#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ge8 n GLU 3 N 0.00 -0.07 -0.31 -0.67 0.00 -1.26 -0.94 120.64 117.39 2ge8 n GLU 3 Ca 0.00 1.38 0.30 0.00 0.00 0.00 0.00 57.16 58.84 2ge8 n GLU 3 Cb 0.00 -2.29 0.65 0.00 0.00 0.00 0.00 31.44 29.80 2ge8 n GLU 3 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 2ge8 h MET 4 N 0.00 0.15 0.00 5.31 2.86 -1.98 -1.86 114.93 119.41 2ge8 h MET 4 Ca 0.66 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 58.29 2ge8 h MET 4 Cb 1.53 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 33.15 2ge8 h MET 4 CO -0.83 0.10 -0.36 0.00 1.06 0.00 0.00 176.91 176.88 2ge8 n ALA 5 N -2.65 3.03 -0.25 6.32 0.00 -0.11 -2.18 120.51 124.66 2ge8 n ALA 5 Ca 0.25 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ge8 n ALA 5 Cb 1.08 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 19.28 2ge8 n ALA 5 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2ge8 n HIS 6 N -1.65 0.00 -0.52 0.00 8.25 -0.73 -4.71 115.22 115.86 2ge8 n HIS 6 Ca 0.06 -0.05 -0.26 0.00 -0.26 0.00 0.00 57.72 57.21 2ge8 n HIS 6 Cb 0.36 -0.01 0.19 0.00 1.12 0.00 0.00 29.99 31.66 2ge8 n HIS 6 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2ge8 n ARG 7 N -0.05 -2.54 -1.54 -0.41 1.74 -1.01 -4.87 116.66 107.98 2ge8 n ARG 7 Ca 0.00 -0.74 -0.50 0.00 -0.77 0.00 0.00 57.85 55.84 2ge8 n ARG 7 Cb 0.10 -1.67 -0.04 0.00 -1.02 0.00 0.00 32.46 29.82 2ge8 n ARG 7 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2ge8 n ARG 8 N -2.80 0.81 -0.32 5.56 0.63 -1.26 -4.77 116.66 114.51 2ge8 n ARG 8 Ca 0.05 0.29 0.14 0.00 -0.92 0.00 0.00 57.85 57.40 2ge8 n ARG 8 Cb 0.50 -1.69 0.32 0.00 0.45 0.00 0.00 32.46 32.04 2ge8 n ARG 8 CO 0.00 0.00 0.00 -0.92 -2.51 0.00 0.00 177.63 174.20 2ge8 h TYR 9 N 2.80 0.82 0.00 -0.14 3.20 -1.98 -1.20 116.97 120.48 2ge8 h TYR 9 Ca -0.41 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.49 2ge8 h TYR 9 Cb 1.37 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.43 2ge8 h TYR 9 CO 0.52 0.04 0.00 0.00 -1.64 0.00 0.00 178.16 177.08 2ge8 n LYS 11 N -1.44 1.77 -1.80 0.00 4.76 -0.47 -5.01 118.16 115.98 2ge8 n LYS 11 Ca 0.08 -0.04 -0.38 0.00 -2.87 0.00 0.00 58.31 55.10 2ge8 n LYS 11 Cb 0.27 -1.22 0.05 0.00 -1.84 0.00 0.00 35.03 32.28 2ge8 n LYS 11 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2ge8 s ARG 12 N -2.54 3.00 0.15 1.97 0.52 -1.12 -4.97 118.95 115.97 2ge8 s ARG 12 Ca 0.02 2.16 0.04 0.00 -0.52 0.00 0.00 55.73 57.44 2ge8 s ARG 12 Cb 0.10 -2.14 -0.04 0.00 0.52 0.00 0.00 34.95 33.38 2ge8 s ARG 12 CO 0.59 -1.28 -0.09 0.95 0.02 0.00 0.00 175.30 175.50 2ge8 s THR 13 N -1.34 1.11 -0.28 0.02 -4.23 -0.93 -5.03 115.64 104.96 2ge8 s THR 13 Ca 0.74 -2.05 -0.24 0.00 -1.18 0.00 0.00 61.69 58.97 2ge8 s THR 13 Cb -0.39 -1.88 -0.00 0.00 1.34 0.00 0.00 72.50 71.57 2ge8 s THR 13 CO 0.45 -0.72 0.80 -0.63 -0.54 0.00 0.00 174.62 173.98 2ge8 s ILE 14 N -3.36 4.81 0.78 2.99 1.01 -1.26 -3.93 121.20 122.24 2ge8 s ILE 14 Ca 0.17 1.32 -0.13 0.00 0.00 0.00 0.00 60.65 62.02 2ge8 s ILE 14 Cb 0.03 -4.13 0.07 0.00 0.01 0.00 0.00 42.46 38.44 2ge8 s ILE 14 CO 0.01 -0.18 1.15 -2.84 0.00 0.00 0.00 174.94 173.08 2ge8 s PRO 15 N 2.91 1.97 0.34 2.79 0.02 -1.26 -4.85 135.00 136.91 2ge8 s PRO 15 Ca 0.33 1.51 -0.26 0.00 0.02 0.00 0.00 61.00 62.60 2ge8 s PRO 15 Cb -0.15 -1.84 -0.13 0.00 0.02 0.00 0.00 34.50 32.41 2ge8 s PRO 15 CO 0.11 -1.92 0.96 -2.30 -0.33 0.00 0.00 177.00 173.52 2ge8 n PRO 16 N -3.26 1.28 0.00 5.54 -0.02 -1.26 -2.33 135.00 134.95 2ge8 n PRO 16 Ca 0.12 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2ge8 n PRO 16 Cb 0.52 