#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ge8 s ARG 8 N 0.00 4.16 0.10 5.56 0.52 -1.26 -4.82 118.95 123.21 2ge8 s ARG 8 Ca 0.00 2.51 -0.14 0.00 -0.52 0.00 0.00 55.73 57.58 2ge8 s ARG 8 Cb 0.00 -3.06 0.02 0.00 0.52 0.00 0.00 34.95 32.43 2ge8 s ARG 8 CO 0.00 -0.61 0.81 0.98 0.02 0.00 0.00 175.30 176.50 2ge8 n TYR 9 N 2.67 -0.14 0.63 -0.53 9.36 -1.26 -1.10 117.16 126.79 2ge8 n TYR 9 Ca 0.10 0.65 0.07 0.00 3.32 0.00 0.00 57.90 62.03 2ge8 n TYR 9 Cb 0.38 -0.60 0.34 0.00 -0.63 0.00 0.00 39.34 38.83 2ge8 n TYR 9 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2ge8 n LYS 11 N -1.32 -0.39 -1.50 0.00 4.76 -0.26 -5.02 118.16 114.43 2ge8 n LYS 11 Ca 0.06 -0.38 -0.41 0.00 -2.87 0.00 0.00 58.31 54.71 2ge8 n LYS 11 Cb 0.12 -0.87 0.02 0.00 -1.84 0.00 0.00 35.03 32.45 2ge8 n LYS 11 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2ge8 n ARG 12 N -0.05 0.74 -4.25 1.97 1.74 -0.88 -4.96 116.66 110.96 2ge8 n ARG 12 Ca 0.00 0.27 -0.14 0.00 -0.77 0.00 0.00 57.85 57.21 2ge8 n ARG 12 Cb 0.04 -1.68 -0.10 0.00 -1.02 0.00 0.00 32.46 29.70 2ge8 n ARG 12 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2ge8 s THR 13 N -1.47 0.58 -0.26 0.55 -4.23 -1.26 -5.09 115.64 104.45 2ge8 s THR 13 Ca 0.65 -1.98 -0.11 0.00 -1.18 0.00 0.00 61.69 59.07 2ge8 s THR 13 Cb -0.56 -2.27 -0.05 0.00 1.34 0.00 0.00 72.50 70.96 2ge8 s THR 13 CO 0.57 -0.33 0.17 -0.63 -0.54 0.00 0.00 174.62 173.86 2ge8 s ILE 14 N -3.73 5.28 0.41 2.99 1.01 -1.26 -5.07 121.20 120.83 2ge8 s ILE 14 Ca 0.28 0.16 -0.00 0.00 0.00 0.00 0.00 60.65 61.09 2ge8 s ILE 14 Cb 0.07 -3.49 -0.02 0.00 0.01 0.00 0.00 42.46 39.03 2ge8 s ILE 14 CO 0.07 0.29 0.64 -2.16 0.00 0.00 0.00 174.94 173.78 2ge8 s PRO 15 N 1.49 3.30 0.23 2.79 0.04 -1.26 -4.86 135.00 136.72 2ge8 s PRO 15 Ca 0.07 -0.33 -0.25 0.00 0.04 0.00 0.00 61.00 60.53 2ge8 s PRO 15 Cb -0.15 -2.57 -0.16 0.00 0.04 0.00 0.00 34.50 31.66 2ge8 s PRO 15 CO 0.08 -0.10 0.40 -2.30 0.04 0.00 0.00 177.00 175.12 2ge8 n PRO 16 N -1.99 0.00 -0.90 0.56 -0.02 -1.26 -2.27 135.00 129.13 2ge8 n PRO 16 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 2ge8 n PRO 16 Cb 0.57 -0.94 0.00 0.00 -0.02 0.00 0.00 33.50 33.11 2ge8 n PRO 16 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ge8 n GLY 17 N 1.95 0.49 3.88 -1.23 0.00 -1.26 -5.01 105.19 104.00 2ge8 n GLY 17 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2ge8 n GLY 17 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ge8 s TYR 18 N -2.34 3.56 0.98 1.61 1.51 -0.96 -5.08 117.35 116.64 2ge8 s TYR 18 Ca 0.00 0.67 -0.14 0.00 -1.01 0.00 0.00 57.07 56.59 2ge8 s TYR 18 Cb 0.00 -2.07 0.18 0.00 -0.11 0.00 0.00 41.96 39.96 2ge8 s TYR 18 CO 0.00 0.54 1.14 0.15 -1.11 0.00 0.00 175.55 176.27 2ge8 s LYS 19 N -1.97 0.58 -0.10 -0.62 1.02 -1.26 -3.77 119.74 113.62 2ge8 s LYS 19 Ca 0.32 0.24 -0.23 0.00 0.02 0.00 0.00 55.97 56.32 2ge8 s LYS 19 Cb -0.13 -1.78 -0.28 0.00 -0.52 0.00 0.00 37.83 35.12 2ge8 s LYS 19 CO 0.18 -2.57 0.74 0.28 -0.92 0.00 0.00 175.35 173.07 2ge8 h VAL 20 N -1.77 1.48 0.00 3.17 2.07 -1.83 -3.35 116.25 116.02 2ge8 h VAL 20 Ca -0.50 -2.42 0.00 0.00 0.82 0.00 0.00 66.70 64.59 2ge8 h VAL 20 Cb 1.32 3.11 0.00 0.00 -1.52 0.00 0.00 31.29 34.20 2ge8 h VAL 20 CO 0.55 0.64 0.00 -0.90 0.02 0.00 0.00 177.57 177.89 2ge8 n ASP 21 N -4.28 0.00 0.07 0.57 5.75 -1.25 -0.48 116.55 116.92 2ge8 n ASP 21 Ca -0.16 -0.30 -0.02 0.00 -0.01 0.00 0.00 54.79 54.30 2ge8 n ASP 21 Cb 0.71 -0.12 -0.06 0.00 -1.03 0.00 0.00 41.12 40.62 2ge8 n ASP 21 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 2ge8 h GLN 22 N 0.00 0.00 0.00 0.11 4.20 -1.84 -3.27 115.11 114.31 2ge8 h GLN 22 Ca 0.00 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.53 2ge8 h GLN 22 Cb 0.07 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 2ge8 h GLN 22 CO 0.00 0.58 -1.46 0.28 -0.67 0.00 0.00 178.83 177.56 2ge8 n VAL 23 N -3.15 1.27 -0.58 -0.54 0.31 0.37 -4.68 118.33 111.33 2ge8 n VAL 23 Ca -0.04 -0.04 0.07 0.00 -0.01 0.00 0.00 64.34 64.32 2ge8 n VAL 23 Cb 0.86 -1.96 0.19 0.00 -0.91 0.00 0.00 33.84 32.01 2ge8 n VAL 23 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2ge8 n PHE 24 N -4.06 0.61 -0.04 3.52 3.01 -0.14 -5.07 117.46 115.29 2ge8 n PHE 24 Ca -0.26 -0.70 0.00 0.00 1.01 0.00 0.00 57.45 57.51 2ge8 n PHE 24 Cb 0.59 -0.16 -0.00 0.00 -0.01 0.00 0.00 39.48 39.89 2ge8 n PHE 24 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ge8 n GLY 25 N -0.15 -1.79 3.63 1.37 0.00 -1.22 -4.88 105.19 102.15 2ge8 n GLY 25 Ca 0.15 -1.50 -0.49 0.00 0.00 0.00 0.00 46.02 44.18 2ge8 n GLY 25 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ge8 n PRO 26 N -2.19 1.58 -1.77 1.61 -0.04 -1.25 -3.93 135.00 129.01 2ge8 n PRO 26 Ca -0.00 0.57 -0.41 0.00 -0.04 0.00 0.00 63.50 63.62 2ge8 n PRO 26 Cb 0.02 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.21 2ge8 n PRO 26 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2ge8 n ARG 27 N 2.96 2.59 -4.74 0.54 5.12 -1.26 -4.94 116.66 116.92 2ge8 n ARG 27 Ca 0.18 0.91 -0.32 0.00 -1.93 0.00 0.00 57.85 56.68 2ge8 n ARG 27 Cb 0.23 -2.65 -0.08 0.00 -1.16 0.00 0.00 32.46 28.80 2ge8 n ARG 27 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2ge8 s THR 28 N -1.13 1.20 -0.17 0.55 -4.23 0.48 -4.88 115.64 107.47 2ge8 s THR 28 Ca 0.55 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.06 2ge8 s THR 28 Cb -0.47 -2.23 0.02 0.00 1.34 0.00 0.00 72.50 71.16 2ge8 s THR 28 CO 0.63 0.00 -0.17 -0.54 -0.54 0.00 0.00 174.62 173.99 2ge8 s LYS 29 N -3.86 2.67 -1.01 3.99 1.02 -1.26 -4.24 119.74 117.06 2ge8 s LYS 29 Ca 0.09 -0.73 0.00 0.00 0.02 0.00 0.00 55.97 55.34 2ge8 s LYS 29 Cb 0.02 -2.39 0.00 0.00 -0.52 0.00 0.00 37.83 34.95 2ge8 s LYS 29 CO 0.04 -0.23 0.00 0.41 -0.92 0.00 0.00 175.35 174.65 2ge8 n GLY 30 N 4.68 -0.05 3.34 -3.33 0.00 -1.26 -5.00 105.19 103.57 2ge8 n GLY 30 Ca -0.19 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 2ge8 n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ge8 s LYS 31 N -4.51 1.42 0.32 1.61 1.02 -1.26 -5.10 119.74 113.23 2ge8 s LYS 31 Ca 0.00 -1.58 -0.28 0.00 0.02 0.00 0.00 55.97 54.13 2ge8 s LYS 31 Cb 0.00 0.35 -0.13 0.00 -0.52 0.00 0.00 37.83 37.53 2ge8 s LYS 31 CO 0.00 -0.53 1.24 0.39 -0.92 0.00 0.00 175.35 175.54 2ge8 n GLU 32 N -0.37 1.94 -2.52 1.68 1.02 -1.26 -3.06 120.64 118.08 2ge8 n GLU 32 Ca 0.01 0.68 -0.06 0.00 -0.02 0.00 0.00 57.16 57.78 2ge8 n GLU 32 Cb 0.64 -2.22 0.03 0.00 -0.02 0.00 0.00 31.44 29.87 2ge8 n GLU 32 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ge8 n GLY 33 N 1.04 0.17 0.00 0.62 0.00 -1.26 -4.58 105.19 101.19 2ge8 n GLY 33 Ca 0.07 -0.28 0.05 0.00 0.00 0.00 0.00 46.02 45.86 2ge8 n GLY 33 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ge8 n ASN 34 N -1.66 1.05 -4.57 1.61 6.94 -1.17 0.18 115.26 117.63 2ge8 n ASN 34 Ca -0.10 -0.54 -0.43 0.00 -0.02 0.00 0.00 54.58 53.49 2ge8 n ASN 34 Cb 0.56 1.13 -0.04 0.00 -2.36 0.00 