#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gpl s ASP -7 N 0.00 6.39 0.62 6.43 3.68 -1.26 -4.87 116.67 127.67 2gpl s ASP -7 Ca 0.00 0.26 0.22 0.00 2.13 0.00 0.00 52.55 55.16 2gpl s ASP -7 Cb 0.00 -2.55 0.96 0.00 -1.45 0.00 0.00 42.92 39.88 2gpl s ASP -7 CO 0.00 -1.50 1.48 -0.65 0.13 0.00 0.00 175.17 174.63 2gpl h PRO -6 N 9.93 0.00 0.00 4.34 0.11 -2.02 0.33 132.00 144.69 2gpl h PRO -6 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2gpl h PRO -6 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2gpl h PRO -6 CO 1.17 0.00 -0.27 0.43 -0.21 0.00 0.00 178.00 179.12 2gpl n SER -5 N -3.13 0.30 -0.37 -2.05 7.64 -1.26 -3.76 113.62 111.00 2gpl n SER -5 Ca 0.10 0.13 0.10 0.00 1.01 0.00 0.00 58.87 60.21 2gpl n SER -5 Cb 1.02 -0.13 0.18 0.00 -1.01 0.00 0.00 64.21 64.28 2gpl n SER -5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2gpl n SER -4 N -1.57 2.90 -0.06 6.43 7.64 0.11 -4.41 113.62 124.66 2gpl n SER -4 Ca 0.06 -3.07 -0.22 0.00 1.01 0.00 0.00 58.87 56.65 2gpl n SER -4 Cb 0.35 -0.47 -0.12 0.00 -1.01 0.00 0.00 64.21 62.95 2gpl n SER -4 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2gpl n ILE -3 N -1.11 1.63 -0.07 0.44 5.41 -1.23 -4.63 119.36 119.81 2gpl n ILE -3 Ca 0.18 -0.31 -0.05 0.00 1.00 0.00 0.00 62.75 63.56 2gpl n ILE -3 Cb 0.73 -1.89 -0.16 0.00 -0.71 0.00 0.00 39.64 37.61 2gpl n ILE -3 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2gpl n ASN -2 N -4.01 0.09 -0.63 4.38 5.03 -1.26 -1.43 115.26 117.43 2gpl n ASN -2 Ca -0.34 0.04 0.08 0.00 0.87 0.00 0.00 54.58 55.24 2gpl n ASN -2 Cb 0.85 1.10 -0.03 0.00 -1.02 0.00 0.00 39.78 40.67 2gpl n ASN -2 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2gpl n GLY -1 N 1.62 -2.28 0.00 7.41 0.00 -1.26 -1.74 105.19 108.95 2gpl n GLY -1 Ca -0.25 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2gpl n GLY -1 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gpl n GLY 1 N -3.29 4.19 3.18 -0.02 0.00 -1.22 -4.66 105.19 103.37 2gpl n GLY 1 Ca -0.02 -1.55 -0.08 0.00 0.00 0.00 0.00 46.02 44.37 2gpl n GLY 1 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gpl s ILE 2 N -2.18 0.16 -0.10 -0.61 -4.36 -1.26 -1.35 121.20 111.49 2gpl s ILE 2 Ca 0.00 -1.31 -0.12 0.00 -0.26 0.00 0.00 60.65 58.96 2gpl s ILE 2 Cb 0.00 -1.37 0.03 0.00 1.25 0.00 0.00 42.46 42.37 2gpl s ILE 2 CO 0.00 -0.73 0.31 -0.69 0.24 0.00 0.00 174.94 174.08 2gpl s VAL 3 N -3.86 0.01 -0.03 8.37 1.01 -0.34 -2.82 120.40 122.74 2gpl s VAL 3 Ca 0.05 -0.09 -0.05 0.00 0.00 0.00 0.00 61.98 61.90 2gpl s VAL 3 Cb 0.05 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 35.97 2gpl s VAL 3 CO -0.11 -0.05 0.11 0.54 0.00 0.00 0.00 175.10 175.60 2gpl s VAL 4 N -0.09 0.03 0.03 2.92 0.11 -0.19 -1.53 120.40 121.67 2gpl s VAL 4 Ca -0.02 -0.24 0.05 0.00 -2.93 0.00 0.00 61.98 58.83 2gpl s VAL 4 Cb -0.03 -0.24 -0.02 0.00 -1.53 0.00 0.00 36.38 34.56 2gpl s VAL 4 CO 0.01 -0.13 -0.14 0.00 -3.33 0.00 0.00 175.10 171.51 2gpl s ALA 5 N -0.41 1.15 0.03 1.54 0.00 -0.13 -0.30 121.76 123.66 2gpl s ALA 5 Ca -0.05 -0.77 -0.00 0.00 0.00 0.00 0.00 51.96 51.14 2gpl s ALA 5 Cb -0.03 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 2gpl s ALA 5 CO 0.00 0.23 -0.03 -1.64 0.00 0.00 0.00 175.76 174.32 2gpl s MET 6 N -0.94 0.45 0.14 0.00 -1.94 0.12 -1.46 119.30 115.66 2gpl s MET 6 Ca 0.02 -0.87 0.07 0.00 -1.71 0.00 0.00 55.69 53.20 2gpl s MET 6 Cb -0.07 0.13 -0.04 0.00 2.01 0.00 0.00 34.83 36.86 2gpl s MET 6 CO 0.01 -0.07 -0.03 0.95 -0.01 0.00 0.00 175.02 175.87 2gpl s THR 7 