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 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 1.26 2.95 3.86 -1.23 0.00 -1.26 -5.02 105.19 105.75 2ge8 n GLY 17 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.08 3.40 0.35 1.61 1.51 -0.98 -5.05 117.35 116.12 2ge8 s TYR 18 Ca 0.00 1.05 -0.14 0.00 -1.01 0.00 0.00 57.07 56.97 2ge8 s TYR 18 Cb 0.00 -2.40 -0.08 0.00 -0.11 0.00 0.00 41.96 39.37 2ge8 s TYR 18 CO 0.00 0.17 0.76 0.15 -1.11 0.00 0.00 175.55 175.52 2ge8 s LYS 19 N -2.94 3.94 0.27 -0.62 1.02 -1.26 -4.03 119.74 116.12 2ge8 s LYS 19 Ca 0.51 0.63 -0.00 0.00 0.02 0.00 0.00 55.97 57.13 2ge8 s LYS 19 Cb -0.11 -2.40 0.53 0.00 -0.52 0.00 0.00 37.83 35.33 2ge8 s LYS 19 CO 0.20 0.08 1.79 0.28 -0.92 0.00 0.00 175.35 176.78 2ge8 h VAL 20 N 1.69 0.81 0.00 3.17 2.07 -1.35 -1.69 116.25 120.95 2ge8 h VAL 20 Ca -0.48 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 66.78 2ge8 h VAL 20 Cb 1.18 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2ge8 h VAL 20 CO 0.65 0.14 0.00 -0.90 0.02 0.00 0.00 177.57 177.48 2ge8 n ASP 21 N -4.77 0.57 -0.03 0.57 5.68 -1.26 -0.45 116.55 116.86 2ge8 n ASP 21 Ca 0.17 0.63 0.15 0.00 -0.50 0.00 0.00 54.79 55.24 2ge8 n ASP 21 Cb 0.39 -0.75 0.77 0.00 -1.14 0.00 0.00 41.12 40.39 2ge8 n ASP 21 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ge8 n GLN 22 N -2.12 0.65 0.00 0.11 6.02 -0.63 -2.65 117.38 118.76 2ge8 n GLN 22 Ca 0.03 -0.07 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 2ge8 n GLN 22 Cb 0.25 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.01 2ge8 n GLN 22 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2ge8 n VAL 23 N -1.12 0.00 -0.22 5.09 0.31 -0.71 -4.85 118.33 116.84 2ge8 n VAL 23 Ca 0.17 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.55 2ge8 n VAL 23 Cb 0.22 -0.78 0.13 0.00 -0.91 0.00 0.00 33.84 32.50 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 -2.52 0.41 -0.09 3.52 3.01 0.40 -4.96 117.46 117.23 2ge8 n PHE 24 Ca 0.00 -0.53 0.01 0.00 1.01 0.00 0.00 57.45 57.94 2ge8 n PHE 24 Cb 0.34 -0.05 -0.00 0.00 -0.01 0.00 0.00 39.48 39.75 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 0.24 -1.79 3.75 1.37 0.00 -1.08 -4.93 105.19 102.74 2ge8 n GLY 25 Ca 0.10 -1.49 -0.39 0.00 0.00 0.00 0.00 46.02 44.24 2ge8 n GLY 25 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ge8 n PRO 26 N -2.21 1.91 -2.16 1.61 -0.02 -1.26 -3.99 135.00 128.87 2ge8 n PRO 26 Ca -0.00 0.69 -0.41 0.00 -2.02 0.00 0.00 63.50 61.76 2ge8 n PRO 26 Cb 0.04 -2.60 -0.03 0.00 -0.02 0.00 0.00 33.50 30.90 2ge8 n PRO 26 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2ge8 s ARG 27 N -2.71 4.38 0.51 -0.52 1.81 -1.26 -4.89 118.95 116.27 2ge8 s ARG 27 Ca 0.68 2.14 0.04 0.00 -1.72 0.00 0.00 55.73 56.86 2ge8 s ARG 27 Cb -0.43 -3.13 0.00 0.00 -0.45 0.00 0.00 34.95 30.94 2ge8 s ARG 27 CO 0.52 -0.22 0.20 0.95 -0.68 0.00 0.00 175.30 176.07 2ge8 s THR 28 N -0.50 1.55 -0.15 0.02 -4.23 -0.32 -4.88 115.64 107.12 2ge8 s THR 28 Ca 0.53 -1.74 0.01 0.00 -1.18 0.00 0.00 61.69 59.30 2ge8 s THR 28 Cb -0.38 -2.29 0.00 0.00 1.34 0.00 0.00 72.50 71.17 2ge8 s THR 28 CO 0.45 0.00 -0.16 -0.54 -0.54 0.00 0.00 174.62 173.83 2ge8 s LYS 29 N -4.05 3.19 -0.04 3.99 1.02 -1.26 -4.13 119.74 118.46 2ge8 s LYS 29 Ca 0.23 -0.76 0.00 0.00 0.02 0.00 0.00 55.97 55.46 2ge8 s LYS 29 Cb 0.01 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 2ge8 s LYS 29 CO 0.14 0.00 0.00 0.41 -0.92 0.00 0.00 175.35 174.98 2ge8 n GLY 30 N 4.08 0.42 3.45 -3.33 0.00 -1.26 -4.97 105.19 103.57 2ge8 n GLY 30 Ca -0.19 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.60 