0.00 39.78 39.07 2ge8 n ASN 34 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 2ge8 s PHE 35 N -2.20 2.95 0.00 -2.53 5.36 -1.26 -1.01 117.98 119.29 2ge8 s PHE 35 Ca 0.02 0.43 0.00 0.00 -0.96 0.00 0.00 56.93 56.42 2ge8 s PHE 35 Cb 0.08 -3.90 0.00 0.00 -0.34 0.00 0.00 43.02 38.86 2ge8 s PHE 35 CO 0.44 -1.05 0.00 0.41 -1.46 0.00 0.00 175.22 173.56 2ge8 n GLY 36 N 4.85 4.31 0.00 13.12 0.00 -0.91 -4.94 105.19 121.61 2ge8 n GLY 36 Ca 0.06 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.42 2ge8 n GLY 36 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ge8 n ASP 37 N 0.00 0.00 -0.06 1.61 5.68 -1.26 -3.76 116.55 118.76 2ge8 n ASP 37 Ca 0.00 0.00 -0.17 0.00 -0.50 0.00 0.00 54.79 54.12 2ge8 n ASP 37 Cb 0.00 0.00 -0.14 0.00 -1.14 0.00 0.00 41.12 39.84 2ge8 n ASP 37 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2ge8 n ASP 38 N 0.00 1.65 0.24 -1.12 8.00 0.53 -3.40 116.55 122.45 2ge8 n ASP 38 Ca 0.00 0.08 0.10 0.00 0.71 0.00 0.00 54.79 55.68 2ge8 n ASP 38 Cb 0.00 -0.37 0.61 0.00 -0.02 0.00 0.00 41.12 41.35 2ge8 n ASP 38 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2ge8 h LYS 39 N 0.03 0.00 0.17 -1.24 3.64 -1.95 -2.19 116.57 115.03 2ge8 h LYS 39 Ca -0.48 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 58.66 2ge8 h LYS 39 Cb 2.01 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.85 2ge8 h LYS 39 CO 0.02 0.18 -1.08 1.98 -2.27 0.00 0.00 179.45 178.27 2ge8 h MET 40 N 0.00 0.36 0.00 1.90 4.05 -1.90 -2.47 114.93 116.87 2ge8 h MET 40 Ca -0.00 -0.61 0.00 0.00 -0.28 0.00 0.00 59.70 58.80 2ge8 h MET 40 Cb 0.42 0.23 0.00 0.00 -0.80 0.00 0.00 31.60 31.45 2ge8 h MET 40 CO 0.02 1.29 0.00 -1.71 0.23 0.00 0.00 176.91 176.75 2ge8 n ASN 41 N -3.98 0.00 0.00 1.39 4.05 -1.07 -2.71 115.26 112.94 2ge8 n ASN 41 Ca -0.16 -1.13 0.00 0.00 0.45 0.00 0.00 54.58 53.74 2ge8 n ASN 41 Cb 0.91 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.92 2ge8 n ASN 41 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2ge8 n GLU 42 N -0.53 1.99 0.02 1.20 1.02 -0.85 -3.97 120.64 119.52 2ge8 n GLU 42 Ca 0.01 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.26 2ge8 n GLU 42 Cb 0.00 -0.94 0.01 0.00 -0.02 0.00 0.00 31.44 30.49 2ge8 n GLU 42 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2ge8 n GLU 43 N -2.07 0.26 0.00 3.49 1.02 -0.93 -4.58 120.64 117.82 2ge8 n GLU 43 Ca 0.00 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 2ge8 n GLU 43 Cb 0.44 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 2ge8 n GLU 43 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ge8 n GLY 44 N 1.39 2.86 0.05 0.62 0.00 -1.10 -0.78 105.19 108.22 2ge8 n GLY 44 Ca 0.02 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 45.97 2ge8 n GLY 44 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2ge8 n ILE 45 N 0.00 1.16 -0.13 -0.61 -5.35 -1.26 -2.67 119.36 110.49 2ge8 n ILE 45 Ca 0.00 0.34 -0.07 0.00 -0.27 0.00 0.00 62.75 62.76 2ge8 n ILE 45 Cb 0.00 -1.22 0.10 0.00 -1.74 0.00 0.00 39.64 36.79 2ge8 n ILE 45 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 2ge8 h LYS 46 N 0.00 0.87 -6.42 6.28 1.79 -1.33 -3.43 116.57 114.33 2ge8 h LYS 46 Ca 0.00 -0.28 -0.53 0.00 -2.18 0.00 0.00 60.65 57.66 2ge8 h LYS 46 Cb 0.20 -0.08 0.02 0.00 -1.58 0.00 0.00 32.23 30.79 2ge8 h LYS 46 CO 0.00 0.91 1.02 0.34 -1.08 0.00 0.00 179.45 180.64 2ge8 s ASP 47 N -6.65 6.61 0.15 0.86 -1.08 -1.09 -4.91 116.67 110.55 2ge8 s ASP 47 Ca -0.10 2.46 0.26 