.00 60.65 60.78 1gg2 s ILE 81 Cb -0.13 -3.37 -0.04 0.00 0.01 0.00 0.00 42.46 38.93 1gg2 s ILE 81 CO 0.01 0.26 0.15 0.26 0.00 0.00 0.00 174.94 175.62 1gg2 s TRP 82 N 1.71 3.03 -0.57 3.97 0.52 0.25 -0.26 118.94 127.59 1gg2 s TRP 82 Ca 0.07 -0.13 -0.12 0.00 0.02 0.00 0.00 56.10 55.94 1gg2 s TRP 82 Cb -0.16 -1.36 0.14 0.00 -1.15 0.00 0.00 33.47 30.94 1gg2 s TRP 82 CO 0.09 0.54 0.49 0.34 0.02 0.00 0.00 176.95 178.42 1gg2 s ASP 83 N -3.78 6.04 0.53 2.95 -1.08 -0.31 -0.93 116.67 120.09 1gg2 s ASP 83 Ca 0.32 -2.08 0.23 0.00 -0.52 0.00 0.00 52.55 50.50 1gg2 s ASP 83 Cb -0.08 -2.11 1.38 0.00 -1.46 0.00 0.00 42.92 40.66 1gg2 s ASP 83 CO 0.24 -0.71 2.04 0.77 0.52 0.00 0.00 175.17 178.03 1gg2 h SER 84 N 8.38 0.00 0.19 -0.34 4.64 -1.44 0.45 113.55 125.43 1gg2 h SER 84 Ca -0.17 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.14 1gg2 h SER 84 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1gg2 h SER 84 CO 0.90 0.00 -0.09 1.88 -0.87 0.00 0.00 176.83 178.64 1gg2 h TYR 85 N 0.00 -0.24 0.00 4.77 -1.99 -1.93 -3.37 116.97 114.21 1gg2 h TYR 85 Ca 0.18 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.90 1gg2 h TYR 85 Cb 0.73 0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.53 1gg2 h TYR 85 CO 0.00 0.03 -0.50 1.79 -0.00 0.00 0.00 178.16 179.48 1gg2 h THR 86 N -1.01 0.00 0.00 -2.88 1.35 -1.95 -3.48 112.91 104.94 1gg2 h THR 86 Ca -0.03 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.88 1gg2 h THR 86 Cb 0.38 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 1gg2 h THR 86 CO 0.04 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 175.66 1gg2 n THR 87 N -2.82 0.00 -2.07 6.82 -2.24 0.16 -5.01 114.28 109.11 1gg2 n THR 87 Ca 0.02 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.43 1gg2 n THR 87 Cb 0.53 -0.01 0.02 0.00 -2.10 0.00 0.00 70.33 68.76 1gg2 n THR 87 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1gg2 s ASN 88 N -2.57 5.60 -0.37 3.42 0.02 -1.24 -4.69 114.94 115.12 1gg2 s ASN 88 Ca 0.00 2.42 -0.19 0.00 -1.02 0.00 0.00 52.86 54.08 1gg2 s ASN 88 Cb 0.00 -2.61 0.00 0.00 0.02 0.00 0.00 41.25 38.67 1gg2 s ASN 88 CO 0.00 -1.32 0.54 -0.54 0.02 0.00 0.00 177.10 175.80 1gg2 s LYS 89 N -3.01 3.55 0.42 -0.60 1.02 -1.26 -1.16 119.74 118.70 1gg2 s LYS 89 Ca 0.71 -0.20 0.22 0.00 0.02 0.00 0.00 55.97 56.72 1gg2 s LYS 89 Cb -0.31 -3.84 0.36 0.00 -0.52 0.00 0.00 37.83 33.52 1gg2 s LYS 89 CO 0.36 -0.72 1.61 0.28 -0.92 0.00 0.00 175.35 175.96 1gg2 h VAL 90 N 5.66 0.17 -2.55 3.17 2.07 -0.95 -3.48 116.25 120.35 1gg2 h VAL 90 Ca -0.27 -1.20 0.14 0.00 0.82 0.00 0.00 66.70 66.19 1gg2 h VAL 90 Cb 1.12 2.05 -0.07 0.00 -1.52 0.00 0.00 31.29 32.87 1gg2 h VAL 90 CO 0.80 0.10 0.42 -1.00 0.02 0.00 0.00 177.57 177.90 1gg2 s HIS 91 N -3.20 -0.12 -0.30 1.57 3.76 -0.93 -4.94 115.29 111.13 1gg2 s HIS 91 Ca 0.06 -0.25 -0.01 0.00 -0.15 0.00 0.00 55.06 54.70 1gg2 s HIS 91 Cb 0.06 0.67 0.19 0.00 1.11 0.00 0.00 32.58 34.61 1gg2 s HIS 91 CO 0.68 -0.97 0.61 0.00 -0.85 0.00 0.00 174.74 174.20 1gg2 s ALA 92 N -3.32 -2.27 -0.27 -1.40 0.00 -1.25 -1.92 121.76 111.32 1gg2 s ALA 92 Ca 0.13 1.86 -0.10 0.00 0.00 0.00 0.00 51.96 53.85 1gg2 s ALA 92 Cb -0.03 -2.16 -0.05 0.00 0.00 0.00 0.00 23.12 20.88 1gg2 s ALA 92 CO 0.04 -1.32 0.17 0.42 0.00 0.00 0.00 175.76 175.07 1gg2 s ILE 93 N 2.86 5.11 -0.28 0.00 1.01 0.24 -4.90 121.20 125.23 1gg2 s ILE 93 Ca 0.20 0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.66 1gg2 s ILE 93 Cb -0.15 -3.43 -0.02 0.00 0.01 0.00 0.00 42.46 38.88 1gg2 s ILE 93 CO -0.21 0.27 1.59 -2.84 0.00 0.00 0.00 174.94 173.75 1gg2 s PRO 94 N 1.73 3.68 0.09 2.79 0.02 -1.26 -1.92 135.00 140.12 1gg2 s PRO 94 Ca 0.07 1.46 -0.25 0.00 0.02 0.00 0.00 61.00 62.30 1gg2 s PRO 94 Cb -0.16 -4.05 -0.06 0.00 0.02 0.00 0.00 34.50 30.25 1gg2 s PRO 94 CO 0.09 -1.44 0.77 -0.51 -0.33 0.00 0.00 177.00 175.59 1gg2 s LEU 95 N 5.51 4.50 0.33 -5.54 1.43 0.50 -4.93 118.68 120.47 1gg2 s LEU 95 Ca 0.70 1.52 0.23 0.00 -1.03 0.00 0.00 54.13 55.55 1gg2 s LEU 95 Cb -0.22 -3.26 1.20 0.00 0.03 0.00 0.00 46.19 43.94 1gg2 s LEU 95 CO 0.30 0.08 1.70 0.08 0.23 0.00 0.00 176.35 178.75 1gg2 h ARG 96 N 5.19 0.00 -2.45 1.70 -0.00 -1.94 -3.39 114.38 113.49 1gg2 h ARG 96 Ca -0.45 0.00 -0.07 0.00 -0.00 0.00 0.00 59.98 59.46 1gg2 h ARG 96 Cb 1.21 0.00 -0.25 0.00 -0.00 0.00 0.00 29.97 30.92 1gg2 h ARG 96 CO 0.69 0.00 -0.24 0.45 -0.00 0.00 0.00 179.97 180.87 1gg2 s SER 97 N -4.14 -0.58 0.00 0.08 0.15 -1.26 -5.06 113.70 102.89 1gg2 s SER 97 Ca -0.01 1.08 0.29 0.00 0.70 0.00 0.00 55.95 58.00 1gg2 s SER 97 Cb 0.07 1.10 1.21 0.00 -1.71 0.00 0.00 66.02 66.69 1gg2 s SER 97 CO 0.24 -0.21 1.84 -1.54 1.20 0.00 0.00 173.24 174.77 1gg2 n SER 98 N 4.58 0.81 -3.08 5.45 3.41 -1.26 -4.41 113.62 119.12 1gg2 n SER 98 Ca -0.19 -1.00 -0.34 0.00 -0.26 0.00 0.00 58.87 57.08 1gg2 n SER 98 Cb 0.54 -0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.44 1gg2 n SER 98 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1gg2 n TRP 99 N -0.54 2.01 -2.70 7.33 7.02 -1.26 -4.18 117.44 125.11 1gg2 n TRP 99 Ca 0.17 -2.68 -0.42 0.00 -1.02 0.00 0.00 57.50 53.55 1gg2 n TRP 99 Cb 0.28 -2.09 -0.03 0.00 -2.42 0.00 0.00 31.31 27.05 1gg2 n TRP 99 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1gg2 s VAL 100 N 0.78 4.82 -0.26 -0.99 0.11 -1.26 -0.92 120.40 122.68 1gg2 s VAL 100 Ca 0.65 2.04 0.08 0.00 -2.93 0.00 0.00 61.98 61.81 1gg2 s VAL 100 Cb 0.22 -4.31 -0.10 0.00 -1.53 0.00 0.00 36.38 30.66 1gg2 s VAL 100 CO -0.07 0.07 0.28 0.23 -3.33 0.00 0.00 175.10 172.29 1gg2 n MET 101 N 4.53 3.17 -3.43 1.54 2.81 -0.45 -4.64 117.12 120.64 1gg2 n MET 101 Ca 0.07 -0.02 -0.12 0.00 -1.81 0.00 0.00 57.70 55.82 1gg2 n MET 101 Cb 0.50 -0.96 -0.02 0.00 -0.71 0.00 0.00 33.22 32.02 1gg2 n MET 101 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1gg2 s THR 102 N -1.98 0.00 0.01 2.03 -1.32 -1.16 -4.42 115.64 108.80 1gg2 s THR 102 Ca 0.01 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.37 1gg2 s THR 102 Cb 0.06 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 70.06 1gg2 s THR 102 CO 0.32 0.00 0.25 0.00 -2.21 0.00 0.00 174.62 172.99 1gg2 s ALA 104 N -1.80 0.09 -0.18 0.00 0.00 0.85 -4.53 121.76 116.18 1gg2 s ALA 104 Ca -0.11 0.32 -0.22 0.00 0.00 0.00 0.00 51.96 51.95 1gg2 s ALA 104 Cb -0.04 -0.51 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 1gg2 s ALA 104 CO 0.01 -0.34 0.68 -0.47 0.00 0.00 0.00 175.76 175.63 1gg2 s TYR 105 N 1.73 3.40 0.53 0.00 6.14 -1.26 0.15 117.35 128.04 1gg2 s TYR 105 Ca -0.01 1.01 -0.21 0.00 0.64 0.00 0.00 57.07 58.50 1gg2 s TYR 105 Cb -0.12 -2.84 -0.05 0.00 0.42 0.00 0.00 41.96 39.36 1gg2 s TYR 105 CO -0.04 -0.17 1.21 0.00 0.64 0.00 0.00 175.55 177.19 1gg2 s ALA 106 N 1.90 2.77 0.38 3.97 0.00 -1.05 -4.80 121.76 124.91 1gg2 s ALA 106 Ca 0.31 1.02 0.08 0.00 0.00 0.00 0.00 51.96 53.37 1gg2 s ALA 106 Cb -0.16 -3.44 0.82 0.00 0.00 0.00 0.00 23.12 20.34 1gg2 s ALA 106 CO 0.11 -0.97 1.96 -1.35 0.00 0.00 0.00 175.76 175.51 1gg2 h PRO 107 N 1.44 0.64 0.00 0.00 0.11 -1.88 -2.11 132.00 130.20 1gg2 h PRO 107 Ca -0.50 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.49 1gg2 h PRO 107 Cb 1.28 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1gg2 h PRO 107 CO 0.58 0.43 -0.40 0.66 -0.21 0.00 0.00 178.00 179.05 1gg2 h SER 108 N 0.66 0.00 0.00 -2.05 4.64 -1.94 -3.40 113.55 111.46 1gg2 h SER 108 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1gg2 h SER 108 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1gg2 h SER 108 CO -0.11 0.40 0.00 0.61 -0.87 0.00 0.00 176.83 176.87 1gg2 n GLY 109 N 0.61 0.97 0.15 -0.77 0.00 -0.80 -4.93 105.19 100.44 1gg2 n GLY 109 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1gg2 n GLY 109 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1gg2 h ASN 110 N 0.00 0.81 -1.19 1.61 -0.26 -1.92 -3.46 115.58 111.16 1gg2 h ASN 110 Ca 0.00 -0.81 -0.64 0.00 -0.56 0.00 0.00 56.30 54.29 1gg2 h ASN 110 Cb 0.00 -0.26 -0.13 0.00 -1.06 0.00 0.00 38.32 36.87 1gg2 h ASN 110 CO 0.00 1.62 -0.54 -0.31 -1.06 0.00 0.00 177.43 177.14 1gg2 s TYR 111 N -2.78 2.02 0.11 1.19 1.51 -1.26 -0.85 117.35 117.28 1gg2 s TYR 111 Ca -0.08 -0.93 -0.19 0.00 -1.01 0.00 0.00 57.07 54.85 1gg2 s TYR 111 Cb 0.05 -1.57 0.05 0.00 -0.11 0.00 0.00 41.96 40.37 1gg2 s TYR 111 CO 0.93 0.20 0.47 0.54 -1.11 0.00 0.00 175.55 176.58 1gg2 s VAL 112 N -2.90 0.05 0.19 0.71 0.11 -0.62 -2.54 120.40 115.39 1gg2 s VAL 112 Ca 0.17 -0.37 -0.05 0.00 -2.93 0.00 0.00 61.98 58.80 1gg2 s VAL 112 Cb 0.04 -1.07 -0.03 0.00 -1.53 0.00 0.00 36.38 33.79 