1.74 0.20 1.61 1.02 -1.26 -5.09 119.74 117.36 2ge8 s LYS 31 Ca 0.00 -2.01 -0.32 0.00 0.02 0.00 0.00 55.97 53.66 2ge8 s LYS 31 Cb 0.00 -0.57 -0.14 0.00 -0.52 0.00 0.00 37.83 36.60 2ge8 s LYS 31 CO 0.00 -0.37 1.46 0.39 -0.92 0.00 0.00 175.35 175.92 2ge8 n GLU 32 N -0.74 2.03 -0.46 1.68 1.02 -1.26 -2.90 120.64 120.00 2ge8 n GLU 32 Ca -0.03 0.73 0.00 0.00 -0.02 0.00 0.00 57.16 57.84 2ge8 n GLU 32 Cb 0.66 -2.42 0.00 0.00 -0.02 0.00 0.00 31.44 29.65 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 2.63 1.02 0.57 0.62 0.00 -1.26 -4.67 105.19 104.10 2ge8 n GLY 33 Ca 0.14 -0.35 0.13 0.00 0.00 0.00 0.00 46.02 45.94 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 0.68 1.85 -4.64 1.61 6.94 -1.14 -1.18 115.26 119.38 2ge8 n ASN 34 Ca 0.00 -1.54 -0.40 0.00 -0.02 0.00 0.00 54.58 52.63 2ge8 n ASN 34 Cb 0.06 0.05 -0.07 0.00 -2.36 0.00 0.00 39.78 37.47 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 -2.11 3.32 0.00 -2.53 5.36 -1.26 -0.12 117.98 120.64 2ge8 s PHE 35 Ca 0.32 0.73 0.00 0.00 -0.96 0.00 0.00 56.93 57.02 2ge8 s PHE 35 Cb 0.20 -2.71 0.00 0.00 -0.34 0.00 0.00 43.02 40.17 2ge8 s PHE 35 CO 0.37 -0.20 0.00 0.41 -1.46 0.00 0.00 175.22 174.34 2ge8 n GLY 36 N 4.10 3.98 3.94 13.12 0.00 0.36 -4.96 105.19 125.72 2ge8 n GLY 36 Ca -0.04 -0.68 -0.27 0.00 0.00 0.00 0.00 46.02 45.03 2ge8 n GLY 36 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2ge8 s ASP 37 N 0.00 4.07 0.43 1.61 1.47 -1.25 -3.01 116.67 119.98 2ge8 s ASP 37 Ca 0.00 0.32 0.11 0.00 1.18 0.00 0.00 52.55 54.15 2ge8 s ASP 37 Cb 0.00 -0.67 0.93 0.00 -0.34 0.00 0.00 42.92 42.84 2ge8 s ASP 37 CO 0.00 -2.11 2.01 0.44 0.68 0.00 0.00 175.17 176.19 2ge8 h ASP 38 N -1.05 0.21 -0.72 2.11 5.19 -0.45 0.29 116.42 122.00 2ge8 h ASP 38 Ca -0.43 -0.02 -0.07 0.00 -0.62 0.00 0.00 57.03 55.88 2ge8 h ASP 38 Cb 1.28 -0.05 -0.03 0.00 0.18 0.00 0.00 39.33 40.71 2ge8 h ASP 38 CO 0.50 0.27 0.19 0.50 -3.12 0.00 0.00 179.24 177.58 2ge8 h LYS 39 N 0.23 1.15 -0.28 3.56 3.64 -1.94 -1.58 116.57 121.35 2ge8 h LYS 39 Ca 0.06 -0.27 -0.10 0.00 -1.27 0.00 0.00 60.65 59.07 2ge8 h LYS 39 Cb 0.18 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2ge8 h LYS 39 CO 0.00 1.00 -0.22 1.98 -2.27 0.00 0.00 179.45 179.94 2ge8 h MET 40 N 1.09 0.65 -0.49 1.90 4.05 -1.52 -1.04 114.93 119.58 2ge8 h MET 40 Ca 0.23 -0.32 0.04 0.00 -0.28 0.00 0.00 59.70 59.37 2ge8 h MET 40 Cb 0.36 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.11 2ge8 h MET 40 CO -0.00 0.92 0.25 -0.97 0.23 0.00 0.00 176.91 177.34 2ge8 h ASN 41 N 0.39 0.36 -0.47 1.39 -0.73 -0.95 0.07 115.58 115.65 2ge8 h ASN 41 Ca 0.05 0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.22 2ge8 h ASN 41 Cb 0.77 -0.04 -0.02 0.00 0.27 0.00 0.00 38.32 39.30 2ge8 h ASN 41 CO 0.06 0.25 0.17 -0.33 -0.37 0.00 0.00 177.43 177.20 2ge8 h GLU 42 N 0.49 0.71 0.00 6.67 5.08 -1.18 -0.62 114.58 125.73 2ge8 h GLU 42 Ca 0.21 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2ge8 h GLU 42 Cb 0.12 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2ge8 h GLU 42 CO -0.15 0.66 -0.60 0.39 -1.00 0.00 0.00 179.01 178.31 2ge8 n GLU 43 N -4.56 0.18 0.00 2.33 1.02 -0.40 -4.57 120.64 114.64 2ge8 n GLU 43 Ca 0.01 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 2ge8 n GLU 43 Cb 0.17 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 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 1.40 2.43 0.31 0.62 0.00 -0.01 -1.44 105.19 108.50 2ge8 n GLY 44 Ca 0.04 -0.23 0.21 0.00 0.00 0.00 0.00 46.02 46.03 2ge8 n GLY 44 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2ge8 