N -2.47 3.65 0.00 2.05 -4.23 -0.73 -0.19 115.64 113.73 2gpl s THR 7 Ca -0.06 -1.31 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 2gpl s THR 7 Cb -0.03 -2.78 0.00 0.00 1.34 0.00 0.00 72.50 71.03 2gpl s THR 7 CO -0.05 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.64 2gpl n GLY 8 N 0.24 3.40 3.57 3.99 0.00 0.36 -4.67 105.19 112.09 2gpl n GLY 8 Ca -0.11 -1.44 -0.40 0.00 0.00 0.00 0.00 46.02 44.07 2gpl n GLY 8 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2gpl s LYS 9 N -1.92 2.83 -1.67 1.61 2.47 0.15 -2.89 119.74 120.33 2gpl s LYS 9 Ca 0.00 1.24 0.00 0.00 -1.56 0.00 0.00 55.97 55.65 2gpl s LYS 9 Cb 0.00 -4.36 0.00 0.00 -1.46 0.00 0.00 37.83 32.01 2gpl s LYS 9 CO 0.00 -2.46 0.00 -0.25 0.16 0.00 0.00 175.35 172.80 2gpl n ASP 10 N 12.40 -5.45 -3.76 1.43 9.92 -1.26 -4.66 116.55 125.16 2gpl n ASP 10 Ca 0.26 0.07 -0.09 0.00 -0.53 0.00 0.00 54.79 54.49 2gpl n ASP 10 Cb 0.50 -4.58 -0.04 0.00 -0.64 0.00 0.00 41.12 36.36 2gpl n ASP 10 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2gpl s VAL 12 N -3.89 0.44 -0.03 0.00 -7.23 -0.72 -0.49 120.40 108.49 2gpl s VAL 12 Ca 0.10 -1.86 -0.01 0.00 -1.81 0.00 0.00 61.98 58.40 2gpl s VAL 12 Cb -0.01 -1.58 0.02 0.00 0.56 0.00 0.00 36.38 35.37 2gpl s VAL 12 CO -0.01 -0.93 0.06 0.00 -0.31 0.00 0.00 175.10 173.90 2gpl s ALA 13 N -3.74 -0.07 -0.03 1.32 0.00 0.74 -0.34 121.76 119.63 2gpl s ALA 13 Ca 0.09 0.27 0.04 0.00 0.00 0.00 0.00 51.96 52.36 2gpl s ALA 13 Cb 0.06 -0.19 -0.00 0.00 0.00 0.00 0.00 23.12 22.99 2gpl s ALA 13 CO -0.07 -0.07 -0.15 -1.50 0.00 0.00 0.00 175.76 173.97 2gpl s ILE 14 N 0.55 1.20 0.04 0.00 1.10 -0.75 0.13 121.20 123.47 2gpl s ILE 14 Ca -0.04 -0.61 -0.08 0.00 -0.51 0.00 0.00 60.65 59.41 2gpl s ILE 14 Cb -0.06 -1.03 -0.00 0.00 0.15 0.00 0.00 42.46 41.52 2gpl s ILE 14 CO -0.02 0.35 0.17 0.00 -2.11 0.00 0.00 174.94 173.33 2gpl s ALA 15 N -0.03 -0.26 0.19 1.50 0.00 0.59 -0.54 121.76 123.23 2gpl s ALA 15 Ca -0.01 -0.40 -0.14 0.00 0.00 0.00 0.00 51.96 51.41 2gpl s ALA 15 Cb -0.09 0.29 0.01 0.00 0.00 0.00 0.00 23.12 23.33 2gpl s ALA 15 CO 0.01 -0.37 0.43 0.00 0.00 0.00 0.00 175.76 175.83 2gpl s ASP 17 N -2.93 4.18 0.00 0.00 3.84 -1.13 -1.35 116.67 119.28 2gpl s ASP 17 Ca 0.14 -0.30 0.01 0.00 -0.00 0.00 0.00 52.55 52.40 2gpl s ASP 17 Cb 0.01 -0.03 0.02 0.00 -1.38 0.00 0.00 42.92 41.53 2gpl s ASP 17 CO -0.00 -1.98 0.67 0.18 -0.00 0.00 0.00 175.17 174.04 2gpl n LEU 18 N -2.95 1.37 -4.78 2.11 4.77 0.45 -4.43 117.00 113.54 2gpl n LEU 18 Ca 0.15 -1.28 -0.36 0.00 -0.03 0.00 0.00 56.01 54.49 2gpl n LEU 18 Cb 0.60 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.67 2gpl n LEU 18 CO 0.43 0.33 0.78 -0.60 -1.33 0.00 0.00 177.39 177.00 2gpl s ARG 19 N -0.35 3.81 -0.15 3.23 3.52 -1.01 -1.37 118.95 126.64 2gpl s ARG 19 Ca 0.02 1.61 -0.04 0.00 -0.13 0.00 0.00 55.73 57.18 2gpl s ARG 19 Cb 0.01 -2.32 0.07 0.00 -1.56 0.00 0.00 34.95 31.15 2gpl s ARG 19 CO 0.01 -0.47 0.17 -1.17 -0.81 0.00 0.00 175.30 173.03 2gpl s LEU 20 N -3.13 0.00 0.00 -0.88 1.98 -0.70 -4.70 118.68 111.25 2gpl s LEU 20 Ca 0.64 -0.09 0.00 0.00 -2.89 0.00 0.00 54.13 51.80 2gpl s LEU 20 Cb -0.24 0.20 -0.00 0.00 0.66 0.00 0.00 46.19 46.81 2gpl s LEU 20 CO 0.29 -0.30 0.01 0.61 -1.89 0.00 0.00 176.35 175.07 2gpl n GLY 21 N 5.31 3.90 2.48 7.98 0.00 -0.71 -0.85 105.19 123.31 2gpl n GLY 21 Ca -0.05 -2.22 -0.25 0.00 0.00 0.00 0.00 46.02 43.50 2gpl n GLY 21 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2gpl s SER 22 N -2.11 1.60 1.53 1.61 0.15 0.26 -4.20 