1gg2 s VAL 112 CO 0.09 -0.21 0.21 0.00 -3.33 0.00 0.00 175.10 171.86 1gg2 s ALA 113 N -3.41 0.66 -0.07 1.54 0.00 0.12 -0.88 121.76 119.72 1gg2 s ALA 113 Ca 0.00 -1.38 -0.32 0.00 0.00 0.00 0.00 51.96 50.27 1gg2 s ALA 113 Cb 0.01 1.16 0.13 0.00 0.00 0.00 0.00 23.12 24.41 1gg2 s ALA 113 CO -0.09 -0.64 1.25 0.00 0.00 0.00 0.00 175.76 176.28 1gg2 s GLY 115 N -2.70 -0.27 0.00 0.00 0.00 -1.11 0.93 107.32 104.17 1gg2 s GLY 115 Ca 0.12 0.32 0.00 0.00 0.00 0.00 0.00 44.72 45.16 1gg2 s GLY 115 CO -0.04 5.45 0.00 0.61 0.00 0.00 0.00 173.10 179.12 1gg2 n GLY 116 N -0.88 0.38 0.06 0.20 0.00 -1.23 -1.34 105.19 102.38 1gg2 n GLY 116 Ca 0.03 0.43 0.05 0.00 0.00 0.00 0.00 46.02 46.53 1gg2 n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gg2 n LEU 117 N 0.00 0.23 0.01 0.99 4.77 -0.10 -0.58 117.00 122.32 1gg2 n LEU 117 Ca 0.00 0.59 0.14 0.00 -0.03 0.00 0.00 56.01 56.71 1gg2 n LEU 117 Cb 0.00 -0.61 0.53 0.00 -2.33 0.00 0.00 43.42 41.02 1gg2 n LEU 117 CO 0.00 -0.61 0.86 -0.90 -1.33 0.00 0.00 177.39 175.41 1gg2 n ASP 118 N -1.79 0.16 -0.29 -1.43 5.75 -1.26 -4.80 116.55 112.89 1gg2 n ASP 118 Ca 0.00 0.38 -0.04 0.00 -0.01 0.00 0.00 54.79 55.12 1gg2 n ASP 118 Cb 0.05 -0.39 -0.02 0.00 -1.03 0.00 0.00 41.12 39.74 1gg2 n ASP 118 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1gg2 n ASN 119 N -1.58 -4.54 -4.55 -1.12 3.02 0.25 -4.98 115.26 101.76 1gg2 n ASN 119 Ca 0.07 0.09 -0.30 0.00 -0.03 0.00 0.00 54.58 54.40 1gg2 n ASN 119 Cb 0.35 -2.37 -0.11 0.00 -0.61 0.00 0.00 39.78 37.04 1gg2 n ASN 119 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1gg2 s ILE 120 N -1.77 3.30 -0.23 2.41 -1.09 -1.26 -4.13 121.20 118.42 1gg2 s ILE 120 Ca 0.00 -1.15 -0.05 0.00 -2.23 0.00 0.00 60.65 57.23 1gg2 s ILE 120 Cb 0.00 -2.49 -0.01 0.00 -1.58 0.00 0.00 42.46 38.38 1gg2 s ILE 120 CO 0.00 0.22 -0.02 0.00 -1.23 0.00 0.00 174.94 173.91 1gg2 s SER 122 N 1.50 5.46 -0.33 0.00 0.01 0.26 0.78 113.70 121.39 1gg2 s SER 122 Ca 0.05 -0.04 -0.13 0.00 1.31 0.00 0.00 55.95 57.15 1gg2 s SER 122 Cb -0.15 -1.96 -0.02 0.00 0.21 0.00 0.00 66.02 64.10 1gg2 s SER 122 CO -0.02 0.08 0.24 -0.63 0.41 0.00 0.00 173.24 173.32 1gg2 s ILE 123 N 0.95 5.29 -0.24 1.44 -1.09 0.12 -2.03 121.20 125.64 1gg2 s ILE 123 Ca 0.04 -0.14 -0.07 0.00 -2.23 0.00 0.00 60.65 58.25 1gg2 s ILE 123 Cb -0.14 -3.69 -0.03 0.00 -1.58 0.00 0.00 42.46 37.03 1gg2 s ILE 123 CO 0.03 0.03 0.05 -0.31 -1.23 0.00 0.00 174.94 173.51 1gg2 s TYR 124 N 1.74 3.07 -0.28 3.97 2.02 -0.06 -0.81 117.35 126.99 1gg2 s TYR 124 Ca 0.06 -0.47 -0.20 0.00 -0.37 0.00 0.00 57.07 56.10 1gg2 s TYR 124 Cb -0.17 -2.19 -0.01 0.00 -0.40 0.00 0.00 41.96 39.18 1gg2 s TYR 124 CO 0.11 -0.34 0.62 1.21 -1.57 0.00 0.00 175.55 175.57 1gg2 s ASN 125 N 1.46 6.52 0.43 2.29 2.47 -1.26 -1.58 114.94 125.27 1gg2 s ASN 125 Ca 0.05 0.53 0.24 0.00 0.42 0.00 0.00 52.86 54.10 1gg2 s ASN 125 Cb -0.15 -2.33 0.69 0.00 -1.45 0.00 0.00 41.25 38.01 1gg2 s ASN 125 CO 0.02 -0.43 1.73 -0.07 -3.72 0.00 0.00 177.10 174.63 1gg2 h LEU 126 N 9.05 0.00 -2.41 3.21 3.38 -1.33 -3.26 115.31 123.95 1gg2 h LEU 126 Ca -0.27 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.61 1gg2 h LEU 126 Cb 1.12 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.81 1gg2 h LEU 126 CO 0.78 0.17 0.12 0.29 0.09 0.00 0.00 178.44 179.90 1gg2 n LYS 127 N -3.22 2.16 -1.79 1.13 4.01 -1.25 -4.85 118.16 114.35 1gg2 n LYS 127 Ca 0.02 -1.30 -0.20 0.00 -0.51 0.00 0.00 58.31 56.31 1gg2 n LYS 127 Cb 0.49 -1.68 -0.08 0.00 -0.51 0.00 0.00 35.03 33.24 1gg2 n LYS 127 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1gg2 s THR 128 N -1.59 3.23 0.56 -0.18 2.01 -1.23 -4.73 115.64 113.71 1gg2 s THR 128 Ca 0.23 -0.34 0.42 0.00 0.31 0.00 0.00 61.69 62.32 1gg2 s THR 128 Cb 0.19 -4.01 0.62 0.00 0.01 0.00 0.00 72.50 69.30 1gg2 s THR 128 CO 0.06 -0.43 1.44 0.54 -0.69 0.00 0.00 174.62 175.53 1gg2 n ARG 129 N 8.39 0.00 0.24 4.92 5.12 -1.26 0.16 116.66 134.24 1gg2 n ARG 129 Ca 0.43 1.04 0.16 0.00 -1.93 0.00 0.00 57.85 57.55 1gg2 n ARG 129 Cb 0.46 -2.45 0.80 0.00 -1.16 0.00 0.00 32.46 30.12 1gg2 n ARG 129 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1gg2 h GLU 130 N 0.00 0.00 0.00 5.56 5.08 -2.00 -3.47 114.58 119.75 1gg2 h GLU 130 Ca 0.79 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.15 1gg2 h GLU 130 Cb 3.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 32.69 1gg2 h GLU 130 CO -0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.41 1gg2 n GLY 131 N -0.78 -0.82 0.00 -3.84 0.00 0.43 -5.14 105.19 95.05 1gg2 n GLY 131 Ca -0.01 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1gg2 n GLY 131 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gg2 n ASN 132 N 0.00 0.00 -4.41 1.61 3.02 -1.25 -4.63 115.26 109.60 1gg2 n ASN 132 Ca 0.00 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.23 1gg2 n ASN 132 Cb 0.00 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.03 1gg2 n ASN 132 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1gg2 s VAL 133 N 3.34 2.64 -0.03 2.41 1.01 -1.26 -4.23 120.40 124.28 1gg2 s VAL 133 Ca 0.00 -0.89 -0.10 0.00 0.00 0.00 0.00 61.98 60.99 1gg2 s VAL 133 Cb 0.00 -1.99 0.02 0.00 0.00 0.00 0.00 36.38 34.40 1gg2 s VAL 133 CO 0.00 0.58 0.22 -0.60 0.00 0.00 0.00 175.10 175.31 1gg2 s ARG 134 N -0.70 0.48 0.03 2.72 3.52 -1.26 -4.83 118.95 118.92 1gg2 s ARG 134 Ca 0.11 -0.10 -0.36 0.00 -0.13 0.00 0.00 55.73 55.24 1gg2 s ARG 134 Cb -0.10 0.21 -0.16 0.00 -1.56 0.00 0.00 34.95 33.34 1gg2 s ARG 134 CO -0.00 -0.11 1.50 0.28 -0.81 0.00 0.00 175.30 176.16 1gg2 n VAL 135 N 1.86 0.09 -0.05 7.11 0.31 -1.26 -4.51 118.33 121.88 1gg2 n VAL 135 Ca -0.19 -0.02 -0.19 0.00 -0.01 0.00 0.00 64.34 63.93 1gg2 n VAL 135 Cb 0.57 -1.13 -0.13 0.00 -0.91 0.00 0.00 33.84 32.23 1gg2 n VAL 135 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1gg2 n SER 136 N 3.48 1.98 -3.94 4.52 7.64 0.01 -4.98 113.62 122.33 1gg2 n SER 136 Ca 0.20 0.08 -0.10 0.00 1.01 0.00 0.00 58.87 60.06 1gg2 n SER 136 Cb 0.21 -0.62 -0.11 0.00 -1.01 0.00 0.00 64.21 62.69 1gg2 n SER 136 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1gg2 s ARG 137 N -2.54 0.38 -0.16 1.43 1.81 -0.85 -5.00 118.95 114.03 1gg2 s ARG 137 Ca -0.26 -0.53 -0.02 0.00 -1.72 0.00 0.00 55.73 53.20 1gg2 s ARG 137 Cb 0.08 0.15 0.05 0.00 -0.45 0.00 0.00 34.95 34.77 1gg2 s ARG 137 CO 0.71 -0.08 0.02 -1.21 -0.68 0.00 0.00 175.30 174.06 1gg2 s GLU 138 N -1.45 0.72 -0.55 3.54 2.02 -1.26 0.13 118.70 121.86 1gg2 s GLU 138 Ca -0.15 -0.28 -0.21 0.00 0.02 0.00 0.00 54.97 54.35 1gg2 s GLU 138 Cb -0.09 -1.77 0.06 0.00 0.10 0.00 0.00 34.13 32.42 1gg2 s GLU 138 CO -0.00 -0.52 0.79 -0.51 0.02 0.00 0.00 175.26 175.03 1gg2 s LEU 139 N 1.87 4.62 -0.12 1.80 1.43 0.23 -4.90 118.68 123.62 1gg2 s LEU 139 Ca 0.01 -0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 52.31 1gg2 s LEU 139 Cb -0.15 -2.57 -0.03 0.00 0.03 0.00 0.00 46.19 43.47 1gg2 s LEU 139 CO -0.07 -1.10 -0.00 0.00 0.23 0.00 0.00 176.35 175.41 1gg2 s ALA 140 N 3.28 3.22 0.00 4.21 0.00 -1.26 -2.37 121.76 128.84 1gg2 s ALA 140 Ca 0.21 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.37 1gg2 s ALA 140 Cb -0.17 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.40 1gg2 s ALA 140 CO 0.14 0.43 0.00 0.41 0.00 0.00 0.00 175.76 176.74 1gg2 n GLY 141 N 2.70 0.47 3.76 0.00 0.00 -1.26 -4.89 105.19 105.96 1gg2 n GLY 141 Ca -0.18 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 1gg2 n GLY 141 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1gg2 s HIS 142 N 0.00 2.52 -0.19 1.61 3.76 -1.26 -4.93 115.29 116.81 1gg2 s HIS 142 Ca 0.00 1.42 0.15 0.00 -0.15 0.00 0.00 55.06 56.47 1gg2 s HIS 142 Cb 0.00 -3.67 0.39 0.00 1.11 0.00 0.00 32.58 30.41 1gg2 s HIS 142 CO 0.00 -2.40 1.25 0.25 -0.85 0.00 0.00 174.74 172.98 1gg2 n THR 143 N -0.71 2.14 -3.90 1.30 -2.24 -1.26 -4.86 114.28 104.74 1gg2 n THR 143 Ca 0.08 -2.65 -0.09 0.00 -2.27 0.00 0.00 64.05 59.13 1gg2 n THR 143 Cb 0.46 -0.25 -0.04 0.00 -2.10 0.00 0.00 70.33 68.39 1gg2 n THR 143 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1gg2 s GLY 144 N -2.87 0.25 0.74 3.38 0.00 -1.26 -4.72 107.32 102.85 1gg2 s GLY 144 Ca 0.37 -0.60 -0.15 0.00 0.00 0.00 0.00 44.72 44.34 1gg2 s GLY 144 CO -0.00 -0.44 1.22 -2.52 0.00 0.00 0.00 173.10 171.35 1gg2 s TYR 145 N -3.96 1.99 -0.33 1.90 -0.85 -1.26 -4.35 117.35 110.49 1gg2 s TYR 145 Ca 0.17 1.61 -0.23 0.00 -0.52 0.00 0.00 57.07 58.09 1gg2 s TYR 145 Cb -0.02 -3.50 0.00 0.00 0.38 0.00 0.00 41.96 38.83 1gg2 s TYR 145 CO 0.05 -2.70 0.75 -1.17 -1.52 0.00 0.00 