#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g48 s MET 1 N 0.00 3.25 0.30 0.00 1.00 -1.26 -5.11 119.30 117.49 3g48 s MET 1 Ca 0.00 -0.50 -0.00 0.00 0.00 0.00 0.00 55.69 55.19 3g48 s MET 1 Cb 0.00 -2.80 -0.04 0.00 0.00 0.00 0.00 34.83 32.00 3g48 s MET 1 CO 0.00 0.47 0.50 0.00 0.00 0.00 0.00 175.02 175.99 3g48 s ALA 2 N -0.27 3.73 -0.20 3.03 0.00 -1.26 -5.07 121.76 121.73 3g48 s ALA 2 Ca 0.05 -0.87 -0.11 0.00 0.00 0.00 0.00 51.96 51.03 3g48 s ALA 2 Cb -0.13 -2.08 -0.05 0.00 0.00 0.00 0.00 23.12 20.87 3g48 s ALA 2 CO 0.02 0.13 0.17 1.21 0.00 0.00 0.00 175.76 177.29 3g48 s ASN 3 N -3.73 6.25 0.46 0.00 3.84 -1.26 -5.00 114.94 115.50 3g48 s ASN 3 Ca 0.40 0.28 0.12 0.00 0.21 0.00 0.00 52.86 53.86 3g48 s ASN 3 Cb -0.10 -2.11 1.04 0.00 -0.55 0.00 0.00 41.25 39.53 3g48 s ASN 3 CO 0.33 0.15 2.08 0.15 -2.79 0.00 0.00 177.10 177.02 3g48 h PHE 4 N 6.74 0.23 -0.21 0.43 3.57 -2.00 -1.76 116.94 123.94 3g48 h PHE 4 Ca -0.41 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.07 3g48 h PHE 4 Cb 1.15 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.81 3g48 h PHE 4 CO 0.59 0.18 0.01 0.93 -2.23 0.00 0.00 178.31 177.79 3g48 h GLU 5 N 0.24 0.30 -0.30 1.11 4.39 -1.99 -1.15 114.58 117.19 3g48 h GLU 5 Ca 0.06 -0.04 -0.09 0.00 0.34 0.00 0.00 59.36 59.63 3g48 h GLU 5 Cb 0.04 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 3g48 h GLU 5 CO -0.01 0.32 -0.18 -0.44 -1.16 0.00 0.00 179.01 177.54 3g48 h ASP 6 N 0.30 0.67 -0.88 1.42 3.32 -1.74 -2.96 116.42 116.55 3g48 h ASP 6 Ca 0.07 -0.43 0.08 0.00 0.02 0.00 0.00 57.03 56.77 3g48 h ASP 6 Cb 0.18 -0.19 -0.07 0.00 0.22 0.00 0.00 39.33 39.48 3g48 h ASP 6 CO 0.00 0.96 0.54 0.15 -1.72 0.00 0.00 179.24 179.17 3g48 h PHE 7 N 0.40 0.99 0.00 4.55 3.57 -1.31 -2.19 116.94 122.94 3g48 h PHE 7 Ca 0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3g48 h PHE 7 Cb 0.72 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.15 3g48 h PHE 7 CO 0.06 0.47 0.00 -0.07 -2.23 0.00 0.00 178.31 176.54 3g48 h LEU 8 N 0.95 0.00 -0.53 0.59 3.38 -1.07 -1.26 115.31 117.36 3g48 h LEU 8 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.37 3g48 h LEU 8 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3g48 h LEU 8 CO -0.20 0.00 0.00 0.71 0.09 0.00 0.00 178.44 179.04 3g48 h THR 9 N 0.00 0.00 -3.66 0.22 1.35 -1.32 -3.45 112.91 106.05 3g48 h THR 9 Ca 0.00 -0.55 -0.50 0.00 -0.55 0.00 0.00 66.41 64.81 3g48 h THR 9 Cb 0.17 1.48 -0.03 0.00 -1.73 0.00 0.00 68.15 68.04 3g48 h THR 9 CO 0.00 0.00 0.22 -0.76 -0.25 0.00 0.00 175.52 174.73 3g48 s LEU 10 N -5.33 4.45 -0.50 3.87 1.43 -0.48 -5.03 118.68 117.09 3g48 s LEU 10 Ca 0.06 1.66 -0.04 0.00 -1.03 0.00 0.00 54.13 54.78 3g48 s LEU 10 Cb 0.09 -3.62 0.13 0.00 0.03 0.00 0.00 46.19 42.82 3g48 s LEU 10 CO 0.55 0.07 0.32 -0.62 0.23 0.00 0.00 176.35 176.90 3g48 s ASP 11 N -1.44 5.32 -0.09 2.29 -1.08 -1.26 -5.07 116.67 115.34 3g48 s ASP 11 Ca 0.43 -2.34 -0.14 0.00 -0.52 0.00 0.00 52.55 49.98 3g48 s ASP 11 Cb -0.20 -1.86 -0.05 0.00 -1.46 0.00 0.00 42.92 39.35 3g48 s ASP 11 CO 0.24 -0.49 0.34 -0.76 0.52 0.00 0.00 175.17 175.02 3g48 s LEU 12 N 0.70 4.36 0.04 -1.34 1.02 -1.26 -0.99 118.68 121.20 3g48 s LEU 12 Ca 0.11 0.71 0.01 0.00 0.02 0.00 0.00 54.13 54.99 3g48 s LEU 12 Cb -0.22 -2.45 -0.02 0.00 0.02 0.00 0.00 46.19 43.52 3g48 s LEU 12 CO -0.04 0.22 -0.06 -0.13 0.02 0.00 0.00 176.35 176.36 3g48 s ARG 13 N -0.30 0.46 0.14 1.70 1.81 0.21 -1.25 118.95 121.72 3g48 s ARG 13 Ca 0.20 -0.74 -0.26 0.00 -1.72 0.00 0.00 55.73 53.21 3g48 s ARG 13 Cb -0.14 -0.11 -0.07 0.00 -0.45 0.00 0.00 34.95 34.17 3g48 s ARG 13 CO 0.08 0.00 0.81 0.42 -0.68 0.00 0.00 175.30 175.93 3g48 s ILE 14 N -1.61 4.44 0.07 1.52 -1.09 -0.50 -1.39 121.20 122.63 3g48 s ILE 14 Ca -0.11 1.77 -0.03 0.00 -2.23 0.00 0.00 60.65 60.05 3g48 s ILE 14 Cb -0.09 -4.17 -0.03 0.00 -1.58 0.00 0.00 42.46 36.59 3g48 s ILE 14 CO -0.01 0.46 0.04 -0.83 -1.23 0.00 0.00 174.94 173.37 3g48 s GLY 15 N -0.76 0.44 -0.14 6.18 0.00 -0.78 -0.18 107.32 112.08 3g48 s GLY 15 Ca 0.38 -1.10 -0.02 0.00 0.00 0.00 0.00 44.72 43.98 3g48 s GLY 15 CO 0.26 -1.20 -0.07 -1.59 0.00 0.00 0.00 173.10 170.51 3g48 s THR 16 N -3.92 3.62 -0.05 0.90 2.01 -0.46 -0.67 115.64 117.07 3g48 s THR 16 Ca 0.09 -0.46 -0.30 0.00 0.31 0.00 0.00 61.69 61.33 3g48 s THR 16 Cb 0.07 -2.56 -0.05 0.00 0.01 0.00 0.00 72.50 69.97 3g48 s THR 16 CO -0.09 0.51 1.51 -0.69 -0.69 0.00 0.00 174.62 175.18 3g48 s VAL 17 N 0.22 3.71 -0.03 3.82 1.01 -0.08 -0.74 120.40 128.31 3g48 s VAL 17 Ca -0.04 0.95 0.17 0.00 0.00 0.00 0.00 61.98 63.05 3g48 s VAL 17 Cb -0.14 -3.61 -0.26 0.00 0.00 0.00 0.00 36.38 32.37 3g48 s VAL 17 CO 0.04 -0.06 0.34 0.35 0.00 0.00 0.00 175.10 175.77 3g48 n THR 18 N 5.19 0.08 -3.71 3.92 -2.24 0.06 -0.80 114.28 116.78 3g48 n THR 18 Ca 0.15 -0.41 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 3g48 n THR 18 Cb 0.43 0.06 -0.09 0.00 -2.10 0.00 0.00 70.33 68.64 3g48 n THR 18 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3g48 s HIS 19 N -3.10 -0.40 -0.17 4.78 3.76 -1.16 -4.86 115.29 114.13 3g48 s HIS 19 Ca -0.06 0.84 -0.19 0.00 -0.15 0.00 0.00 55.06 55.50 3g48 s HIS 19 Cb 0.10 0.18 0.05 0.00 1.11 0.00 0.00 32.58 34.02 3g48 s HIS 19 CO 0.69 -0.35 0.51 0.00 -0.85 0.00 0.00 174.74 174.75 3g48 s ALA 20 N -0.56 -1.28 -0.13 -1.40 0.00 -1.26 -1.42 121.76 115.71 3g48 s ALA 20 Ca -0.07 1.36 -0.09 0.00 0.00 0.00 0.00 51.96 53.16 3g48 s ALA 20 Cb -0.03 -0.71 0.04 0.00 0.00 0.00 0.00 23.12 22.42 3g48 s ALA 20 CO 0.03 -0.26 0.32 -2.00 0.00 0.00 0.00 175.76 173.86 3g48 s GLU 21 N 0.03 0.32 0.27 0.00 2.12 -0.83 -4.84 118.70 115.77 3g48 s GLU 21 Ca -0.02 0.57 -0.29 0.00 0.36 0.00 0.00 54.97 55.58 3g48 s GLU 21 Cb -0.03 0.03 -0.09 0.00 0.26 0.00 0.00 34.13 34.29 3g48 s GLU 21 CO 0.02 -0.11 1.12 -2.00 -0.54 0.00 0.00 175.26 173.74 3g48 s GLU 22 N 0.86 4.61 0.38 4.30 -6.30 -1.26 -0.78 118.70 120.51 3g48 s GLU 22 Ca -0.06 1.84 -0.09 0.00 -2.50 0.00 0.00 54.97 54.16 3g48 s GLU 22 Cb -0.07 -3.19 0.04 0.00 0.00 0.00 0.00 34.13 30.91 3g48 s GLU 22 CO -0.06 0.16 0.66 1.97 0.02 0.00 0.00 175.26 178.00 3g48 n PHE 23 N 1.29 -1.98 -4.06 5.30 1.16 -0.49 -4.91 117.46 113.78 3g48 n PHE 23 Ca -0.01 -2.07 -0.34 0.00 -1.87 0.00 0.00 57.45 53.16 3g48 n PHE 23 Cb 0.45 0.76 -0.14 0.00 -1.61 0.00 0.00 39.48 38.94 3g48 n PHE 23 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 3g48 s LYS 24 N -2.40 3.34 -0.35 3.97 -0.14 -1.26 -1.00 119.74 121.90 3g48 s LYS 24 Ca 0.22 -0.65 -0.09 0.00 -1.36 0.00 0.00 55.97 54.08 3g48 s LYS 24 Cb -0.03 -2.91 0.03 0.00 -1.68 0.00 0.00 37.83 33.24 3g48 s LYS 24 CO 0.16 -0.13 0.16 -2.00 -0.76 0.00 0.00 175.35 172.78 3g48 s GLU 25 N 1.28 2.85 -1.48 1.68 2.12 0.32 -4.46 118.70 121.01 3g48 s GLU 25 Ca 0.03 -1.05 -0.07 0.00 0.36 0.00 0.00 54.97 54.25 3g48 s GLU 25 Cb -0.14 -3.61 0.05 0.00 0.26 0.00 0.00 34.13 30.69 3g48 s GLU 25 CO -0.03 -0.64 0.64 0.00 -0.54 0.00 0.00 175.26 174.70 3g48 n ALA 26 N 4.94 -1.72 -1.23 6.30 0.00 -1.26 -0.88 120.51 126.65 3g48 n ALA 26 Ca -0.12 -0.11 -0.08 0.00 0.00 0.00 0.00 53.44 53.12 3g48 n ALA 26 Cb 0.46 -2.53 -0.03 0.00 0.00 0.00 0.00 19.45 17.35 3g48 n ALA 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3g48 n ARG 27 N -4.43 -1.19 -4.11 0.00 1.74 -1.26 -5.02 116.66 102.39 3g48 n ARG 27 Ca -0.16 0.71 -0.35 0.00 -0.77 0.00 0.00 57.85 57.28 3g48 n ARG 27 Cb 0.61 -4.80 -0.12 0.00 -1.02 