113.70 112.53 2gpl s SER 22 Ca 0.02 -2.54 0.00 0.00 0.70 0.00 0.00 55.95 54.13 2gpl s SER 22 Cb 0.00 -0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.19 2gpl s SER 22 CO 0.01 -0.21 0.00 0.00 1.20 0.00 0.00 173.24 174.24 2gpl n GLN 23 N 3.36 0.00 0.12 5.44 1.13 -0.51 -2.61 117.38 124.30 2gpl n GLN 23 Ca 0.22 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.26 2gpl n GLN 23 Cb 0.45 0.00 0.23 0.00 0.11 0.00 0.00 30.24 31.03 2gpl n GLN 23 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2gpl h SER 24 N 0.00 0.18 -2.85 1.08 4.64 -1.95 -3.44 113.55 111.21 2gpl h SER 24 Ca 0.00 -0.08 -0.56 0.00 -0.47 0.00 0.00 61.79 60.68 2gpl h SER 24 Cb 0.00 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 2gpl h SER 24 CO 0.00 0.60 1.01 -0.22 -0.87 0.00 0.00 176.83 177.35 2gpl s LEU 25 N -8.13 4.10 0.28 5.97 2.96 -1.07 -5.01 118.68 117.78 2gpl s LEU 25 Ca -0.04 1.72 -0.29 0.00 -0.22 0.00 0.00 54.13 55.30 2gpl s LEU 25 Cb 0.13 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 43.19 2gpl s LEU 25 CO 0.76 -0.96 1.12 -0.83 -1.32 0.00 0.00 176.35 175.12 2gpl s GLY 26 N 2.93 3.04 -0.00 7.98 0.00 -1.26 -0.58 107.32 119.43 2gpl s GLY 26 Ca 0.63 0.93 0.00 0.00 0.00 0.00 0.00 44.72 46.28 2gpl s GLY 26 CO 0.23 1.55 -0.00 -0.62 0.00 0.00 0.00 173.10 174.26 2gpl n VAL 27 N 1.23 0.01 -3.93 1.40 0.31 -0.03 -4.89 118.33 112.44 2gpl n VAL 27 Ca -0.01 -0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.22 2gpl n VAL 27 Cb 0.45 -0.58 -0.11 0.00 -0.91 0.00 0.00 33.84 32.68 2gpl n VAL 27 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2gpl s SER 28 N -3.85 0.12 -0.09 4.52 0.15 -0.63 -5.01 113.70 108.91 2gpl s SER 28 Ca -0.00 -0.30 0.13 0.00 0.70 0.00 0.00 55.95 56.48 2gpl s SER 28 Cb 0.00 0.13 0.24 0.00 -1.71 0.00 0.00 66.02 64.68 2gpl s SER 28 CO 0.00 -0.26 1.15 -0.46 1.20 0.00 0.00 173.24 174.88 2gpl n ASN 29 N 1.88 2.50 -0.41 5.45 2.04 -1.26 -1.72 115.26 123.75 2gpl n ASN 29 Ca -0.21 -2.71 0.05 0.00 -0.44 0.00 0.00 54.58 51.27 2gpl n ASN 29 Cb 0.56 -0.31 0.08 0.00 -2.53 0.00 0.00 39.78 37.58 2gpl n ASN 29 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 2gpl n LYS 30 N -0.92 0.67 -2.78 -3.83 5.02 -1.17 -4.72 118.16 110.43 2gpl n LYS 30 Ca 0.12 -1.94 -0.43 0.00 -2.02 0.00 0.00 58.31 54.05 2gpl n LYS 30 Cb 0.55 -0.97 -0.02 0.00 -0.02 0.00 0.00 35.03 34.57 2gpl n LYS 30 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2gpl s PHE 31 N -1.48 2.92 0.31 2.13 5.36 -0.47 -5.00 117.98 121.76 2gpl s PHE 31 Ca 0.19 -1.26 -0.28 0.00 -0.96 0.00 0.00 56.93 54.62 2gpl s PHE 31 Cb 0.18 -4.46 -0.10 0.00 -0.34 0.00 0.00 43.02 38.31 2gpl s PHE 31 CO -0.01 -1.66 1.15 -1.21 -1.46 0.00 0.00 175.22 172.03 2gpl s GLU 32 N 3.50 4.48 -0.05 10.12 2.02 -1.26 -4.43 118.70 133.08 2gpl s GLU 32 Ca 0.39 1.88 0.11 0.00 0.02 0.00 0.00 54.97 57.38 2gpl s GLU 32 Cb -0.02 -3.07 0.33 0.00 0.10 0.00 0.00 34.13 31.47 2gpl s GLU 32 CO -0.08 0.04 1.26 1.63 0.02 0.00 0.00 175.26 178.13 2gpl n LYS 33 N 0.90 2.83 -4.80 1.61 5.02 -1.26 -4.96 118.16 117.50 2gpl n LYS 33 Ca 0.00 -2.21 -0.33 0.00 -2.02 0.00 0.00 58.31 53.75 2gpl n LYS 33 Cb 0.45 -1.40 -0.15 0.00 -0.02 0.00 0.00 35.03 33.91 2gpl n LYS 33 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2gpl s ILE 34 N -1.56 2.85 0.26 -0.18 -1.09 -1.26 -0.91 121.20 119.31 2gpl s ILE 34 Ca 0.26 -0.73 0.03 0.00 -2.23 0.00 0.00 60.65 57.98 2gpl s ILE 34 Cb 0.17 -2.18 -0.06 0.00 -1.58 0.00 0.00 42.46 38.81 2gpl s ILE 34 CO 0.11 0.53 0.02 -0.36 -1.23 0.00 0.00 174.94 174.01 