175.55 170.96 1gg2 s LEU 146 N -5.22 4.12 0.10 -3.49 2.96 -0.69 -0.61 118.68 115.85 1gg2 s LEU 146 Ca 0.75 0.48 0.22 0.00 -0.22 0.00 0.00 54.13 55.36 1gg2 s LEU 146 Cb -0.30 -3.00 -0.13 0.00 0.50 0.00 0.00 46.19 43.26 1gg2 s LEU 146 CO 0.46 -0.64 0.81 -1.54 -1.32 0.00 0.00 176.35 174.13 1gg2 n SER 147 N 6.23 0.56 -3.57 3.68 3.41 -0.75 -4.13 113.62 119.05 1gg2 n SER 147 Ca 0.02 0.22 -0.08 0.00 -0.26 0.00 0.00 58.87 58.77 1gg2 n SER 147 Cb 0.48 0.92 -0.04 0.00 -0.26 0.00 0.00 64.21 65.31 1gg2 n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gg2 s ARG 150 N -0.58 0.20 0.36 0.00 1.81 0.11 -4.52 118.95 116.33 1gg2 s ARG 150 Ca -0.07 0.45 -0.22 0.00 -1.72 0.00 0.00 55.73 54.17 1gg2 s ARG 150 Cb -0.03 -0.08 -0.10 0.00 -0.45 0.00 0.00 34.95 34.29 1gg2 s ARG 150 CO 0.04 -0.13 0.91 -0.06 -0.68 0.00 0.00 175.30 175.38 1gg2 s PHE 151 N 0.99 3.49 -0.11 -0.53 0.40 -1.26 0.78 117.98 121.75 1gg2 s PHE 151 Ca -0.07 1.63 0.02 0.00 -0.60 0.00 0.00 56.93 57.90 1gg2 s PHE 151 Cb -0.09 -2.83 -0.24 0.00 0.51 0.00 0.00 43.02 40.37 1gg2 s PHE 151 CO -0.06 0.07 0.41 1.28 0.70 0.00 0.00 175.22 177.62 1gg2 n LEU 152 N -0.03 1.94 -3.61 -0.37 4.77 0.16 -4.80 117.00 115.06 1gg2 n LEU 152 Ca 0.04 0.24 -0.04 0.00 -0.03 0.00 0.00 56.01 56.23 1gg2 n LEU 152 Cb 0.52 -0.59 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 1gg2 n LEU 152 CO 0.41 0.69 1.06 1.51 -1.33 0.00 0.00 177.39 179.72 1gg2 s ASP 153 N -6.61 -0.10 0.45 -1.43 -4.77 -1.04 -4.84 116.67 98.34 1gg2 s ASP 153 Ca -0.17 -0.00 0.16 0.00 -3.30 0.00 0.00 52.55 49.24 1gg2 s ASP 153 Cb 0.07 0.11 0.56 0.00 -1.09 0.00 0.00 42.92 42.57 1gg2 s ASP 153 CO 0.78 -0.18 0.91 0.47 0.70 0.00 0.00 175.17 177.86 1gg2 n ASP 154 N -0.08 0.00 0.05 2.11 9.92 -1.26 0.12 116.55 127.42 1gg2 n ASP 154 Ca 0.02 0.52 0.07 0.00 -0.53 0.00 0.00 54.79 54.87 1gg2 n ASP 154 Cb 0.58 -0.16 -0.06 0.00 -0.64 0.00 0.00 41.12 40.84 1gg2 n ASP 154 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1gg2 n ASN 155 N -2.59 0.66 -3.89 -2.24 3.02 -1.26 -4.70 115.26 104.26 1gg2 n ASN 155 Ca 0.14 0.27 -0.11 0.00 -0.03 0.00 0.00 54.58 54.86 1gg2 n ASN 155 Cb 1.06 0.67 -0.10 0.00 -0.61 0.00 0.00 39.78 40.80 1gg2 n ASN 155 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1gg2 s GLN 156 N -3.23 0.51 -0.11 3.52 -0.21 0.32 -1.93 119.66 118.54 1gg2 s GLN 156 Ca -0.03 -0.51 -0.09 0.00 0.02 0.00 0.00 55.36 54.75 1gg2 s GLN 156 Cb 0.10 0.21 0.03 0.00 1.00 0.00 0.00 33.01 34.35 1gg2 s GLN 156 CO 0.82 -0.12 0.28 -1.50 -2.12 0.00 0.00 175.29 172.64 1gg2 s ILE 157 N -1.74 -0.01 -0.02 1.08 2.07 -1.05 0.36 121.20 121.90 1gg2 s ILE 157 Ca -0.12 0.04 -0.02 0.00 -1.41 0.00 0.00 60.65 59.14 1gg2 s ILE 157 Cb -0.06 -0.40 -0.04 0.00 0.13 0.00 0.00 42.46 42.09 1gg2 s ILE 157 CO -0.00 0.01 0.13 0.68 -1.91 0.00 0.00 174.94 173.85 1gg2 s VAL 158 N 0.45 5.09 0.03 4.00 -7.23 0.23 -1.41 120.40 121.57 1gg2 s VAL 158 Ca -0.02 -0.25 0.04 0.00 -1.81 0.00 0.00 61.98 59.93 1gg2 s VAL 158 Cb -0.04 -3.34 -0.02 0.00 0.56 0.00 0.00 36.38 33.54 1gg2 s VAL 158 CO -0.02 0.36 -0.12 0.42 -0.31 0.00 0.00 175.10 175.43 1gg2 s THR 159 N -1.24 0.89 0.18 5.32 -4.23 0.09 0.06 115.64 116.72 1gg2 s THR 159 Ca 0.24 -0.89 0.08 0.00 -1.18 0.00 0.00 61.69 59.94 1gg2 s THR 159 Cb -0.12 -0.83 -0.04 0.00 1.34 0.00 0.00 72.50 72.85 1gg2 s THR 159 CO 0.15 -0.05 -0.02 -0.94 -0.54 0.00 0.00 174.62 173.23 1gg2 s SER 160 N -1.05 4.66 0.05 3.99 1.04 0.12 -0.19 113.70 122.33 1gg2 s SER 160 Ca -0.01 -0.44 -0.14 0.00 0.48 0.00 0.00 55.95 55.85 1gg2 s SER 160 Cb -0.07 -0.95 0.02 0.00 0.10 0.00 0.00 66.02 65.12 1gg2 s SER 160 CO 0.01 0.09 0.30 -0.55 0.98 0.00 0.00 173.24 174.07 1gg2 s SER 161 N -2.92 -0.11 0.17 7.02 0.15 0.18 -1.82 113.70 116.36 1gg2 s SER 161 Ca 0.27 -0.23 0.16 0.00 0.70 0.00 0.00 55.95 56.85 1gg2 s SER 161 Cb -0.09 0.36 0.75 0.00 -1.71 0.00 0.00 66.02 65.34 1gg2 s SER 161 CO 0.18 -0.64 1.49 0.61 1.20 0.00 0.00 173.24 176.08 1gg2 n GLY 162 N 0.48 -0.93 0.00 9.45 0.00 0.22 -1.08 105.19 113.33 1gg2 n GLY 162 Ca -0.18 0.07 0.05 0.00 0.00 0.00 0.00 46.02 45.96 1gg2 n GLY 162 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gg2 n ASP 163 N -1.94 0.00 -0.19 1.61 5.68 -1.26 -4.25 116.55 116.20 1gg2 n ASP 163 Ca 0.01 -1.31 -0.02 0.00 -0.50 0.00 0.00 54.79 52.97 1gg2 n ASP 163 Cb 0.11 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.08 1gg2 n ASP 163 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1gg2 n THR 164 N -0.70 0.00 -4.30 2.12 -2.24 -0.24 -4.97 114.28 103.95 1gg2 n THR 164 Ca 0.08 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.70 1gg2 n THR 164 Cb 0.04 -0.65 -0.10 0.00 -2.10 0.00 0.00 70.33 67.52 1gg2 n THR 164 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1gg2 s THR 165 N -2.08 0.63 0.33 4.28 -4.23 -1.23 -4.04 115.64 109.30 1gg2 s THR 165 Ca 0.00 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.57 1gg2 s THR 165 Cb 0.00 -2.51 -0.07 0.00 1.34 0.00 0.00 72.50 71.26 1gg2 s THR 165 CO 0.00 -0.12 0.00 0.00 -0.54 0.00 0.00 174.62 173.96 1gg2 s ALA 167 N -3.04 -1.56 -0.04 0.00 0.00 0.74 -1.21 121.76 116.64 1gg2 s ALA 167 Ca 0.34 0.73 0.05 0.00 0.00 0.00 0.00 51.96 53.08 1gg2 s ALA 167 Cb 0.07 0.51 -0.02 0.00 0.00 0.00 0.00 23.12 23.68 1gg2 s ALA 167 CO 0.15 -0.59 -0.19 -1.17 0.00 0.00 0.00 175.76 173.96 1gg2 s LEU 168 N -2.13 2.47 0.09 0.00 2.96 0.12 -0.73 118.68 121.47 1gg2 s LEU 168 Ca -0.04 -0.30 0.05 0.00 -0.22 0.00 0.00 54.13 53.62 1gg2 s LEU 168 Cb -0.01 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.18 1gg2 s LEU 168 CO -0.04 0.34 -0.13 0.26 -1.32 0.00 0.00 176.35 175.46 1gg2 s TRP 169 N -0.68 1.22 -0.57 5.38 0.52 -0.50 0.94 118.94 125.25 1gg2 s TRP 169 Ca 0.11 -0.53 -0.14 0.00 0.02 0.00 0.00 56.10 55.56 1gg2 s TRP 169 Cb -0.10 -0.67 0.14 0.00 -1.15 0.00 0.00 33.47 31.69 1gg2 s TRP 169 CO -0.00 0.07 0.51 0.34 0.02 0.00 0.00 176.95 177.89 1gg2 s ASP 170 N -2.09 6.16 0.14 2.95 2.15 -0.38 -2.51 116.67 123.08 1gg2 s ASP 170 Ca 0.03 -1.97 -0.28 0.00 0.43 0.00 0.00 52.55 50.76 1gg2 s ASP 170 Cb -0.07 -2.16 -0.04 0.00 -0.30 0.00 0.00 42.92 40.35 1gg2 s ASP 170 CO 0.02 -0.78 1.59 0.40 -0.17 0.00 0.00 175.17 176.24 1gg2 h ILE 171 N 5.76 0.19 -1.27 4.11 2.04 -1.68 1.08 117.51 127.73 1gg2 h ILE 171 Ca -0.22 0.00 0.44 0.00 1.00 0.00 0.00 64.86 66.08 1gg2 h ILE 171 Cb 1.08 0.19 -0.14 0.00 -0.74 0.00 0.00 36.82 37.21 1gg2 h ILE 171 CO 0.96 0.00 0.80 -0.08 0.00 0.00 0.00 178.15 179.83 1gg2 h GLU 172 N -0.45 0.07 0.00 2.37 4.57 -1.84 -0.33 114.58 118.97 1gg2 h GLU 172 Ca 0.09 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1gg2 h GLU 172 Cb 0.60 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1gg2 h GLU 172 CO -0.40 0.05 -1.44 -2.37 -1.18 0.00 0.00 179.01 173.67 1gg2 n THR 173 N -4.80 0.00 -0.99 0.32 5.66 -0.85 -5.01 114.28 108.61 1gg2 n THR 173 Ca 0.38 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 61.14 1gg2 n THR 173 Cb 1.42 0.28 0.00 0.00 -1.55 0.00 0.00 70.33 70.48 1gg2 n THR 173 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1gg2 n GLY 174 N 1.91 0.66 3.83 1.09 0.00 0.37 -5.02 105.19 108.02 1gg2 n GLY 174 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1gg2 n GLY 174 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gg2 s GLN 175 N -0.06 4.15 -0.42 1.61 -0.21 -1.19 -4.74 119.66 118.79 1gg2 s GLN 175 Ca 0.00 0.73 -0.29 0.00 0.02 0.00 0.00 55.36 55.82 1gg2 s GLN 175 Cb 0.00 -2.87 0.01 0.00 1.00 0.00 0.00 33.01 31.15 1gg2 s GLN 175 CO 0.00 0.41 1.38 -1.14 -2.12 0.00 0.00 175.29 173.82 1gg2 s GLN 176 N -2.02 3.59 0.05 2.91 0.74 -1.26 -1.25 119.66 122.42 1gg2 s GLN 176 Ca 0.42 0.90 -0.20 0.00 0.05 0.00 0.00 55.36 56.52 1gg2 s GLN 176 Cb -0.16 -4.01 -0.13 0.00 1.10 0.00 0.00 33.01 29.81 1gg2 s GLN 176 CO 0.20 -1.54 1.39 1.15 -0.55 0.00 0.00 175.29 175.94 1gg2 h THR 177 N 6.44 1.32 -3.11 -0.34 2.02 0.25 -3.47 112.91 116.02 1gg2 h THR 177 Ca -0.27 -1.15 -0.14 0.00 0.77 0.00 0.00 66.41 65.62 1gg2 h THR 177 Cb 1.10 1.74 -0.22 0.00 -1.74 0.00 0.00 68.15 69.03 1gg2 h THR 177 CO 1.09 0.34 -0.36 -0.89 0.37 0.00 0.00 175.52 176.07 1gg2 s THR 178 N -4.52 0.04 -0.18 3.16 2.01 -0.73 -4.94 115.64 110.47 1gg2 s THR 178 Ca -0.14 -0.29 -0.01 0.00 0.31 0.00 0.00 61.69 61.56 1gg2 s THR 178 Cb 0.05 -0.49 -0.00 0.00 0.01 0.00 0.00 72.50 72.07 1gg2 s THR 178 CO 0.74 -0.16 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.50 1gg2 s THR 179 N -0.66 2.82 -1.03 -0.82 2.01 -1.26 0.12 115.64 116.82 1gg2 s THR 179 Ca -0.08 -0.70 -0.12 0.00 0.31 0.00 0.00 61.69 61.11 1gg2 