#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gh2 s LEU 6 N 0.00 4.26 0.28 4.31 1.43 -1.26 -5.05 118.68 122.64 2gh2 s LEU 6 Ca 0.00 0.14 0.08 0.00 -1.03 0.00 0.00 54.13 53.33 2gh2 s LEU 6 Cb 0.00 -2.70 -0.04 0.00 0.03 0.00 0.00 46.19 43.48 2gh2 s LEU 6 CO 0.00 -0.51 0.11 -0.76 0.23 0.00 0.00 176.35 175.41 2gh2 s LEU 7 N 2.55 3.45 0.03 1.79 1.43 -1.26 -5.07 118.68 121.60 2gh2 s LEU 7 Ca 0.22 -0.51 -0.30 0.00 -1.03 0.00 0.00 54.13 52.50 2gh2 s LEU 7 Cb -0.15 -1.98 -0.06 0.00 0.03 0.00 0.00 46.19 44.03 2gh2 s LEU 7 CO 0.13 -0.08 1.37 -0.75 0.23 0.00 0.00 176.35 177.26 2gh2 s LYS 8 N -3.78 4.31 0.14 1.70 2.20 -1.26 -4.95 119.74 118.10 2gh2 s LYS 8 Ca 0.33 1.97 -0.31 0.00 -0.36 0.00 0.00 55.97 57.60 2gh2 s LYS 8 Cb -0.06 -3.47 -0.09 0.00 -1.51 0.00 0.00 37.83 32.70 2gh2 s LYS 8 CO 0.23 -0.51 1.46 -2.14 -0.36 0.00 0.00 175.35 174.03 2gh2 s PRO 9 N 1.93 4.28 0.18 4.03 0.02 -1.26 -4.89 135.00 139.29 2gh2 s PRO 9 Ca 0.63 2.19 0.16 0.00 0.02 0.00 0.00 61.00 64.00 2gh2 s PRO 9 Cb -0.32 -3.20 -0.03 0.00 0.02 0.00 0.00 34.50 30.96 2gh2 s PRO 9 CO 0.28 -0.49 1.16 0.00 -0.33 0.00 0.00 177.00 177.61 2gh2 h ARG 10 N 6.67 0.00 -3.64 5.54 3.08 -1.92 -3.42 114.38 120.69 2gh2 h ARG 10 Ca -0.43 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.56 2gh2 h ARG 10 Cb 1.21 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.17 2gh2 h ARG 10 CO 0.88 0.39 -0.10 0.95 -1.07 0.00 0.00 179.97 181.02 2gh2 s THR 11 N -2.96 0.00 0.22 2.04 -4.23 -1.26 -4.96 115.64 104.49 2gh2 s THR 11 Ca 0.01 -1.39 -0.09 0.00 -1.18 0.00 0.00 61.69 59.04 2gh2 s THR 11 Cb 0.08 -2.24 0.19 0.00 1.34 0.00 0.00 72.50 71.87 2gh2 s THR 11 CO 0.78 0.00 1.89 0.25 -0.54 0.00 0.00 174.62 177.00 2gh2 h LEU 12 N 2.23 0.95 -1.12 4.79 5.85 -1.93 0.34 115.31 126.42 2gh2 h LEU 12 Ca -0.26 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 2gh2 h LEU 12 Cb 1.25 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 2gh2 h LEU 12 CO 0.35 0.68 0.42 0.00 -0.34 0.00 0.00 178.44 179.55 2gh2 h ALA 13 N 1.32 1.33 -0.40 1.25 0.00 -1.96 -0.45 119.26 120.34 2gh2 h ALA 13 Ca 0.31 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 2gh2 h ALA 13 Cb -0.11 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 2gh2 h ALA 13 CO -0.08 0.55 -0.11 0.22 0.00 0.00 0.00 179.25 179.84 2gh2 h ASP 14 N 1.04 0.79 -0.72 0.00 3.58 -1.74 -1.78 116.42 117.59 2gh2 h ASP 14 Ca 0.27 -0.37 0.04 0.00 0.42 0.00 0.00 57.03 57.39 2gh2 h ASP 14 Cb 0.01 -0.22 -0.05 0.00 1.72 0.00 0.00 39.33 40.79 2gh2 h ASP 14 CO -0.04 0.98 0.44 0.25 -2.88 0.00 0.00 179.24 177.99 2gh2 h LEU 15 N 0.60 0.71 -0.58 2.28 5.85 -0.32 -0.84 115.31 123.01 2gh2 h LEU 15 Ca 0.10 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 2gh2 h LEU 15 Cb 0.64 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2gh2 h LEU 15 CO 0.04 0.48 0.26 0.40 -0.34 0.00 0.00 178.44 179.28 2gh2 h ILE 16 N 0.85 1.22 -0.59 4.05 2.04 -0.80 0.83 117.51 125.10 2gh2 h ILE 16 Ca 0.30 -0.64 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 2gh2 h ILE 16 Cb 0.08 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 2gh2 h ILE 16 CO -0.13 0.25 0.33 -0.09 0.00 0.00 0.00 178.15 178.51 2gh2 h ARG 17 N 0.79 0.81 -0.71 2.37 1.12 -0.82 -1.10 114.38 116.85 2gh2 h ARG 17 Ca 0.20 -0.09 -0.05 0.00 -1.11 0.00 0.00 59.98 58.93 2gh2 h ARG 17 Cb 0.16 -0.16 -0.03 0.00 -0.01 0.00 0.00 29.97 29.92 2gh2 h ARG 17 CO -0.02 0.61 0.24 0.82 -3.11 0.00 0.00 179.97 178.51 2gh2 h ILE 18 N 0.80 1.26 -0.51 1.20 2.04 -0.74 -2.13 117.51 119.43 2gh2 h ILE 18 Ca 0.21 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 2gh2 h ILE 18 Cb 0.02 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 2gh2 h ILE 18 CO -0.04 0.34 0.14 -0.07 0.00 0.00 0.00 178.15 178.52 2gh2 h LEU 19 N 1.04 0.71 -1.54 1.44 3.38 -0.46 -0.86 115.31 119.02 2gh2 h LEU 19 Ca 0.23 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2gh2 h LEU 19 Cb 0.28 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2gh2 h LEU 19 CO -0.01 0.69 -0.02 0.45 0.09 0.00 0.00 178.44 179.64 2gh2 h HIS 20 N 0.74 0.27 -0.20 1.13 3.86 -0.57 -1.40 115.15 118.97 2gh2 h HIS 20 Ca 0.17 -0.02 -0.13 0.00 -1.16 0.00 0.00 60.37 59.24 2gh2 h HIS 20 Cb 0.26 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.64 2gh2 h HIS 20 CO 0.01 0.30 -0.37 0.93 0.86 0.00 0.00 177.93 179.67 2gh2 h GLU 21 N 0.26 0.61 0.00 2.45 5.08 -0.71 -2.79 114.58 119.47 2gh2 h GLU 21 Ca 0.06 -0.38 -0.01 0.00 -1.00 0.00 0.00 59.36 58.03 2gh2 h GLU 21 Cb 0.22 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 2gh2 h GLU 21 CO 0.01 0.99 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.90 2gh2 h LEU 22 N 0.28 0.00 -3.30 1.33 3.38 -0.69 -2.49 115.31 113.83 2gh2 h LEU 22 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2gh2 h LEU 22 Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2gh2 h LEU 22 CO 0.08 0.04 0.00 0.49 0.09 0.00 0.00 178.44 179.14 2gh2 n PHE 23 N -3.18 1.14 0.23 1.13 3.72 -0.58 -4.58 117.46 115.33 2gh2 n PHE 23 Ca -0.00 -0.84 0.08 0.00 -0.05 0.00 0.00 57.45 56.64 2gh2 n PHE 23 Cb 0.27 -0.34 0.55 0.00 -0.94 0.00 0.00 39.48 39.01 2gh2 n PHE 23 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2gh2 h ALA 24 N 2.23 1.37 -3.07 4.37 0.00 -1.16 -3.45 119.26 119.56 2gh2 h ALA 24 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2gh2 h ALA 24 Cb 1.52 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.27 2gh2 h ALA 24 CO 0.26 0.27 0.00 0.41 0.00 0.00 0.00 179.25 180.20 2gh2 n GLY 25 N -0.61 1.54 0.00 0.00 0.00 -1.26 -5.05 105.19 99.81 2gh2 n GLY 25 Ca -0.02 -1.99 0.10 0.00 0.00 0.00 0.00 46.02 44.11 2gh2 n GLY 25 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gh2 n ASP 26 N -0.24 0.92 -4.81 1.61 8.00 -1.26 -4.97 116.55 115.80 2gh2 n ASP 26 Ca 0.00 -0.93 -0.28 0.00 0.71 0.00 0.00 54.79 54.29 2gh2 n ASP 26 Cb 0.00 1.06 -0.05 0.00 -0.02 0.00 0.00 41.12 42.11 2gh2 n ASP 26 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2gh2 s GLU 27 N -2.98 2.22 -0.08 -1.24 0.41 -1.26 -5.14 118.70 110.62 2gh2 s GLU 27 Ca 0.07 -2.10 -0.00 0.00 -0.41 0.00 0.00 54.97 52.52 2gh2 s GLU 27 Cb 0.15 -1.87 0.02 0.00 -1.78 0.00 0.00 34.13 30.66 2gh2 s GLU 27 CO 0.85 -0.38 -0.04 0.08 -0.49 0.00 0.00 175.26 175.27 2gh2 s VAL 28 N -2.76 0.70 -0.77 2.63 1.01 -1.26 -4.86 120.40 115.09 2gh2 s VAL 28 Ca 0.27 -0.11 -0.22 0.00 0.00 0.00 0.00 61.98 61.92 2gh2 s VAL 28 Cb 0.01 -0.77 0.09 0.00 0.00 0.00 0.00 36.38 35.71 2gh2 s VAL 28 CO 0.15 0.30 1.05 0.21 0.00 0.00 0.00 175.10 176.82 2gh2 s ASN 29 N 1.62 6.33 0.21 3.32 3.84 -1.26 -4.89 114.94 124.12 2gh2 s ASN 29 Ca 0.01 -1.33 -0.09 0.00 0.21 0.00 0.00 52.86 51.66 2gh2 s ASN 29 Cb -0.13 -2.43 0.25 0.00 -0.55 0.00 0.00 41.25 38.40 2gh2 s ASN 29 CO -0.05 -1.34 1.82 0.58 -2.79 0.00 0.00 177.10 175.32 2gh2 h VAL 30 N 5.99 0.99 -0.47 -5.21 2.07 -1.99 -1.64 116.25 115.97 2gh2 h VAL 30 Ca -0.12 -0.25 -0.08 0.00 0.82 0.00 0.00 66.70 67.06 2gh2 h VAL 30 Cb 1.05 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 2gh2 h VAL 30 CO 1.18 0.14 -0.05 -0.33 0.02 0.00 0.00 177.57 178.53 2gh2 h GLU 31 N 0.74 0.81 -0.32 1.57 3.07 -1.99 -0.42 114.58 118.03 2gh2 h GLU 31 Ca 0.31 -0.24 -0.14 0.00 -0.50 0.00 0.00 59.36 58.78 2gh2 h GLU 31 Cb 0.18 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.00 2gh2 h GLU 31 CO -0.18 0.85 -0.36 0.93 -1.40 0.00 0.00 179.01 178.85 2gh2 h GLU 32 N 0.75 0.82 -0.60 2.33 5.08 -1.89 -0.92 114.58 120.15 2gh2 h GLU 32 Ca 0.14 -0.45 -0.03 0.00 -1.00 0.00 0.00 59.36 58.02 2gh2 h GLU 32 Cb 0.52 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 2gh2 h GLU 32 CO 0.03 1.08 0.25 0.28 -1.00 0.00 0.00 179.01 179.65 2gh2 h VAL 33 N 0.60 1.23 -0.80 3.13 2.07 -1.09 -1.69 116.25 119.70 2gh2 h VAL 33 Ca 0.05 -0.70 -0.05 0.00 0.82 0.00 0.00 66.70 66.82 2gh2 h VAL 33 Cb 0.95 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 2gh2 h VAL 33 CO 0.09 0.27 0.32 -0.61 0.02 0.00 0.00 177.57 177.66 2gh2 h GLN 34 N 0.83 1.20 -0.60 1.57 4.15 -1.03 -1.33 115.11 119.90 2gh2 h GLN 34 Ca 0.20 -0.22 -0.05 0.00 0.77 0.00 0.00 58.65 59.35 2gh2 h GLN 34 Cb 0.19 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.66 2gh2 h GLN 34 CO -0.02 0.97 0.19 0.00 -1.93 0.00 0.00 178.83 178.04 2gh2 h ALA 35 N 1.17 0.78 -0.20 3.38 0.00 -0.81 -0.10 119.26 123.49 2gh2 h ALA 35 Ca 0.27 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 2gh2 h ALA 35 Cb 0.22 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2gh2 h ALA 35 CO -0.02 0.45 -0.54 -0.24 0.00 0.00 0.00 179.25 178.90 2gh2 h VAL 36 N 0.85 1.32 -0.33 0.00 3.04 -1.08 -1.01 116.25 119.05 2gh2 h VAL 36 Ca 0.19 -1.78 -0.04 0.00 -1.01 0.00 0.00 66.70 64.06 2gh2 h VAL 36 Cb 0.28 1.75 -0.01 0.00 -2.01 0.00 0.00 31.29 31.30 2gh2 h VAL 36 CO -0.01 0.56 0.07 -0.07 -1.01 0.00 0.00 177.57 177.11 2gh2 h LEU 37 N 0.45 0.51 -1.21 3.16 3.38 -1.06 -2.37 115.31 118.17 2gh2 h LEU 37 Ca 0.01 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 2gh2 h LEU 37 Cb 1.09 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 2gh2 h LEU 37 CO 0.10 0.62 -0.01 -0.08 0.09 0.00 0.00 178.44 179.17 2gh2 h GLU 38 N 0.37 0.53 0.00 1.13 4.81 -0.87 -2.92 114.58 117.63 2gh2 h GLU 38 Ca 0.10 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 2gh2 h GLU 38 Cb 0.32 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.62 2gh2 h GLU 38 CO 0.00 0.57 -0.16 0.00 -0.73 0.00 0.00 179.01 178.69 2gh2 h ALA 39 N 1.49 1.04 -2.35 2.92 0.00 -0.83 -3.43 119.26 118.10 2gh2 h ALA 39 Ca 0.11 -0.15 -0.54 0.00 0.00 0.00 0.00 54.91 54.33 2gh2 h ALA 39 Cb 0.34 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2gh2 h ALA 39 CO 0.01 0.20 0.92 -0.47 0.00 0.00 0.00 179.25 179.92 2gh2 s TYR 40 N -3.71 2.58 -0.32 0.00 5.04 -0.93 -4.67 117.35 115.36 2gh2 s TYR 40 Ca 0.00 0.60 -0.22 0.00 -2.44 0.00 0.00 57.07 55.01 2gh2 s TYR 40 Cb 0.10 -3.77 -0.00 0.00 0.35 0.00 0.00 41.96 38.64 2gh2 s TYR 40 CO 0.61 -2.98 0.73 -1.21 -1.34 0.00 0.00 175.55 171.36 2gh2 s GLU 41 N 2.86 3.90 0.05 4.97 2.02 -1.26 -4.99 118.70 126.24 2gh2 s GLU 41 Ca 0.67 0.43 -0.36 0.00 0.02 0.00 0.00 54.97 55.73 2gh2 s GLU 41 Cb -0.33 -3.74 -0.15 0.00 0.10 0.00 0.00 34.13 30.01 2gh2 s GLU 41 CO 0.27 -0.67 1.52 0.45 0.02 0.00 0.00 175.26 176.85 2gh2 n SER 42 N 6.11 2.35 -3.89 -0.19 2.88 -1.26 -4.94 113.62 114.68 2gh2 n SER 42 Ca 0.02 1.09 -0.30 0.00 -1.33 0.00 0.00 58.87 58.34 2gh2 n SER 42 Cb 0.48 -1.27 -0.15 0.00 -0.75 0.00 0.00 64.21 62.52 2gh2 n SER 42 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2gh2 s ASN 43 N 1.35 4.26 0.44 -3.46 3.84 -1.26 -5.02 114.94 115.09 2gh2 s ASN 43 Ca 0.85 -1.72 0.25 0.00 0.21 0.00 0.00 52.86 52.46 2gh2 s ASN 43 Cb -0.86 -1.23 1.27 0.00 -0.55 0.00 0.00 41.25 39.88 2gh2 s ASN 43 CO 0.47 -0.36 1.76 -0.65 -2.79 0.00 0.00 177.10 175.53 2gh2 h PRO 44 N 7.88 0.24 -0.11 0.43 0.11 -1.92 0.32 132.00 138.95 2gh2 h PRO 44 Ca -0.11 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.94 2gh2 h PRO 44 Cb 1.03 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 2gh2 h PRO 44 CO 0.47 0.16 -0.14 0.00 -0.21 0.00 0.00 178.00 178.28 2gh2 h ALA 45 N 1.56 1.57 0.00 -0.75 0.00 -2.01 -1.34 119.26 118.29 2gh2 h ALA 45 Ca 0.62 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 55.26 2gh2 h ALA 45 Cb 1.85 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.56 2gh2 h ALA 45 CO -0.23 0.31 -0.35 0.93 0.00 0.00 0.00 179.25 179.91 2gh2 h GLU 46 N 0.16 0.00 -0.03 0.00 5.08 -1.36 -3.29 114.58 115.14 2gh2 h GLU 46 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2gh2 h GLU 46 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2gh2 h GLU 46 CO 0.02 0.35 0.00 -2.67 -1.00 0.00 0.00 179.01 175.71 2gh2 n TRP 47 N -3.52 0.04 -0.33 4.33 4.27 -1.02 -4.72 117.44 116.47 2gh2 n TRP 47 Ca -0.00 -0.42 0.11 0.00 -3.89 0.00 0.00 57.50 53.29 2gh2 n TRP 47 Cb 0.49 -0.04 0.31 0.00 -1.36 0.00 0.00 31.31 30.71 2gh2 n TRP 47 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2gh2 h ALA 48 N 0.21 1.67 -0.78 -1.67 0.00 -1.32 -0.74 119.26 116.64 2gh2 h ALA 48 Ca 0.00 0.04 0.18 0.00 0.00 0.00 0.00 54.91 55.13 2gh2 h ALA 48 Cb 0.45 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 2gh2 h ALA 48 CO 0.00 0.03 0.53 1.25 0.00 0.00 0.00 179.25 181.06 2gh2 h LEU 49 N 0.83 0.25 -0.21 0.00 5.85 -1.84 -1.81 115.31 118.37 2gh2 h LEU 49 Ca 0.51 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.25 2gh2 h LEU 49 Cb 0.71 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.71 2gh2 h LEU 49 CO -0.29 0.12 -0.67 -1.22 -0.34 0.00 0.00 178.44 176.04 2gh2 n TYR 50 N -4.43 0.00 -1.99 