0.00 0.00 32.46 27.13 3g48 n ARG 27 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3g48 s VAL 28 N -1.98 4.00 0.23 1.55 1.01 -0.06 -5.04 120.40 120.11 3g48 s VAL 28 Ca 0.00 -0.30 -0.31 0.00 0.00 0.00 0.00 61.98 61.37 3g48 s VAL 28 Cb 0.00 -2.80 -0.14 0.00 0.00 0.00 0.00 36.38 33.44 3g48 s VAL 28 CO 0.00 0.44 1.34 -2.65 0.00 0.00 0.00 175.10 174.22 3g48 n PRO 29 N 4.11 1.82 -3.94 2.72 -0.02 -1.26 -0.52 135.00 137.91 3g48 n PRO 29 Ca -0.17 0.65 -0.08 0.00 -2.02 0.00 0.00 63.50 61.87 3g48 n PRO 29 Cb 0.52 -2.26 -0.04 0.00 -0.02 0.00 0.00 33.50 31.70 3g48 n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g48 s ALA 30 N -0.15 -0.61 -0.14 3.55 0.00 -0.17 -4.69 121.76 119.54 3g48 s ALA 30 Ca 0.69 -0.67 0.02 0.00 0.00 0.00 0.00 51.96 52.00 3g48 s ALA 30 Cb -0.69 0.98 0.01 0.00 0.00 0.00 0.00 23.12 23.42 3g48 s ALA 30 CO 0.51 -0.93 -0.20 0.42 0.00 0.00 0.00 175.76 175.56 3g48 s ILE 31 N -3.95 1.95 -0.14 0.00 1.01 -0.02 -1.39 121.20 118.66 3g48 s ILE 31 Ca 0.18 -0.90 -0.23 0.00 0.00 0.00 0.00 60.65 59.69 3g48 s ILE 31 Cb -0.03 -1.74 -0.03 0.00 0.01 0.00 0.00 42.46 40.68 3g48 s ILE 31 CO 0.08 0.53 0.72 -0.60 0.00 0.00 0.00 174.94 175.67 3g48 s ARG 32 N 0.93 4.33 -0.04 2.79 6.06 0.04 -1.47 118.95 131.60 3g48 s ARG 32 Ca -0.05 0.84 0.06 0.00 -2.50 0.00 0.00 55.73 54.09 3g48 s ARG 32 Cb -0.15 -3.52 -0.02 0.00 0.06 0.00 0.00 34.95 31.32 3g48 s ARG 32 CO -0.04 -0.14 -0.23 -0.51 -2.50 0.00 0.00 175.30 171.88 3g48 s LEU 33 N 1.52 2.21 -0.15 -0.88 1.43 0.31 -1.96 118.68 121.16 3g48 s LEU 33 Ca 0.35 -0.42 -0.03 0.00 -1.03 0.00 0.00 54.13 53.00 3g48 s LEU 33 Cb -0.17 -1.40 -0.03 0.00 0.03 0.00 0.00 46.19 44.63 3g48 s LEU 33 CO 0.14 0.30 -0.05 -1.61 0.23 0.00 0.00 176.35 175.37 3g48 s GLU 34 N -0.51 3.60 -0.05 1.70 8.01 -0.51 -1.37 118.70 129.57 3g48 s GLU 34 Ca 0.07 -0.54 0.02 0.00 0.01 0.00 0.00 54.97 54.53 3g48 s GLU 34 Cb -0.11 -2.87 0.01 0.00 -4.31 0.00 0.00 34.13 26.86 3g48 s GLU 34 CO 0.00 0.26 -0.09 0.42 0.01 0.00 0.00 175.26 175.86 3g48 s ILE 35 N 0.31 0.90 -0.38 -1.63 1.01 -0.11 -0.76 121.20 120.53 3g48 s ILE 35 Ca -0.04 -0.35 -0.20 0.00 0.00 0.00 0.00 60.65 60.06 3g48 s ILE 35 Cb -0.14 -0.84 0.01 0.00 0.01 0.00 0.00 42.46 41.50 3g48 s ILE 35 CO 0.03 0.30 0.59 -0.62 0.00 0.00 0.00 174.94 175.24 3g48 s ASP 36 N 0.66 6.36 -0.41 3.58 -1.08 0.08 -0.68 116.67 125.18 3g48 s ASP 36 Ca -0.12 -0.05 0.05 0.00 -0.52 0.00 0.00 52.55 51.91 3g48 s ASP 36 Cb -0.14 -2.30 0.61 0.00 -1.46 0.00 0.00 42.92 39.63 3g48 s ASP 36 CO 0.02 -0.61 1.79 0.49 0.52 0.00 0.00 175.17 177.39 3g48 n PHE 37 N 5.99 2.53 0.00 -5.34 3.72 0.05 -1.35 117.46 123.06 3g48 n PHE 37 Ca -0.03 -1.84 0.00 0.00 -0.05 0.00 0.00 57.45 55.53 3g48 n PHE 37 Cb 0.48 -0.84 0.00 0.00 -0.94 0.00 0.00 39.48 38.19 3g48 n PHE 37 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3g48 n GLY 38 N -1.13 3.61 0.32 1.37 0.00 -1.26 -2.33 105.19 105.77 3g48 n GLY 38 Ca 0.53 -0.06 0.16 0.00 0.00 0.00 0.00 46.02 46.65 3g48 n GLY 38 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3g48 h GLU 39 N 0.00 0.00 -0.00 1.61 4.11 -1.92 -0.83 114.58 117.55 3g48 h GLU 39 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3g48 h GLU 39 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3g48 h GLU 39 CO 0.00 0.00 -0.11 1.28 0.07 0.00 0.00 179.01 180.25 3g48 n LEU 40 N -3.80 0.17 0.00 3.06 4.77 -0.99 -5.05 117.00 115.16 3g48 n LEU 40 Ca -0.00 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 3g48 n LEU 40 Cb 0.22 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 3g48 n LEU 40 CO 0.27 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 3g48 n GLY 41 N 1.43 -0.79 3.76 -0.72 0.00 -0.32 -4.87 105.19 