s THR 179 Cb -0.04 -2.23 0.24 0.00 0.01 0.00 0.00 72.50 70.48 1gg2 s THR 179 CO 0.02 0.49 1.05 -0.36 -0.69 0.00 0.00 174.62 175.13 1gg2 s PHE 180 N 1.10 3.98 0.51 4.92 0.40 -0.35 -4.97 117.98 123.57 1gg2 s PHE 180 Ca 0.00 -2.36 -0.15 0.00 -0.60 0.00 0.00 56.93 53.82 1gg2 s PHE 180 Cb -0.14 -3.91 -0.07 0.00 0.51 0.00 0.00 43.02 39.40 1gg2 s PHE 180 CO -0.03 -1.04 0.95 0.95 0.70 0.00 0.00 175.22 176.75 1gg2 s THR 181 N -0.33 4.60 0.00 0.64 -4.23 -1.26 -3.02 115.64 112.03 1gg2 s THR 181 Ca 0.28 1.07 0.00 0.00 -1.18 0.00 0.00 61.69 61.86 1gg2 s THR 181 Cb -0.09 -3.74 0.00 0.00 1.34 0.00 0.00 72.50 70.01 1gg2 s THR 181 CO -0.08 -0.72 0.00 0.61 -0.54 0.00 0.00 174.62 173.90 1gg2 n GLY 182 N -1.68 1.71 3.68 3.99 0.00 -1.26 -4.84 105.19 106.79 1gg2 n GLY 182 Ca 0.06 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1gg2 n GLY 182 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1gg2 n HIS 183 N 0.00 1.84 -1.83 1.61 8.25 -1.26 -4.92 115.22 118.91 1gg2 n HIS 183 Ca 0.00 0.51 -0.27 0.00 -0.26 0.00 0.00 57.72 57.69 1gg2 n HIS 183 Cb 0.00 -2.33 0.04 0.00 1.12 0.00 0.00 29.99 28.82 1gg2 n HIS 183 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1gg2 n THR 184 N -0.40 2.86 -3.72 1.59 -2.24 -1.26 -4.84 114.28 106.27 1gg2 n THR 184 Ca 0.08 -3.87 -0.02 0.00 -2.27 0.00 0.00 64.05 57.97 1gg2 n THR 184 Cb 0.40 -1.15 -0.01 0.00 -2.10 0.00 0.00 70.33 67.47 1gg2 n THR 184 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1gg2 s GLY 185 N -3.06 -0.28 0.17 3.38 0.00 -1.26 -4.71 107.32 101.56 1gg2 s GLY 185 Ca 0.55 0.29 -0.32 0.00 0.00 0.00 0.00 44.72 45.24 1gg2 s GLY 185 CO 0.01 0.03 1.76 0.99 0.00 0.00 0.00 173.10 175.90 1gg2 s ASP 186 N -2.96 6.40 -0.26 1.64 1.01 -1.26 -4.12 116.67 117.12 1gg2 s ASP 186 Ca 0.13 2.82 -0.26 0.00 0.71 0.00 0.00 52.55 55.95 1gg2 s ASP 186 Cb 0.00 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.35 1gg2 s ASP 186 CO 0.01 -0.98 0.89 -0.69 0.21 0.00 0.00 175.17 174.61 1gg2 s VAL 187 N 1.79 4.77 -0.15 -1.27 1.01 -0.81 -0.09 120.40 125.65 1gg2 s VAL 187 Ca 0.77 1.63 0.18 0.00 0.00 0.00 0.00 61.98 64.57 1gg2 s VAL 187 Cb -0.48 -4.19 -0.25 0.00 0.00 0.00 0.00 36.38 31.45 1gg2 s VAL 187 CO 0.34 -0.16 0.28 0.23 0.00 0.00 0.00 175.10 175.79 1gg2 n MET 188 N 6.18 0.67 -3.93 2.72 0.00 0.46 -3.48 117.12 119.74 1gg2 n MET 188 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 57.70 57.69 1gg2 n MET 188 Cb 0.47 -1.57 -0.08 0.00 0.00 0.00 0.00 33.22 32.04 1gg2 n MET 188 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1gg2 s SER 189 N -5.39 0.19 0.03 7.83 0.15 -1.15 -4.27 113.70 111.09 1gg2 s SER 189 Ca -0.08 -0.78 -0.16 0.00 0.70 0.00 0.00 55.95 55.63 1gg2 s SER 189 Cb 0.08 0.32 0.03 0.00 -1.71 0.00 0.00 66.02 64.74 1gg2 s SER 189 CO 0.84 -0.73 0.35 -1.48 1.20 0.00 0.00 173.24 173.43 1gg2 s LEU 190 N -2.90 0.66 -0.05 3.45 0.05 -1.26 -1.22 118.68 117.42 1gg2 s LEU 190 Ca 0.08 -0.04 -0.02 0.00 0.05 0.00 0.00 54.13 54.20 1gg2 s LEU 190 Cb 0.05 1.51 0.03 0.00 -2.05 0.00 0.00 46.19 45.73 1gg2 s LEU 190 CO -0.09 -0.60 0.10 -0.55 -0.55 0.00 0.00 176.35 174.67 1gg2 s SER 191 N -1.87 -0.06 -0.07 1.48 0.15 -0.00 -4.82 113.70 108.51 1gg2 s SER 191 Ca -0.07 0.20 -0.25 0.00 0.70 0.00 0.00 55.95 56.53 1gg2 s SER 191 Cb -0.02 0.11 -0.03 0.00 -1.71 0.00 0.00 66.02 64.38 1gg2 s SER 191 CO -0.01 -0.12 0.80 -0.22 1.20 0.00 0.00 173.24 174.89 1gg2 s LEU 192 N 0.91 4.30 0.42 3.45 2.96 -1.26 -1.37 118.68 128.09 1gg2 s LEU 192 Ca -0.07 1.30 -0.25 0.00 -0.22 0.00 0.00 54.13 54.89 1gg2 s LEU 192 Cb -0.10 -3.23 -0.08 0.00 0.50 0.00 0.00 46.19 43.28 1gg2 s LEU 192 CO -0.04 -0.21 1.22 0.00 -1.32 0.00 0.00 176.35 176.00 1gg2 s ALA 193 N 1.15 3.12 0.26 5.97 0.00 -0.22 -4.85 121.76 127.19 1gg2 s ALA 193 Ca 0.41 1.06 0.19 0.00 0.00 0.00 0.00 51.96 53.62 1gg2 s ALA 193 Cb -0.18 -3.43 0.87 0.00 0.00 0.00 0.00 23.12 20.39 1gg2 s ALA 193 CO 0.19 -0.70 0.92 -2.30 0.00 0.00 0.00 175.76 173.87 1gg2 n PRO 194 N -0.11 -0.02 0.00 0.00 -0.02 -1.26 0.11 135.00 133.70 1gg2 n PRO 194 Ca 0.05 0.74 0.11 0.00 -2.02 0.00 0.00 63.50 62.38 1gg2 n PRO 194 Cb 0.46 -1.45 0.05 0.00 -0.02 0.00 0.00 33.50 32.54 1gg2 n PRO 194 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1gg2 n ASP 195 N -3.87 0.72 -2.59 2.55 5.68 -1.26 -4.98 116.55 112.80 1gg2 n ASP 195 Ca 0.24 -0.54 -0.13 0.00 -0.50 0.00 0.00 54.79 53.85 1gg2 n ASP 195 Cb 0.92 0.68 0.06 0.00 -1.14 0.00 0.00 41.12 41.63 1gg2 n ASP 195 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1gg2 n THR 196 N -1.60 -3.09 -0.10 2.12 -2.24 0.12 -4.95 114.28 104.54 1gg2 n THR 196 Ca 0.04 -0.18 -0.15 0.00 -2.27 0.00 0.00 64.05 61.49 1gg2 n THR 196 Cb 0.36 -3.71 -0.08 0.00 -2.10 0.00 0.00 70.33 64.79 1gg2 n THR 196 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1gg2 n ARG 197 N -3.27 0.46 -4.15 -0.78 0.63 -1.26 -5.00 116.66 103.28 1gg2 n ARG 197 Ca -0.10 0.13 -0.11 0.00 -0.92 0.00 0.00 57.85 56.84 1gg2 n ARG 197 Cb 0.58 -1.34 -0.09 0.00 0.45 0.00 0.00 32.46 32.06 1gg2 n ARG 197 CO 0.00 0.00 0.00 -0.48 -2.51 0.00 0.00 177.63 174.64 1gg2 s LEU 198 N -6.34 0.97 0.11 6.15 0.05 -1.26 -2.27 118.68 116.08 1gg2 s LEU 198 Ca -0.26 -1.29 -0.12 0.00 0.05 0.00 0.00 54.13 52.51 1gg2 s LEU 198 Cb 0.08 0.70 0.01 0.00 -2.05 0.00 0.00 46.19 44.93 1gg2 s LEU 198 CO 0.41 -0.91 0.28 0.72 -0.55 0.00 0.00 176.35 176.30 1gg2 s PHE 199 N -4.11 0.04 0.17 3.48 -0.71 -0.73 -1.05 117.98 115.07 1gg2 s PHE 199 Ca 0.35 -0.42 0.09 0.00 -1.04 0.00 0.00 56.93 55.91 1gg2 s PHE 199 Cb 0.05 0.07 -0.04 0.00 -1.21 0.00 0.00 43.02 41.89 1gg2 s PHE 199 CO 0.12 -0.63 -0.13 0.14 -1.34 0.00 0.00 175.22 173.38 1gg2 s VAL 200 N -3.85 3.01 -0.01 -2.49 -7.23 -0.47 0.02 120.40 109.38 1gg2 s VAL 200 Ca 0.05 -1.70 0.02 0.00 -1.81 0.00 0.00 61.98 58.54 1gg2 s VAL 200 Cb 0.03 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.50 1gg2 s VAL 200 CO -0.10 -0.08 -0.05 -0.94 -0.31 0.00 0.00 175.10 173.61 1gg2 s SER 201 N -2.72 0.69 -0.03 4.85 1.04 -0.36 -0.82 113.70 116.35 1gg2 s SER 201 Ca 0.23 -0.10 -0.02 0.00 0.48 0.00 0.00 55.95 56.54 1gg2 s SER 201 Cb -0.09 -0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.86 1gg2 s SER 201 CO 0.14 0.04 0.10 -0.83 0.98 0.00 0.00 173.24 173.67 1gg2 s GLY 202 N 0.07 2.06 0.25 7.32 0.00 -0.36 -1.93 107.32 114.73 1gg2 s GLY 202 Ca -0.00 -0.81 -0.00 0.00 0.00 0.00 0.00 44.72 43.91 1gg2 s GLY 202 CO -0.00 -0.66 0.24 0.00 0.00 0.00 0.00 173.10 172.68 1gg2 s ALA 203 N -1.17 1.15 -1.44 3.20 0.00 -1.00 -0.41 121.76 122.10 1gg2 s ALA 203 Ca 0.22 -1.69 0.17 0.00 0.00 0.00 0.00 51.96 50.66 1gg2 s ALA 203 Cb -0.12 1.35 0.88 0.00 0.00 0.00 0.00 23.12 25.23 1gg2 s ALA 203 CO 0.12 -0.66 1.52 0.00 0.00 0.00 0.00 175.76 176.74 1gg2 n ASP 205 N -1.28 2.24 -3.07 0.00 5.68 -1.26 -4.23 116.55 114.62 1gg2 n ASP 205 Ca 0.08 -2.18 -0.22 0.00 -0.50 0.00 0.00 54.79 51.97 1gg2 n ASP 205 Cb 0.14 -0.38 0.03 0.00 -1.14 0.00 0.00 41.12 39.77 1gg2 n ASP 205 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1gg2 n ALA 206 N 0.32 -0.99 -2.90 2.12 0.00 -0.82 -4.97 120.51 113.27 1gg2 n ALA 206 Ca 0.11 0.25 -0.11 0.00 0.00 0.00 0.00 53.44 53.68 1gg2 n ALA 206 Cb 0.43 -3.63 -0.13 0.00 0.00 0.00 0.00 19.45 16.13 1gg2 n ALA 206 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1gg2 s SER 207 N -2.69 0.20 0.40 0.00 1.04 -1.25 -3.73 113.70 107.68 1gg2 s SER 207 Ca 0.31 -0.24 0.08 0.00 0.48 0.00 0.00 55.95 56.58 1gg2 s SER 207 Cb -0.15 0.04 0.01 0.00 0.10 0.00 0.00 66.02 66.02 1gg2 s SER 207 CO 0.39 -0.13 0.54 0.00 0.98 0.00 0.00 173.24 175.03 1gg2 s ALA 208 N -0.68 4.44 -0.23 5.32 0.00 0.13 -2.36 121.76 128.37 1gg2 s ALA 208 Ca -0.07 -1.61 -0.19 0.00 0.00 0.00 0.00 51.96 50.09 1gg2 s ALA 208 Cb -0.05 -1.65 0.06 0.00 0.00 0.00 0.00 23.12 21.49 1gg2 s ALA 208 CO -0.00 -0.22 0.61 0.15 0.00 0.00 0.00 175.76 176.30 1gg2 s LYS 209 N -4.31 0.68 -0.19 0.00 1.02 -0.82 -1.58 119.74 114.55 1gg2 s LYS 209 Ca 0.52 0.93 -0.11 0.00 0.02 0.00 0.00 55.97 57.33 1gg2 s LYS 209 Cb -0.10 0.27 -0.05 0.00 -0.52 0.00 0.00 37.83 37.43 1gg2 s LYS 209 CO 0.33 -0.11 0.17 -1.17 -0.92 0.00 0.00 175.35 173.65 1gg2 s LEU 210 N 0.71 4.21 -0.02 3.17 2.96 -0.72 -1.22 118.68 127.77 1gg2 s LEU 210 Ca -0.03 0.28 0.06 0.00 -0.22 0.00 0.00 54.13 54.22 1gg2 s LEU 210 Cb -0.05 -2.15 -0.01 0.00 0.50 0.00 0.00 46.19 44.47 1gg2 s LEU 210 CO -0.05 0.15 -0.20 0.26 -1.32 0.00 0.00 176.35 175.20 1gg2 s TRP 211 N 0.43 1.77 -0.38 5.38 0.52 0.10 -0.43 118.94 126.34 1gg2 s TRP 211 Ca 0.10 -0.36 -0.21 0.00 0.02 0.00 0.00 56.10 