1.25 4.01 -0.30 -4.65 117.16 111.05 2gh2 n TYR 50 Ca 0.16 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.48 2gh2 n TYR 50 Cb 0.66 -0.10 -0.00 0.00 -0.31 0.00 0.00 39.34 39.60 2gh2 n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2gh2 n ALA 51 N -1.17 5.84 -2.68 -0.72 0.00 -0.68 -4.77 120.51 116.32 2gh2 n ALA 51 Ca 0.06 -4.07 -0.41 0.00 0.00 0.00 0.00 53.44 49.03 2gh2 n ALA 51 Cb 0.35 -3.18 -0.11 0.00 0.00 0.00 0.00 19.45 16.52 2gh2 n ALA 51 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2gh2 s LYS 52 N 1.28 3.00 0.36 0.00 1.02 -1.26 -5.04 119.74 119.11 2gh2 s LYS 52 Ca 0.47 -0.97 -0.02 0.00 0.02 0.00 0.00 55.97 55.46 2gh2 s LYS 52 Cb 0.13 -3.80 -0.04 0.00 -0.52 0.00 0.00 37.83 33.60 2gh2 s LYS 52 CO -0.04 -0.65 0.60 -0.06 -0.92 0.00 0.00 175.35 174.27 2gh2 s PHE 53 N 1.62 3.51 0.04 3.18 0.08 -1.26 -4.73 117.98 120.41 2gh2 s PHE 53 Ca 0.04 0.54 0.07 0.00 0.12 0.00 0.00 56.93 57.70 2gh2 s PHE 53 Cb -0.19 -2.05 -0.02 0.00 -0.57 0.00 0.00 43.02 40.19 2gh2 s PHE 53 CO 0.08 0.05 -0.21 0.34 -0.10 0.00 0.00 175.22 175.37 2gh2 s ASP 54 N -3.81 2.56 0.42 1.36 2.15 -1.26 -5.04 116.67 113.05 2gh2 s ASP 54 Ca 0.43 -0.51 0.19 0.00 0.43 0.00 0.00 52.55 53.08 2gh2 s ASP 54 Cb -0.10 -0.22 0.94 0.00 -0.30 0.00 0.00 42.92 43.23 2gh2 s ASP 54 CO 0.36 0.19 1.88 -0.61 -0.17 0.00 0.00 175.17 176.82 2gh2 h GLN 55 N 4.95 0.00 0.00 4.34 4.15 -2.00 -3.34 115.11 123.22 2gh2 h GLN 55 Ca -0.43 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 58.85 2gh2 h GLN 55 Cb 1.15 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.82 2gh2 h GLN 55 CO 0.44 0.29 -2.08 0.66 -1.93 0.00 0.00 178.83 176.21 2gh2 n TYR 56 N -3.79 0.09 -3.86 3.99 4.01 -1.26 -4.97 117.16 111.36 2gh2 n TYR 56 Ca -0.01 0.03 -0.08 0.00 -0.16 0.00 0.00 57.90 57.67 2gh2 n TYR 56 Cb 0.38 -0.74 -0.03 0.00 -0.31 0.00 0.00 39.34 38.64 2gh2 n TYR 56 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 2gh2 s ARG 57 N -3.09 1.65 0.62 -0.72 1.70 -1.25 -5.00 118.95 112.85 2gh2 s ARG 57 Ca -0.08 -1.03 -0.16 0.00 -0.47 0.00 0.00 55.73 53.99 2gh2 s ARG 57 Cb 0.11 0.56 -0.02 0.00 -0.57 0.00 0.00 34.95 35.02 2gh2 s ARG 57 CO 0.87 -0.73 1.11 1.52 -1.08 0.00 0.00 175.30 176.99 2gh2 s TYR 58 N -3.93 2.67 0.16 5.89 -0.85 -1.26 -4.16 117.35 115.86 2gh2 s TYR 58 Ca 0.14 1.55 0.09 0.00 -0.52 0.00 0.00 57.07 58.32 2gh2 s TYR 58 Cb -0.04 -3.19 -0.04 0.00 0.38 0.00 0.00 41.96 39.07 2gh2 s TYR 58 CO 0.05 -1.60 -0.14 0.95 -1.52 0.00 0.00 175.55 173.30 2gh2 s THR 59 N -2.18 3.01 -0.18 -3.49 -4.23 -0.63 -4.94 115.64 103.01 2gh2 s THR 59 Ca 0.68 -1.62 -0.01 0.00 -1.18 0.00 0.00 61.69 59.56 2gh2 s THR 59 Cb -0.21 -2.45 -0.00 0.00 1.34 0.00 0.00 72.50 71.18 2gh2 s THR 59 CO 0.37 -0.03 -0.12 -0.13 -0.54 0.00 0.00 174.62 174.17 2gh2 s ARG 60 N -2.56 3.25 -0.24 3.99 0.52 -1.26 -1.61 118.95 121.05 2gh2 s ARG 60 Ca 0.22 -0.71 0.01 0.00 -0.52 0.00 0.00 55.73 54.73 2gh2 s ARG 60 Cb -0.09 -2.77 0.06 0.00 0.52 0.00 0.00 34.95 32.66 2gh2 s ARG 60 CO 0.13 -0.10 -0.05 -0.80 0.02 0.00 0.00 175.30 174.50 2gh2 s ASN 61 N 1.13 3.85 0.12 0.23 0.01 0.40 -0.09 114.94 120.59 2gh2 s ASN 61 Ca 0.01 -1.19 -0.31 0.00 -0.71 0.00 0.00 52.86 50.66 2gh2 s ASN 61 Cb -0.14 -1.17 -0.08 0.00 0.41 0.00 0.00 41.25 40.27 2gh2 s ASN 61 CO -0.04 -0.24 1.41 -0.22 -1.51 0.00 0.00 177.10 176.50 2gh2 s LEU 62 N 1.40 4.37 -0.17 0.60 2.96 -0.35 -0.33 118.68 127.17 2gh2 s LEU 62 Ca -0.05 2.37 -0.02 0.00 -0.22 0.00 0.00 54.13 56.21 2gh2 s LEU 62 Cb -0.19 -3.59 -0.10 0.00 0.50 0.00 0.00 46.19 42.81 2gh2 s LEU 62 CO -0.06 -0.67 -0.17 0.52 -1.32 0.00 0.00 176.35 174.65 2gh2 n VAL 63 N 3.89 0.95 -3.70 1.68 0.31 0.48 -0.72 118.33 121.23 2gh2 n VAL 63 Ca 0.12 -0.33 -0.14 0.00 -0.01 0.00 0.00 64.34 63.98 2gh2 n VAL 63 Cb 0.42 -1.27 -0.09 0.00 -0.91 0.00 0.00 33.84 31.99 2gh2 n VAL 63 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2gh2 s ASP 64 N -5.88 -0.43 -0.01 4.52 2.15 -0.90 -4.71 116.67 111.41 2gh2 s ASP 64 Ca -0.23 0.68 0.21 0.00 0.43 0.00 0.00 52.55 53.64 2gh2 s ASP 64 Cb 0.07 0.73 0.63 0.00 -0.30 0.00 0.00 42.92 44.05 2gh2 s ASP 64 CO 0.36 -0.29 1.53 0.00 -0.17 0.00 0.00 175.17 176.60 2gh2 n GLN 65 N 2.19 2.75 -3.09 4.34 6.02 -1.26 -0.83 117.38 127.49 2gh2 n GLN 65 Ca -0.16 -2.56 -0.19 0.00 -0.01 0.00 0.00 57.00 54.08 2gh2 n GLN 65 Cb 0.57 -1.58 -0.01 0.00 1.02 0.00 0.00 30.24 30.23 2gh2 n GLN 65 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2gh2 n GLY 66 N 1.56 -0.49 2.75 1.08 0.00 -1.05 -0.75 105.19 108.29 2gh2 n GLY 66 Ca 0.24 0.06 -0.20 0.00 0.00 0.00 0.00 46.02 46.11 2gh2 n GLY 66 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2gh2 n ASN 67 N -2.08 -5.20 0.00 1.61 3.02 -1.26 -1.36 115.26 109.99 2gh2 n ASN 67 Ca -0.04 -0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.40 2gh2 n ASN 67 Cb 0.55 -4.30 0.00 0.00 -0.61 0.00 0.00 39.78 35.42 2gh2 n ASN 67 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2gh2 n GLY 68 N -1.15 1.86 0.11 7.41 0.00 0.07 -4.88 105.19 108.60 2gh2 n GLY 68 Ca -0.15 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.92 2gh2 n GLY 68 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gh2 h LYS 69 N 2.77 0.00 -2.94 1.61 1.79 -1.36 -3.42 116.57 115.03 2gh2 h LYS 69 Ca 0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2gh2 h LYS 69 Cb 0.00 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 30.53 2gh2 h LYS 69 CO 0.00 0.20 0.23 -0.59 -1.08 0.00 0.00 179.45 178.22 2gh2 s PHE 70 N -3.09 -0.52 -0.15 -1.35 -0.12 -1.25 -4.16 117.98 107.35 2gh2 s PHE 70 Ca -0.01 0.31 -0.02 0.00 -0.05 0.00 0.00 56.93 57.16 2gh2 s PHE 70 Cb 0.09 0.56 -0.02 0.00 -0.63 0.00 0.00 43.02 43.01 2gh2 s PHE 70 CO 0.79 -0.83 -0.07 -0.80 -0.05 0.00 0.00 175.22 174.26 2gh2 s ASN 71 N -2.73 4.50 -0.18 1.98 0.01 -0.42 -2.54 114.94 115.55 2gh2 s ASN 71 Ca 0.02 -0.20 -0.02 0.00 -0.71 0.00 0.00 52.86 51.94 2gh2 s ASN 71 Cb -0.01 -1.72 -0.01 0.00 0.41 0.00 0.00 41.25 39.93 2gh2 s ASN 71 CO -0.12 0.17 -0.09 -0.22 -1.51 0.00 0.00 177.10 175.32 2gh2 s LEU 72 N 0.36 2.73 0.07 0.60 2.96 -0.01 -1.59 118.68 123.81 2gh2 s LEU 72 Ca -0.07 -0.40 -0.02 0.00 -0.22 0.00 0.00 54.13 53.42 2gh2 s LEU 72 Cb -0.15 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 2gh2 s LEU 72 CO 0.04 0.04 0.02 0.00 -1.32 0.00 