0.00 -0.52 0.00 0.00 52.55 54.65 2ge8 s ASP 47 Cb 0.14 -2.56 0.94 0.00 -1.46 0.00 0.00 42.92 39.98 2ge8 s ASP 47 CO 0.83 -0.90 1.79 0.61 0.52 0.00 0.00 175.17 178.02 2ge8 n GLY 48 N 4.04 -1.56 0.30 2.66 0.00 -1.26 -2.44 105.19 106.93 2ge8 n GLY 48 Ca 0.16 -0.03 -0.05 0.00 0.00 0.00 0.00 46.02 46.10 2ge8 n GLY 48 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2ge8 h ARG 49 N 0.00 0.92 -0.23 1.61 3.08 -1.95 -2.83 114.38 114.99 2ge8 h ARG 49 Ca 0.00 -0.23 0.06 0.00 0.07 0.00 0.00 59.98 59.88 2ge8 h ARG 49 Cb 0.60 -0.11 -0.07 0.00 0.08 0.00 0.00 29.97 30.47 2ge8 h ARG 49 CO 0.00 0.87 -0.24 0.28 -1.07 0.00 0.00 179.97 179.81 2ge8 h VAL 50 N 0.86 0.40 -0.50 2.04 2.07 -1.79 0.35 116.25 119.68 2ge8 h VAL 50 Ca 0.17 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.70 2ge8 h VAL 50 Cb 0.41 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2ge8 h VAL 50 CO 0.01 0.00 0.33 0.74 0.02 0.00 0.00 177.57 178.68 2ge8 h THR 51 N -0.25 1.13 0.01 2.57 2.02 -1.63 0.28 112.91 117.04 2ge8 h THR 51 Ca 0.13 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 2ge8 h THR 51 Cb 0.45 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 2ge8 h THR 51 CO -0.37 0.12 -0.01 0.00 0.37 0.00 0.00 175.52 175.63 2ge8 h ALA 52 N 1.69 -0.02 -0.53 6.16 0.00 -1.22 -3.12 119.26 122.22 2ge8 h ALA 52 Ca 0.19 -0.38 0.10 0.00 0.00 0.00 0.00 54.91 54.82 2ge8 h ALA 52 Cb -0.07 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2ge8 h ALA 52 CO -0.04 -0.11 0.36 0.52 0.00 0.00 0.00 179.25 179.98 2ge8 h MET 53 N -0.81 0.27 0.00 0.00 2.86 0.02 0.18 114.93 117.46 2ge8 h MET 53 Ca -0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2ge8 h MET 53 Cb 0.76 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.36 2ge8 h MET 53 CO 0.00 0.18 0.00 -0.07 1.06 0.00 0.00 176.91 178.08 2ge8 h LEU 54 N 0.28 0.00 -0.52 1.22 3.38 -0.37 -1.46 115.31 117.84 2ge8 h LEU 54 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2ge8 h LEU 54 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2ge8 h LEU 54 CO -0.05 0.00 0.00 0.78 0.09 0.00 0.00 178.44 179.26 2ge8 h ASN 55 N 0.00 0.00 0.03 -0.43 2.35 -0.67 -2.86 115.58 114.00 2ge8 h ASN 55 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2ge8 h ASN 55 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 2ge8 h ASN 55 CO 0.00 0.00 -0.62 0.18 -1.65 0.00 0.00 177.43 175.34 2ge8 n LEU 56 N -2.41 1.57 -4.69 1.61 4.77 -0.55 -4.95 117.00 112.35 2ge8 n LEU 56 Ca 0.03 -0.61 -0.42 0.00 -0.03 0.00 0.00 56.01 54.98 2ge8 n LEU 56 Cb 0.33 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 2ge8 n LEU 56 CO 0.25 0.31 0.80 -0.69 -1.33 0.00 0.00 177.39 176.73 2ge8 s VAL 57 N -2.66 4.76 0.63 4.08 1.01 -1.08 -4.65 120.40 122.48 2ge8 s VAL 57 Ca 0.16 2.02 -0.19 0.00 0.00 0.00 0.00 61.98 63.97 2ge8 s VAL 57 Cb 0.18 -4.30 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 2ge8 s VAL 57 CO 0.66 0.00 1.30 -2.16 0.00 0.00 0.00 175.10 174.91 2ge8 s PRO 58 N 2.04 2.68 0.76 2.72 0.04 -1.26 -4.98 135.00 136.99 2ge8 s PRO 58 Ca 0.49 2.09 -0.11 0.00 0.04 0.00 0.00 61.00 63.50 2ge8 s PRO 58 Cb -0.19 -1.92 0.05 0.00 0.04 0.00 0.00 34.50 32.48 2ge8 s PRO 58 CO 0.18 -1.51 1.10 -1.54 0.04 0.00 0.00 177.00 175.27 2ge8 s SER 59 N -1.32 4.52 0.24 6.66 1.04 -1.26 -4.71 113.70 118.86 2ge8 s SER 59 Ca 0.81 1.89 -0.12 0.00 0.48 0.00 0.00 55.95 59.00 2ge8 s SER 59 Cb -0.38 -2.53 0.31 0.00 0.10 0.00 0.00 66.02 63.52 2ge8 s SER 59 CO 0.41 -2.03 1.59 0.77 0.98 0.00 0.00 173.24 174.96 2ge8 h SER 60 N -0.93 -0.85 -0.47 7.02 4.64 -1.99 0.58 113.55 121.55 2ge8 h SER 60 Ca -0.44 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2ge8 h SER 60 Cb 1.24 0.53 -0.02 0.00 -0.31 0.00 0.00 62.40 63.83 2ge8 h SER 60 CO 0.51 -0.27 0.30 0.45 -0.87 0.00 0.00 176.83 176.94 2ge8 h HIS 61 N -0.02 0.61 0.08 4.77 3.86 -2.00 -1.73 115.15 120.72 2ge8 h HIS 61 Ca 0.37 0.01 -0.29 0.00 -1.16 0.00 0.00 60.37 59.30 2ge8 h HIS 61 Cb 0.59 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.84 2ge8 h HIS 61 CO -0.66 0.40 -1.48 0.00 0.86 0.00 0.00 177.93 177.05 2ge8 h ALA 62 N 1.68 0.37 -0.78 2.45 0.00 -1.42 -0.86 119.26 120.69 2ge8 h ALA 62 Ca 0.17 -1.14 0.08 0.00 0.00 0.00 0.00 54.91 54.03 2ge8 h ALA 62 Cb -0.04 0.25 -0.07 0.00 0.00 0.00 0.00 17.79 17.93 2ge8 h ALA 62 CO -0.03 1.23 0.44 0.00 0.00 0.00 0.00 179.25 180.89 2ge8 h LEU 64 N 0.77 -0.05 0.00 0.00 7.12 -1.26 -3.07 115.31 118.83 2ge8 h LEU 64 Ca 0.37 -0.63 0.00 0.00 0.13 0.00 0.00 57.88 57.74 2ge8 h LEU 64 Cb 0.30 0.01 0.00 0.00 -0.53 0.00 0.00 40.66 40.44 2ge8 h LEU 64 CO -0.22 0.70 -1.19 0.49 -0.13 0.00 0.00 178.44 178.08 2ge8 n PHE 65 N -4.75 0.74 0.59 1.25 3.01 -0.34 -4.31 117.46 113.65 2ge8 n PHE 65 Ca -0.08 0.21 0.07 0.00 1.01 0.00 0.00 57.45 58.67 2ge8 n PHE 65 Cb 0.33 -0.84 0.06 0.00 -0.01 0.00 0.00 39.48 39.02 2ge8 n PHE 65 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ge8 n GLY 66 N 1.21 -0.03 3.85 1.37 0.00 0.76 -4.99 105.19 107.35 2ge8 n GLY 66 Ca -0.01 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 2ge8 n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ge8 s SER 67 N -1.19 4.69 -0.37 1.61 0.01 -1.11 -4.79 113.70 112.56 2ge8 s SER 67 Ca 0.16 1.09 -0.22 0.00 1.31 0.00 0.00 55.95 58.30 2ge8 s SER 67 Cb 0.12 -1.78 0.01 0.00 0.21 0.00 0.00 66.02 64.58 2ge8 s SER 67 CO 0.18 -1.82 0.71 -0.60 0.41 0.00 0.00 173.24 172.13 2ge8 s ARG 68 N -5.33 3.67 -0.14 12.44 3.52 -0.33 -4.89 118.95 127.89 2ge8 s ARG 68 Ca 0.60 0.14 -0.14 0.00 -0.13 0.00 0.00 55.73 56.20 2ge8 s ARG 68 Cb -0.13 -3.83 -0.05 0.00 -1.56 0.00 0.00 34.95 29.39 2ge8 s ARG 68 CO 0.52 -0.83 0.31 0.08 -0.81 0.00 0.00 175.30 174.58 2ge8 s VAL 69 N 2.94 5.28 -0.23 7.11 1.01 -1.26 -0.92 120.40 134.33 2ge8 s VAL 69 Ca 0.28 0.60 -0.02 0.00 0.00 0.00 0.00 61.98 62.83 2ge8 s VAL 69 Cb -0.14 -3.65 0.07 0.00 0.00 0.00 0.00 36.38 32.67 2ge8 s VAL 69 CO 0.17 0.41 0.05 -0.89 0.00 0.00 0.00 175.10 174.83 2ge8 s THR 70 N 0.30 0.63 0.18 3.92 2.01 -0.49 -5.00 115.64 117.19 2ge8 s THR 70 Ca 0.18 -0.78 -0.28 0.00 0.31 0.00 0.00 61.69 61.12 2ge8 s THR 70 Cb -0.13 -1.21 -0.08 0.00 0.01 0.00 0.00 72.50 71.09 2ge8 s THR 70 CO 0.05 -0.33 0.87 -2.16 -0.69 0.00 0.00 174.62 172.37 2ge8 s PRO 71 N 1.79 4.70 -0.10 4.92 0.04 -1.26 -1.60 135.00 143.50 2ge8 s PRO 71 Ca 0.01 1.33 0.01 0.00 0.04 0.00 0.00 61.00 62.40 2ge8 s PRO 71 Cb -0.17 -3.30 0.02 0.00 0.04 0.00 0.00 34.50 31.09 2ge8 s PRO 71 CO -0.13 0.47 -0.11 0.21 0.04 0.00 0.00 177.00 177.48 2ge8 s LYS 72 N -0.88 1.75 -0.05 4.56 2.20 0.43 -4.99 119.74 122.75 2ge8 s LYS 72 Ca 0.40 -0.38 -0.23 0.00 -0.36 0.00 0.00 55.97 55.40 2ge8 s LYS 72 Cb -0.24 -1.59 -0.04 0.00 -1.51 0.00 0.00 37.83 34.45 2ge8 s LYS 72 CO 0.29 -0.12 0.68 -0.51 -0.36 0.00 0.00 175.35 175.33 2ge8 s LEU 73 N 1.16 4.34 0.26 5.43 1.43 -1.26 -0.27 118.68 129.77 2ge8 s LEU 73 Ca -0.05 1.19 0.10 0.00 -1.03 0.00 0.00 54.13 54.34 2ge8 s LEU 73 