55.65 1gg2 s TRP 211 Cb -0.12 -1.15 0.01 0.00 -1.15 0.00 0.00 33.47 31.07 1gg2 s TRP 211 CO -0.00 -0.05 0.68 0.34 0.02 0.00 0.00 176.95 177.94 1gg2 s ASP 212 N -0.40 6.43 0.15 2.95 -1.08 0.58 -1.77 116.67 123.52 1gg2 s ASP 212 Ca 0.06 0.06 -0.22 0.00 -0.52 0.00 0.00 52.55 51.93 1gg2 s ASP 212 Cb -0.08 -2.35 0.04 0.00 -1.46 0.00 0.00 42.92 39.07 1gg2 s ASP 212 CO -0.00 -0.70 1.63 0.58 0.52 0.00 0.00 175.17 177.20 1gg2 h VAL 213 N 5.77 0.42 -0.04 1.11 2.07 -1.77 1.93 116.25 125.74 1gg2 h VAL 213 Ca -0.26 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.18 1gg2 h VAL 213 Cb 1.10 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1gg2 h VAL 213 CO 0.88 0.00 -0.36 -0.09 0.02 0.00 0.00 177.57 178.01 1gg2 h ARG 214 N -0.22 0.09 0.00 1.57 9.65 -1.92 -2.88 114.38 120.67 1gg2 h ARG 214 Ca 0.14 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 1gg2 h ARG 214 Cb 0.44 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.02 1gg2 h ARG 214 CO -0.39 0.44 -1.11 0.39 2.80 0.00 0.00 179.97 182.10 1gg2 n GLU 215 N -4.09 0.47 -2.66 0.20 -0.58 -0.76 -4.96 120.64 108.27 1gg2 n GLU 215 Ca -0.02 0.03 -0.19 0.00 -0.42 0.00 0.00 57.16 56.57 1gg2 n GLU 215 Cb 0.42 -1.69 0.00 0.00 -0.57 0.00 0.00 31.44 29.60 1gg2 n GLU 215 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1gg2 n GLY 216 N 1.27 -0.50 3.29 0.62 0.00 0.65 -4.95 105.19 105.56 1gg2 n GLY 216 Ca 0.00 0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 1gg2 n GLY 216 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1gg2 s MET 217 N -5.29 1.15 -0.29 1.61 -1.94 -1.20 -4.76 119.30 108.58 1gg2 s MET 217 Ca 0.11 -1.34 -0.22 0.00 -1.71 0.00 0.00 55.69 52.53 1gg2 s MET 217 Cb -0.05 -1.09 -0.01 0.00 2.01 0.00 0.00 34.83 35.69 1gg2 s MET 217 CO 0.14 0.21 0.71 0.00 -0.01 0.00 0.00 175.02 176.07 1gg2 n ARG 219 N 5.98 0.00 -3.79 0.00 1.74 0.43 -4.97 116.66 116.06 1gg2 n ARG 219 Ca 0.02 0.13 -0.23 0.00 -0.77 0.00 0.00 57.85 57.00 1gg2 n ARG 219 Cb 0.48 -0.80 -0.04 0.00 -1.02 0.00 0.00 32.46 31.08 1gg2 n ARG 219 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1gg2 s GLN 220 N -0.68 2.40 -0.09 5.56 -0.21 -1.23 -4.96 119.66 120.44 1gg2 s GLN 220 Ca 0.00 -1.69 -0.03 0.00 0.02 0.00 0.00 55.36 53.65 1gg2 s GLN 220 Cb 0.00 -2.21 0.05 0.00 1.00 0.00 0.00 33.01 31.84 1gg2 s GLN 220 CO 0.00 -0.21 0.11 0.99 -2.12 0.00 0.00 175.29 174.06 1gg2 s THR 221 N -2.55 -0.17 -0.23 -0.19 2.01 -1.26 -1.75 115.64 111.49 1gg2 s THR 221 Ca 0.44 0.25 -0.09 0.00 0.31 0.00 0.00 61.69 62.61 1gg2 s THR 221 Cb -0.01 -0.32 -0.04 0.00 0.01 0.00 0.00 72.50 72.14 1gg2 s THR 221 CO 0.25 0.05 0.11 -0.36 -0.69 0.00 0.00 174.62 173.99 1gg2 s PHE 222 N 2.22 3.21 0.45 4.92 0.40 -0.61 -4.95 117.98 123.61 1gg2 s PHE 222 Ca 0.04 -0.02 0.06 0.00 -0.60 0.00 0.00 56.93 56.41 1gg2 s PHE 222 Cb -0.13 -2.23 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 1gg2 s PHE 222 CO -0.06 -0.07 0.11 0.95 0.70 0.00 0.00 175.22 176.85 1gg2 s THR 223 N 1.16 1.86 0.00 0.64 -4.23 -1.26 0.17 115.64 113.99 1gg2 s THR 223 Ca 0.06 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 58.73 1gg2 s THR 223 Cb -0.14 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 71.00 1gg2 s THR 223 CO 0.04 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 1gg2 n GLY 224 N -1.22 1.94 3.73 3.99 0.00 -1.26 -4.77 105.19 107.60 1gg2 n GLY 224 Ca -0.07 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1gg2 n GLY 224 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1gg2 s HIS 225 N 0.00 3.52 -2.06 1.61 3.76 -1.24 -4.92 115.29 115.96 1gg2 s HIS 225 Ca 0.00 1.49 0.16 0.00 -0.15 0.00 0.00 55.06 56.56 1gg2 s HIS 225 Cb 0.00 -3.34 0.87 0.00 1.11 0.00 0.00 32.58 31.22 1gg2 s HIS 225 CO 0.00 -0.88 1.57 0.39 -0.85 0.00 0.00 174.74 174.97 1gg2 n GLU 226 N 2.91 1.18 -3.71 1.40 1.02 -1.26 -4.73 120.64 117.45 1gg2 n GLU 226 Ca 0.05 -0.27 -0.07 0.00 -0.02 0.00 0.00 57.16 56.85 1gg2 n GLU 226 Cb 0.46 -1.27 0.03 0.00 -0.02 0.00 0.00 31.44 30.63 1gg2 n GLU 226 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1gg2 n SER 227 N -0.48 -2.12 -4.29 1.62 2.88 -1.26 -4.91 113.62 105.06 1gg2 n SER 227 Ca 0.13 -2.40 -0.38 0.00 -1.33 0.00 0.00 58.87 54.89 1gg2 n SER 227 Cb 0.12 3.51 0.04 0.00 -0.75 0.00 0.00 64.21 67.12 1gg2 n SER 227 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1gg2 n ASP 228 N -1.47 -3.14 -4.26 -3.46 8.00 -1.26 -3.95 116.55 107.01 1gg2 n ASP 228 Ca -0.07 0.56 -0.34 0.00 0.71 0.00 0.00 54.79 55.64 1gg2 n ASP 228 Cb 0.57 -0.97 -0.15 0.00 -0.02 0.00 0.00 41.12 40.56 1gg2 n ASP 228 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1gg2 s ILE 229 N -1.95 2.96 -0.16 0.53 1.01 -0.63 -1.46 121.20 121.50 1gg2 s ILE 229 Ca 0.57 -0.64 0.15 0.00 0.00 0.00 0.00 60.65 60.74 1gg2 s ILE 229 Cb -0.39 -2.31 -0.21 0.00 0.01 0.00 0.00 42.46 39.56 1gg2 s ILE 229 CO 0.66 0.47 0.06 0.59 0.00 0.00 0.00 174.94 176.72 1gg2 n ASN 230 N 4.61 0.85 -4.17 3.58 3.02 -0.16 -3.84 115.26 119.15 1gg2 n ASN 230 Ca -0.19 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.18 1gg2 n ASN 230 Cb 0.51 0.93 -0.12 0.00 -0.61 0.00 0.00 39.78 40.49 1gg2 n ASN 230 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gg2 s ALA 231 N -2.42 1.15 -0.06 5.41 0.00 -1.14 -4.09 121.76 120.60 1gg2 s ALA 231 Ca -0.08 -1.00 -0.10 0.00 0.00 0.00 0.00 51.96 50.77 1gg2 s ALA 231 Cb 0.05 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.11 1gg2 s ALA 231 CO 0.69 0.14 0.25 -1.50 0.00 0.00 0.00 175.76 175.35 1gg2 s ILE 232 N -1.36 0.03 -0.16 0.00 2.07 -1.26 -0.37 121.20 120.14 1gg2 s ILE 232 Ca -0.02 -0.22 -0.15 0.00 -1.41 0.00 0.00 60.65 58.85 1gg2 s ILE 232 Cb -0.10 -0.44 0.04 0.00 0.13 0.00 0.00 42.46 42.10 1gg2 s ILE 232 CO 0.02 -0.12 0.43 0.00 -1.91 0.00 0.00 174.94 173.36 1gg2 s PHE 234 N 0.28 3.94 0.29 0.00 0.08 -1.26 0.95 117.98 122.27 1gg2 s PHE 234 Ca -0.00 1.81 -0.29 0.00 0.12 0.00 0.00 56.93 58.56 1gg2 s PHE 234 Cb -0.03 -2.91 -0.10 0.00 -0.57 0.00 0.00 43.02 39.40 1gg2 s PHE 234 CO -0.00 0.45 1.34 0.12 -0.10 0.00 0.00 175.22 177.03 1gg2 s PHE 235 N -1.04 3.08 0.51 0.36 5.36 0.28 -4.79 117.98 121.73 1gg2 s PHE 235 Ca 0.40 1.30 0.42 0.00 -0.96 0.00 0.00 56.93 58.09 1gg2 s PHE 235 Cb -0.25 -3.70 1.63 0.00 -0.34 0.00 0.00 43.02 40.36 1gg2 s PHE 235 CO 0.30 -2.03 1.59 -1.00 -1.46 0.00 0.00 175.22 172.62 1gg2 h PRO 236 N 4.06 0.01 0.00 10.12 0.13 -1.89 0.31 132.00 144.74 1gg2 h PRO 236 Ca -0.48 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1gg2 h PRO 236 Cb 1.22 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1gg2 h PRO 236 CO 0.70 0.01 0.00 0.27 -0.23 0.00 0.00 178.00 178.75 1gg2 n ASN 237 N -4.27 0.74 0.00 1.44 0.23 -1.26 -4.84 115.26 107.30 1gg2 n ASN 237 Ca 0.41 0.57 0.00 0.00 -0.53 0.00 0.00 54.58 55.04 1gg2 n ASN 237 Cb 1.78 -0.77 0.00 0.00 -2.08 0.00 0.00 39.78 38.71 1gg2 n ASN 237 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1gg2 n GLY 238 N 1.29 0.77 0.96 4.83 0.00 0.11 -4.91 105.19 108.24 1gg2 n GLY 238 Ca 0.06 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.15 1gg2 n GLY 238 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gg2 n ASN 239 N 0.00 3.72 -3.53 1.61 5.03 -1.26 -4.95 115.26 115.88 1gg2 n ASN 239 Ca 0.00 -2.49 -0.10 0.00 0.87 0.00 0.00 54.58 52.86 1gg2 n ASN 239 Cb 0.00 -0.43 -0.02 0.00 -1.02 0.00 0.00 39.78 38.31 1gg2 n ASN 239 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1gg2 s ALA 240 N -1.89 -1.59 0.06 5.41 0.00 -1.26 -1.51 121.76 120.98 1gg2 s ALA 240 Ca 0.37 0.46 -0.17 0.00 0.00 0.00 0.00 51.96 52.61 1gg2 s ALA 240 Cb 0.25 0.76 0.03 0.00 0.00 0.00 0.00 23.12 24.17 1gg2 s ALA 240 CO 0.15 -0.81 0.39 -0.59 0.00 0.00 0.00 175.76 174.90 1gg2 s PHE 241 N -3.60 -0.23 0.03 0.00 -0.12 -0.86 0.10 117.98 113.30 1gg2 s PHE 241 Ca 0.04 0.10 0.05 0.00 -0.05 0.00 0.00 56.93 57.08 1gg2 s PHE 241 Cb -0.02 0.21 -0.03 0.00 -0.63 0.00 0.00 43.02 42.55 1gg2 s PHE 241 CO -0.08 -0.60 -0.10 0.00 -0.05 0.00 0.00 175.22 174.39 1gg2 s ALA 242 N -2.83 2.89 0.01 1.99 0.00 0.27 -0.79 121.76 123.30 1gg2 s ALA 242 Ca -0.03 -1.10 0.06 0.00 0.00 0.00 0.00 51.96 50.89 1gg2 s ALA 242 Cb -0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 23.12 22.12 1gg2 s ALA 242 CO -0.05 0.61 -0.20 0.95 0.00 0.00 0.00 175.76 177.07 1gg2 s THR 243 N -1.01 1.59 -0.15 0.00 -4.23 -0.35 -0.24 115.64 111.25 1gg2 s THR 243 Ca 0.17 -0.97 -0.02 0.00 -1.18 0.00 0.00 61.69 59.69 1gg2 s THR 243 Cb -0.11 -1.35 -0.02 0.00 1.34 0.00 0.00 72.50 72.36 1gg2 s THR 243 CO 0.08 0.36 -0.07 -0.83 -0.54 0.00 0.00 174.62 