103.68 3g48 n GLY 41 Ca 0.09 -1.17 -0.40 0.00 0.00 0.00 0.00 46.02 44.54 3g48 n GLY 41 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3g48 s MET 42 N 0.00 4.73 0.07 1.61 -2.45 -1.26 -0.77 119.30 121.23 3g48 s MET 42 Ca 0.00 1.35 0.03 0.00 -1.25 0.00 0.00 55.69 55.83 3g48 s MET 42 Cb 0.00 -3.28 -0.03 0.00 1.25 0.00 0.00 34.83 32.77 3g48 s MET 42 CO 0.00 0.51 -0.10 0.15 1.05 0.00 0.00 175.02 176.63 3g48 s LYS 43 N -1.06 0.70 0.01 4.11 -0.14 0.14 -4.96 119.74 118.54 3g48 s LYS 43 Ca 0.39 -0.95 0.01 0.00 -1.36 0.00 0.00 55.97 54.07 3g48 s LYS 43 Cb -0.25 -0.49 -0.04 0.00 -1.68 0.00 0.00 37.83 35.38 3g48 s LYS 43 CO 0.30 0.09 0.03 -0.65 -0.76 0.00 0.00 175.35 174.36 3g48 s GLN 44 N -2.06 2.87 0.05 1.68 -0.21 -1.26 -0.94 119.66 119.79 3g48 s GLN 44 Ca -0.03 -0.59 -0.13 0.00 0.02 0.00 0.00 55.36 54.63 3g48 s GLN 44 Cb -0.07 -2.73 0.02 0.00 1.00 0.00 0.00 33.01 31.23 3g48 s GLN 44 CO 0.01 0.62 0.29 0.45 -2.12 0.00 0.00 175.29 174.54 3g48 s SER 45 N -1.72 -0.10 -0.04 5.90 0.15 -0.47 -0.59 113.70 116.83 3g48 s SER 45 Ca 0.22 -0.23 0.01 0.00 0.70 0.00 0.00 55.95 56.64 3g48 s SER 45 Cb -0.12 0.35 -0.03 0.00 -1.71 0.00 0.00 66.02 64.51 3g48 s SER 45 CO 0.13 -0.62 -0.05 -0.44 1.20 0.00 0.00 173.24 173.46 3g48 s SER 46 N -2.12 4.80 -0.02 5.45 0.01 -1.26 -0.53 113.70 120.02 3g48 s SER 46 Ca -0.04 -0.02 0.01 0.00 1.31 0.00 0.00 55.95 57.21 3g48 s SER 46 Cb -0.01 -1.22 0.01 0.00 0.21 0.00 0.00 66.02 65.02 3g48 s SER 46 CO -0.04 0.34 -0.04 0.00 0.41 0.00 0.00 173.24 173.91 3g48 s ALA 47 N -0.90 0.51 -1.31 1.44 0.00 -0.54 -4.85 121.76 116.10 3g48 s ALA 47 Ca 0.15 -0.08 -0.10 0.00 0.00 0.00 0.00 51.96 51.93 3g48 s ALA 47 Cb -0.11 -0.27 0.15 0.00 0.00 0.00 0.00 23.12 22.89 3g48 s ALA 47 CO 0.04 0.03 1.93 1.04 0.00 0.00 0.00 175.76 178.81 3g48 n GLN 48 N 3.60 3.50 -0.25 0.00 6.02 -1.26 -0.84 117.38 128.14 3g48 n GLN 48 Ca -0.21 -3.38 0.09 0.00 -0.01 0.00 0.00 57.00 53.49 3g48 n GLN 48 Cb 0.54 -2.99 0.18 0.00 1.02 0.00 0.00 30.24 28.99 3g48 n GLN 48 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 3g48 n ILE 49 N 3.63 2.06 0.29 5.09 -5.35 -1.26 -4.68 119.36 119.13 3g48 n ILE 49 Ca 0.42 -2.27 0.17 0.00 -0.27 0.00 0.00 62.75 60.80 3g48 n ILE 49 Cb 0.37 -0.25 0.66 0.00 -1.74 0.00 0.00 39.64 38.68 3g48 n ILE 49 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 3g48 h THR 50 N 0.61 0.00 -0.15 7.28 1.35 -1.82 -2.08 112.91 118.11 3g48 h THR 50 Ca 0.01 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 3g48 h THR 50 Cb 1.15 1.47 -0.01 0.00 -1.73 0.00 0.00 68.15 69.04 3g48 h THR 50 CO 0.08 0.00 0.10 0.50 -0.25 0.00 0.00 175.52 175.95 3g48 h LYS 51 N 0.00 0.20 -0.00 4.72 3.64 -1.85 -3.35 116.57 119.93 3g48 h LYS 51 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3g48 h LYS 51 Cb 0.51 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 3g48 h LYS 51 CO 0.00 0.15 -0.49 0.54 -2.27 0.00 0.00 179.45 177.39 3g48 n ARG 52 N -4.97 3.30 -4.39 1.90 1.74 -1.21 -5.03 116.66 108.00 3g48 n ARG 52 Ca -0.04 -0.06 -0.23 0.00 -0.77 0.00 0.00 57.85 56.75 3g48 n ARG 52 Cb 0.04 -1.02 -0.13 0.00 -1.02 0.00 0.00 32.46 30.33 3g48 n ARG 52 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3g48 s TYR 53 N -1.97 1.66 0.21 -1.55 2.02 -0.78 -5.15 117.35 111.78 3g48 s TYR 53 Ca 0.05 -0.40 0.10 0.00 -0.37 0.00 0.00 57.07 56.45 3g48 s TYR 53 Cb 0.08 -0.95 -0.05 0.00 -0.40 0.00 0.00 41.96 40.65 3g48 s TYR 53 CO 0.43 0.13 -0.20 0.54 -1.57 0.00 0.00 175.55 174.88 3g48 s ASN 54 N -1.56 3.12 0.24 2.29 2.20 -1.26 -4.37 114.94 115.59 3g48 s ASN 54 Ca 0.05 -0.93 -0.05 0.00 -0.94 0.00 0.00 52.86 50.99 3g48 s ASN 54 Cb -0.09 -0.22 0.34 0.00 -2.00 0.00 0.00 41.25 39.28 3g48 s ASN 