Cb -0.14 -3.05 -0.05 0.00 0.03 0.00 0.00 46.19 42.98 2ge8 s LEU 73 CO -0.03 -0.06 -0.16 -1.10 0.23 0.00 0.00 176.35 175.24 2ge8 s GLN 74 N 0.55 1.54 0.32 1.70 -1.52 -0.01 -4.97 119.66 117.26 2ge8 s GLN 74 Ca 0.36 -1.72 0.07 0.00 -1.95 0.00 0.00 55.36 52.12 2ge8 s GLN 74 Cb -0.18 -1.45 0.88 0.00 -0.22 0.00 0.00 33.01 32.04 2ge8 s GLN 74 CO 0.18 0.23 1.61 -1.35 -0.25 0.00 0.00 175.29 175.71 2ge8 h PRO 75 N 2.36 0.10 0.00 2.91 0.11 -2.05 -1.49 132.00 133.95 2ge8 h PRO 75 Ca -0.39 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2ge8 h PRO 75 Cb 1.24 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2ge8 h PRO 75 CO 0.62 0.07 -0.12 -0.40 -0.21 0.00 0.00 178.00 177.96 2ge8 n ASP 76 N -5.31 0.36 0.00 -2.05 5.75 -1.26 -5.03 116.55 109.01 2ge8 n ASP 76 Ca 0.26 0.39 0.00 0.00 -0.01 0.00 0.00 54.79 55.43 2ge8 n ASP 76 Cb 0.85 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 2ge8 n ASP 76 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ge8 n GLY 77 N 1.43 -0.11 3.60 6.12 0.00 -0.56 -5.09 105.19 110.58 2ge8 n GLY 77 Ca 0.06 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.10 2ge8 n GLY 77 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ge8 s LEU 78 N 0.00 4.10 -0.58 0.99 2.96 -1.26 -0.83 118.68 124.07 2ge8 s LEU 78 Ca 0.00 0.52 -0.22 0.00 -0.22 0.00 0.00 54.13 54.21 2ge8 s LEU 78 Cb 0.00 -3.05 0.06 0.00 0.50 0.00 0.00 46.19 43.70 2ge8 s LEU 78 CO 0.00 -0.66 0.86 -1.00 -1.32 0.00 0.00 176.35 174.22 2ge8 s HIS 79 N 3.02 2.83 -0.51 5.38 3.76 0.63 -4.96 115.29 125.44 2ge8 s HIS 79 Ca 0.32 -0.38 -0.18 0.00 -0.15 0.00 0.00 55.06 54.67 2ge8 s HIS 79 Cb -0.14 -4.01 0.06 0.00 1.11 0.00 0.00 32.58 29.60 2ge8 s HIS 79 CO 0.14 -1.37 0.59 -1.17 -0.85 0.00 0.00 174.74 172.08 2ge8 s LEU 80 N 3.58 5.13 -0.07 0.89 0.20 -1.26 -0.43 118.68 126.72 2ge8 s LEU 80 Ca 0.23 -1.04 -0.20 0.00 0.69 0.00 0.00 54.13 53.81 2ge8 s LEU 80 Cb -0.16 -2.38 -0.04 0.00 -0.43 0.00 0.00 46.19 43.17 2ge8 s LEU 80 CO 0.14 -0.86 0.58 -0.75 -0.29 0.00 0.00 176.35 175.17 2ge8 s LYS 81 N 2.44 4.36 -0.15 1.98 2.20 -0.63 -4.95 119.74 124.98 2ge8 s LYS 81 Ca 0.13 0.67 -0.02 0.00 -0.36 0.00 0.00 55.97 56.39 2ge8 s LYS 81 Cb -0.21 -3.41 -0.02 0.00 -1.51 0.00 0.00 37.83 32.69 2ge8 s LYS 81 CO 0.10 0.20 -0.08 -0.06 -0.36 0.00 0.00 175.35 175.15 2ge8 s PHE 82 N 0.41 2.91 -0.39 4.03 0.40 -1.26 -1.40 117.98 122.68 2ge8 s PHE 82 Ca 0.31 -0.57 0.00 0.00 -0.60 0.00 0.00 56.93 56.08 2ge8 s PHE 82 Cb -0.17 -1.92 0.11 0.00 0.51 0.00 0.00 43.02 41.55 2ge8 s PHE 82 CO 0.15 -0.20 0.14 -1.21 0.70 0.00 0.00 175.22 174.80 2ge8 s GLU 83 N 0.52 1.78 -0.08 0.44 2.02 -0.09 -4.96 118.70 118.32 2ge8 s GLU 83 Ca -0.06 -1.89 0.04 0.00 0.02 0.00 0.00 54.97 53.08 2ge8 s GLU 83 Cb -0.15 -3.42 -0.00 0.00 0.10 0.00 0.00 34.13 30.66 2ge8 s GLU 83 CO 0.03 -1.02 -0.22 0.12 0.02 0.00 0.00 175.26 174.19 2ge8 s PHE 84 N 0.96 2.34 -0.27 1.61 5.36 -1.26 -1.19 117.98 125.53 2ge8 s PHE 84 Ca 0.10 -0.88 0.02 0.00 -0.96 0.00 0.00 56.93 55.21 2ge8 s PHE 84 Cb -0.21 -1.57 0.07 0.00 -0.34 0.00 0.00 43.02 40.97 2ge8 s PHE 84 CO -0.06 -0.34 -0.03 0.99 -1.46 0.00 0.00 175.22 174.31 2ge8 s THR 85 N 0.26 1.80 -0.03 0.12 2.01 -1.26 -5.03 115.64 113.50 2ge8 s THR 85 Ca -0.14 -1.59 -0.29 0.00 0.31 0.00 0.00 61.69 59.98 2ge8 s THR 85 Cb -0.16 -2.10 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 2ge8 s THR 85 CO 0.07 -0.24 0.97 -0.89 -0.69 0.00 0.00 174.62 173.84 2ge8 s THR 86 N 