173.61 1gg2 s GLY 244 N -0.72 1.65 0.25 3.99 0.00 0.50 -1.37 107.32 111.61 1gg2 s GLY 244 Ca 0.07 -0.86 0.06 0.00 0.00 0.00 0.00 44.72 44.00 1gg2 s GLY 244 CO 0.00 -0.09 -0.07 -0.45 0.00 0.00 0.00 173.10 172.49 1gg2 s SER 245 N 0.40 2.50 0.47 1.64 0.15 -0.67 -0.99 113.70 117.20 1gg2 s SER 245 Ca -0.06 -1.15 0.19 0.00 0.70 0.00 0.00 55.95 55.64 1gg2 s SER 245 Cb -0.15 -0.12 1.17 0.00 -1.71 0.00 0.00 66.02 65.22 1gg2 s SER 245 CO 0.04 -0.33 2.02 0.44 1.20 0.00 0.00 173.24 176.60 1gg2 h ASP 246 N 2.41 0.00 0.00 5.45 3.32 -1.48 -1.47 116.42 124.65 1gg2 h ASP 246 Ca -0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1gg2 h ASP 246 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1gg2 h ASP 246 CO 0.65 0.17 0.00 -0.90 -1.72 0.00 0.00 179.24 177.44 1gg2 n ASP 247 N -4.04 1.63 0.00 6.45 5.75 -1.26 -3.81 116.55 121.26 1gg2 n ASP 247 Ca -0.02 -1.23 0.00 0.00 -0.01 0.00 0.00 54.79 53.53 1gg2 n ASP 247 Cb 0.25 -0.31 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 1gg2 n ASP 247 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gg2 n ALA 248 N 0.61 0.00 -2.54 2.12 0.00 -1.11 -4.94 120.51 114.64 1gg2 n ALA 248 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 1gg2 n ALA 248 Cb 0.28 -1.04 -0.09 0.00 0.00 0.00 0.00 19.45 18.60 1gg2 n ALA 248 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1gg2 s THR 249 N -1.20 2.75 0.05 0.00 -4.23 -1.26 -4.76 115.64 106.99 1gg2 s THR 249 Ca 0.00 -2.17 0.09 0.00 -1.18 0.00 0.00 61.69 58.43 1gg2 s THR 249 Cb 0.00 -2.57 -0.03 0.00 1.34 0.00 0.00 72.50 71.24 1gg2 s THR 249 CO 0.00 -0.34 -0.26 0.00 -0.54 0.00 0.00 174.62 173.48 1gg2 s ARG 251 N -1.25 0.21 -0.12 0.00 0.52 -0.47 -0.15 118.95 117.68 1gg2 s ARG 251 Ca 0.12 0.01 -0.14 0.00 -0.52 0.00 0.00 55.73 55.20 1gg2 s ARG 251 Cb -0.10 -0.32 -0.05 0.00 0.52 0.00 0.00 34.95 35.01 1gg2 s ARG 251 CO 0.02 -0.05 0.32 -1.17 0.02 0.00 0.00 175.30 174.44 1gg2 s LEU 252 N 0.52 4.31 -0.02 2.53 2.96 -0.24 -1.21 118.68 127.53 1gg2 s LEU 252 Ca -0.05 0.63 0.06 0.00 -0.22 0.00 0.00 54.13 54.56 1gg2 s LEU 252 Cb -0.08 -2.42 -0.02 0.00 0.50 0.00 0.00 46.19 44.18 1gg2 s LEU 252 CO -0.01 0.17 -0.21 -0.36 -1.32 0.00 0.00 176.35 174.61 1gg2 s PHE 253 N 0.01 1.91 -0.16 5.38 0.40 0.03 -0.15 117.98 125.39 1gg2 s PHE 253 Ca 0.19 -0.38 -0.09 0.00 -0.60 0.00 0.00 56.93 56.06 1gg2 s PHE 253 Cb -0.14 -1.23 -0.05 0.00 0.51 0.00 0.00 43.02 42.11 1gg2 s PHE 253 CO 0.07 -0.04 0.13 0.34 0.70 0.00 0.00 175.22 176.41 1gg2 s ASP 254 N -0.47 6.26 -0.01 1.36 -1.08 0.15 -2.03 116.67 120.86 1gg2 s ASP 254 Ca 0.07 0.33 -0.25 0.00 -0.52 0.00 0.00 52.55 52.18 1gg2 s ASP 254 Cb -0.08 -2.07 -0.18 0.00 -1.46 0.00 0.00 42.92 39.12 1gg2 s ASP 254 CO -0.01 0.28 1.24 -0.07 0.52 0.00 0.00 175.17 177.14 1gg2 h LEU 255 N 5.95 -0.15 -0.79 -1.34 3.38 -1.57 -1.62 115.31 119.17 1gg2 h LEU 255 Ca -0.47 -0.32 -0.07 0.00 0.09 0.00 0.00 57.88 57.12 1gg2 h LEU 255 Cb 1.18 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 1gg2 h LEU 255 CO 0.68 0.26 0.14 0.03 0.09 0.00 0.00 178.44 179.64 1gg2 h ARG 256 N -0.59 1.05 -0.08 1.13 3.08 -1.96 -1.82 114.38 115.20 1gg2 h ARG 256 Ca -0.02 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.78 1gg2 h ARG 256 Cb 0.46 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1gg2 h ARG 256 CO 0.03 0.94 0.00 0.00 -1.07 0.00 0.00 179.97 179.88 1gg2 n ALA 257 N -2.46 2.57 -4.22 0.04 0.00 -1.25 -4.94 120.51 110.25 1gg2 n ALA 257 Ca 0.05 -0.34 -0.34 0.00 0.00 0.00 0.00 53.44 52.81 1gg2 n ALA 257 Cb 0.26 -1.20 -0.07 0.00 0.00 0.00 0.00 19.45 18.44 1gg2 n ALA 257 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1gg2 n ASP 258 N -0.20 -0.20 -3.61 0.00 2.03 -0.68 -4.91 116.55 108.98 1gg2 n ASP 258 Ca 0.16 -1.25 -0.01 0.00 0.52 0.00 0.00 54.79 54.21 1gg2 n ASP 258 Cb 0.21 -1.54 -0.01 0.00 -0.72 0.00 0.00 41.12 39.07 1gg2 n ASP 258 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1gg2 s GLN 259 N -7.29 0.35 0.42 -0.67 -2.07 -0.73 -4.91 119.66 104.76 1gg2 s GLN 259 Ca 0.11 -0.17 -0.26 0.00 -1.82 0.00 0.00 55.36 53.23 1gg2 s GLN 259 Cb -0.06 0.13 -0.08 0.00 -1.09 0.00 0.00 33.01 31.91 1gg2 s GLN 259 CO 0.96 -0.16 1.32 -2.00 -1.32 0.00 0.00 175.29 174.10 1gg2 s GLU 260 N -2.41 3.87 -0.06 9.60 2.12 -1.26 0.29 118.70 130.85 1gg2 s GLU 260 Ca 0.12 2.19 0.03 0.00 0.36 0.00 0.00 54.97 57.67 1gg2 s GLU 260 Cb 0.02 -2.70 -0.06 0.00 0.26 0.00 0.00 34.13 31.65 1gg2 s GLU 260 CO -0.04 -0.59 -0.03 1.28 -0.54 0.00 0.00 175.26 175.35 1gg2 n LEU 261 N -0.01 1.64 -3.72 2.70 4.77 0.78 -4.79 117.00 118.38 1gg2 n LEU 261 Ca 0.04 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.89 1gg2 n LEU 261 Cb 0.43 -0.08 -0.07 0.00 -2.33 0.00 0.00 43.42 41.38 1gg2 n LEU 261 CO 0.56 0.40 0.07 -0.32 -1.33 0.00 0.00 177.39 176.77 1gg2 s MET 262 N -2.14 0.88 -0.07 3.23 0.00 -1.08 -4.29 119.30 115.83 1gg2 s MET 262 Ca -0.07 -0.53 0.03 0.00 0.00 0.00 0.00 55.69 55.13 1gg2 s MET 262 Cb 0.02 0.38 0.01 0.00 0.00 0.00 0.00 34.83 35.24 1gg2 s MET 262 CO 0.19 -0.30 -0.16 0.99 0.00 0.00 0.00 175.02 175.75 1gg2 s THR 263 N -2.79 1.39 -0.33 10.11 2.01 -1.26 -1.08 115.64 123.69 1gg2 s THR 263 Ca -0.03 -0.64 -0.06 0.00 0.31 0.00 0.00 61.69 61.27 1gg2 s THR 263 Cb -0.00 -1.24 0.04 0.00 0.01 0.00 0.00 72.50 71.31 1gg2 s THR 263 CO -0.05 0.41 0.09 -0.31 -0.69 0.00 0.00 174.62 174.07 1gg2 s TYR 264 N 0.48 3.24 0.18 4.92 1.51 0.78 -4.94 117.35 123.54 1gg2 s TYR 264 Ca -0.14 -1.44 -0.19 0.00 -1.01 0.00 0.00 57.07 54.29 1gg2 s TYR 264 Cb -0.16 -2.25 0.04 0.00 -0.11 0.00 0.00 41.96 39.48 1gg2 s TYR 264 CO 0.05 -0.73 0.54 -1.54 -1.11 0.00 0.00 175.55 172.76 1gg2 s SER 265 N 1.39 -0.33 -0.15 2.29 1.04 -1.26 -1.56 113.70 115.12 1gg2 s SER 265 Ca -0.02 -0.36 -0.12 0.00 0.48 0.00 0.00 55.95 55.93 1gg2 s SER 265 Cb -0.19 0.58 0.04 0.00 0.10 0.00 0.00 66.02 66.55 1gg2 s SER 265 CO 0.02 -1.03 0.38 -2.28 0.98 0.00 0.00 173.24 171.32 1gg2 s HIS 266 N -3.84 -0.46 0.63 5.02 5.04 -1.26 -5.02 115.29 115.40 1gg2 s HIS 266 Ca 0.07 1.08 -0.18 0.00 -1.54 0.00 0.00 55.06 54.48 1gg2 s HIS 266 Cb -0.01 0.17 -0.02 0.00 0.04 0.00 0.00 32.58 32.76 1gg2 s HIS 266 CO -0.06 -0.24 1.25 -0.51 -2.34 0.00 0.00 174.74 172.85 1gg2 s ASP 267 N 0.55 4.83 -0.31 9.88 1.01 -1.26 -2.86 116.67 128.50 1gg2 s ASP 267 Ca -0.03 2.50 -0.01 0.00 0.71 0.00 0.00 52.55 55.73 1gg2 s ASP 267 Cb -0.04 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.28 1gg2 s ASP 267 CO -0.03 -1.85 0.08 0.59 0.21 0.00 0.00 175.17 174.18 1gg2 n ASN 268 N -1.83 -2.27 -3.15 0.27 4.13 -1.26 -4.99 115.26 106.17 1gg2 n ASN 268 Ca 0.15 -0.04 0.01 0.00 1.68 0.00 0.00 54.58 56.37 1gg2 n ASN 268 Cb 0.49 -1.34 -0.01 0.00 -1.54 0.00 0.00 39.78 37.38 1gg2 n ASN 268 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1gg2 s ILE 269 N -2.52 -0.97 -0.08 2.41 1.01 -1.14 -5.03 121.20 114.88 1gg2 s ILE 269 Ca 0.04 -0.10 0.12 0.00 0.00 0.00 0.00 60.65 60.71 1gg2 s ILE 269 Cb -0.02 0.00 0.19 0.00 0.01 0.00 0.00 42.46 42.64 1gg2 s ILE 269 CO 0.05 0.00 1.08 -0.38 0.00 0.00 0.00 174.94 175.69 1gg2 n ILE 270 N 4.23 1.47 -3.30 2.92 5.41 -1.26 -4.68 119.36 124.15 1gg2 n ILE 270 Ca 0.12 -1.71 -0.24 0.00 1.00 0.00 0.00 62.75 61.92 1gg2 n ILE 270 Cb 0.57 0.04 -0.01 0.00 -0.71 0.00 0.00 39.64 39.53 1gg2 n ILE 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1gg2 s GLY 272 N -4.07 1.65 -0.12 0.00 0.00 -1.25 -3.74 107.32 99.79 1gg2 s GLY 272 Ca 0.42 0.03 -0.07 0.00 0.00 0.00 0.00 44.72 45.10 1gg2 s GLY 272 CO 0.36 0.39 0.13 -0.42 0.00 0.00 0.00 173.10 173.56 1gg2 s ILE 273 N -3.04 5.39 -0.11 0.90 1.09 -0.57 -1.49 121.20 123.38 1gg2 s ILE 273 Ca 0.60 0.17 0.09 0.00 -1.10 0.00 0.00 60.65 60.41 1gg2 s ILE 273 Cb -0.15 -3.34 -0.13 0.00 -1.06 0.00 0.00 42.46 37.77 1gg2 s ILE 273 CO 0.55 0.62 0.25 0.35 -0.10 0.00 0.00 174.94 176.60 1gg2 n THR 274 N 2.03 0.00 -3.62 2.92 -2.24 0.22 -4.27 114.28 109.32 1gg2 n THR 274 Ca -0.20 -0.23 -0.16 0.00 -2.27 0.00 0.00 64.05 61.19 1gg2 n THR 274 Cb 0.55 0.45 -0.07 0.00 -2.10 0.00 0.00 70.33 69.16 1gg2 n THR 274 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1gg2 s SER 275 N -2.80 -0.49 -0.00 3.42 1.04 -1.18 -4.26 113.70 109.43 1gg2 s SER 275 Ca -0.02 0.52 0.00 0.00 0.48 0.00 0.00 55.95 56.94 1gg2 s SER 275 Cb 0.06 0.50 -0.00 0.00 0.10 0.00 0.00 66.02 66.68 1gg2 s SER 275 CO 0.38 -0.53 -0.01 0.68 0.98 0.00 0.00 173.24 174.75 1gg2 s VAL 276 N -1.14 0.08 0.01 5.02 -7.23 -1.25 0.96 120.40 116.85 1gg2 s VAL 276 Ca -0.11 -0.04 -0.12 0.00 -1.81 0.00 0.00 61.98 59.89 1gg2 s VAL 276 Cb -0.02 -0.08 