0.00 176.35 175.13 2gh2 s MET 73 N 1.07 0.71 -0.13 1.98 0.23 0.14 -0.39 119.30 122.92 2gh2 s MET 73 Ca 0.00 -1.24 0.00 0.00 -1.03 0.00 0.00 55.69 53.43 2gh2 s MET 73 Cb -0.15 0.24 -0.01 0.00 -1.53 0.00 0.00 34.83 33.38 2gh2 s MET 73 CO -0.02 -0.17 -0.14 0.42 -2.03 0.00 0.00 175.02 173.08 2gh2 s ILE 74 N -3.94 2.93 -0.13 3.16 1.01 0.55 0.09 121.20 124.87 2gh2 s ILE 74 Ca 0.11 -0.70 -0.05 0.00 0.00 0.00 0.00 60.65 60.01 2gh2 s ILE 74 Cb 0.07 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 2gh2 s ILE 74 CO -0.07 0.53 0.03 -0.76 0.00 0.00 0.00 174.94 174.67 2gh2 s LEU 75 N 0.40 3.72 -0.21 2.97 1.02 0.46 -0.46 118.68 126.58 2gh2 s LEU 75 Ca -0.11 0.13 -0.00 0.00 0.02 0.00 0.00 54.13 54.17 2gh2 s LEU 75 Cb -0.16 -1.89 0.02 0.00 0.02 0.00 0.00 46.19 44.18 2gh2 s LEU 75 CO 0.05 0.29 -0.14 0.00 0.02 0.00 0.00 176.35 176.57 2gh2 s TRP 77 N 1.30 3.14 1.04 0.00 0.52 0.15 -1.60 118.94 123.50 2gh2 s TRP 77 Ca 0.02 -1.39 -0.14 0.00 0.02 0.00 0.00 56.10 54.62 2gh2 s TRP 77 Cb -0.15 -2.15 0.21 0.00 -1.15 0.00 0.00 33.47 30.23 2gh2 s TRP 77 CO -0.09 -0.69 1.10 0.20 0.02 0.00 0.00 176.95 177.50 2gh2 s GLY 78 N 1.38 1.57 0.07 0.98 0.00 -1.26 -1.10 107.32 108.96 2gh2 s GLY 78 Ca -0.00 -0.52 -0.33 0.00 0.00 0.00 0.00 44.72 43.86 2gh2 s GLY 78 CO -0.01 0.15 1.73 1.18 0.00 0.00 0.00 173.10 176.15 2gh2 n GLU 79 N -4.29 2.28 -0.96 2.90 4.71 -1.26 -1.35 120.64 122.67 2gh2 n GLU 79 Ca 0.07 0.83 0.00 0.00 -0.01 0.00 0.00 57.16 58.05 2gh2 n GLU 79 Cb 0.58 -2.65 0.00 0.00 -1.01 0.00 0.00 31.44 28.36 2gh2 n GLU 79 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2gh2 n GLY 80 N 3.90 0.96 3.78 0.62 0.00 -0.48 -4.98 105.19 109.00 2gh2 n GLY 80 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 2gh2 n GLY 80 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2gh2 s HIS 81 N -3.86 3.56 0.30 1.61 3.76 -0.46 -4.81 115.29 115.40 2gh2 s HIS 81 Ca 0.00 1.73 -0.16 0.00 -0.15 0.00 0.00 55.06 56.49 2gh2 s HIS 81 Cb 0.00 -2.97 0.02 0.00 1.11 0.00 0.00 32.58 30.74 2gh2 s HIS 81 CO 0.00 -0.01 0.64 0.20 -0.85 0.00 0.00 174.74 174.72 2gh2 s GLY 82 N -1.65 0.36 0.53 -2.22 0.00 -1.26 -0.18 107.32 102.90 2gh2 s GLY 82 Ca 0.53 -0.70 0.09 0.00 0.00 0.00 0.00 44.72 44.64 2gh2 s GLY 82 CO 0.24 -0.39 0.66 -1.35 0.00 0.00 0.00 173.10 172.27 2gh2 s SER 83 N -3.01 5.14 0.77 1.64 1.04 0.04 -4.82 113.70 114.49 2gh2 s SER 83 Ca 0.17 -0.82 -0.09 0.00 0.48 0.00 0.00 55.95 55.69 2gh2 s SER 83 Cb -0.04 0.07 0.09 0.00 0.10 0.00 0.00 66.02 66.24 2gh2 s SER 83 CO 0.10 -1.15 1.11 -0.94 0.98 0.00 0.00 173.24 173.34 2gh2 s SER 84 N -4.51 4.45 -0.02 7.02 1.04 -1.26 -4.62 113.70 115.80 2gh2 s SER 84 Ca 0.56 0.47 -0.30 0.00 0.48 0.00 0.00 55.95 57.16 2gh2 s SER 84 Cb -0.06 -0.97 -0.03 0.00 0.10 0.00 0.00 66.02 65.06 2gh2 s SER 84 CO 0.34 -1.87 1.04 -0.63 0.98 0.00 0.00 173.24 173.10 2gh2 s ILE 85 N -3.43 4.67 0.18 -1.02 1.01 -1.26 -4.38 121.20 116.96 2gh2 s ILE 85 Ca 0.63 1.92 -0.09 0.00 0.00 0.00 0.00 60.65 63.11 2gh2 s ILE 85 Cb -0.09 -4.23 -0.01 0.00 0.01 0.00 0.00 42.46 38.13 2gh2 s ILE 85 CO 0.47 0.10 0.30 -1.38 0.00 0.00 0.00 174.94 174.44 2gh2 s HIS 86 N 1.37 0.42 0.15 3.97 -3.43 -0.30 -0.64 115.29 116.83 2gh2 s HIS 86 Ca 0.52 -0.78 0.02 0.00 -0.80 0.00 0.00 55.06 54.03 2gh2 s HIS 86 Cb -0.22 -0.04 0.02 0.00 -1.43 0.00 0.00 32.58 30.91 2gh2 s HIS 86 CO 0.25 -0.75 0.18 -0.40 -2.00 0.00 0.00 174.74 172.02 2gh2 n ASP 87 N -0.24 0.89 -0.81 7.38 5.68 -1.16 -2.35 116.55 125.93 2gh2 n ASP 87 Ca -0.06 -1.45 0.04 0.00 -0.50 0.00 0.00 54.79 52.82 2gh2 n ASP 87 Cb 0.63 -0.08 0.07 0.00 -1.14 0.00 0.00 41.12 40.60 2gh2 n ASP 87 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2gh2 n HIS 88 N -1.17 0.00 -3.87 2.11 8.25 -1.26 -4.65 115.22 114.64 2gh2 n HIS 88 Ca 0.03 -0.63 -0.25 0.00 -0.26 0.00 0.00 57.72 56.60 2gh2 n HIS 88 Cb 0.16 -0.14 0.01 0.00 1.12 0.00 0.00 29.99 31.14 2gh2 n HIS 88 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2gh2 n THR 89 N -0.27 -3.27 -2.14 1.59 -1.04 -1.26 -0.91 114.28 106.98 2gh2 n THR 89 Ca 0.08 -0.38 -0.20 0.00 -2.04 0.00 0.00 64.05 61.52 2gh2 n THR 89 Cb 0.85 -3.05 -0.03 0.00 -1.82 0.00 0.00 70.33 66.28 2gh2 n THR 89 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2gh2 n ASP 90 N -2.96 -5.55 -4.55 8.00 8.00 -1.26 -4.98 116.55 113.25 2gh2 n ASP 90 Ca -0.22 0.16 -0.24 0.00 0.71 0.00 0.00 54.79 55.21 2gh2 n ASP 90 Cb 0.64 -4.72 -0.09 0.00 -0.02 0.00 0.00 41.12 36.94 2gh2 n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2gh2 s SER 91 N -2.25 4.03 0.29 -2.24 0.01 -0.08 -4.75 113.70 108.71 2gh2 s SER 91 Ca 0.00 -0.85 -0.28 0.00 1.31 0.00 0.00 55.95 56.13 2gh2 s SER 91 Cb 0.00 -0.55 -0.09 0.00 0.21 0.00 0.00 66.02 65.58 2gh2 s SER 91 CO 0.00 0.02 0.96 -1.00 0.41 0.00 0.00 173.24 173.63 2gh2 s HIS 92 N -2.42 3.79 -0.08 2.43 3.76 0.45 -4.46 115.29 118.74 2gh2 s HIS 92 Ca 0.31 1.83 -0.02 0.00 -0.15 0.00 0.00 55.06 57.03 2gh2 s HIS 92 Cb -0.06 -2.98 0.03 0.00 1.11 0.00 0.00 32.58 30.69 2gh2 s HIS 92 CO 0.17 0.23 0.01 0.00 -0.85 0.00 0.00 174.74 174.30 2gh2 s PHE 94 N 1.99 2.91 -0.10 0.00 0.08 0.16 -1.23 117.98 121.80 2gh2 s PHE 94 Ca 0.04 -0.04 -0.01 0.00 0.12 0.00 0.00 56.93 57.04 2gh2 s PHE 94 Cb -0.13 -1.72 0.03 0.00 -0.57 0.00 0.00 43.02 40.63 2gh2 s PHE 94 CO -0.05 0.28 -0.01 -1.17 -0.10 0.00 0.00 175.22 174.16 2gh2 s LEU 95 N -0.69 0.80 -0.11 -0.37 0.20 0.16 -1.12 118.68 117.55 2gh2 s LEU 95 Ca 0.10 -0.22 0.03 0.00 0.69 0.00 0.00 54.13 54.74 2gh2 s LEU 95 Cb -0.11 -0.55 -0.00 0.00 -0.43 0.00 0.00 46.19 45.09 2gh2 s LEU 95 CO 0.02 -0.19 -0.21 -0.75 -0.29 0.00 0.00 176.35 174.92 2gh2 s LYS 96 N 1.90 3.13 -0.00 1.98 2.20 0.68 0.63 119.74 130.26 2gh2 s LYS 96 Ca 0.04 -0.83 -0.30 0.00 -0.36 0.00 0.00 55.97 54.52 2gh2 s LYS 96 Cb -0.13 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.77 2gh2 s LYS 96 CO -0.06 0.19 1.09 -0.51 -0.36 0.00 0.00 175.35 175.69 2gh2 s LEU 97 N 0.34 4.34 -0.10 5.43 2.01 -0.17 0.16 118.68 130.70 2gh2 s LEU 97 Ca -0.17 1.78 0.18 0.00 0.01 0.00 0.00 54.13 55.93 2gh2 s LEU 97 Cb -0.17 -3.57 -0.26 0.00 0.01 0.00 0.00 46.19 42.19 2gh2 s LEU 97 CO 0.08 -0.40 0.25 0.18 1.01 0.00 0.00 176.35 177.47 2gh2 n LEU 98 N 4.23 0.00 -3.64 1.79 4.77 0.61 -0.38 117.00 124.38 2gh2 n LEU 98 Ca 0.08 