54 CO 0.03 0.01 1.84 -0.65 -2.94 0.00 0.00 177.10 175.39 3g48 h PRO 55 N 2.89 0.89 -0.58 3.55 0.11 -1.96 -2.62 132.00 134.28 3g48 h PRO 55 Ca -0.42 -0.05 0.08 0.00 0.11 0.00 0.00 66.00 65.72 3g48 h PRO 55 Cb 1.22 -0.20 -0.07 0.00 0.11 0.00 0.00 31.00 32.07 3g48 h PRO 55 CO 0.54 0.59 0.22 1.49 -0.21 0.00 0.00 178.00 180.63 3g48 h GLU 56 N 0.92 0.40 0.00 1.05 4.81 -1.97 -1.87 114.58 117.92 3g48 h GLU 56 Ca 0.38 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 3g48 h GLU 56 Cb 0.21 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.50 3g48 h GLU 56 CO -0.19 0.26 0.00 -0.40 -0.73 0.00 0.00 179.01 177.95 3g48 n ASP 57 N -4.98 0.48 0.10 1.04 5.68 -1.00 -3.24 116.55 114.61 3g48 n ASP 57 Ca 0.08 0.56 -0.02 0.00 -0.50 0.00 0.00 54.79 54.91 3g48 n ASP 57 Cb 0.24 -0.68 -0.05 0.00 -1.14 0.00 0.00 41.12 39.49 3g48 n ASP 57 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 3g48 h LEU 58 N 0.00 0.00 -9.46 -2.12 3.38 -1.23 -3.44 115.31 102.43 3g48 h LEU 58 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3g48 h LEU 58 Cb 0.56 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.34 3g48 h LEU 58 CO 0.00 0.73 1.11 -0.63 0.09 0.00 0.00 178.44 179.74 3g48 s ILE 59 N -2.84 2.75 0.00 1.22 -1.09 -1.19 -1.27 121.20 118.78 3g48 s ILE 59 Ca 0.02 0.15 0.00 0.00 -2.23 0.00 0.00 60.65 58.59 3g48 s ILE 59 Cb 0.09 -3.10 0.00 0.00 -1.58 0.00 0.00 42.46 37.87 3g48 s ILE 59 CO 0.78 -0.00 0.00 0.61 -1.23 0.00 0.00 174.94 175.10 3g48 n GLY 60 N 4.24 1.01 3.78 6.18 0.00 0.02 -5.03 105.19 115.39 3g48 n GLY 60 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3g48 n GLY 60 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g48 s GLN 61 N -0.41 4.62 -0.15 1.61 -1.52 -0.39 -4.80 119.66 118.61 3g48 s GLN 61 Ca 0.00 1.34 -0.10 0.00 -1.95 0.00 0.00 55.36 54.65 3g48 s GLN 61 Cb 0.00 -2.88 -0.05 0.00 -0.22 0.00 0.00 33.01 29.87 3g48 s GLN 61 CO 0.00 0.32 0.18 -0.65 -0.25 0.00 0.00 175.29 174.89 3g48 s GLN 62 N -1.92 3.86 0.42 2.91 -0.21 -1.26 -0.90 119.66 122.56 3g48 s GLN 62 Ca 0.49 -0.09 0.04 0.00 0.02 0.00 0.00 55.36 55.81 3g48 s GLN 62 Cb -0.20 -3.31 -0.05 0.00 1.00 0.00 0.00 33.01 30.46 3g48 s GLN 62 CO 0.25 0.53 0.03 0.96 -2.12 0.00 0.00 175.29 174.94 3g48 s ILE 63 N -0.33 1.40 -0.10 1.08 -5.25 0.16 -4.45 121.20 113.72 3g48 s ILE 63 Ca 0.13 -2.00 0.04 0.00 -0.99 0.00 0.00 60.65 57.83 3g48 s ILE 63 Cb -0.12 -2.62 0.00 0.00 2.95 0.00 0.00 42.46 42.67 3g48 s ILE 63 CO 0.02 0.00 -0.23 -0.69 -1.79 0.00 0.00 174.94 172.26 3g48 s VAL 64 N -2.94 1.97 0.02 8.37 1.01 -1.25 -1.87 120.40 125.71 3g48 s VAL 64 Ca 0.25 -0.97 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 3g48 s VAL 64 Cb 0.06 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 3g48 s VAL 64 CO 0.13 0.54 0.05 0.00 0.00 0.00 0.00 175.10 175.82 3g48 s ALA 65 N 0.37 -0.06 -0.15 5.51 0.00 -0.49 -1.08 121.76 125.86 3g48 s ALA 65 Ca -0.18 -0.44 -0.23 0.00 0.00 0.00 0.00 51.96 51.11 3g48 s ALA 65 Cb -0.18 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.07 3g48 s ALA 65 CO 0.08 -0.21 0.71 0.08 0.00 0.00 0.00 175.76 176.43 3g48 s VAL 66 N -1.68 4.99 -0.97 0.00 1.01 -0.23 -0.62 120.40 122.90 3g48 s VAL 66 Ca -0.13 1.40 0.12 0.00 0.00 0.00 0.00 61.98 63.37 3g48 s VAL 66 Cb -0.07 -4.03 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 3g48 s VAL 66 CO -0.01 0.13 0.66 1.33 0.00 0.00 0.00 175.10 177.21 3g48 n VAL 67 N 4.41 0.00 -1.57 2.92 0.24 -0.16 -1.35 118.33 122.82 3g48 n VAL 67 Ca 0.00 -0.33 -0.02 0.00 -2.04 0.00 0.00 64.34 61.96 3g48 n VAL 67 Cb 0.50 1.10 0.19 0.00 -1.47 0.00 0.00 33.84 34.16 3g48 n VAL 67 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 3g48 n ASN 68 N -0.52 2.42 -4.91 -1.34 6.94 -1.26 -4.85 115.26 111.75 3g48 n ASN 68 Ca 0.04 -3.84 -0.28 0.00 -0.02 0.00 0.00 54.58 50.48 3g48 n ASN 68 Cb 0.24 -0.57 -0.02 0.00 -2.36 0.00 0.00 39.78 37.07 3g48 n ASN 68 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3g48 s PHE 69 N -3.29 3.51 0.64 -2.53 0.08 -1.26 -4.96 117.98 110.16 3g48 s PHE 69 Ca 0.43 0.73 -0.18 0.00 0.12 0.00 0.00 56.93 58.03 3g48 s PHE 69 Cb 0.39 -2.20 -0.02 0.00 -0.57 0.00 0.00 43.02 40.62 3g48 s PHE 69 CO -0.03 -0.05 1.17 -2.30 -0.10 0.00 0.00 175.22 173.91 3g48 n PRO 70 N -1.62 1.02 -1.88 0.24 -0.02 -1.26 -4.92 135.00 126.56 3g48 n PRO 70 Ca -0.01 0.40 -0.36 0.00 -2.02 0.00 0.00 63.50 61.51 3g48 n PRO 70 Cb 0.55 -2.40 0.05 0.00 -0.02 0.00 0.00 33.50 31.68 3g48 n PRO 70 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3g48 s PRO 71 N -3.15 2.78 -0.17 0.52 0.04 -1.26 -5.00 135.00 128.76 3g48 s PRO 71 Ca 0.80 1.86 -0.08 0.00 0.04 0.00 0.00 61.00 63.62 3g48 s PRO 71 Cb -0.39 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 3g48 s PRO 71 CO 0.42 -1.36 0.11 0.21 0.04 0.00 0.00 177.00 176.42 3g48 s LYS 72 N -3.43 3.92 -0.11 4.56 2.20 -0.18 -4.91 119.74 121.78 3g48 s LYS 72 Ca 0.78 -0.25 0.03 0.00 -0.36 0.00 0.00 55.97 56.18 3g48 s LYS 72 Cb -0.31 -3.28 0.00 0.00 -1.51 0.00 0.00 37.83 32.73 3g48 s LYS 72 CO 0.36 0.41 -0.23 1.03 -0.36 0.00 0.00 175.35 176.56 3g48 s ARG 73 N 0.01 3.01 -0.18 4.03 0.52 -1.26 0.65 118.95 125.74 3g48 s ARG 73 Ca 0.08 -0.86 -0.01 0.00 -0.52 0.00 0.00 55.73 54.43 3g48 s ARG 73 Cb -0.12 -2.33 0.05 0.00 0.52 0.00 0.00 34.95 33.07 3g48 s ARG 73 CO 0.00 0.10 -0.04 0.08 0.02 0.00 0.00 175.30 175.46 3g48 s VAL 74 N 0.53 1.10 -1.38 3.52 1.01 -0.46 -4.94 120.40 119.78 3g48 s VAL 74 Ca -0.14 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.09 3g48 s VAL 74 Cb -0.17 -1.32 0.03 0.00 0.00 0.00 0.00 36.38 34.92 3g48 s VAL 74 CO 0.05 0.07 0.84 0.00 0.00 0.00 0.00 175.10 176.05 3g48 n ALA 75 N 4.87 -1.72 0.00 5.51 0.00 -1.26 -0.44 120.51 127.46 3g48 n ALA 75 Ca -0.12 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 3g48 n ALA 75 Cb 0.47 -3.06 0.00 0.00 0.00 0.00 0.00 19.45 16.86 3g48 n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g48 n GLY 76 N -1.62 2.38 3.53 0.00 0.00 -1.26 -4.92 105.19 103.29 3g48 n GLY 76 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 3g48 n GLY 76 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g48 s PHE 77 N -2.46 3.21 -0.10 1.61 0.08 0.41 -5.05 117.98 115.69 3g48 s PHE 77 Ca 0.00 -0.16 -0.21 0.00 0.12 0.00 0.00 56.93 56.69 3g48 s PHE 77 Cb 0.00 -2.64 -0.04 0.00 -0.57 0.00 0.00 43.02 39.77 3g48 s PHE 77 CO 0.00 -0.46 0.58 0.21 -0.10 0.00 0.00 175.22 175.45 3g48 s LYS 78 N 1.93 4.38 -0.18 0.44 2.20 -1.26 -1.35 119.74 125.90 3g48 s LYS 78 Ca 0.10 0.64 -0.01 0.00 -0.36 0.00 0.00 55.97 56.34 3g48 s LYS 78 Cb -0.17 -3.44 -0.00 0.00 -1.51 0.00 0.00 37.83 32.70 3g48 s LYS 78 CO 0.11 0.11 -0.12 -1.12 -0.36 0.00 0.00 175.35 173.97 3g48 s SER 79 N 0.71 3.83 0.05 1.43 0.01 0.21 -4.59 113.70 115.34 3g48 s SER 79 Ca 0.31 -0.45 0.23 0.00 1.31 0.00 0.00 55.95 57.35 3g48 s SER 79 Cb -0.16 -1.61 -0.05 0.00 0.21 0.00 0.00 66.02 64.40 3g48 s SER 79 CO 0.14 0.05 0.92 -0.62 0.41 0.00 0.00 173.24 174.14 3g48 n GLU 80 N 4.29 0.36 -4.07 12.44 1.02 0.24 -1.01 120.64 133.92 3g48 n GLU 80 Ca -0.19 -0.03 -0.12 0.00 -0.02 0.00 0.00 57.16 56.81 3g48 n GLU 80 Cb 0.51 -1.59 -0.11 0.00 -0.02 0.00 0.00 31.44 30.23 3g48 n GLU 80 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3g48 s VAL 81 N -3.26 0.50 -0.40 2.62 -7.23 -1.25 -4.77 120.40 106.62 3g48 s VAL 81 Ca 0.01 -1.23 -0.14 0.00 -1.81 0.00 0.00 61.98 58.81 3g48 s VAL 81 Cb 0.14 -0.78 0.02 