1.23 4.86 -0.39 -0.82 2.01 -1.26 -5.04 115.64 116.23 2ge8 s THR 86 Ca -0.02 2.02 -0.09 0.00 0.31 0.00 0.00 61.69 63.91 2ge8 s THR 86 Cb -0.19 -4.30 0.05 0.00 0.01 0.00 0.00 72.50 68.07 2ge8 s THR 86 CO -0.08 0.13 0.21 -0.69 -0.69 0.00 0.00 174.62 173.50 2ge8 s VAL 87 N 1.24 4.21 -0.42 3.82 1.01 -1.26 -5.09 120.40 123.92 2ge8 s VAL 87 Ca 0.50 -1.19 -0.17 0.00 0.00 0.00 0.00 61.98 61.13 2ge8 s VAL 87 Cb -0.20 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.73 2ge8 s VAL 87 CO 0.25 -0.35 0.40 -0.69 0.00 0.00 0.00 175.10 174.71 2ge8 s VAL 88 N 1.45 5.14 0.63 2.92 1.01 -1.26 -5.07 120.40 125.21 2ge8 s VAL 88 Ca 0.02 -0.42 -0.19 0.00 0.00 0.00 0.00 61.98 61.39 2ge8 s VAL 88 Cb -0.21 -4.00 -0.02 0.00 0.00 0.00 0.00 36.38 32.15 2ge8 s VAL 88 CO 0.04 -0.38 1.29 -2.84 0.00 0.00 0.00 175.10 173.20 2ge8 s PRO 89 N 2.01 2.70 0.48 2.72 0.02 -1.26 -4.90 135.00 136.77 2ge8 s PRO 89 Ca 0.10 2.04 0.19 0.00 0.02 0.00 0.00 61.00 63.36 2ge8 s PRO 89 Cb -0.18 -1.91 1.19 0.00 0.02 0.00 0.00 34.50 33.63 2ge8 s PRO 89 CO 0.13 -1.48 2.03 0.00 -0.33 0.00 0.00 177.00 177.35 2ge8 h ARG 90 N 0.72 0.00 -0.92 5.54 3.08 -2.00 -1.30 114.38 119.50 2ge8 h ARG 90 Ca -0.51 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.41 2ge8 h ARG 90 Cb 1.33 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 31.30 2ge8 h ARG 90 CO 0.54 0.15 0.17 -0.25 -1.07 0.00 0.00 179.97 179.51 2ge8 n ASP 91 N -4.08 3.26 -4.66 7.04 8.00 -1.26 -4.86 116.55 119.99 2ge8 n ASP 91 Ca -0.02 -2.60 -0.37 0.00 0.71 0.00 0.00 54.79 52.51 2ge8 n ASP 91 Cb 0.23 -0.62 -0.09 0.00 -0.02 0.00 0.00 41.12 40.62 2ge8 n ASP 91 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2ge8 s ASP 92 N -0.17 6.20 0.50 -2.24 -1.08 -0.49 -4.97 116.67 114.41 2ge8 s ASP 92 Ca 0.25 0.21 0.31 0.00 -0.52 0.00 0.00 52.55 52.81 2ge8 s ASP 92 Cb 0.21 -2.14 1.42 0.00 -1.46 0.00 0.00 42.92 40.95 2ge8 s ASP 92 CO 0.06 0.03 1.80 -0.65 0.52 0.00 0.00 175.17 176.93 2ge8 h PRO 93 N 7.49 0.10 0.00 4.34 0.11 -1.89 0.12 132.00 142.27 2ge8 h PRO 93 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2ge8 h PRO 93 Cb 1.17 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2ge8 h PRO 93 CO 0.67 0.07 -0.75 1.04 -0.21 0.00 0.00 178.00 178.82 2ge8 n GLN 94 N -4.32 0.09 -0.32 1.05 1.13 -1.26 -4.57 117.38 109.18 2ge8 n GLN 94 Ca 0.25 0.00 0.04 0.00 -1.94 0.00 0.00 57.00 55.35 2ge8 n GLN 94 Cb 1.12 -1.53 0.12 0.00 0.11 0.00 0.00 30.24 30.05 2ge8 n GLN 94 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 2ge8 h PHE 95 N 0.00 -0.49 -0.03 1.08 3.57 -1.05 -0.38 116.94 119.64 2ge8 h PHE 95 Ca 0.00 0.08 -0.12 0.00 3.53 0.00 0.00 57.97 61.46 2ge8 h PHE 95 Cb 0.57 0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 2ge8 h PHE 95 CO 0.00 -0.39 -0.54 -0.44 -2.23 0.00 0.00 178.31 174.70 2ge8 h ASP 96 N -0.00 0.10 -0.18 0.41 3.32 -1.80 -2.59 116.42 115.67 2ge8 h ASP 96 Ca 0.43 -0.05 -0.21 0.00 0.02 0.00 0.00 57.03 57.23 2ge8 h ASP 96 Cb 0.66 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 40.19 2ge8 h ASP 96 CO -0.94 0.62 -0.70 -1.13 -1.72 0.00 0.00 179.24 175.38 2ge8 h ASN 97 N 0.07 0.92 -0.28 6.45 -0.00 -1.41 -2.85 115.58 118.48 2ge8 h ASN 97 Ca -0.00 -0.61 0.06 0.00 -0.00 0.00 0.00 56.30 55.75 2ge8 h ASN 97 Cb 0.99 -0.27 -0.07 0.00 -0.00 0.00 0.00 38.32 38.97 2ge8 h ASN 97 CO 0.08 1.37 -0.16 1.88 -0.00 0.00 0.00 177.43 180.60 2ge8 h TYR 98 N 0.52 -0.40 0.00 0.67 0.99 -1.23 -1.73 116.97 115.80 2ge8 h