2gpl s PHE 35 N 0.42 1.69 -0.06 3.97 0.40 0.83 -4.97 117.98 120.27 2gpl s PHE 35 Ca -0.11 -0.95 -0.13 0.00 -0.60 0.00 0.00 56.93 55.13 2gpl s PHE 35 Cb -0.16 -1.01 0.03 0.00 0.51 0.00 0.00 43.02 42.38 2gpl s PHE 35 CO 0.05 -0.04 0.32 -3.38 0.70 0.00 0.00 175.22 172.87 2gpl s HIS 36 N -3.40 -0.25 -0.24 0.36 -3.43 -1.26 0.26 115.29 107.32 2gpl s HIS 36 Ca 0.32 0.52 -0.00 0.00 -0.80 0.00 0.00 55.06 55.09 2gpl s HIS 36 Cb 0.07 0.11 0.07 0.00 -1.43 0.00 0.00 32.58 31.39 2gpl s HIS 36 CO 0.11 -0.30 -0.01 0.71 -2.00 0.00 0.00 174.74 173.25 2gpl s TYR 38 N -0.72 2.09 0.00 0.38 2.02 0.52 -4.98 117.35 116.66 2gpl s TYR 38 Ca -0.08 -1.63 0.00 0.00 -0.37 0.00 0.00 57.07 54.99 2gpl s TYR 38 Cb -0.04 -1.56 0.00 0.00 -0.40 0.00 0.00 41.96 39.96 2gpl s TYR 38 CO 0.03 -0.76 0.00 0.41 -1.57 0.00 0.00 175.55 173.65 2gpl n GLY 39 N 4.75 1.89 0.78 0.71 0.00 -1.26 -1.73 105.19 110.33 2gpl n GLY 39 Ca -0.09 -0.50 0.09 0.00 0.00 0.00 0.00 46.02 45.52 2gpl n GLY 39 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2gpl n HIS 40 N 13.05 0.44 -3.60 1.61 1.44 -1.26 -4.87 115.22 122.03 2gpl n HIS 40 Ca 0.00 -0.22 -0.36 0.00 -2.01 0.00 0.00 57.72 55.13 2gpl n HIS 40 Cb 0.00 0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.03 2gpl n HIS 40 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2gpl s VAL 41 N -1.56 5.33 -0.03 0.61 1.01 -0.71 -4.50 120.40 120.56 2gpl s VAL 41 Ca 0.32 0.38 -0.00 0.00 0.00 0.00 0.00 61.98 62.68 2gpl s VAL 41 Cb 0.17 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 2gpl s VAL 41 CO 0.24 0.38 0.02 -0.36 0.00 0.00 0.00 175.10 175.38 2gpl s PHE 42 N 0.68 3.16 -0.07 5.22 0.40 -0.02 -0.35 117.98 127.00 2gpl s PHE 42 Ca 0.12 0.15 -0.01 0.00 -0.60 0.00 0.00 56.93 56.60 2gpl s PHE 42 Cb -0.13 -1.73 0.03 0.00 0.51 0.00 0.00 43.02 41.70 2gpl s PHE 42 CO 0.03 0.49 -0.00 -1.17 0.70 0.00 0.00 175.22 175.27 2gpl s LEU 43 N -1.40 0.66 -0.06 -0.37 2.96 0.14 -1.41 118.68 119.20 2gpl s LEU 43 Ca 0.19 -0.09 -0.02 0.00 -0.22 0.00 0.00 54.13 53.99 2gpl s LEU 43 Cb -0.12 -0.43 -0.04 0.00 0.50 0.00 0.00 46.19 46.10 2gpl s LEU 43 CO 0.09 -0.18 0.06 -0.83 -1.32 0.00 0.00 176.35 174.17 2gpl s GLY 44 N 1.86 1.99 -0.11 7.98 0.00 0.38 -0.12 107.32 119.30 2gpl s GLY 44 Ca 0.03 -0.80 -0.01 0.00 0.00 0.00 0.00 44.72 43.94 2gpl s GLY 44 CO -0.05 -0.61 -0.02 -0.42 0.00 0.00 0.00 173.10 172.00 2gpl s ILE 45 N -1.05 0.67 0.31 0.90 -1.09 -0.09 -0.72 121.20 120.13 2gpl s ILE 45 Ca 0.18 -0.17 0.07 0.00 -2.23 0.00 0.00 60.65 58.50 2gpl s ILE 45 Cb -0.12 -0.83 -0.03 0.00 -1.58 0.00 0.00 42.46 39.90 2gpl s ILE 45 CO 0.08 0.21 0.31 0.42 -1.23 0.00 0.00 174.94 174.73 2gpl s THR 46 N 1.84 3.98 -1.38 2.92 -4.23 -1.15 -4.82 115.64 112.80 2gpl s THR 46 Ca 0.04 -1.28 0.00 0.00 -1.18 0.00 0.00 61.69 59.27 2gpl s THR 46 Cb -0.13 -3.33 0.00 0.00 1.34 0.00 0.00 72.50 70.38 2gpl s THR 46 CO -0.07 -0.22 0.00 0.61 -0.54 0.00 0.00 174.62 174.40 2gpl n GLY 47 N -1.38 0.47 3.67 3.99 0.00 -1.26 -0.87 105.19 109.80 2gpl n GLY 47 Ca -0.03 -2.00 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 2gpl n GLY 47 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2gpl s LEU 48 N 0.00 4.31 0.21 0.99 2.96 -0.53 -4.53 118.68 122.08 2gpl s LEU 48 Ca 0.00 2.17 -0.10 0.00 -0.22 0.00 0.00 54.13 55.97 2gpl s LEU 48 Cb 0.00 -3.54 0.28 0.00 0.50 0.00 0.00 46.19 43.43 2gpl s LEU 48 CO 0.00 -0.87 1.70 0.00 -1.32 0.00 0.00 176.35 175.87 2gpl h ALA 49 N 8.99 0.68 -0.50 5.97 0.00 -1.90 -1.15 119.26 131.35 2gpl h ALA 49 Ca -0.38 0.13 