0.00 0.56 0.00 0.00 36.38 36.32 3g48 s VAL 81 CO 0.83 -0.51 0.27 -0.22 -0.31 0.00 0.00 175.10 175.16 3g48 s LEU 82 N -1.87 4.98 -0.05 1.32 2.96 -0.46 -4.77 118.68 120.79 3g48 s LEU 82 Ca -0.06 -0.89 -0.29 0.00 -0.22 0.00 0.00 54.13 52.67 3g48 s LEU 82 Cb -0.07 -2.13 -0.02 0.00 0.50 0.00 0.00 46.19 44.47 3g48 s LEU 82 CO -0.01 -0.42 0.94 -0.69 -1.32 0.00 0.00 176.35 174.85 3g48 s VAL 83 N 1.65 4.87 -0.02 1.68 1.01 -1.26 -1.06 120.40 127.27 3g48 s VAL 83 Ca 0.04 1.94 -0.12 0.00 0.00 0.00 0.00 61.98 63.85 3g48 s VAL 83 Cb -0.19 -4.27 -0.05 0.00 0.00 0.00 0.00 36.38 31.87 3g48 s VAL 83 CO 0.09 0.12 0.33 -0.76 0.00 0.00 0.00 175.10 174.89 3g48 s LEU 84 N 1.34 4.43 0.13 3.92 1.43 -0.24 -5.00 118.68 124.69 3g48 s LEU 84 Ca 0.48 0.79 -0.18 0.00 -1.03 0.00 0.00 54.13 54.19 3g48 s LEU 84 Cb -0.19 -2.52 0.04 0.00 0.03 0.00 0.00 46.19 43.55 3g48 s LEU 84 CO 0.23 0.32 0.46 -0.83 0.23 0.00 0.00 176.35 176.75 3g48 s GLY 85 N -1.21 -0.37 0.21 -3.19 0.00 -1.26 -2.09 107.32 99.41 3g48 s GLY 85 Ca 0.23 0.14 -0.26 0.00 0.00 0.00 0.00 44.72 44.83 3g48 s GLY 85 CO 0.12 -0.14 0.84 -0.32 0.00 0.00 0.00 173.10 173.60 3g48 s GLY 86 N -2.71 2.93 -0.51 0.20 0.00 0.39 -4.87 107.32 102.74 3g48 s GLY 86 Ca 0.02 0.43 0.03 0.00 0.00 0.00 0.00 44.72 45.20 3g48 s GLY 86 CO -0.11 0.93 0.29 0.14 0.00 0.00 0.00 173.10 174.35 3g48 s VAL 87 N -1.26 2.10 -0.33 1.40 1.01 -1.26 -1.01 120.40 121.05 3g48 s VAL 87 Ca 0.40 -3.14 0.22 0.00 0.00 0.00 0.00 61.98 59.46 3g48 s VAL 87 Cb -0.23 -2.45 0.28 0.00 0.00 0.00 0.00 36.38 33.99 3g48 s VAL 87 CO 0.27 -0.88 1.61 1.55 0.00 0.00 0.00 175.10 177.65 3g48 h PRO 88 N 6.40 0.00 -3.24 2.72 0.13 -1.97 -3.47 132.00 132.58 3g48 h PRO 88 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 3g48 h PRO 88 Cb 0.89 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.93 3g48 h PRO 88 CO 0.60 0.11 0.09 -1.83 -0.23 0.00 0.00 178.00 176.74 3g48 s GLU 89 N -3.20 1.52 0.25 0.86 -1.05 -1.26 -5.09 118.70 110.73 3g48 s GLU 89 Ca 0.06 -0.93 -0.31 0.00 -0.15 0.00 0.00 54.97 53.64 3g48 s GLU 89 Cb 0.06 0.55 -0.12 0.00 -0.44 0.00 0.00 34.13 34.18 3g48 s GLU 89 CO 0.68 -0.66 1.65 0.00 0.95 0.00 0.00 175.26 177.87 3g48 n ALA 90 N -0.39 2.57 -0.46 -0.84 0.00 -1.26 -1.88 120.51 118.26 3g48 n ALA 90 Ca -0.08 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.76 3g48 n ALA 90 Cb 0.62 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.59 3g48 n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g48 n GLY 91 N 3.02 1.43 3.23 0.00 0.00 -1.26 -5.02 105.19 106.60 3g48 n GLY 91 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 3g48 n GLY 91 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3g48 s ASP 92 N -3.20 3.87 -0.05 1.61 -1.08 -0.79 -4.59 116.67 112.43 3g48 s ASP 92 Ca 0.00 -0.54 0.03 0.00 -0.52 0.00 0.00 52.55 51.53 3g48 s ASP 92 Cb 0.00 -1.64 0.01 0.00 -1.46 0.00 0.00 42.92 39.83 3g48 s ASP 92 CO 0.00 -0.02 -0.14 -0.69 0.52 0.00 0.00 175.17 174.84 3g48 s VAL 93 N 1.39 1.22 -0.18 1.11 1.01 -1.26 -3.76 120.40 119.93 3g48 s VAL 93 Ca 0.05 -0.56 -0.01 0.00 0.00 0.00 0.00 61.98 61.46 3g48 s VAL 93 Cb -0.14 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.16 3g48 s VAL 93 CO -0.07 0.37 -0.14 -0.69 0.00 0.00 0.00 175.10 174.57 3g48 s VAL 94 N 0.37 2.65 0.44 2.92 1.01 -0.18 -4.68 120.40 122.94 3g48 s VAL 94 Ca -0.09 -0.75 -0.24 0.00 0.00 0.00 0.00 61.98 60.90 3g48 s VAL 94 Cb -0.13 -2.15 -0.08 0.00 0.00 0.00 0.00 36.38 34.02 3g48 s VAL 94 CO 0.03 0.50 1.19 -0.76 0.00 0.00 0.00 175.10 176.06 3g48 s LEU 95 N 1.17 4.07 0.57 3.92 1.43 -1.26 -0.46 118.68 128.11 3g48 s LEU 95 Ca 0.01 2.38 -0.17 0.00 -1.03 0.00 0.00 54.13 55.33 3g48 s LEU 95 Cb -0.14 -4.15 -0.05 0.00 0.03 0.00 0.00 46.19 41.88 3g48 s LEU 95 CO -0.05 -0.89 1.06 -0.76 0.23 0.00 0.00 176.35 175.93 3g48 s LEU 96 N -2.86 3.57 0.10 1.79 1.43 -0.89 -4.84 118.68 116.98 3g48 s LEU 96 Ca 0.62 1.84 -0.17 0.00 -1.03 0.00 0.00 54.13 55.39 3g48 s LEU 96 Cb -0.31 -4.54 0.04 0.00 0.03 0.00 0.00 46.19 41.41 3g48 s LEU 96 CO 0.38 -1.09 0.41 0.00 0.23 0.00 0.00 176.35 176.28 3g48 s GLN 97 N -3.90 1.03 0.44 1.70 -2.07 -1.26 -3.85 119.66 111.75 3g48 s GLN 97 Ca 0.64 -0.60 -0.22 0.00 -1.82 0.00 0.00 55.36 53.36 3g48 s GLN 97 Cb -0.16 0.45 -0.08 0.00 -1.09 0.00 0.00 33.01 32.13 3g48 s GLN 97 CO 0.33 -0.39 1.06 -1.25 -1.32 0.00 0.00 175.29 173.73 3g48 s PRO 98 N -3.40 3.95 0.51 9.60 0.04 -1.26 -4.93 135.00 139.51 3g48 s PRO 98 Ca 0.00 1.49 0.30 0.00 0.04 0.00 0.00 61.00 62.83 3g48 s PRO 98 Cb 0.01 -2.34 1.29 0.00 0.04 0.00 0.00 34.50 33.50 3g48 s PRO 98 CO -0.09 -0.32 1.97 -0.97 0.04 0.00 0.00 177.00 177.63 3g48 h ASN 99 N 2.05 0.00 -5.36 6.66 -1.24 -2.01 -3.44 115.58 112.25 3g48 h ASN 99 Ca -0.49 0.00 -0.16 0.00 0.71 0.00 0.00 56.30 56.36 3g48 h ASN 99 Cb 1.22 0.00 -0.15 0.00 0.73 0.00 0.00 38.32 40.12 3g48 h ASN 99 CO 0.61 0.10 -0.63 -0.04 -1.29 0.00 0.00 177.43 176.18 3g48 s MET 100 N -3.79 0.85 0.33 6.67 -1.94 -1.26 -5.13 119.30 115.02 3g48 s MET 100 Ca -0.00 -1.35 -0.29 0.00 -1.71 0.00 0.00 55.69 52.34 3g48 s MET 100 Cb 0.10 0.24 -0.11 0.00 2.01 0.00 0.00 34.83 37.08 3g48 s MET 100 CO 0.58 -0.23 1.44 -1.21 -0.01 0.00 0.00 175.02 175.59 3g48 s GLU 101 N -4.00 4.21 0.12 2.03 2.02 -1.26 -5.02 118.70 116.79 3g48 s GLU 101 Ca 0.18 2.42 0.06 0.00 0.02 0.00 0.00 54.97 57.66 3g48 s GLU 101 Cb 0.07 -3.03 -0.04 0.00 0.10 0.00 0.00 34.13 31.24 3g48 s GLU 101 CO -0.02 -0.43 -0.15 -0.51 0.02 0.00 0.00 175.26 174.17 3g48 s LEU 102 N -1.51 2.38 0.41 1.80 1.43 -1.26 -5.13 118.68 116.80 3g48 s LEU 102 Ca 0.54 -0.78 -0.27 0.00 -1.03 0.00 0.00 54.13 52.60 3g48 s LEU 102 Cb -0.44 -0.61 -0.10 0.00 0.03 0.00 0.00 46.19 45.07 3g48 s LEU 102 CO 0.55 -0.10 1.46 -2.65 0.23 0.00 0.00 176.35 175.83 3g48 n PRO 103 N 0.66 2.47 -1.74 1.29 -0.02 -1.26 -4.92 135.00 131.48 3g48 n PRO 103 Ca -0.16 0.87 -0.40 0.00 -2.02 0.00 0.00 63.50 61.79 3g48 n PRO 103 Cb 0.56 -2.64 0.02 0.00 -0.02 0.00 0.00 33.50 31.42 3g48 n PRO 103 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3g48 n ASN 104 N 0.17 2.93 0.00 2.55 3.02 -1.26 -2.01 115.26 120.66 3g48 n ASN 104 Ca 0.03 1.09 0.00 0.00 -0.03 0.00 0.00 54.58 55.67 3g48 n ASN 104 Cb 0.40 -1.56 0.00 0.00 -0.61 0.00 0.00 39.78 38.01 3g48 n ASN 104 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3g48 n GLY 105 N 0.69 1.09 3.71 7.41 0.00 0.75 -4.03 105.19 114.81 3g48 n GLY 105 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 3g48 n GLY 105 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3g48 n THR 106 N -2.00 0.93 -2.97 2.61 -1.04 -0.85 -4.69 114.28 106.28 3g48 n THR 106 Ca 0.00 -0.23 -0.36 0.00 -2.04 0.00 0.00 64.05 61.42 3g48 n THR 106 Cb 0.00 -1.75 -0.06 0.00 -1.82 0.00 0.00 70.33 66.69 3g48 n THR 106 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3g48 s LYS 107 N -0.36 4.34 -0.12 -2.82 1.02 -1.26 -1.41 119.74 119.12 3g48 s LYS 107 Ca 0.66 1.03 -0.02 0.00 0.02 0.00 0.00 55.97 57.66 3g48 s LYS 107 Cb -0.56 -2.73 -0.03 0.00 -0.52 0.00 0.00 37.83 33.98 3g48 s LYS 107 CO 0.48 0.29 -0.03 0.42 -0.92 0.00 0.00 175.35 175.58 3g48 s ILE 108 N -1.67 3.97 0.00 2.17 1.01 -0.38 -4.97 121.20 121.33 3g48 s ILE 108 Ca 0.49 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.79 3g48 s ILE 108 Cb -0.16 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.61 3g48 s ILE 108 CO 0.21 0.54 0.00 -1.54 0.00 0.00 0.00 174.94 174.15