0.01 0.00 0.56 0.00 0.00 36.38 36.85 1gg2 s VAL 276 CO 0.07 0.03 0.26 -0.55 -0.31 0.00 0.00 175.10 174.60 1gg2 s SER 277 N -0.01 -0.09 0.07 4.85 0.15 0.17 -4.58 113.70 114.26 1gg2 s SER 277 Ca 0.00 -0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.55 1gg2 s SER 277 Cb -0.01 0.30 -0.04 0.00 -1.71 0.00 0.00 66.02 64.56 1gg2 s SER 277 CO -0.00 -0.50 0.14 -0.36 1.20 0.00 0.00 173.24 173.72 1gg2 s PHE 278 N -1.88 3.35 0.55 3.44 0.08 -1.26 0.39 117.98 122.65 1gg2 s PHE 278 Ca -0.10 0.16 -0.17 0.00 0.12 0.00 0.00 56.93 56.94 1gg2 s PHE 278 Cb -0.04 -1.69 -0.05 0.00 -0.57 0.00 0.00 43.02 40.67 1gg2 s PHE 278 CO 0.00 0.55 1.05 -1.54 -0.10 0.00 0.00 175.22 175.19 1gg2 s SER 279 N -2.44 6.01 0.56 1.36 1.04 -0.14 -4.81 113.70 115.28 1gg2 s SER 279 Ca 0.32 1.85 0.39 0.00 0.48 0.00 0.00 55.95 58.99 1gg2 s SER 279 Cb -0.13 -2.54 1.51 0.00 0.10 0.00 0.00 66.02 64.97 1gg2 s SER 279 CO 0.25 -1.01 1.65 0.50 0.98 0.00 0.00 173.24 175.61 1gg2 h LYS 280 N 0.85 0.00 0.00 4.02 3.64 -1.89 0.61 116.57 123.80 1gg2 h LYS 280 Ca -0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1gg2 h LYS 280 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 1gg2 h LYS 280 CO 0.58 0.00 -1.01 -1.13 -2.27 0.00 0.00 179.45 175.62 1gg2 n SER 281 N -3.89 0.63 0.00 4.20 3.41 -1.26 -4.92 113.62 111.79 1gg2 n SER 281 Ca 0.30 -0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 1gg2 n SER 281 Cb 1.52 0.70 0.00 0.00 -0.26 0.00 0.00 64.21 66.17 1gg2 n SER 281 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gg2 n GLY 282 N 1.33 0.70 0.13 5.00 0.00 0.21 -4.91 105.19 107.65 1gg2 n GLY 282 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 1gg2 n GLY 282 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1gg2 h ARG 283 N 4.08 0.33 -5.79 1.61 9.65 -1.93 -3.42 114.38 118.90 1gg2 h ARG 283 Ca 0.00 -0.33 -0.65 0.00 -1.10 0.00 0.00 59.98 57.91 1gg2 h ARG 283 Cb 0.00 0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 28.60 1gg2 h ARG 283 CO 0.00 1.01 -0.38 -0.51 2.80 0.00 0.00 179.97 182.89 1gg2 s LEU 284 N -8.48 4.42 -0.20 3.80 1.43 -1.26 0.33 118.68 118.71 1gg2 s LEU 284 Ca -0.14 0.65 -0.01 0.00 -1.03 0.00 0.00 54.13 53.60 1gg2 s LEU 284 Cb 0.03 -2.30 0.01 0.00 0.03 0.00 0.00 46.19 43.97 1gg2 s LEU 284 CO 0.79 0.37 -0.13 -0.22 0.23 0.00 0.00 176.35 177.39 1gg2 s LEU 285 N -1.10 2.55 -0.24 1.79 2.96 0.18 -0.97 118.68 123.85 1gg2 s LEU 285 Ca 0.19 -0.62 -0.10 0.00 -0.22 0.00 0.00 54.13 53.38 1gg2 s LEU 285 Cb -0.14 -1.59 -0.05 0.00 0.50 0.00 0.00 46.19 44.92 1gg2 s LEU 285 CO 0.08 -0.03 0.14 -0.76 -1.32 0.00 0.00 176.35 174.47 1gg2 s LEU 286 N 1.35 4.02 -0.10 -0.68 1.43 0.16 0.09 118.68 124.95 1gg2 s LEU 286 Ca 0.04 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 1gg2 s LEU 286 Cb -0.14 -2.08 0.02 0.00 0.03 0.00 0.00 46.19 44.02 1gg2 s LEU 286 CO -0.09 0.06 -0.12 0.00 0.23 0.00 0.00 176.35 176.43 1gg2 s ALA 287 N 1.08 1.45 -0.13 4.21 0.00 0.42 0.45 121.76 129.25 1gg2 s ALA 287 Ca 0.07 -0.58 -0.27 0.00 0.00 0.00 0.00 51.96 51.18 1gg2 s ALA 287 Cb -0.14 -0.77 -0.02 0.00 0.00 0.00 0.00 23.12 22.19 1gg2 s ALA 287 CO 0.04 -0.12 0.89 0.20 0.00 0.00 0.00 175.76 176.78 1gg2 s GLY 288 N 1.09 2.30 0.18 0.00 0.00 0.27 -0.16 107.32 111.00 1gg2 s GLY 288 Ca -0.06 0.20 0.06 0.00 0.00 0.00 0.00 44.72 44.92 1gg2 s GLY 288 CO -0.02 1.70 0.13 -0.19 0.00 0.00 0.00 173.10 174.73 1gg2 s TYR 289 N 1.88 3.11 0.43 1.90 1.51 0.15 0.72 117.35 127.05 1gg2 s TYR 289 Ca 0.43 -0.05 0.11 0.00 -1.01 0.00 0.00 57.07 56.55 1gg2 s TYR 289 Cb -0.18 -1.48 0.98 0.00 -0.11 0.00 0.00 41.96 41.18 1gg2 s TYR 289 CO 0.16 0.52 2.04 -0.44 -1.11 0.00 0.00 175.55 176.72 1gg2 h ASP 290 N 2.26 0.37 0.00 2.29 3.32 -1.52 -2.80 116.42 120.34 1gg2 h ASP 290 Ca -0.48 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1gg2 h ASP 290 Cb 1.21 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1gg2 h ASP 290 CO 0.62 0.25 0.00 -0.90 -1.72 0.00 0.00 179.24 177.49 1gg2 n ASP 291 N -4.48 2.29 0.00 6.45 5.68 -1.26 -3.92 116.55 121.31 1gg2 n ASP 291 Ca 0.05 -1.57 0.00 0.00 -0.50 0.00 0.00 54.79 52.77 1gg2 n ASP 291 Cb 0.19 -0.39 0.00 0.00 -1.14 0.00 0.00 41.12 39.77 1gg2 n ASP 291 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1gg2 n PHE 292 N 0.58 0.00 -3.92 2.11 3.72 -1.12 -4.93 117.46 113.90 1gg2 n PHE 292 Ca 0.00 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.12 1gg2 n PHE 292 Cb 0.38 -0.27 -0.03 0.00 -0.94 0.00 0.00 39.48 38.62 1gg2 n PHE 292 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1gg2 s ASN 293 N -2.85 6.35 -0.24 4.37 0.01 -1.25 -4.18 114.94 117.16 1gg2 s ASN 293 Ca 0.00 0.22 -0.04 0.00 -0.71 0.00 0.00 52.86 52.33 1gg2 s ASN 293 Cb 0.00 -1.93 -0.00 0.00 0.41 0.00 0.00 41.25 39.72 1gg2 s ASN 293 CO 0.00 0.09 -0.03 0.00 -1.51 0.00 0.00 177.10 175.66 1gg2 s ASN 295 N 1.46 6.57 -0.25 0.00 0.01 0.77 0.55 114.94 124.06 1gg2 s ASN 295 Ca 0.04 0.68 -0.06 0.00 -0.71 0.00 0.00 52.86 52.81 1gg2 s ASN 295 Cb -0.15 -2.18 -0.02 0.00 0.41 0.00 0.00 41.25 39.31 1gg2 s ASN 295 CO -0.03 0.27 0.04 -0.69 -1.51 0.00 0.00 177.10 175.18 1gg2 s VAL 296 N -0.55 3.98 0.28 1.60 1.01 -0.95 -0.44 120.40 125.34 1gg2 s VAL 296 Ca 0.19 -0.36 0.09 0.00 0.00 0.00 0.00 61.98 61.91 1gg2 s VAL 296 Cb -0.14 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 1gg2 s VAL 296 CO 0.08 0.32 0.01 0.26 0.00 0.00 0.00 175.10 175.77 1gg2 s TRP 297 N 1.56 2.67 -0.39 5.22 0.52 0.11 0.86 118.94 129.49 1gg2 s TRP 297 Ca 0.06 -0.27 -0.25 0.00 0.02 0.00 0.00 56.10 55.66 1gg2 s TRP 297 Cb -0.15 -1.28 0.02 0.00 -1.15 0.00 0.00 33.47 30.90 1gg2 s TRP 297 CO 0.01 0.57 0.86 0.34 0.02 0.00 0.00 176.95 178.75 1gg2 s ASP 298 N -3.70 6.57 0.47 2.95 -1.08 0.19 -0.65 116.67 121.43 1gg2 s ASP 298 Ca 0.33 0.35 0.32 0.00 -0.52 0.00 0.00 52.55 53.03 1gg2 s ASP 298 Cb -0.05 -2.43 1.59 0.00 -1.46 0.00 0.00 42.92 40.57 1gg2 s ASP 298 CO 0.20 -0.86 1.97 0.00 0.52 0.00 0.00 175.17 177.00 1gg2 h ALA 299 N 8.64 1.00 0.00 3.66 0.00 0.51 0.40 119.26 133.46 1gg2 h ALA 299 Ca -0.24 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.28 1gg2 h ALA 299 Cb 1.08 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 1gg2 h ALA 299 CO 0.96 0.00 -2.45 1.28 0.00 0.00 0.00 179.25 179.05 1gg2 n LEU 300 N -2.69 2.73 0.07 0.00 4.77 -1.26 -4.64 117.00 115.99 1gg2 n LEU 300 Ca -0.01 -0.03 0.04 0.00 -0.03 0.00 0.00 56.01 55.99 1gg2 n LEU 300 Cb 0.14 -0.86 -0.04 0.00 -2.33 0.00 0.00 43.42 40.33 1gg2 n LEU 300 CO 0.18 0.84 -0.09 0.11 -1.33 0.00 0.00 177.39 177.11 1gg2 h LYS 301 N -0.22 0.00 0.00 3.23 1.79 -1.91 -3.42 116.57 116.04 1gg2 h LYS 301 Ca -0.59 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.88 1gg2 h LYS 301 Cb 1.81 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.46 1gg2 h LYS 301 CO -0.16 0.20 0.00 0.00 -1.08 0.00 0.00 179.45 178.40 1gg2 n ALA 302 N -2.30 0.00 -2.90 3.86 0.00 0.12 -5.00 120.51 114.29 1gg2 n ALA 302 Ca -0.05 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.18 1gg2 n ALA 302 Cb 0.72 -0.01 -0.02 0.00 0.00 0.00 0.00 19.45 20.15 1gg2 n ALA 302 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1gg2 s ASP 303 N -2.01 6.26 -0.58 0.00 1.47 -1.26 -4.64 116.67 115.92 1gg2 s ASP 303 Ca 0.00 0.03 -0.28 0.00 1.18 0.00 0.00 52.55 53.48 1gg2 s ASP 303 Cb 0.00 -1.77 0.01 0.00 -0.34 0.00 0.00 42.92 40.82 1gg2 s ASP 303 CO 0.00 -0.12 1.42 -0.13 0.68 0.00 0.00 175.17 177.02 1gg2 s ARG 304 N -4.00 3.27 0.51 2.11 0.52 -1.26 -0.63 118.95 119.47 1gg2 s ARG 304 Ca 0.35 0.41 0.34 0.00 -0.52 0.00 0.00 55.73 56.31 1gg2 s ARG 304 Cb -0.09 -4.14 1.53 0.00 0.52 0.00 0.00 34.95 32.77 1gg2 s ARG 304 CO 0.29 -1.98 2.01 0.00 0.02 0.00 0.00 175.30 175.64 1gg2 h ALA 305 N 11.10 1.00 0.00 2.13 0.00 0.21 -3.48 119.26 130.23 1gg2 h ALA 305 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1gg2 h ALA 305 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1gg2 h ALA 305 CO 1.19 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.85 1gg2 n GLY 306 N -0.30 -0.75 3.64 0.00 0.00 -1.03 -2.41 105.19 104.34 1gg2 n GLY 306 Ca -0.00 -1.00 -0.07 0.00 0.00 0.00 0.00 46.02 44.95 1gg2 n GLY 306 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gg2 s VAL 307 N -3.00 0.00 -0.47 1.61 0.11 -1.26 -2.23 120.40 115.16 1gg2 s VAL 307 Ca 0.00 0.00 -0.17 0.00 -2.93 0.00 0.00 61.98 58.88 1gg2 s VAL 307 Cb 0.00 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 33.90 1gg2 s VAL 307 CO 0.00 0.00 0.47 -0.76 -3.33 0.00 0.00 175.10 171.48 1gg2 s LEU 308 N 1.55 5.24 -0.22 2.54 1.43 0.19 -4.92 