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.96 2gh2 n LEU 98 Cb 0.49 0.21 -0.07 0.00 -2.33 0.00 0.00 43.42 41.72 2gh2 n LEU 98 CO 0.54 0.21 0.49 -1.58 -1.33 0.00 0.00 177.39 175.72 2gh2 s GLN 99 N -2.90 0.70 2.18 3.23 0.74 -0.77 -4.82 119.66 118.03 2gh2 s GLN 99 Ca -0.08 0.94 0.00 0.00 0.05 0.00 0.00 55.36 56.27 2gh2 s GLN 99 Cb 0.09 0.29 0.00 0.00 1.10 0.00 0.00 33.01 34.49 2gh2 s GLN 99 CO 0.77 -0.10 0.00 0.41 -0.55 0.00 0.00 175.29 175.81 2gh2 n GLY 100 N 3.04 -1.26 3.03 2.59 0.00 -1.26 -0.72 105.19 110.60 2gh2 n GLY 100 Ca -0.15 -1.28 -0.11 0.00 0.00 0.00 0.00 46.02 44.47 2gh2 n GLY 100 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2gh2 s ASN 101 N -4.00 0.56 0.02 1.61 0.01 -1.26 -3.18 114.94 108.70 2gh2 s ASN 101 Ca 0.00 -0.54 0.04 0.00 -0.71 0.00 0.00 52.86 51.65 2gh2 s ASN 101 Cb 0.00 0.07 -0.02 0.00 0.41 0.00 0.00 41.25 41.71 2gh2 s ASN 101 CO 0.00 -0.26 -0.12 -0.76 -1.51 0.00 0.00 177.10 174.45 2gh2 s LEU 102 N -1.57 2.12 -0.20 0.60 1.43 -0.72 -4.65 118.68 115.67 2gh2 s LEU 102 Ca -0.12 -0.36 -0.15 0.00 -1.03 0.00 0.00 54.13 52.47 2gh2 s LEU 102 Cb -0.09 -0.52 -0.04 0.00 0.03 0.00 0.00 46.19 45.56 2gh2 s LEU 102 CO -0.01 0.04 0.35 -0.75 0.23 0.00 0.00 176.35 176.22 2gh2 s LYS 103 N -0.82 4.16 -0.20 1.70 2.20 0.91 -0.24 119.74 127.46 2gh2 s LYS 103 Ca 0.01 0.11 -0.04 0.00 -0.36 0.00 0.00 55.97 55.69 2gh2 s LYS 103 Cb -0.06 -3.53 -0.02 0.00 -1.51 0.00 0.00 37.83 32.71 2gh2 s LYS 103 CO 0.00 0.00 -0.02 -2.00 -0.36 0.00 0.00 175.35 172.98 2gh2 s GLU 104 N 1.20 3.56 -0.14 4.03 2.12 0.15 -0.92 118.70 128.71 2gh2 s GLU 104 Ca 0.17 -0.55 -0.00 0.00 0.36 0.00 0.00 54.97 54.95 2gh2 s GLU 104 Cb -0.14 -3.03 -0.01 0.00 0.26 0.00 0.00 34.13 31.21 2gh2 s GLU 104 CO 0.07 0.00 -0.13 0.99 -0.54 0.00 0.00 175.26 175.65 2gh2 s THR 105 N 1.01 2.98 -0.08 -1.70 2.01 -0.42 -0.97 115.64 118.47 2gh2 s THR 105 Ca 0.01 -0.68 -0.06 0.00 0.31 0.00 0.00 61.69 61.27 2gh2 s THR 105 Cb -0.14 -2.26 -0.04 0.00 0.01 0.00 0.00 72.50 70.07 2gh2 s THR 105 CO 0.01 0.52 0.17 -0.76 -0.69 0.00 0.00 174.62 173.87 2gh2 s LEU 106 N 0.50 4.39 0.04 4.42 1.43 -0.20 -1.08 118.68 128.17 2gh2 s LEU 106 Ca -0.09 0.47 0.03 0.00 -1.03 0.00 0.00 54.13 53.51 2gh2 s LEU 106 Cb -0.16 -2.27 -0.02 0.00 0.03 0.00 0.00 46.19 43.77 2gh2 s LEU 106 CO 0.04 0.36 -0.10 -0.36 0.23 0.00 0.00 176.35 176.52 2gh2 s PHE 107 N -1.12 0.85 0.60 0.29 0.08 -0.30 -0.56 117.98 117.82 2gh2 s PHE 107 Ca 0.19 -0.43 -0.09 0.00 0.12 0.00 0.00 56.93 56.72 2gh2 s PHE 107 Cb -0.12 -0.50 -0.02 0.00 -0.57 0.00 0.00 43.02 41.81 2gh2 s PHE 107 CO 0.09 -0.03 0.97 -0.51 -0.10 0.00 0.00 175.22 175.64 2gh2 s ASP 108 N -1.43 5.97 0.26 1.36 1.01 -1.26 -1.09 116.67 121.49 2gh2 s ASP 108 Ca -0.06 1.14 -0.30 0.00 0.71 0.00 0.00 52.55 54.04 2gh2 s ASP 108 Cb -0.09 -2.19 -0.10 0.00 1.01 0.00 0.00 42.92 41.55 2gh2 s ASP 108 CO 0.01 -0.93 1.48 0.26 0.21 0.00 0.00 175.17 176.20 2gh2 s TRP 109 N -3.09 2.95 0.76 4.23 0.52 -1.26 -4.76 118.94 118.29 2gh2 s TRP 109 Ca 0.54 0.96 -0.11 0.00 0.02 0.00 0.00 56.10 57.51 2gh2 s TRP 109 Cb -0.11 -3.89 0.05 0.00 -1.15 0.00 0.00 33.47 28.38 2gh2 s TRP 109 CO 0.50 -2.92 1.09 -1.25 0.02 0.00 0.00 176.95 174.39 2gh2 s PRO 110 N -0.41 2.33 0.66 4.98 0.04 -1.26 -5.05 135.00 136.30 2gh2 s PRO 110 Ca 0.60 1.13 -0.03 0.00 0.04 0.00 0.00 61.00 62.74 2gh2 s PRO 110 Cb -0.43 -1.91 0.07 0.00 0.04 0.00 0.00 34.50 32.26 2gh2 s PRO 110 CO 0.44 -1.58 0.94 -0.51 0.04 0.00 0.00 177.00 176.34 2gh2 s ASP 111 N -3.45 4.83 0.47 6.66 1.01 -1.26 -4.97 116.67 119.95 2gh2 s ASP 111 Ca 0.61 0.16 0.17 0.00 0.71 0.00 0.00 52.55 54.20 2gh2 s ASP 111 Cb -0.17 -0.83 1.11 0.00 1.01 0.00 0.00 42.92 44.04 2gh2 s ASP 111 CO 0.56 -1.53 2.02 0.11 0.21 0.00 0.00 175.17 176.54 2gh2 h LYS 112 N -0.40 0.00 -6.79 8.23 1.57 -1.98 -3.43 116.57 113.77 2gh2 h LYS 112 Ca -0.42 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 57.84 2gh2 h LYS 112 Cb 1.30 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.64 2gh2 h LYS 112 CO 0.54 0.16 0.55 0.21 -0.57 0.00 0.00 179.45 180.34 2gh2 s LYS 113 N -4.58 4.51 0.17 3.15 2.20 -1.26 -4.96 119.74 118.97 2gh2 s LYS 113 Ca -0.04 1.95 -0.31 0.00 -0.36 0.00 0.00 55.97 57.21 2gh2 s LYS 113 Cb 0.15 -3.17 -0.10 0.00 -1.51 0.00 0.00 37.83 33.21 2gh2 s LYS 113 CO 0.67 0.01 1.50 0.45 -0.36 0.00 0.00 175.35 177.62 2gh2 s SER 114 N -0.49 6.66 -0.00 1.43 0.15 -1.26 -4.92 113.70 115.26 2gh2 s SER 114 Ca 0.48 2.56 -0.28 0.00 0.70 0.00 0.00 55.95 59.41 2gh2 s SER 114 Cb -0.35 -2.60 0.10 0.00 -1.71 0.00 0.00 66.02 61.46 2gh2 s SER 114 CO 0.43 -0.76 0.85 0.21 1.20 0.00 0.00 173.24 175.18 2gh2 s ASN 115 N 0.96 -0.41 0.23 5.45 3.84 -0.41 -5.02 114.94 119.57 2gh2 s ASN 115 Ca 0.66 0.08 -0.30 0.00 0.21 0.00 0.00 52.86 53.52 2gh2 s ASN 115 Cb -0.42 0.41 -0.09 0.00 -0.55 0.00 0.00 41.25 40.60 2gh2 s ASN 115 CO 0.34 -0.64 1.36 -0.70 -2.79 0.00 0.00 177.10 174.66 2gh2 s GLU 116 N -2.87 4.34 -0.39 0.43 2.56 -1.19 -3.28 118.70 118.30 2gh2 s GLU 116 Ca 0.03 2.16 -0.25 0.00 0.00 0.00 0.00 54.97 56.91 2gh2 s GLU 116 Cb -0.01 -3.15 0.02 0.00 2.00 0.00 0.00 34.13 32.98 2gh2 s GLU 116 CO -0.07 -0.30 0.87 -1.64 -0.56 0.00 0.00 175.26 173.55 2gh2 s MET 117 N -0.35 3.70 -0.19 4.30 -1.94 0.36 -4.97 119.30 120.21 2gh2 s MET 117 Ca 0.57 0.34 -0.14 0.00 -1.71 0.00 0.00 55.69 54.74 2gh2 s MET 117 Cb -0.39 -3.84 -0.04 0.00 2.01 0.00 0.00 34.83 32.57 2gh2 s MET 117 CO 0.41 -0.99 0.32 0.42 -0.01 0.00 0.00 175.02 175.17 2gh2 s ILE 118 N 3.40 5.26 0.43 2.53 -1.09 -1.26 -4.94 121.20 125.53 2gh2 s ILE 118 Ca 0.35 0.57 -0.26 0.00 -2.23 0.00 0.00 60.65 59.08 2gh2 s ILE 118 Cb -0.12 -3.66 -0.09 0.00 -1.58 0.00 0.00 42.46 37.01 2gh2 s ILE 118 CO 0.20 0.31 1.44 2.29 -1.23 0.00 0.00 174.94 177.95 2gh2 n LYS 119 N 4.15 2.34 0.08 2.79 2.85 -1.26 -4.64 118.16 124.47 2gh2 n LYS 119 Ca -0.11 0.83 -0.21 0.00 -1.05 0.00 0.00 58.31 57.78 2gh2 n LYS 119 Cb 0.51 -2.62 -0.15 0.00 -0.65 0.00 0.00 35.03 32.12 2gh2 n LYS 119 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 2gh2 h LYS 120 N 2.45 0.36 -2.06 -1.58 1.57 -1.20 -3.49 116.57 112.60 2gh2 h LYS 120 Ca -0.51 -0.61 0.26 0.00 -1.87 0.00 0.00 60.65 57.93 2gh2 h LYS 120 Cb 1.26 0.23 -0.08 0.00 0.08 0.00 0.00 32.23 33.72 2gh2 h LYS 120 CO 0.62 1.25 0.72 -1.54 -0.57 