h ILE 45 N 0.00 0.00 -0.27 -0.61 3.07 -1.85 -2.23 117.51 115.62 2ge8 h ILE 45 Ca 0.00 -0.13 0.01 0.00 1.55 0.00 0.00 64.86 66.29 2ge8 h ILE 45 Cb 0.00 1.09 -0.01 0.00 -0.27 0.00 0.00 36.82 37.63 2ge8 h ILE 45 CO 0.00 0.00 0.18 0.11 -1.05 0.00 0.00 178.15 177.39 2ge8 h LYS 46 N 0.00 0.30 -6.26 0.16 1.79 -1.63 -3.42 116.57 107.51 2ge8 h LYS 46 Ca 0.00 -0.02 -0.55 0.00 -2.18 0.00 0.00 60.65 57.90 2ge8 h LYS 46 Cb 0.14 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 2ge8 h LYS 46 CO 0.00 0.20 0.98 0.34 -1.08 0.00 0.00 179.45 179.89 2ge8 s ASP 47 N -6.79 6.78 0.52 0.86 -1.08 -0.84 -4.86 116.67 111.26 2ge8 s ASP 47 Ca -0.07 2.07 0.24 0.00 -0.52 0.00 0.00 52.55 54.27 2ge8 s ASP 47 Cb 0.17 -2.54 1.42 0.00 -1.46 0.00 0.00 42.92 40.52 2ge8 s ASP 47 CO 0.71 -0.84 2.10 1.23 0.52 0.00 0.00 175.17 178.90 2ge8 h GLY 48 N 9.64 0.00 2.00 2.66 0.00 -1.89 -1.79 103.07 113.68 2ge8 h GLY 48 Ca -0.36 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.95 2ge8 h GLY 48 CO 0.95 0.00 -0.13 3.21 0.00 0.00 0.00 176.54 180.56 2ge8 h ARG 49 N 0.00 0.00 -0.12 4.80 3.08 -1.94 -2.89 114.38 117.31 2ge8 h ARG 49 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2ge8 h ARG 49 Cb 0.23 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 2ge8 h ARG 49 CO 0.01 0.13 -0.01 0.28 -1.07 0.00 0.00 179.97 179.32 2ge8 h VAL 50 N 0.00 1.26 -0.79 2.04 2.07 -1.65 -0.71 116.25 118.47 2ge8 h VAL 50 Ca -0.00 -0.86 0.09 0.00 0.82 0.00 0.00 66.70 66.75 2ge8 h VAL 50 Cb 0.43 1.60 -0.07 0.00 -1.52 0.00 0.00 31.29 31.74 2ge8 h VAL 50 CO 0.02 0.25 0.45 0.74 0.02 0.00 0.00 177.57 179.04 2ge8 h THR 51 N -0.07 0.92 -0.30 2.57 2.02 -1.61 0.19 112.91 116.63 2ge8 h THR 51 Ca 0.03 -0.26 -0.09 0.00 0.77 0.00 0.00 66.41 66.86 2ge8 h THR 51 Cb 0.38 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 2ge8 h THR 51 CO 0.01 0.14 -0.15 0.00 0.37 0.00 0.00 175.52 175.89 2ge8 h ALA 52 N 1.43 0.43 -0.13 6.16 0.00 -1.44 -3.06 119.26 122.65 2ge8 h ALA 52 Ca 0.37 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2ge8 h ALA 52 Cb 0.32 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2ge8 h ALA 52 CO -0.23 0.32 -0.04 0.52 0.00 0.00 0.00 179.25 179.82 2ge8 h MET 53 N 0.39 0.18 0.00 0.00 2.86 -0.51 -2.63 114.93 115.22 2ge8 h MET 53 Ca 0.07 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2ge8 h MET 53 Cb 0.67 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.30 2ge8 h MET 53 CO 0.04 0.24 0.00 -0.07 1.06 0.00 0.00 176.91 178.18 2ge8 h LEU 54 N 0.18 0.00 -1.76 1.22 3.38 -0.87 -2.12 115.31 115.34 2ge8 h LEU 54 Ca 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2ge8 h LEU 54 Cb 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2ge8 h LEU 54 CO 0.01 0.00 -0.01 0.78 0.09 0.00 0.00 178.44 179.31 2ge8 h ASN 55 N 0.00 0.00 -0.03 -0.43 2.35 -1.55 -2.78 115.58 113.14 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 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 2ge8 h ASN 55 CO 0.00 0.01 -0.05 0.18 -1.65 0.00 0.00 177.43 175.92 2ge8 n LEU 56 N -3.11 2.79 -4.77 1.61 4.77 -0.80 -4.94 117.00 112.55 2ge8 n LEU 56 Ca -0.00 -0.97 -0.36 0.00 -0.03 0.00 0.00 56.01 54.64 2ge8 n LEU 56 Cb 0.26 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.28 2ge8 n LEU 56 CO 0.26 0.47 -0.09 -0.69 -1.33 0.00 0.00 177.39 176.02 2ge8 s VAL 57 N -1.94 5.35 0.31 4.08 1.01 -1.05 -4.70 120.40 123.46 2ge8 s VAL 57 Ca 0.26 0.39 -0.29 0.00 0.00 0.00 0.00 61.98 62.34 2ge8 s VAL 57 Cb 0.19 -3.54 -0.10 0.00 0.00 0.00 0.00 36.38 32.92 2ge8 s VAL 57 CO 0.31 0.47 1.38 -2.16 0.00 0.00 0.00 175.10 175.10 2ge8 