TYR 98 Ca -0.04 0.03 0.02 0.00 2.00 0.00 0.00 58.73 60.75 2ge8 h TYR 98 Cb 1.32 0.22 -0.03 0.00 1.00 0.00 0.00 36.73 39.25 2ge8 h TYR 98 CO 0.09 -0.23 -0.13 0.28 -0.00 0.00 0.00 178.16 178.16 2ge8 h VAL 99 N -0.13 0.67 -0.69 -2.88 2.07 -1.52 0.14 116.25 113.91 2ge8 h VAL 99 Ca 0.15 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.77 2ge8 h VAL 99 Cb 0.36 0.67 -0.07 0.00 -1.52 0.00 0.00 31.29 30.73 2ge8 h VAL 99 CO -0.36 0.00 0.33 0.50 0.02 0.00 0.00 177.57 178.05 2ge8 h LYS 100 N -0.22 0.54 0.45 1.57 3.64 -1.25 1.08 116.57 122.38 2ge8 h LYS 100 Ca 0.05 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2ge8 h LYS 100 Cb 0.28 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2ge8 h LYS 100 CO -0.13 0.35 -0.22 0.82 -2.27 0.00 0.00 179.45 178.01 2ge8 h ILE 101 N 0.55 0.55 -0.90 2.00 2.04 -0.91 0.48 117.51 121.32 2ge8 h ILE 101 Ca 0.35 -0.11 0.14 0.00 1.00 0.00 0.00 64.86 66.24 2ge8 h ILE 101 Cb 0.39 0.61 -0.09 0.00 -0.74 0.00 0.00 36.82 36.98 2ge8 h ILE 101 CO -0.28 0.02 0.50 0.00 0.00 0.00 0.00 178.15 178.39 2ge8 h ASP 103 N 0.73 1.01 0.15 0.00 3.32 0.18 -0.80 116.42 121.01 2ge8 h ASP 103 Ca 0.48 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.49 2ge8 h ASP 103 Cb 0.64 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2ge8 h ASP 103 CO -0.34 0.75 -0.07 1.56 -1.72 0.00 0.00 179.24 179.42 2ge8 h GLN 104 N 1.18 -0.19 0.00 3.56 4.20 0.20 -3.43 115.11 120.64 2ge8 h GLN 104 Ca 0.32 0.01 -0.18 0.00 0.06 0.00 0.00 58.65 58.86 2ge8 h GLN 104 Cb -0.11 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 2ge8 h GLN 104 CO -0.07 0.08 -1.22 0.00 -0.67 0.00 0.00 178.83 176.95 2ge8 n VAL 106 N -4.46 0.25 -2.31 0.00 0.31 -0.32 0.76 118.33 112.55 2ge8 n VAL 106 Ca -0.27 -0.05 -0.16 0.00 -0.01 0.00 0.00 64.34 63.86 2ge8 n VAL 106 Cb 0.58 -1.12 -0.01 0.00 -0.91 0.00 0.00 33.84 32.38 2ge8 n VAL 106 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2ge8 n ASP 107 N 4.98 -4.67 0.00 4.52 8.00 -0.18 -4.88 116.55 124.31 2ge8 n ASP 107 Ca 0.26 0.14 0.15 0.00 0.71 0.00 0.00 54.79 56.05 2ge8 n ASP 107 Cb 0.12 -3.97 0.83 0.00 -0.02 0.00 0.00 41.12 38.08 2ge8 n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ge8 n GLY 108 N -0.82 -1.05 3.53 0.44 0.00 0.23 -4.90 105.19 102.62 2ge8 n GLY 108 Ca -0.19 -0.17 -0.49 0.00 0.00 0.00 0.00 46.02 45.18 2ge8 n GLY 108 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2ge8 n VAL 109 N -1.11 1.28 -1.46 1.61 3.14 -1.25 -1.28 118.33 119.27 2ge8 n VAL 109 Ca 0.19 -0.32 -0.07 0.00 -2.96 0.00 0.00 64.34 61.18 2ge8 n VAL 109 Cb 0.15 -0.57 -0.02 0.00 -1.06 0.00 0.00 33.84 32.34 2ge8 n VAL 109 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2ge8 n GLY 110 N 1.79 0.67 3.39 7.55 0.00 -1.26 -5.00 105.19 112.33 2ge8 n GLY 110 Ca 0.15 -0.71 -0.15 0.00 0.00 0.00 0.00 46.02 45.32 2ge8 n GLY 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ge8 s THR 111 N -2.27 0.00 -0.14 2.61 -4.23 -0.40 -5.03 115.64 106.17 2ge8 s THR 111 Ca 0.00 -1.76 -0.31 0.00 -1.18 0.00 0.00 61.69 58.44 2ge8 s THR 111 Cb 0.00 -2.52 0.13 0.00 1.34 0.00 0.00 72.50 71.45 2ge8 s THR 111 CO 0.00 0.00 1.04 -0.60 -0.54 0.00 0.00 174.62 174.52 2ge8 s ARG 112 N -3.51 0.56 0.00 3.99 3.52 -1.26 -0.34 118.95 121.90 2ge8 s ARG 112 Ca 0.34 -0.03 0.05 0.00 -0.13 0.00 0.00 55.73 55.96 2ge8 s ARG 112 Cb 0.02 0.26 0.28 0.00 -1.56 0.00 0.00 34.95 33.95 2ge8 s ARG 112 CO 0.19 -0.21 0.75 -2.30 -0.81 0.00 0.00 175.30 172.92