0.00 0.00 179.45 179.93 2gh2 s SER 121 N -7.21 -0.05 0.06 0.86 1.04 -1.23 -5.01 113.70 102.16 2gh2 s SER 121 Ca -0.12 -0.35 -0.16 0.00 0.48 0.00 0.00 55.95 55.81 2gh2 s SER 121 Cb 0.06 0.31 0.03 0.00 0.10 0.00 0.00 66.02 66.51 2gh2 s SER 121 CO 0.87 -0.59 0.36 -1.83 0.98 0.00 0.00 173.24 173.03 2gh2 s GLU 122 N -2.40 0.90 0.13 4.02 -1.05 -1.26 -1.04 118.70 118.00 2gh2 s GLU 122 Ca 0.20 -0.51 -0.19 0.00 -0.15 0.00 0.00 54.97 54.32 2gh2 s GLU 122 Cb 0.00 0.40 0.05 0.00 -0.44 0.00 0.00 34.13 34.14 2gh2 s GLU 122 CO 0.00 -0.31 0.47 -0.98 0.95 0.00 0.00 175.26 175.39 2gh2 s ARG 123 N -2.83 1.13 -0.26 -4.83 1.70 -0.14 -5.00 118.95 108.73 2gh2 s ARG 123 Ca -0.03 -0.60 -0.09 0.00 -0.47 0.00 0.00 55.73 54.53 2gh2 s ARG 123 Cb 0.00 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 34.84 2gh2 s ARG 123 CO -0.05 -0.46 0.14 0.99 -1.08 0.00 0.00 175.30 174.84 2gh2 s THR 124 N -3.69 4.94 -0.12 4.99 2.01 -1.26 -0.67 115.64 121.84 2gh2 s THR 124 Ca 0.02 0.04 -0.18 0.00 0.31 0.00 0.00 61.69 61.88 2gh2 s THR 124 Cb 0.01 -3.33 -0.04 0.00 0.01 0.00 0.00 72.50 69.15 2gh2 s THR 124 CO -0.12 0.30 0.48 -0.76 -0.69 0.00 0.00 174.62 173.84 2gh2 s LEU 125 N 1.56 4.26 0.40 4.42 1.43 0.67 -4.96 118.68 126.47 2gh2 s LEU 125 Ca 0.07 0.81 0.08 0.00 -1.03 0.00 0.00 54.13 54.05 2gh2 s LEU 125 Cb -0.15 -2.70 -0.03 0.00 0.03 0.00 0.00 46.19 43.33 2gh2 s LEU 125 CO 0.07 -0.02 0.28 -0.13 0.23 0.00 0.00 176.35 176.78 2gh2 s ARG 126 N 0.72 2.42 0.01 1.70 0.52 -1.26 -1.76 118.95 121.30 2gh2 s ARG 126 Ca 0.26 -1.62 -0.38 0.00 -0.52 0.00 0.00 55.73 53.46 2gh2 s ARG 126 Cb -0.15 -2.23 -0.18 0.00 0.52 0.00 0.00 34.95 32.91 2gh2 s ARG 126 CO 0.10 -0.11 1.32 -1.91 0.02 0.00 0.00 175.30 174.72 2gh2 n GLU 127 N -1.39 0.82 -0.40 3.54 2.13 -1.19 -1.24 120.64 122.91 2gh2 n GLU 127 Ca 0.01 0.30 0.00 0.00 0.66 0.00 0.00 57.16 58.13 2gh2 n GLU 127 Cb 0.62 -1.90 0.00 0.00 0.27 0.00 0.00 31.44 30.43 2gh2 n GLU 127 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2gh2 n ASN 128 N 2.58 0.00 -4.78 4.31 5.03 0.49 -4.97 115.26 117.91 2gh2 n ASN 128 Ca 0.20 0.00 -0.36 0.00 0.87 0.00 0.00 54.58 55.29 2gh2 n ASN 128 Cb 0.15 -0.38 -0.04 0.00 -1.02 0.00 0.00 39.78 38.48 2gh2 n ASN 128 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 2gh2 s GLN 129 N -0.09 4.14 -0.16 3.52 0.74 -0.37 -4.67 119.66 122.77 2gh2 s GLN 129 Ca 0.00 1.49 0.02 0.00 0.05 0.00 0.00 55.36 56.91 2gh2 s GLN 129 Cb 0.00 -2.49 0.02 0.00 1.10 0.00 0.00 33.01 31.63 2gh2 s GLN 129 CO 0.00 -0.16 -0.20 0.00 -0.55 0.00 0.00 175.29 174.38 2gh2 s ALA 131 N 1.10 4.11 0.01 0.00 0.00 0.20 -4.90 121.76 122.28 2gh2 s ALA 131 Ca -0.01 -1.36 0.01 0.00 0.00 0.00 0.00 51.96 50.60 2gh2 s ALA 131 Cb -0.14 -1.70 -0.01 0.00 0.00 0.00 0.00 23.12 21.27 2gh2 s ALA 131 CO -0.08 0.08 -0.03 -0.47 0.00 0.00 0.00 175.76 175.27 2gh2 s TYR 132 N -2.09 0.29 0.01 0.00 5.04 -1.26 -0.66 117.35 118.68 2gh2 s TYR 132 Ca 0.40 -0.19 -0.15 0.00 -2.44 0.00 0.00 57.07 54.69 2gh2 s TYR 132 Cb -0.09 -0.19 0.02 0.00 0.35 0.00 0.00 41.96 42.05 2gh2 s TYR 132 CO 0.30 -0.05 0.33 -1.50 -1.34 0.00 0.00 175.55 173.29 2gh2 s ILE 133 N -0.49 0.07 0.16 3.14 2.07 -0.36 -5.03 121.20 120.75 2gh2 s ILE 133 Ca -0.04 -0.54 -0.12 0.00 -1.41 0.00 0.00 60.65 58.54 2gh2 s ILE 133 Cb -0.04 -0.80 0.01 0.00 0.13 0.00 0.00 42.46 41.77 2gh2 s ILE 133 CO -0.00 -0.30 0.36 0.54 -1.91 0.00 0.00 174.94 173.63 2gh2 s ASN 134 N -1.70 -0.08 0.58 4.50 2.20 -1.26 -1.55 114.94 117.64 2gh2 s ASN 134 Ca -0.09 -0.65 0.28 0.00 -0.94 0.00 0.00 52.86 51.45 2gh2 s ASN 134 Cb -0.03 0.47 1.72 0.00 -2.00 0.00 0.00 41.25 41.42 2gh2 s ASN 134 CO 0.01 -0.92 2.21 0.44 -2.94 0.00 0.00 177.10 175.90 2gh2 h ASP 135 N 2.44 0.00 0.48 3.54 3.32 -1.78 -1.54 116.42 122.88 2gh2 h ASP 135 Ca -0.31 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.66 2gh2 h ASP 135 Cb 1.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 2gh2 h ASP 135 CO 0.46 0.00 -0.36 0.77 -1.72 0.00 0.00 179.24 178.39 2gh2 h SER 136 N 0.00 0.00 0.10 6.45 4.64 -1.96 -3.04 113.55 119.74 2gh2 h SER 136 Ca 0.02 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.19 2gh2 h SER 136 Cb 0.10 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.21 2gh2 h SER 136 CO -0.00 0.36 -0.67 0.40 -0.87 0.00 0.00 176.83 176.04 2gh2 h ILE 137 N 0.00 1.54 0.00 0.95 2.04 -1.70 -3.51 117.51 116.82 2gh2 h ILE 137 Ca -0.00 -2.48 0.00 0.00 1.00 0.00 0.00 64.86 63.38 2gh2 h ILE 137 Cb 0.69 3.20 0.00 0.00 -0.74 0.00 0.00 36.82 39.97 2gh2 h ILE 137 CO 0.05 0.68 0.00 0.61 0.00 0.00 0.00 178.15 179.49 2gh2 n GLY 138 N 1.66 -0.04 3.68 5.37 0.00 -1.00 -4.94 105.19 109.92 2gh2 n GLY 138 Ca -0.14 -1.35 -0.24 0.00 0.00 0.00 0.00 46.02 44.29 2gh2 n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gh2 s LEU 139 N 0.00 3.08 0.21 0.99 1.43 -0.25 -4.33 118.68 119.80 2gh2 s LEU 139 Ca 0.00 -0.96 -0.15 0.00 -1.03 0.00 0.00 54.13 51.99 2gh2 s LEU 139 Cb 0.00 -1.46 0.01 0.00 0.03 0.00 0.00 46.19 44.77 2gh2 s LEU 139 CO 0.00 -0.31 0.48 -1.38 0.23 0.00 0.00 176.35 175.37 2gh2 s HIS 140 N -2.51 0.08 0.03 0.29 -3.43 -0.99 -1.14 115.29 107.61 2gh2 s HIS 140 Ca 0.37 -0.43 0.08 0.00 -0.80 0.00 0.00 55.06 54.27 2gh2 s HIS 140 Cb 0.00 0.29 -0.02 0.00 -1.43 0.00 0.00 32.58 31.41 2gh2 s HIS 140 CO 0.21 -0.92 -0.23 0.50 -2.00 0.00 0.00 174.74 172.30 2gh2 s ARG 141 N -3.92 1.60 -0.07 -0.38 3.52 -0.24 -1.14 118.95 118.31 2gh2 s ARG 141 Ca 0.14 -0.96 0.04 0.00 -0.13 0.00 0.00 55.73 54.81 2gh2 s ARG 141 Cb -0.00 -1.70 0.00 0.00 -1.56 0.00 0.00 34.95 31.69 2gh2 s ARG 141 CO 0.01 0.44 -0.18 0.08 -0.81 0.00 0.00 175.30 174.85 2gh2 s VAL 142 N -0.74 1.52 -0.03 7.11 1.01 -1.26 -1.30 120.40 126.71 2gh2 s VAL 142 Ca 0.09 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 2gh2 s VAL 142 Cb -0.09 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 34.97 2gh2 s VAL 142 CO 0.01 0.44 0.10 -1.61 0.00 0.00 0.00 175.10 174.04 2gh2 s GLU 143 N 0.32 0.21 -0.53 2.72 2.02 -0.10 -0.78 118.70 122.56 2gh2 s GLU 143 Ca -0.11 -0.03 -0.17 0.00 0.02 0.00 0.00 54.97 54.67 2gh2 s GLU 143 Cb -0.15 0.09 0.09 0.00 0.10 0.00 0.00 34.13 34.27 2gh2 s GLU 143 CO 0.05 -0.04 0.55 1.21 0.02 0.00 0.00 175.26 177.05 2gh2 s ASN 144 N -0.37 6.18 0.00 -0.19 2.47 0.75 -0.06 114.94 123.73 2gh2 s ASN 144 