s PRO 58 N -0.05 4.29 1.12 2.72 0.04 -1.26 -5.02 135.00 136.83 2ge8 s PRO 58 Ca 0.14 2.30 -0.18 0.00 0.04 0.00 0.00 61.00 63.30 2ge8 s PRO 58 Cb -0.13 -3.07 0.11 0.00 0.04 0.00 0.00 34.50 31.46 2ge8 s PRO 58 CO 0.03 -0.32 0.08 -1.13 0.04 0.00 0.00 177.00 175.70 2ge8 n SER 59 N 1.22 -2.32 -0.22 6.66 3.41 -1.26 -4.67 113.62 116.44 2ge8 n SER 59 Ca 0.02 -0.10 -0.07 0.00 -0.26 0.00 0.00 58.87 58.46 2ge8 n SER 59 Cb 0.41 -0.99 0.07 0.00 -0.26 0.00 0.00 64.21 63.45 2ge8 n SER 59 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2ge8 h SER 60 N -2.08 1.01 0.25 4.04 4.64 -1.99 0.80 113.55 120.22 2ge8 h SER 60 Ca -0.54 -0.23 -0.01 0.00 -0.47 0.00 0.00 61.79 60.54 2ge8 h SER 60 Cb 1.36 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2ge8 h SER 60 CO 0.39 1.00 -0.12 0.45 -0.87 0.00 0.00 176.83 177.67 2ge8 h HIS 61 N 0.99 -0.31 -0.87 4.77 3.86 -1.99 -1.78 115.15 119.83 2ge8 h HIS 61 Ca 0.20 -0.01 0.09 0.00 -1.16 0.00 0.00 60.37 59.49 2ge8 h HIS 61 Cb 0.41 0.10 -0.07 0.00 1.06 0.00 0.00 27.41 28.92 2ge8 h HIS 61 CO 0.03 -0.15 0.52 0.00 0.86 0.00 0.00 177.93 179.19 2ge8 h ALA 62 N 0.35 1.24 -0.64 2.45 0.00 -1.85 0.29 119.26 121.10 2ge8 h ALA 62 Ca -0.03 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2ge8 h ALA 62 Cb 0.30 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2ge8 h ALA 62 CO 0.06 0.19 0.09 0.00 0.00 0.00 0.00 179.25 179.59 2ge8 h LEU 64 N 0.99 0.11 0.00 0.00 6.46 -0.62 -3.29 115.31 118.97 2ge8 h LEU 64 Ca 0.19 -0.60 0.00 0.00 -0.12 0.00 0.00 57.88 57.35 2ge8 h LEU 64 Cb 0.46 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.35 2ge8 h LEU 64 CO 0.02 0.70 -1.42 0.49 -0.62 0.00 0.00 178.44 177.60 2ge8 n PHE 65 N -4.70 0.00 0.57 1.25 3.01 0.96 -4.32 117.46 114.23 2ge8 n PHE 65 Ca -0.08 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.49 2ge8 n PHE 65 Cb 0.35 -0.25 0.07 0.00 -0.01 0.00 0.00 39.48 39.63 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 1.51 -1.27 3.96 1.37 0.00 0.37 -4.97 105.19 106.16 2ge8 n GLY 66 Ca -0.01 -0.36 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 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 -4.00 4.66 -0.29 1.61 0.01 -1.10 -4.89 113.70 109.70 2ge8 s SER 67 Ca 0.04 0.12 -0.10 0.00 1.31 0.00 0.00 55.95 57.32 2ge8 s SER 67 Cb 0.14 -0.71 -0.03 0.00 0.21 0.00 0.00 66.02 65.64 2ge8 s SER 67 CO 0.78 -1.65 0.15 -0.60 0.41 0.00 0.00 173.24 172.33 2ge8 s ARG 68 N -5.15 3.64 -0.11 12.44 3.52 -0.38 -4.91 118.95 127.99 2ge8 s ARG 68 Ca 0.62 -0.52 -0.05 0.00 -0.13 0.00 0.00 55.73 55.66 2ge8 s ARG 68 Cb -0.09 -3.56 -0.04 0.00 -1.56 0.00 0.00 34.95 29.70 2ge8 s ARG 68 CO 0.44 -0.29 0.06 0.08 -0.81 0.00 0.00 175.30 174.78 2ge8 s VAL 69 N 1.68 4.82 -0.27 7.11 1.01 -1.26 -0.93 120.40 132.55 2ge8 s VAL 69 Ca 0.06 -0.05 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 2ge8 s VAL 69 Cb -0.16 -3.08 0.11 0.00 0.00 0.00 0.00 36.38 33.25 2ge8 s VAL 69 CO 0.08 0.59 0.20 -0.89 0.00 0.00 0.00 175.10 175.07 2ge8 s THR 70 N -0.72 -0.22 -0.01 3.92 2.01 -0.34 -4.98 115.64 115.29 2ge8 s THR 70 Ca 0.12 -0.54 -0.30 0.00 0.31 0.00 0.00 61.69 61.29 2ge8 s THR 70 Cb -0.12 -0.92 -0.03 0.00 0.01 0.00 0.00 72.50 71.45 2ge8 s THR 70 CO 0.03 -0.54 0.97 -2.16 -0.69 0.00 0.00 174.62 172.23 2ge8 s PRO 71 N 2.23 4.54 -0.09 4.92 0.04 -1.26 -1.28 135.00 144.09 2ge8 s PRO 71 Ca 0.08 1.39 0.01 0.00 0.04 0.00 0.00 61.00 62.53 2ge8 s PRO 71 Cb -0.15 -3.47 0.02 0.00 0.04 0.00 0.00 34.50 30.94 2ge8 s PRO 71 CO -0.30 -0.07 -0.11 0.21 0.04 0.00 0.00 177.00 176.76 2ge8 s LYS 72 N 1.10 1.74 0.01 4.56 2.20 0.00 -4.97 119.74 