0.11 0.00 0.00 0.00 0.00 54.91 54.77 2gpl h ALA 49 Cb 1.17 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 2gpl h ALA 49 CO 0.95 -0.31 0.35 0.00 0.00 0.00 0.00 179.25 180.23 2gpl h THR 50 N 0.25 0.85 0.13 0.00 1.03 -1.99 -0.39 112.91 112.79 2gpl h THR 50 Ca 0.31 -0.07 -0.29 0.00 -0.01 0.00 0.00 66.41 66.34 2gpl h THR 50 Cb 0.45 0.61 0.00 0.00 -1.07 0.00 0.00 68.15 68.15 2gpl h THR 50 CO -0.40 0.04 -1.39 0.44 -0.01 0.00 0.00 175.52 174.20 2gpl h ASP 51 N 0.22 0.43 -0.39 0.00 3.45 -1.62 -1.49 116.42 117.02 2gpl h ASP 51 Ca 0.24 -0.52 0.01 0.00 0.43 0.00 0.00 57.03 57.19 2gpl h ASP 51 Cb 0.65 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.25 2gpl h ASP 51 CO -0.04 1.42 0.24 0.58 -1.57 0.00 0.00 179.24 179.86 2gpl h VAL 52 N 0.08 1.05 0.24 -1.35 2.07 -0.26 0.24 116.25 118.32 2gpl h VAL 52 Ca -0.19 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 2gpl h VAL 52 Cb 2.00 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 2gpl h VAL 52 CO 0.19 0.09 -0.11 0.74 0.02 0.00 0.00 177.57 178.49 2gpl h THR 53 N 0.48 0.80 -0.67 2.57 2.02 -1.15 -1.99 112.91 114.98 2gpl h THR 53 Ca 0.15 -0.23 0.08 0.00 0.77 0.00 0.00 66.41 67.18 2gpl h THR 53 Cb -0.01 0.94 -0.06 0.00 -1.74 0.00 0.00 68.15 67.28 2gpl h THR 53 CO -0.06 0.05 0.34 0.74 0.37 0.00 0.00 175.52 176.96 2gpl h THR 54 N -0.44 0.89 -0.42 3.16 2.02 -1.02 -1.67 112.91 115.44 2gpl h THR 54 Ca -0.03 -0.21 -0.10 0.00 0.77 0.00 0.00 66.41 66.84 2gpl h THR 54 Cb 0.33 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 2gpl h THR 54 CO 0.05 0.11 -0.15 -0.07 0.37 0.00 0.00 175.52 175.84 2gpl h LEU 55 N 0.61 0.77 -0.68 2.58 3.38 -0.45 -0.21 115.31 121.31 2gpl h LEU 55 Ca 0.32 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2gpl h LEU 55 Cb 0.28 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2gpl h LEU 55 CO -0.23 0.93 0.18 -1.13 0.09 0.00 0.00 178.44 178.28 2gpl h ASN 56 N 0.69 1.01 -0.51 -0.43 -1.24 -0.90 -0.16 115.58 114.05 2gpl h ASN 56 Ca 0.11 -0.22 -0.07 0.00 0.71 0.00 0.00 56.30 56.83 2gpl h ASN 56 Cb 0.64 -0.27 -0.02 0.00 0.73 0.00 0.00 38.32 39.40 2gpl h ASN 56 CO 0.04 0.97 0.08 -0.33 -1.29 0.00 0.00 177.43 176.90 2gpl h GLU 57 N 1.00 0.90 -0.18 6.67 5.08 -0.93 -1.72 114.58 125.41 2gpl h GLU 57 Ca 0.21 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2gpl h GLU 57 Cb 0.34 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2gpl h GLU 57 CO -0.00 0.85 0.02 1.98 -1.00 0.00 0.00 179.01 180.86 2gpl h MET 58 N 0.85 0.31 0.00 2.33 4.05 -0.49 -2.30 114.93 119.69 2gpl h MET 58 Ca 0.17 -0.09 -0.07 0.00 -0.28 0.00 0.00 59.70 59.44 2gpl h MET 58 Cb 0.40 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.15 2gpl h MET 58 CO 0.01 0.48 -0.34 0.74 0.23 0.00 0.00 176.91 178.04 2gpl h PHE 59 N 0.09 0.00 -0.20 1.39 0.05 -0.92 -0.15 116.94 117.21 2gpl h PHE 59 Ca 0.06 0.00 -0.06 0.00 3.82 0.00 0.00 57.97 61.79 2gpl h PHE 59 Cb 0.33 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.27 2gpl h PHE 59 CO 0.02 0.34 -0.10 -0.09 -0.18 0.00 0.00 178.31 178.30 2gpl h ARG 60 N 0.00 0.41 -0.20 1.51 2.43 -1.25 0.54 114.38 117.82 2gpl h ARG 60 Ca -0.00 -0.18 0.04 0.00 -0.81 0.00 0.00 59.98 59.02 2gpl h ARG 60 Cb 0.80 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.30 2gpl h ARG 60 CO 0.04 0.71 -0.05 -0.92 -1.51 0.00 0.00 179.97 178.25 2gpl h TYR 61 N 0.11 -0.10 -0.23 2.20 5.03 -1.05 -0.57 116.97 122.36 2gpl h TYR 61 Ca 0.04 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.29 2gpl h TYR 61 Cb 0.59 