Ca -0.04 -1.41 0.29 0.00 0.42 0.00 0.00 52.86 52.12 2gh2 s ASN 144 Cb -0.03 -2.24 1.23 0.00 -1.45 0.00 0.00 41.25 38.75 2gh2 s ASN 144 CO 0.00 -0.88 1.85 1.33 -3.72 0.00 0.00 177.10 175.68 2gh2 n VAL 145 N 5.39 0.00 -2.01 -5.21 0.24 -1.26 -1.38 118.33 114.10 2gh2 n VAL 145 Ca -0.11 -0.14 -0.39 0.00 -2.04 0.00 0.00 64.34 61.66 2gh2 n VAL 145 Cb 0.43 0.14 0.01 0.00 -1.47 0.00 0.00 33.84 32.94 2gh2 n VAL 145 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2gh2 s SER 146 N -2.18 6.04 0.00 -1.34 0.15 -1.26 -4.69 113.70 110.43 2gh2 s SER 146 Ca 0.36 2.65 0.22 0.00 0.70 0.00 0.00 55.95 59.88 2gh2 s SER 146 Cb 0.21 -2.63 0.01 0.00 -1.71 0.00 0.00 66.02 61.89 2gh2 s SER 146 CO 0.40 -1.04 1.06 1.41 1.20 0.00 0.00 173.24 176.27 2gh2 n HIS 147 N -0.23 0.02 0.00 3.44 8.25 -1.26 -2.14 115.22 123.30 2gh2 n HIS 147 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 2gh2 n HIS 147 Cb 0.44 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.44 2gh2 n HIS 147 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2gh2 n THR 148 N -1.54 0.00 -3.93 1.59 -2.24 -1.26 -4.94 114.28 101.96 2gh2 n THR 148 Ca 0.04 -0.22 -0.28 0.00 -2.27 0.00 0.00 64.05 61.32 2gh2 n THR 148 Cb 0.34 0.98 -0.17 0.00 -2.10 0.00 0.00 70.33 69.38 2gh2 n THR 148 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2gh2 s GLU 149 N -0.47 1.68 0.60 -0.78 0.41 -1.26 -5.04 118.70 113.83 2gh2 s GLU 149 Ca 0.00 -0.39 -0.18 0.00 -0.41 0.00 0.00 54.97 53.99 2gh2 s GLU 149 Cb 0.00 -1.81 -0.03 0.00 -1.78 0.00 0.00 34.13 30.51 2gh2 s GLU 149 CO 0.00 -0.30 1.14 -2.14 -0.49 0.00 0.00 175.26 173.47 2gh2 s PRO 150 N 1.64 3.05 0.17 0.39 0.02 -1.26 -4.58 135.00 134.43 2gh2 s PRO 150 Ca 0.04 1.58 0.11 0.00 0.02 0.00 0.00 61.00 62.75 2gh2 s PRO 150 Cb -0.13 -1.97 -0.04 0.00 0.02 0.00 0.00 34.50 32.38 2gh2 s PRO 150 CO -0.09 -1.09 -0.23 0.00 -0.33 0.00 0.00 177.00 175.27 2gh2 s ALA 151 N -1.94 2.54 -0.03 -1.55 0.00 -0.26 -4.36 121.76 116.16 2gh2 s ALA 151 Ca 0.72 -1.56 0.01 0.00 0.00 0.00 0.00 51.96 51.13 2gh2 s ALA 151 Cb -0.24 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.49 2gh2 s ALA 151 CO 0.34 0.48 -0.03 0.08 0.00 0.00 0.00 175.76 176.62 2gh2 s VAL 152 N -1.46 0.37 0.10 0.00 1.01 0.10 -0.67 120.40 119.84 2gh2 s VAL 152 Ca 0.19 -0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.15 2gh2 s VAL 152 Cb -0.09 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 2gh2 s VAL 152 CO 0.09 0.17 -0.12 -0.94 0.00 0.00 0.00 175.10 174.31 2gh2 s SER 153 N 0.73 1.59 -0.21 3.32 1.04 -0.36 -0.28 113.70 119.53 2gh2 s SER 153 Ca -0.08 -0.76 -0.04 0.00 0.48 0.00 0.00 55.95 55.54 2gh2 s SER 153 Cb -0.12 -0.02 -0.02 0.00 0.10 0.00 0.00 66.02 65.97 2gh2 s SER 153 CO -0.01 -0.20 -0.02 -0.22 0.98 0.00 0.00 173.24 173.78 2gh2 s LEU 154 N -2.27 3.09 -0.03 2.42 2.96 0.12 -0.40 118.68 124.58 2gh2 s LEU 154 Ca 0.04 -0.28 0.07 0.00 -0.22 0.00 0.00 54.13 53.74 2gh2 s LEU 154 Cb -0.05 -1.78 -0.02 0.00 0.50 0.00 0.00 46.19 44.84 2gh2 s LEU 154 CO 0.01 0.03 -0.24 -1.00 -1.32 0.00 0.00 176.35 173.83 2gh2 s HIS 155 N 1.17 2.39 -0.09 5.38 3.76 0.11 -0.23 115.29 127.78 2gh2 s HIS 155 Ca 0.03 -0.41 0.02 0.00 -0.15 0.00 0.00 55.06 54.54 2gh2 s HIS 155 Cb -0.14 -1.52 0.01 0.00 1.11 0.00 0.00 32.58 32.04 2gh2 s HIS 155 CO 0.00 -0.02 -0.14 -1.17 -0.85 0.00 0.00 174.74 172.57 2gh2 s LEU 156 N -0.60 1.64 -0.07 0.89 0.20 -0.27 -0.68 118.68 119.78 2gh2 s LEU 156 Ca 0.09 -0.37 0.04 0.00 0.69 0.00 0.00 54.13 54.58 2gh2 s LEU 156 Cb -0.10 -0.98 0.00 0.00 -0.43 0.00 0.00 46.19 44.68 2gh2 s LEU 156 CO -0.01 0.01 -0.19 -0.31 -0.29 0.00 0.00 176.35 175.56 2gh2 s TYR 157 N 0.95 2.03 -0.07 5.38 4.12 -0.62 -0.66 117.35 128.48 2gh2 s TYR 157 Ca -0.08 -0.74 -0.03 0.00 0.02 0.00 0.00 57.07 56.24 2gh2 s TYR 157 Cb -0.15 -1.39 0.04 0.00 -1.52 0.00 0.00 41.96 38.94 2gh2 s TYR 157 CO -0.00 -0.30 0.14 0.45 0.02 0.00 0.00 175.55 175.85 2gh2 s SER 158 N 0.33 0.37 1.04 2.29 0.15 -0.70 -1.30 113.70 115.88 2gh2 s SER 158 Ca -0.13 0.28 -0.13 0.00 0.70 0.00 0.00 55.95 56.68 2gh2 s SER 158 Cb -0.16 0.19 0.21 0.00 -1.71 0.00 0.00 66.02 64.55 2gh2 s SER 158 CO 0.05 -0.20 1.08 -2.84 1.20 0.00 0.00 173.24 172.54 2gh2 s PRO 159 N 1.74 0.09 0.60 5.44 0.02 -1.26 -0.41 135.00 141.22 2gh2 s PRO 159 Ca -0.03 0.55 -0.18 0.00 0.02 0.00 0.00 61.00 61.36 2gh2 s PRO 159 Cb -0.12 -1.70 -0.03 0.00 0.02 0.00 0.00 34.50 32.67 2gh2 s PRO 159 CO -0.05 -2.97 1.14 -2.14 -0.33 0.00 0.00 177.00 172.65 2gh2 s PRO 160 N -4.87 3.04 -0.01 5.54 0.02 -1.25 -4.79 135.00 132.67 2gh2 s PRO 160 Ca 0.66 1.60 -0.06 0.00 0.02 0.00 0.00 61.00 63.23 2gh2 s PRO 160 Cb -0.20 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.36 2gh2 s PRO 160 CO 0.59 -1.10 0.12 -0.59 -0.33 0.00 0.00 177.00 175.69 2gh2 s PHE 161 N -1.91 0.01 -0.76 6.54 -0.12 -1.26 -5.03 117.98 115.45 2gh2 s PHE 161 Ca 0.72 -0.03 0.12 0.00 -0.05 0.00 0.00 56.93 57.69 2gh2 s PHE 161 Cb -0.25 -0.03 -0.08 0.00 -0.63 0.00 0.00 43.02 42.03 2gh2 s PHE 161 CO 0.33 -0.21 0.58 -0.25 -0.05 0.00 0.00 175.22 175.62 2gh2 n ASP 162 N 1.93 0.84 -4.06 1.98 8.00 -1.26 -4.99 116.55 118.99 2gh2 n ASP 162 Ca -0.20 -0.92 -0.07 0.00 0.71 0.00 0.00 54.79 54.31 2gh2 n ASP 162 Cb 0.56 0.82 -0.10 0.00 -0.02 0.00 0.00 41.12 42.38 2gh2 n ASP 162 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2gh2 s THR 163 N -1.93 0.21 0.12 -3.53 -4.23 -1.26 -0.67 115.64 104.34 2gh2 s THR 163 Ca 0.06 -1.73 -0.04 0.00 -1.18 0.00 0.00 61.69 58.80 2gh2 s THR 163 Cb 0.09 -1.51 0.02 0.00 1.34 0.00 0.00 72.50 72.44 2gh2 s THR 163 CO 0.43 -0.94 0.24 0.00 -0.54 0.00 0.00 174.62 173.80 2gh2 s HIS 165 N -6.82 2.41 -0.07 0.00 3.76 -1.26 -0.22 115.29 113.10 2gh2 s HIS 165 Ca 0.05 -0.37 -0.03 0.00 -0.15 0.00 0.00 55.06 54.56 2gh2 s HIS 165 Cb -0.01 -1.49 -0.04 0.00 1.11 0.00 0.00 32.58 32.15 2gh2 s HIS 165 CO 0.04 0.07 0.09 0.00 -0.85 0.00 0.00 174.74 174.08 2gh2 s ALA 166 N -0.71 3.64 -0.09 -1.40 0.00 -0.15 -2.98 121.76 120.07 2gh2 s ALA 166 Ca 0.11 -0.76 0.01 0.00 0.00 0.00 0.00 51.96 51.32 2gh2 s ALA 166 Cb -0.10 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.28 2gh2 s ALA 166 CO 0.01 0.64 -0.12 -0.06 0.00 0.00 0.00 175.76 176.22 2gh2 s PHE 167 N -1.06 2.80 -0.26 0.00 0.08 0.18 -1.45 117.98 118.27 2gh2 s PHE 167 Ca 0.18 -0.36 -0.29 0.00 0.12 0.00 0.00 56.93 56.58 2gh2 s PHE 167 Cb -0.12 -1.75 0.01 0.00 -0.57 0.00 0.00 43.02 40.59 2gh2 s PHE 167 CO 0.07 0.02 1.10 0.34 -0.10 0.00 0.00 175.22 176.65 2gh2 s ASP 168 N -0.20 6.98 0.54 1.36 -1.08 0.07 -4.33 116.67 120.01 2gh2 s ASP 168 Ca 0.01 1.28 0.26 0.00 -0.52 0.00 0.00 52.55 53.58 2gh2 s ASP 168 Cb -0.13 -2.54 1.55 0.00 -1.46 0.00 0.00 42.92 40.33 2gh2 s ASP 168 CO 0.03 -0.79 2.15 -0.61 0.52 0.00 0.00 175.17 176.47 2gh2 h GLN 169 N 7.93 0.00 0.00 4.34 4.15 -1.94 0.41 115.11 130.00 2gh2 h GLN 169 Ca -0.21 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.10 2gh2 h GLN 169 Cb 1.07 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.74 2gh2 h GLN 169 CO 1.00 0.06 -0.53 0.00 -1.93 0.00 0.00 178.83 177.44 2gh2 h ARG 170 N 0.00 0.00 0.00 1.69 2.47 -1.91 0.11 114.38 116.74 2gh2 h ARG 170 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2gh2 h ARG 170 Cb 0.