118.68 124.48 1gg2 s LEU 308 Ca -0.09 -1.04 -0.05 0.00 -1.03 0.00 0.00 54.13 51.92 1gg2 s LEU 308 Cb -0.05 -2.31 -0.01 0.00 0.03 0.00 0.00 46.19 43.85 1gg2 s LEU 308 CO -0.19 -0.70 -0.01 0.00 0.23 0.00 0.00 176.35 175.68 1gg2 s ALA 309 N 2.06 2.91 0.00 4.21 0.00 -1.26 -2.21 121.76 127.47 1gg2 s ALA 309 Ca 0.09 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.92 1gg2 s ALA 309 Cb -0.21 -1.78 0.00 0.00 0.00 0.00 0.00 23.12 21.13 1gg2 s ALA 309 CO 0.10 -0.39 0.10 0.41 0.00 0.00 0.00 175.76 175.98 1gg2 n GLY 310 N 4.72 0.29 3.34 0.00 0.00 -1.26 -5.04 105.19 107.24 1gg2 n GLY 310 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 1gg2 n GLY 310 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1gg2 s HIS 311 N 0.00 2.15 -0.13 1.61 3.76 -1.26 -5.04 115.29 116.37 1gg2 s HIS 311 Ca 0.00 -0.40 0.17 0.00 -0.15 0.00 0.00 55.06 54.69 1gg2 s HIS 311 Cb 0.00 -1.22 -0.13 0.00 1.11 0.00 0.00 32.58 32.34 1gg2 s HIS 311 CO 0.00 0.21 0.81 -0.25 -0.85 0.00 0.00 174.74 174.66 1gg2 n ASP 312 N 1.35 0.82 -4.68 1.40 8.00 -1.26 -4.84 116.55 117.34 1gg2 n ASP 312 Ca -0.18 0.36 -0.32 0.00 0.71 0.00 0.00 54.79 55.36 1gg2 n ASP 312 Cb 0.53 0.23 -0.06 0.00 -0.02 0.00 0.00 41.12 41.80 1gg2 n ASP 312 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1gg2 n ASN 313 N -2.86 3.35 -4.64 -2.24 2.85 -1.26 -4.94 115.26 105.52 1gg2 n ASN 313 Ca -0.09 -3.19 -0.36 0.00 -0.11 0.00 0.00 54.58 50.82 1gg2 n ASN 313 Cb 0.82 0.32 0.08 0.00 1.24 0.00 0.00 39.78 42.24 1gg2 n ASN 313 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 1gg2 n ARG 314 N -1.31 0.63 -2.85 1.20 1.85 -1.25 -4.12 116.66 110.81 1gg2 n ARG 314 Ca -0.19 0.27 -0.42 0.00 -1.00 0.00 0.00 57.85 56.50 1gg2 n ARG 314 Cb 0.64 -2.27 -0.04 0.00 -1.05 0.00 0.00 32.46 29.74 1gg2 n ARG 314 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1gg2 s VAL 315 N -1.72 4.71 -0.12 8.89 1.01 -1.07 -1.53 120.40 130.56 1gg2 s VAL 315 Ca 0.75 1.35 0.19 0.00 0.00 0.00 0.00 61.98 64.28 1gg2 s VAL 315 Cb -0.36 -4.23 -0.26 0.00 0.00 0.00 0.00 36.38 31.53 1gg2 s VAL 315 CO 0.48 -0.32 0.38 -1.54 0.00 0.00 0.00 175.10 174.10 1gg2 n SER 316 N 6.41 0.18 -3.80 3.32 3.41 -0.81 -4.35 113.62 117.97 1gg2 n SER 316 Ca 0.06 0.08 -0.12 0.00 -0.26 0.00 0.00 58.87 58.63 1gg2 n SER 316 Cb 0.48 1.20 -0.10 0.00 -0.26 0.00 0.00 64.21 65.53 1gg2 n SER 316 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gg2 s LEU 318 N -1.03 2.37 -0.30 0.00 1.43 -1.26 -0.44 118.68 119.45 1gg2 s LEU 318 Ca -0.11 -1.24 -0.19 0.00 -1.03 0.00 0.00 54.13 51.56 1gg2 s LEU 318 Cb -0.05 -0.52 0.19 0.00 0.03 0.00 0.00 46.19 45.84 1gg2 s LEU 318 CO 0.02 -0.44 1.25 -0.83 0.23 0.00 0.00 176.35 176.59 1gg2 s GLY 319 N -3.43 0.27 -0.19 -3.19 0.00 -0.16 -4.89 107.32 95.73 1gg2 s GLY 319 Ca 0.31 3.62 -0.06 0.00 0.00 0.00 0.00 44.72 48.59 1gg2 s GLY 319 CO 0.12 3.30 0.02 0.14 0.00 0.00 0.00 173.10 176.69 1gg2 s VAL 320 N 1.98 4.27 0.64 1.40 1.01 -1.26 0.16 120.40 128.60 1gg2 s VAL 320 Ca -0.01 -0.21 -0.17 0.00 0.00 0.00 0.00 61.98 61.59 1gg2 s VAL 320 Cb -0.01 -2.93 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 1gg2 s VAL 320 CO -0.16 0.44 0.78 0.35 0.00 0.00 0.00 175.10 176.51 1gg2 n THR 321 N 3.98 2.94 -0.18 3.92 -2.24 -0.18 -4.86 114.28 117.66 1gg2 n THR 321 Ca -0.17 -0.46 0.05 0.00 -2.27 0.00 0.00 64.05 61.20 1gg2 n THR 321 Cb 0.52 -0.96 0.33 0.00 -2.10 0.00 0.00 70.33 68.13 1gg2 n THR 321 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1gg2 h ASP 322 N 0.13 0.70 -0.17 3.42 3.32 -1.87 0.13 116.42 122.08 1gg2 h ASP 322 Ca -0.47 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1gg2 h ASP 322 Cb 1.37 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1gg2 h ASP 322 CO 0.48 0.46 0.00 -0.90 -1.72 0.00 0.00 179.24 177.56 1gg2 n ASP 323 N -4.47 0.92 -0.08 6.45 5.75 -1.26 -4.90 116.55 118.97 1gg2 n ASP 323 Ca 0.10 -2.00 -0.01 0.00 -0.01 0.00 0.00 54.79 52.86 1gg2 n ASP 323 Cb 0.18 -0.12 -0.00 0.00 -1.03 0.00 0.00 41.12 40.14 1gg2 n ASP 323 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gg2 n GLY 324 N 0.76 0.09 0.24 6.12 0.00 0.46 -4.84 105.19 108.02 1gg2 n GLY 324 Ca 0.06 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.23 1gg2 n GLY 324 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1gg2 h MET 325 N 0.00 0.00 -3.01 1.61 2.86 -1.91 -3.45 114.93 111.04 1gg2 h MET 325 Ca -0.02 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1gg2 h MET 325 Cb 0.97 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.53 1gg2 h MET 325 CO 0.03 0.00 0.21 0.00 1.06 0.00 0.00 176.91 178.21 1gg2 s ALA 326 N -3.46 -1.47 -0.03 6.32 0.00 -1.26 -4.85 121.76 117.02 1gg2 s ALA 326 Ca 0.04 0.22 0.06 0.00 0.00 0.00 0.00 51.96 52.28 1gg2 s ALA 326 Cb 0.08 0.88 -0.01 0.00 0.00 0.00 0.00 23.12 24.06 1gg2 s ALA 326 CO 0.58 -0.86 -0.21 0.08 0.00 0.00 0.00 175.76 175.35 1gg2 s VAL 327 N -3.81 1.71 -0.06 0.00 1.01 -0.57 -1.01 120.40 117.67 1gg2 s VAL 327 Ca 0.04 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.15 1gg2 s VAL 327 Cb -0.03 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.90 1gg2 s VAL 327 CO -0.06 0.48 -0.16 0.00 0.00 0.00 0.00 175.10 175.36 1gg2 s ALA 328 N -0.34 2.59 -0.13 5.51 0.00 0.43 0.68 121.76 130.50 1gg2 s ALA 328 Ca 0.04 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 1gg2 s ALA 328 Cb -0.10 -0.96 0.03 0.00 0.00 0.00 0.00 23.12 22.09 1gg2 s ALA 328 CO 0.01 0.49 -0.06 0.95 0.00 0.00 0.00 175.76 177.15 1gg2 s THR 329 N -0.48 0.98 0.43 0.00 -4.23 -0.45 -0.99 115.64 110.90 1gg2 s THR 329 Ca 0.06 -0.38 -0.01 0.00 -1.18 0.00 0.00 61.69 60.19 1gg2 s THR 329 Cb -0.12 -1.08 -0.02 0.00 1.34 0.00 0.00 72.50 72.63 1gg2 s THR 329 CO 0.02 0.26 0.66 -0.83 -0.54 0.00 0.00 174.62 174.18 1gg2 s GLY 330 N 1.71 1.49 0.15 3.99 0.00 0.41 -1.94 107.32 113.14 1gg2 s GLY 330 Ca 0.03 -0.94 -0.13 0.00 0.00 0.00 0.00 44.72 43.69 1gg2 s GLY 330 CO -0.08 -0.79 0.36 -0.45 0.00 0.00 0.00 173.10 172.14 1gg2 s SER 331 N -4.16 -0.09 0.31 1.64 0.15 -1.15 -1.92 113.70 108.48 1gg2 s SER 331 Ca 0.46 -0.61 0.26 0.00 0.70 0.00 0.00 55.95 56.76 1gg2 s SER 331 Cb -0.10 0.47 1.04 0.00 -1.71 0.00 0.00 66.02 65.72 1gg2 s SER 331 CO 0.38 -0.91 1.76 -0.50 1.20 0.00 0.00 173.24 175.18 1gg2 h TRP 332 N 2.43 0.00 0.00 3.44 4.06 -1.44 0.08 115.95 124.52 1gg2 h TRP 332 Ca -0.32 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.63 1gg2 h TRP 332 Cb 1.24 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.40 1gg2 h TRP 332 CO 0.37 0.00 0.00 -0.40 -3.56 0.00 0.00 178.44 174.85 1gg2 n ASP 333 N -2.40 0.00 0.00 -3.49 5.68 -1.26 -3.66 116.55 111.43 1gg2 n ASP 333 Ca 0.02 -0.17 0.00 0.00 -0.50 0.00 0.00 54.79 54.14 1gg2 n ASP 333 Cb 0.26 -0.23 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 1gg2 n ASP 333 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1gg2 n SER 334 N -1.23 0.00 -4.82 -1.12 3.41 -1.02 -4.98 113.62 103.87 1gg2 n SER 334 Ca 0.12 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.49 1gg2 n SER 334 Cb 0.16 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.06 1gg2 n SER 334 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1gg2 s PHE 335 N -3.25 3.15 0.06 7.33 0.08 -1.26 -3.98 117.98 120.11 1gg2 s PHE 335 Ca 0.00 -0.06 0.09 0.00 0.12 0.00 0.00 56.93 57.08 1gg2 s PHE 335 Cb 0.00 -1.47 -0.03 0.00 -0.57 0.00 0.00 43.02 40.95 1gg2 s PHE 335 CO 0.00 0.52 -0.25 -0.51 -0.10 0.00 0.00 175.22 174.88 1gg2 s LEU 336 N -3.47 2.19 -0.02 -0.37 1.43 -0.75 -2.94 118.68 114.75 1gg2 s LEU 336 Ca 0.32 -0.60 0.04 0.00 -1.03 0.00 0.00 54.13 52.87 1gg2 s LEU 336 Cb -0.09 -1.17 -0.01 0.00 0.03 0.00 0.00 46.19 44.95 1gg2 s LEU 336 CO 0.24 0.21 -0.15 -0.54 0.23 0.00 0.00 176.35 176.35 1gg2 s LYS 337 N -1.36 1.36 -0.25 1.70 1.02 -0.82 -0.16 119.74 121.23 1gg2 s LYS 337 Ca 0.11 -0.53 -0.09 0.00 0.02 0.00 0.00 55.97 55.47 1gg2 s LYS 337 Cb -0.10 -1.26 -0.04 0.00 -0.52 0.00 0.00 37.83 35.91 1gg2 s LYS 337 CO 0.03 0.27 0.13 0.42 -0.92 0.00 0.00 175.35 175.28 1gg2 s ILE 338 N -0.16 4.97 -0.02 2.17 -1.09 -0.36 -1.35 121.20 125.35 1gg2 s ILE 338 Ca 0.02 0.05 0.03 0.00 -2.23 0.00 0.00 60.65 58.51 1gg2 s ILE 338 Cb -0.08 -3.33 -0.03 0.00 -1.58 0.00 0.00 42.46 37.44 1gg2 s ILE 338 CO 0.00 0.32 -0.08 0.26 -1.23 0.00 0.00 174.94 174.21 1gg2 s TRP 339 N 1.42 2.86 0.00 3.97 0.52 0.22 -0.69 118.94 127.23 1gg2 s TRP 339 Ca 0.06 -0.05 0.00 0.00 0.02 0.00 0.00 56.10 56.14 1gg2 s TRP 339 Cb -0.15 -1.64 0.00 0.00 -1.15 0.00 0.00 33.47 30.54 1gg2 s TRP 339 CO 0.06 0.33 0.00 -1.71 0.02 0.00 0.00 176.95 175.65