0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.94 2gpl h TYR 61 CO 0.06 -0.08 -0.16 0.87 -1.32 0.00 0.00 178.16 177.53 2gpl h LYS 62 N 0.00 0.52 0.00 1.82 1.57 -0.97 -2.78 116.57 116.74 2gpl h LYS 62 Ca 0.10 -0.24 -0.04 0.00 -1.87 0.00 0.00 60.65 58.59 2gpl h LYS 62 Cb 0.14 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2gpl h LYS 62 CO -0.20 0.81 -0.19 1.79 -0.57 0.00 0.00 179.45 181.08 2gpl h THR 63 N 0.22 0.80 0.40 -0.16 1.35 -0.81 -0.56 112.91 114.16 2gpl h THR 63 Ca 0.05 -0.77 -0.02 0.00 -0.55 0.00 0.00 66.41 65.12 2gpl h THR 63 Cb 0.68 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 2gpl h THR 63 CO 0.04 0.19 -0.19 0.78 -0.25 0.00 0.00 175.52 176.09 2gpl h ASN 64 N 0.00 -0.46 -0.13 5.36 2.35 -1.01 -1.77 115.58 119.92 2gpl h ASN 64 Ca -0.00 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.62 2gpl h ASN 64 Cb 0.44 0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 2gpl h ASN 64 CO 0.03 -0.09 0.07 -0.07 -1.65 0.00 0.00 177.43 175.72 2gpl h LEU 65 N -0.88 0.19 -0.66 1.61 3.38 -1.31 -1.67 115.31 115.96 2gpl h LEU 65 Ca -0.06 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 2gpl h LEU 65 Cb 0.55 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 2gpl h LEU 65 CO 0.09 0.17 0.21 0.22 0.09 0.00 0.00 178.44 179.21 2gpl h TYR 66 N 0.22 1.06 -0.46 1.13 5.03 -0.98 -1.99 116.97 120.98 2gpl h TYR 66 Ca 0.06 -0.11 -0.11 0.00 2.58 0.00 0.00 58.73 61.15 2gpl h TYR 66 Cb 0.03 -0.31 -0.01 0.00 1.55 0.00 0.00 36.73 37.99 2gpl h TYR 66 CO 0.00 0.86 -0.15 -0.22 -1.32 0.00 0.00 178.16 177.33 2gpl h LYS 67 N 0.96 0.91 -0.43 1.82 3.64 -0.44 0.15 116.57 123.18 2gpl h LYS 67 Ca 0.21 -0.37 -0.03 0.00 -1.27 0.00 0.00 60.65 59.19 2gpl h LYS 67 Cb 0.30 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 2gpl h LYS 67 CO -0.01 1.02 0.13 -0.07 -2.27 0.00 0.00 179.45 178.25 2gpl h LEU 68 N 0.75 0.58 0.00 5.20 3.38 -1.13 0.24 115.31 124.32 2gpl h LEU 68 Ca 0.11 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.84 2gpl h LEU 68 Cb 0.70 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2gpl h LEU 68 CO 0.05 0.56 -0.92 0.11 0.09 0.00 0.00 178.44 178.33 2gpl h LYS 69 N 0.62 0.00 0.00 1.13 1.57 -1.21 -3.36 116.57 115.32 2gpl h LYS 69 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2gpl h LYS 69 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2gpl h LYS 69 CO -0.01 0.96 0.00 0.93 -0.57 0.00 0.00 179.45 180.76 2gpl h GLU 70 N -1.00 0.00 -4.51 3.15 4.39 -0.76 -3.47 114.58 112.38 2gpl h GLU 70 Ca -0.25 0.00 -0.39 0.00 0.34 0.00 0.00 59.36 59.06 2gpl h GLU 70 Cb 1.19 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.86 2gpl h GLU 70 CO -0.15 0.00 -0.58 0.39 -1.16 0.00 0.00 179.01 177.51 2gpl n GLU 71 N -2.79 -4.16 -3.44 2.33 1.02 0.82 -4.95 120.64 109.48 2gpl n GLU 71 Ca 0.02 0.82 -0.11 0.00 -0.02 0.00 0.00 57.16 57.87 2gpl n GLU 71 Cb 0.34 -5.62 -0.02 0.00 -0.02 0.00 0.00 31.44 26.12 2gpl n GLU 71 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2gpl s ARG 72 N -5.67 1.15 0.21 3.49 1.70 -1.22 -5.06 118.95 113.55 2gpl s ARG 72 Ca 0.28 -0.41 -0.28 0.00 -0.47 0.00 0.00 55.73 54.85 2gpl s ARG 72 Cb -0.13 0.53 -0.08 0.00 -0.57 0.00 0.00 34.95 34.70 2gpl s ARG 72 CO 0.34 -0.50 0.88 0.00 -1.08 0.00 0.00 175.30 174.94 2gpl s ALA 73 N -3.53 3.37 0.52 7.88 0.00 -1.26 -4.22 121.76 124.52 2gpl s ALA 73 Ca 0.02 0.52 -0.22 0.00 0.00 0.00 0.00 51.96 52.28 2gpl s ALA 73 Cb -0.01 -3.12 -0.06 0.00 0.00 0.00 0.00 23.12 19.93 2gpl s ALA 73 CO -0.11 0.22 1.33 -1.50 0.00 0.00 0.00 175.76 