124.38 2ge8 s LYS 72 Ca 0.51 -0.38 -0.22 0.00 -0.36 0.00 0.00 55.97 55.52 2ge8 s LYS 72 Cb -0.21 -1.58 -0.05 0.00 -1.51 0.00 0.00 37.83 34.48 2ge8 s LYS 72 CO 0.27 -0.11 0.64 -0.51 -0.36 0.00 0.00 175.35 175.28 2ge8 s LEU 73 N 1.13 4.42 0.09 5.43 1.43 -1.26 -0.44 118.68 129.48 2ge8 s LEU 73 Ca -0.05 1.24 -0.02 0.00 -1.03 0.00 0.00 54.13 54.27 2ge8 s LEU 73 Cb -0.14 -3.01 -0.04 0.00 0.03 0.00 0.00 46.19 43.03 2ge8 s LEU 73 CO -0.02 0.07 0.03 -1.10 0.23 0.00 0.00 176.35 175.56 2ge8 s GLN 74 N -0.14 0.78 0.16 1.70 -1.52 0.43 -4.99 119.66 116.08 2ge8 s GLN 74 Ca 0.33 -1.31 -0.31 0.00 -1.95 0.00 0.00 55.36 52.12 2ge8 s GLN 74 Cb -0.19 0.24 -0.07 0.00 -0.22 0.00 0.00 33.01 32.77 2ge8 s GLN 74 CO 0.19 -0.19 1.54 -1.35 -0.25 0.00 0.00 175.29 175.22 2ge8 h PRO 75 N 2.98 -0.00 0.00 2.91 0.11 -2.04 0.37 132.00 136.33 2ge8 h PRO 75 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2ge8 h PRO 75 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2ge8 h PRO 75 CO 0.62 -0.00 0.00 0.38 -0.21 0.00 0.00 178.00 178.79 2ge8 h ASP 76 N -0.00 0.00 -1.77 -2.05 2.03 -2.01 -3.48 116.42 109.14 2ge8 h ASP 76 Ca 0.16 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.46 2ge8 h ASP 76 Cb 0.41 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.91 2ge8 h ASP 76 CO -0.93 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 177.89 2ge8 n GLY 77 N -0.37 -0.37 3.67 7.15 0.00 0.12 -5.07 105.19 110.32 2ge8 n GLY 77 Ca 0.01 -1.53 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 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 4.16 -0.37 0.99 2.96 -1.26 -0.42 118.68 124.74 2ge8 s LEU 78 Ca 0.00 1.19 -0.11 0.00 -0.22 0.00 0.00 54.13 54.99 2ge8 s LEU 78 Cb 0.00 -3.27 0.02 0.00 0.50 0.00 0.00 46.19 43.44 2ge8 s LEU 78 CO 0.00 -0.43 0.21 -1.00 -1.32 0.00 0.00 176.35 173.80 2ge8 s HIS 79 N 2.29 3.24 -0.48 5.38 3.76 0.41 -4.96 115.29 124.94 2ge8 s HIS 79 Ca 0.39 -0.90 -0.11 0.00 -0.15 0.00 0.00 55.06 54.29 2ge8 s HIS 79 Cb -0.16 -2.44 0.11 0.00 1.11 0.00 0.00 32.58 31.20 2ge8 s HIS 79 CO 0.12 -0.62 0.36 -1.17 -0.85 0.00 0.00 174.74 172.58 2ge8 s LEU 80 N 1.57 5.70 -0.02 0.89 0.20 -1.26 -0.82 118.68 124.94 2ge8 s LEU 80 Ca 0.02 -1.78 -0.25 0.00 0.69 0.00 0.00 54.13 52.81 2ge8 s LEU 80 Cb -0.19 -2.06 -0.04 0.00 -0.43 0.00 0.00 46.19 43.47 2ge8 s LEU 80 CO 0.07 -0.70 0.78 -0.75 -0.29 0.00 0.00 176.35 175.47 2ge8 s LYS 81 N 1.44 4.48 -0.12 1.98 2.20 -0.41 -4.93 119.74 124.38 2ge8 s LYS 81 Ca 0.05 1.06 0.01 0.00 -0.36 0.00 0.00 55.97 56.72 2ge8 s LYS 81 Cb -0.26 -3.43 -0.01 0.00 -1.51 0.00 0.00 37.83 32.62 2ge8 s LYS 81 CO 0.01 0.09 -0.16 -0.06 -0.36 0.00 0.00 175.35 174.87 2ge8 s PHE 82 N 0.63 2.74 -0.35 4.03 0.40 -1.26 -1.20 117.98 122.98 2ge8 s PHE 82 Ca 0.41 -0.80 -0.05 0.00 -0.60 0.00 0.00 56.93 55.90 2ge8 s PHE 82 Cb -0.19 -1.81 0.06 0.00 0.51 0.00 0.00 43.02 41.58 2ge8 s PHE 82 CO 0.22 -0.30 0.11 -1.21 0.70 0.00 0.00 175.22 174.74 2ge8 s GLU 83 N 0.40 2.46 -0.06 0.44 2.02 -0.11 -4.95 118.70 118.91 2ge8 s GLU 83 Ca -0.13 -1.35 0.06 0.00 0.02 0.00 0.00 54.97 53.57 2ge8 s GLU 83 Cb -0.16 -3.44 -0.01 0.00 0.10 0.00 0.00 34.13 30.62 2ge8 s GLU 83 CO 0.06 -0.75 -0.23 0.12 0.02 0.00 0.00 175.26 174.47 2ge8 s PHE 84 N 1.32 2.31 -0.17 1.61 5.36 -1.26 -1.25 117.98 125.90 2ge8 s PHE 84 Ca -0.01 -0.71 0.00 0.00 -0.96 0.00 0.00 56.93 55.26 2ge8 s PHE 84 Cb -0.21 -1.52 0.03 0.00 -0.34 0.00 0.00 43.02 40.98 2ge8 s PHE 84 CO 0.00 -0.23 -0.12 0.99 -1.46 0.00 0.00 175.22 174.40 2ge8 s THR 85 N -0.07 1.57 -0.06 0.12 2.01 -1.26 -5.08 115.64 112.87 2ge8 s THR 85 Ca -0.05 -0.77 -0.13 0.00 0.31 0.00 0.00 61.69 61.05 2ge8 s THR 85 Cb -0.14 -1.55 -0.05 0.00 0.01 0.00 0.00 72.50 70.77 2ge8 s THR 85 CO 0.04 0.34 0.34 -0.89 -0.69 0.00 0.00 174.62 173.76 2ge8 s THR 86 N 1.46 5.18 -0.21 -0.82 2.01 -1.26 -5.07 115.64 116.93 2ge8 s THR 86 Ca 0.03 0.67 -0.04 0.00 0.31 0.00 0.00 61.69 62.66 2ge8 s THR 86 Cb -0.14 -3.65 -0.01 0.00 0.01 0.00 0.00 72.50 68.71 2ge8 s THR 86 CO -0.10 0.53 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.63 2ge8 s VAL 87 N -0.64 3.44 -0.33 3.82 1.01 -1.26 -5.09 120.40 121.36 2ge8 s VAL 87 Ca 0.21 -0.48 -0.09 0.00 0.00 0.00 0.00 61.98 61.62 2ge8 s VAL 87 Cb -0.15 -2.55 0.01 0.00 0.00 0.00 0.00 36.38 33.68 2ge8 s VAL 87 CO 0.10 0.43 0.15 -0.69 0.00 0.00 0.00 175.10 175.09 2ge8 s VAL 88 N 1.31 4.46 0.82 2.92 1.01 -1.26 -5.10 120.40 124.56 2ge8 s VAL 88 Ca 0.04 -0.62 -0.11 0.00 0.00 0.00 0.00 61.98 61.29 2ge8 s VAL 88 Cb -0.14 -3.35 0.08 0.00 0.00 0.00 0.00 36.38 32.97 2ge8 s VAL 88 CO -0.02 -0.03 1.09 -2.84 0.00 0.00 0.00 175.10 173.30 2ge8 s PRO 89 N 1.57 1.88 0.31 2.72 0.02 -1.26 -4.92 135.00 135.33 2ge8 s PRO 89 Ca 0.03 0.94 0.03 0.00 0.02 0.00 0.00 61.00 62.02 2ge8 s PRO 89 Cb -0.18 -1.87 0.62 0.00 0.02 0.00 0.00 34.50 33.09 2ge8 s PRO 89 CO 0.06 -1.84 1.89 0.00 -0.33 0.00 0.00 177.00 176.77 2ge8 h ARG 90 N -1.26 0.89 0.00 5.54 2.47 -2.00 -2.42 114.38 117.60 2ge8 h ARG 90 Ca -0.46 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.20 2ge8 h ARG 90 Cb 1.26 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 29.37 2ge8 h ARG 90 CO 0.54 0.59 0.00 -0.40 0.56 0.00 0.00 179.97 181.26 2ge8 n ASP 91 N -4.54 0.00 -4.67 7.04 5.68 -1.26 -4.74 116.55 114.06 2ge8 n ASP 91 Ca 0.16 0.31 -0.44 0.00 -0.50 0.00 0.00 54.79 54.31 2ge8 n ASP 91 Cb 0.30 -0.43 -0.02 0.00 -1.14 0.00 0.00 41.12 39.83 2ge8 n ASP 91 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2ge8 n ASP 92 N -1.43 2.74 0.04 -1.12 -0.08 -0.91 -4.86 116.55 110.92 2ge8 n ASP 92 Ca 0.09 1.15 0.12 0.00 -1.51 0.00 0.00 54.79 54.64 2ge8 n ASP 92 Cb 0.30 -1.43 0.47 0.00 2.34 0.00 0.00 41.12 42.79 2ge8 n ASP 92 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2ge8 n PRO 93 N 1.81 0.08 -0.12 -0.67 -0.04 -1.26 -1.88 135.00 132.92 2ge8 n PRO 93 Ca 0.11 0.18 0.11 0.00 -0.04 0.00 0.00 63.50 63.85 2ge8 n PRO 93 Cb 0.32 -1.62 0.29 0.00 -0.04 0.00 0.00 33.50 32.45 2ge8 n PRO 93 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2ge8 n GLN 94 N -1.76 2.10 -0.07 0.54 1.13 -1.26 -4.65 117.38 113.40 2ge8 n GLN 94 Ca 0.05 -1.66 -0.07 0.00 -1.94 0.00 0.00 57.00 53.39 2ge8 n GLN 94 Cb 0.29 -1.45 -0.01 0.00 0.11 0.00 0.00 30.24 29.19 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 3.34 -0.34 -0.38 1.08 3.57 -1.67 -0.70 116.94 121.85 2ge8 h PHE 95 Ca 0.00 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.41 2ge8 h PHE 95 Cb 0.73 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 2ge8 h PHE 95 CO 0.16 -0.21 -0.25 -0.44 -2.23 0.00 0.00 178.31 175.34 2ge8 h ASP 96 N -0.10 0.79 0.07 0.41 3.32 -1.82 -0.85 116.42 118.24 2ge8 h ASP 96 Ca 0.15 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 56.90 2ge8 h ASP 96 Cb 0.33 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2ge8 h ASP 96 CO -0.35 1.00 -0.03 -1.13 -1.72 0.00 0.00 179.24 177.01 2ge8 h ASN 97 N 0.67 -0.08 -0.46 6.45 -0.00 -1.67 0.08 115.58 120.57 2ge8 h ASN 97 Ca 0.09 -0.31 0.09 0.00 -0.00 0.00 0.00 56.30 56.18 2ge8 h ASN 97 Cb 0.76 0.02 -0.09 0.00 -0.00 0.00 0.00 38.32 39.01 2ge8 h ASN 97 CO 0.06 0.27 -0.15 1.88 -0.00 0.00 0.00 177.43 179.49 2ge8 h TYR 98 N -0.44 -0.35 -0.34 0.67 