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 2gh2 h ARG 170 CO 0.01 0.53 -0.65 0.25 0.56 0.00 0.00 179.97 180.67 2gh2 n THR 171 N -3.38 0.00 -0.09 2.04 -2.24 -0.89 -3.14 114.28 106.58 2gh2 n THR 171 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2gh2 n THR 171 Cb 0.67 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 2gh2 n THR 171 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gh2 n GLY 172 N 1.91 0.68 3.77 3.38 0.00 0.14 -1.29 105.19 113.78 2gh2 n GLY 172 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2gh2 n GLY 172 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2gh2 s HIS 173 N -2.32 2.72 0.24 1.61 5.04 -1.26 -4.64 115.29 116.68 2gh2 s HIS 173 Ca 0.00 1.34 0.11 0.00 -1.54 0.00 0.00 55.06 54.98 2gh2 s HIS 173 Cb 0.00 -3.78 -0.05 0.00 0.04 0.00 0.00 32.58 28.79 2gh2 s HIS 173 CO 0.00 -2.40 -0.20 -1.59 -2.34 0.00 0.00 174.74 168.21 2gh2 s LYS 174 N -2.23 1.68 -0.02 2.88 -2.85 -1.26 -0.75 119.74 117.19 2gh2 s LYS 174 Ca 0.57 -1.64 -0.03 0.00 -1.00 0.00 0.00 55.97 53.87 2gh2 s LYS 174 Cb -0.41 -1.84 0.00 0.00 -2.06 0.00 0.00 37.83 33.53 2gh2 s LYS 174 CO 0.53 0.36 0.07 0.54 0.10 0.00 0.00 175.35 176.95 2gh2 s ASN 175 N -3.19 -0.02 0.19 0.03 4.22 -0.53 -4.97 114.94 110.67 2gh2 s ASN 175 Ca 0.27 0.03 -0.30 0.00 -2.14 0.00 0.00 52.86 50.71 2gh2 s ASN 175 Cb -0.06 0.15 -0.08 0.00 1.28 0.00 0.00 41.25 42.54 2gh2 s ASN 175 CO 0.13 -0.10 1.13 -0.75 -2.04 0.00 0.00 177.10 175.48 2gh2 s LYS 176 N -0.31 4.56 0.03 3.55 2.20 -1.26 -0.97 119.74 127.54 2gh2 s LYS 176 Ca -0.04 1.78 0.06 0.00 -0.36 0.00 0.00 55.97 57.41 2gh2 s LYS 176 Cb -0.03 -3.25 -0.02 0.00 -1.51 0.00 0.00 37.83 33.02 2gh2 s LYS 176 CO 0.00 0.03 -0.17 0.08 -0.36 0.00 0.00 175.35 174.94 2gh2 s VAL 177 N -0.29 1.33 -0.17 4.02 1.01 0.69 -4.91 120.40 122.08 2gh2 s VAL 177 Ca 0.50 -0.99 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 2gh2 s VAL 177 Cb -0.31 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2gh2 s VAL 177 CO 0.36 0.15 0.04 -0.89 0.00 0.00 0.00 175.10 174.76 2gh2 s THR 178 N -0.72 4.56 0.26 3.92 2.01 -1.26 -1.67 115.64 122.74 2gh2 s THR 178 Ca 0.05 -0.12 -0.28 0.00 0.31 0.00 0.00 61.69 61.64 2gh2 s THR 178 Cb -0.08 -3.03 -0.09 0.00 0.01 0.00 0.00 72.50 69.31 2gh2 s THR 178 CO 0.01 0.48 0.93 -0.32 -0.69 0.00 0.00 174.62 175.03 2gh2 s MET 179 N 0.27 4.74 0.05 4.92 0.00 0.15 -5.00 119.30 124.44 2gh2 s MET 179 Ca 0.02 1.41 0.06 0.00 0.00 0.00 0.00 55.69 57.17 2gh2 s MET 179 Cb -0.13 -3.11 -0.02 0.00 0.00 0.00 0.00 34.83 31.57 2gh2 s MET 179 CO 0.01 0.44 -0.16 0.95 0.00 0.00 0.00 175.02 176.26 2gh2 s THR 180 N -1.33 1.24 -0.16 10.11 -4.23 -1.26 -4.91 115.64 115.11 2gh2 s THR 180 Ca 0.44 -1.13 -0.14 0.00 -1.18 0.00 0.00 61.69 59.67 2gh2 s THR 180 Cb -0.23 -1.13 -0.05 0.00 1.34 0.00 0.00 72.50 72.43 2gh2 s THR 180 CO 0.29 -0.02 0.31 -0.36 -0.54 0.00 0.00 174.62 174.31 2gh2 s PHE 181 N -0.95 3.47 0.21 3.99 0.08 -1.26 -4.59 117.98 118.92 2gh2 s PHE 181 Ca 0.02 0.63 -0.01 0.00 0.12 0.00 0.00 56.93 57.69 2gh2 s PHE 181 Cb -0.09 -2.37 0.16 0.00 -0.57 0.00 0.00 43.02 40.16 2gh2 s PHE 181 CO 0.02 0.23 1.53 1.25 -0.10 0.00 0.00 175.22 178.15 2gh2 h HIS 182 N 6.67 0.60 -3.40 0.36 -0.00 -0.76 -3.42 115.15 115.20 2gh2 h HIS 182 Ca -0.41 -0.21 -0.05 0.00 -0.00 0.00 0.00 60.37 59.70 2gh2 h HIS 182 Cb 1.17 -0.11 -0.13 0.00 -0.00 0.00 0.00 27.41 28.34 2gh2 h HIS 182 CO 0.60 0.92 -0.07 -1.54 -0.00 0.00 0.00 177.93 177.85 2gh2 s SER 183 N -6.91 -0.23 -0.04 3.26 1.04 -1.22 -1.35 113.70 108.25 2gh2 s SER 183 Ca -0.07 -0.35 -0.01 0.00 0.48 0.00 0.00 55.95 56.00 2gh2 s SER 183 Cb 0.12 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.75 2gh2 s SER 183 CO 0.83 -0.88 0.03 -0.54 0.98 0.00 0.00 173.24 173.66 2gh2 s LYS 184 N -3.82 0.19 -1.45 4.02 1.02 0.21 -1.21 119.74 118.70 2gh2 s LYS 184 Ca 0.04 0.21 -0.08 0.00 0.02 0.00 0.00 55.97 56.16 2gh2 s LYS 184 Cb 0.02 -0.59 0.04 0.00 -0.52 0.00 0.00 37.83 36.78 2gh2 s LYS 184 CO -0.11 -0.25 0.72 1.19 -0.92 0.00 0.00 175.35 175.98 2gh2 n PHE 185 N 4.84 -2.10 -0.51 3.18 3.72 0.11 -1.51 117.46 125.18 2gh2 n PHE 185 Ca -0.13 0.64 0.00 0.00 -0.05 0.00 0.00 57.45 57.92 2gh2 n PHE 185 Cb 0.50 -4.03 0.00 0.00 -0.94 0.00 0.00 39.48 35.01 2gh2 n PHE 185 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gh2 n GLY 186 N -1.52 1.21 3.57 1.37 0.00 -1.26 -5.03 105.19 103.53 2gh2 n GLY 186 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 2gh2 n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gh2 s ILE 187 N -3.22 4.66 0.23 -0.61 -1.09 -0.57 -4.96 121.20 115.64 2gh2 s ILE 187 Ca 0.00 -0.07 -0.31 0.00 -2.23 0.00 0.00 60.65 58.04 2gh2 s ILE 187 Cb 0.00 -3.13 -0.11 0.00 -1.58 0.00 0.00 42.46 37.64 2gh2 s ILE 187 CO 0.00 0.41 1.59 -0.60 -1.23 0.00 0.00 174.94 175.11 2gh2 s ARG 188 N 0.85 4.17 -0.52 2.79 6.06 -1.26 -0.62 118.95 130.43 2gh2 s ARG 188 Ca 0.04 2.48 0.03 0.00 -2.50 0.00 0.00 55.73 55.78 2gh2 s ARG 188 Cb -0.14 -3.09 0.14 0.00 0.06 0.00 0.00 34.95 31.93 2gh2 s ARG 188 CO 0.02 -0.62 0.29 0.95 -2.50 0.00 0.00 175.30 173.45 2gh2 s THR 189 N 0.62 2.11 -2.00 4.11 -4.23 -0.45 -4.87 115.64 110.94 2gh2 s THR 189 Ca 0.67 -3.17 0.24 0.00 -1.18 0.00 0.00 61.69 58.26 2gh2 s THR 189 Cb -0.46 -2.46 0.69 0.00 1.34 0.00 0.00 72.50 71.62 2gh2 s THR 189 CO 0.38 -0.88 1.82 -0.81 -0.54 0.00 0.00 174.62 174.59