0.99 -0.93 0.33 116.97 116.90 2ge8 h TYR 98 Ca -0.01 0.04 -0.07 0.00 2.00 0.00 0.00 58.73 60.69 2ge8 h TYR 98 Cb 0.38 0.23 -0.02 0.00 1.00 0.00 0.00 36.73 38.32 2ge8 h TYR 98 CO 0.04 -0.24 -0.09 0.28 -0.00 0.00 0.00 178.16 178.15 2ge8 h VAL 99 N -0.05 1.23 -0.43 -2.88 2.07 -1.13 -0.78 116.25 114.29 2ge8 h VAL 99 Ca 0.22 -1.01 -0.10 0.00 0.82 0.00 0.00 66.70 66.64 2ge8 h VAL 99 Cb 0.39 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 2ge8 h VAL 99 CO -0.50 0.34 -0.11 0.50 0.02 0.00 0.00 177.57 177.82 2ge8 h LYS 100 N 0.53 0.83 -0.51 1.57 3.64 0.12 -0.85 116.57 121.90 2ge8 h LYS 100 Ca 0.10 -0.32 -0.03 0.00 -1.27 0.00 0.00 60.65 59.13 2ge8 h LYS 100 Cb 0.48 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 2ge8 h LYS 100 CO 0.03 0.95 0.20 0.82 -2.27 0.00 0.00 179.45 179.18 2ge8 h ILE 101 N 0.65 1.22 -0.91 2.00 2.04 0.09 -2.37 117.51 120.23 2ge8 h ILE 101 Ca 0.11 -0.67 0.03 0.00 1.00 0.00 0.00 64.86 65.32 2ge8 h ILE 101 Cb 0.65 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 37.38 2ge8 h ILE 101 CO 0.04 0.26 0.59 0.00 0.00 0.00 0.00 178.15 179.04 2ge8 h ASP 103 N 1.16 0.04 0.01 0.00 3.32 -0.78 -0.43 116.42 119.74 2ge8 h ASP 103 Ca 0.36 0.09 -0.15 0.00 0.02 0.00 0.00 57.03 57.35 2ge8 h ASP 103 Cb -0.01 0.11 0.01 0.00 0.22 0.00 0.00 39.33 39.67 2ge8 h ASP 103 CO -0.12 0.05 -0.60 1.56 -1.72 0.00 0.00 179.24 178.41 2ge8 h GLN 104 N 0.27 0.38 0.07 3.56 4.20 -0.91 -3.41 115.11 119.26 2ge8 h GLN 104 Ca 0.26 -0.43 -0.36 0.00 0.06 0.00 0.00 58.65 58.18 2ge8 h GLN 104 Cb 0.35 0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.22 2ge8 h GLN 104 CO -0.33 1.11 -2.07 0.00 -0.67 0.00 0.00 178.83 176.87 2ge8 s VAL 106 N -2.55 3.39 -1.73 0.00 1.01 -0.18 -0.49 120.40 119.84 2ge8 s VAL 106 Ca -0.21 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.24 2ge8 s VAL 106 Cb 0.07 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 33.13 2ge8 s VAL 106 CO 0.75 -0.06 0.00 0.47 0.00 0.00 0.00 175.10 176.26 2ge8 n ASP 107 N 7.63 -4.87 -0.22 3.32 8.00 0.83 -4.87 116.55 126.38 2ge8 n ASP 107 Ca 0.19 0.29 0.15 0.00 0.71 0.00 0.00 54.79 56.12 2ge8 n ASP 107 Cb 0.43 -4.25 0.69 0.00 -0.02 0.00 0.00 41.12 37.97 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 -0.57 -0.58 3.62 0.44 0.00 -0.68 -4.86 105.19 102.54 2ge8 n GLY 108 Ca -0.19 -0.32 -0.53 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.52 0.06 0.00 1.61 3.14 -1.16 -1.36 118.33 120.11 2ge8 n VAL 109 Ca 0.20 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.56 2ge8 n VAL 109 Cb 0.25 -0.94 0.00 0.00 -1.06 0.00 0.00 33.84 32.09 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 2.89 1.24 3.41 7.55 0.00 -1.26 -4.93 105.19 114.09 2ge8 n GLY 110 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.12 1.98 0.13 2.61 -4.23 -0.46 -4.92 115.64 108.63 2ge8 s THR 111 Ca 0.00 -2.26 -0.07 0.00 -1.18 0.00 0.00 61.69 58.19 2ge8 s THR 111 Cb 0.00 -2.23 -0.02 0.00 1.34 0.00 0.00 72.50 71.59 2ge8 s THR 111 CO 0.00 -0.46 0.19 0.00 -0.54 0.00 0.00 174.62 173.81 2ge8 s ARG 112 N -3.62 0.99 0.84 3.99 1.70 -1.26 0.13 118.95 121.73 2ge8 s ARG 112 Ca 0.27 -1.19 -0.11 0.00 -0.47 0.00 0.00 55.73 54.23 2ge8 s ARG 112 Cb -0.01 0.33 0.09 0.00 -0.57 0.00 0.00 34.95 34.79 2ge8 s ARG 112 CO 0.11 -0.33 1.09 -2.14 -1.08 0.00 0.00 175.30 172.95 2ge8 s PRO 113 N -3.96 1.73 0.00 3.89 0.02 -1.26 -5.05 135.00 130.37 2ge8 s PRO 113 Ca 0.15 0.88 0.28 0.00 0.02 0.00 0.00 61.00 62.33 2ge8 s PRO 113 Cb 0.05 -1.86 1.07 0.00 0.02 0.00 0.00 34.50 33.78 2ge8 s PRO 113 CO -0.03 -1.93 1.75 1.63 -0.33 0.00 0.00 177.00 178.10