175.70 2gpl s ILE 74 N -1.09 2.25 0.21 0.00 2.07 -1.26 -5.02 121.20 118.35 2gpl s ILE 74 Ca 0.39 0.19 0.00 0.00 -1.41 0.00 0.00 60.65 59.83 2gpl s ILE 74 Cb -0.25 -3.10 -0.04 0.00 0.13 0.00 0.00 42.46 39.20 2gpl s ILE 74 CO 0.30 0.00 0.38 -1.61 -1.91 0.00 0.00 174.94 172.10 2gpl s GLU 75 N -2.81 3.50 0.21 3.50 0.41 -1.26 -4.73 118.70 117.52 2gpl s GLU 75 Ca 0.69 -0.42 -0.17 0.00 -0.41 0.00 0.00 54.97 54.66 2gpl s GLU 75 Cb -0.39 -2.85 0.21 0.00 -1.78 0.00 0.00 34.13 29.33 2gpl s GLU 75 CO 0.47 0.40 1.59 -1.35 -0.49 0.00 0.00 175.26 175.87 2gpl h PRO 76 N 1.84 -0.08 -0.38 0.39 0.11 -1.94 0.44 132.00 132.40 2gpl h PRO 76 Ca -0.49 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2gpl h PRO 76 Cb 1.20 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2gpl h PRO 76 CO 0.67 -0.05 0.21 0.93 -0.21 0.00 0.00 178.00 179.55 2gpl h GLU 77 N -0.08 0.52 -0.44 1.05 3.07 -1.97 -1.21 114.58 115.52 2gpl h GLU 77 Ca 0.30 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 59.08 2gpl h GLU 77 Cb 0.56 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.35 2gpl h GLU 77 CO -0.76 0.41 0.19 1.15 -1.40 0.00 0.00 179.01 178.61 2gpl h THR 78 N 0.48 1.19 -0.79 1.13 2.02 -1.77 -2.78 112.91 112.40 2gpl h THR 78 Ca 0.13 -0.56 0.01 0.00 0.77 0.00 0.00 66.41 66.76 2gpl h THR 78 Cb 0.04 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 2gpl h THR 78 CO -0.02 0.21 0.51 0.15 0.37 0.00 0.00 175.52 176.74 2gpl h PHE 79 N 0.56 1.00 -0.53 3.16 3.57 -0.73 -1.64 116.94 122.33 2gpl h PHE 79 Ca 0.15 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.75 2gpl h PHE 79 Cb 0.15 -0.34 -0.07 0.00 2.79 0.00 0.00 35.95 38.49 2gpl h PHE 79 CO -0.01 0.63 0.16 1.15 -2.23 0.00 0.00 178.31 178.02 2gpl h THR 80 N 1.07 0.77 -0.68 4.41 2.02 -0.99 0.14 112.91 119.64 2gpl h THR 80 Ca 0.29 -0.11 0.02 0.00 0.77 0.00 0.00 66.41 67.37 2gpl h THR 80 Cb -0.11 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 66.68 2gpl h THR 80 CO -0.06 0.06 0.44 1.56 0.37 0.00 0.00 175.52 177.89 2gpl h GLN 81 N 0.32 0.86 -0.70 6.66 1.08 -1.11 -0.83 115.11 121.40 2gpl h GLN 81 Ca 0.26 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.40 2gpl h GLN 81 Cb 0.32 -0.19 -0.03 0.00 -0.05 0.00 0.00 27.48 27.53 2gpl h GLN 81 CO -0.29 0.57 0.37 1.25 -0.95 0.00 0.00 178.83 179.77 2gpl h LEU 82 N 0.88 0.88 -0.23 1.46 5.85 -0.18 -0.56 115.31 123.41 2gpl h LEU 82 Ca 0.26 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2gpl h LEU 82 Cb -0.04 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 2gpl h LEU 82 CO -0.08 0.73 0.11 0.58 -0.34 0.00 0.00 178.44 179.43 2gpl h VAL 83 N 0.96 1.15 0.26 1.05 2.07 -0.29 -0.26 116.25 121.18 2gpl h VAL 83 Ca 0.24 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2gpl h VAL 83 Cb 0.05 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2gpl h VAL 83 CO -0.04 0.14 -0.15 -1.28 0.02 0.00 0.00 177.57 176.27 2gpl h SER 84 N 0.23 -0.37 -0.50 0.57 0.87 -0.87 -0.33 113.55 113.15 2gpl h SER 84 Ca 0.08 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.63 2gpl h SER 84 Cb 0.13 0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.17 2gpl h SER 84 CO -0.01 -0.25 0.21 0.77 -0.53 0.00 0.00 176.83 177.03 2gpl h SER 85 N -0.39 0.72 -0.51 6.23 4.64 -1.06 -1.29 113.55 121.90 2gpl h SER 85 Ca -0.03 -0.09 -0.09 0.00 -0.47 0.00 0.00 61.79 61.11 2gpl h SER 85 Cb 0.32 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 2gpl h SER 85 CO 0.04 0.66 -0.00 0.28 -0.87 0.00 0.00 176.83 176.93 2gpl h SER 86 N 0.78 0.91 -0.14 4.97 0.02 -0.69 -2.29 113.55 117.12 2gpl h SER 86 Ca 0.19 -0.24 -0.07 0.00 -0.84 0.00 0.00 61.79 60.83 2gpl h SER 86 Cb 0.17 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.46 2gpl h SER 86 CO -0.02 0.97 -0.18 -0.07 -1.14 0.00 0.00 176.83 176.40 2gpl h LEU 87 N 0.87 0.39 -2.16 5.07 3.38 -0.56 -3.15 115.31 119.15 2gpl h LEU 87 Ca 0.16 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 2gpl h LEU 87 Cb 0.51 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 2gpl h LEU 87 CO 0.03 0.82 -0.06 0.22 0.09 0.00 0.00 178.44 179.53 2gpl h TYR 88 N -0.03 0.00 0.00 1.13 3.20 -1.10 -1.46 116.97 118.70 2gpl h TYR 88 Ca 0.02 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 2gpl h TYR 88 Cb 0.73 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.00 2gpl h TYR 88 CO 0.09 0.06 -0.01 1.49 -1.64 0.00 0.00 178.16 178.16 2gpl h GLU 89 N 0.00 0.00 -0.62 1.82 4.81 -1.37 0.12 114.58 119.34 2gpl h GLU 89 Ca -0.00 0.00 -0.38 0.00 -0.13 0.00 0.00 59.36 58.85 2gpl h GLU 89 Cb 0.17 0.00 -0.22 0.00 0.63 0.00 0.00 28.75 29.32 2gpl h GLU 89 CO 0.01 0.01 0.04 0.54 -0.73 0.00 0.00 179.01 178.88 2gpl n ARG 90 N -3.43 2.35 -0.33 1.92 5.12 -0.55 -4.81 116.66 116.92 2gpl n ARG 90 Ca -0.03 -3.36 0.24 0.00 -1.93 0.00 0.00 57.85 52.77 2gpl n ARG 90 Cb 0.09 -2.03 0.48 0.00 -1.16 0.00 0.00 32.46 29.84 2gpl n ARG 90 CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 2gpl h ARG 91 N 1.38 0.29 -0.47 5.56 9.65 -0.83 0.17 114.38 130.12 2gpl h ARG 91 Ca 0.37 -0.02 -0.11 0.00 -1.10 0.00 0.00 59.98 59.12 2gpl h ARG 91 Cb 1.66 -0.06 -0.07 0.00 -1.39 0.00 0.00 29.97 30.11 2gpl h ARG 91 CO 0.76 0.19 0.09 1.19 2.80 0.00 0.00 179.97 184.99 2gpl n PHE 92 N -5.08 1.60 -2.68 2.20 3.01 -1.26 -4.39 117.46 110.86 2gpl n PHE 92 Ca 0.32 -1.12 -0.05 0.00 1.01 0.00 0.00 57.45 57.61 2gpl n PHE 92 Cb 1.00 -0.50 0.06 0.00 -0.01 0.00 0.00 39.48 40.04 2gpl n PHE 92 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2gpl n GLY 93 N -0.43 -0.14 3.66 1.37 0.00 -0.17 -5.16 105.19 104.31 2gpl n GLY 93 Ca 0.31 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 46.16 2gpl n GLY 93 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2gpl n PRO 94 N -0.21 -0.37 -3.05 1.61 -0.04 0.42 -4.85 135.00 128.52 2gpl n PRO 94 Ca -0.12 -0.04 -0.40 0.00 -0.04 0.00 0.00 63.50 62.91 2gpl n PRO 94 Cb 0.73 -2.36 -0.05 0.00 -0.04 0.00 0.00 33.50 31.79 2gpl n PRO 94 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2gpl s TYR 95 N -2.55 3.67 -1.21 0.54 1.51 -1.26 -4.97 117.35 113.07 2gpl s TYR 95 Ca 0.67 1.34 -0.15 0.00 -1.01 0.00 0.00 57.07 57.92 2gpl s TYR 95 Cb -0.24 -2.77 0.14 0.00 -0.11 0.00 0.00 41.96 38.98 2gpl s TYR 95 CO 0.58 0.22 1.50 -0.06 -1.11 0.00 0.00 175.55 176.68 2gpl s PHE 96 N 0.22 3.26 0.18 2.71 0.08 -1.26 -4.79 117.98 118.38 2gpl s PHE 96 Ca 0.37 -1.92 -0.01 0.00 0.12 0.00 0.00 56.93 55.49 2gpl s PHE 96 Cb -0.19 -4.44 -0.04 0.00 -0.57 0.00 0.00 43.02 37.77 2gpl s PHE 96 CO 0.20 -1.53 0.10 0.14 -0.10 0.00 0.00 175.22 174.04 2gpl s VAL 97 N 2.46 0.08 -0.46 -0.44 -7.23 -1.26 -1.45 120.40 112.09 2gpl s VAL 97 Ca 0.45 -1.97 0.03 0.00 -1.81 0.00 0.00 61.98 58.68 2gpl s VAL 97 Cb -0.01 -2.36 0.16 0.00 0.56 0.00 0.00 36.38 34.73 2gpl s VAL 97 CO 0.01 -0.15 0.33 -0.83 -0.31 0.00 0.00 175.10 174.16 2gpl s GLY 98 N -3.13 1.56 0.61 2.32 0.00 -0.05 -3.71 107.32 104.91 2gpl s GLY 98 Ca 0.34 -2.66 -0.18 0.00 0.00 0.00 0.00 44.72 42.23 2gpl s GLY 98 CO 0.09 1.83 1.15 -4.14 0.00 0.00 0.00 173.10 172.03 2gpl s PRO 99 N -0.04 2.98 -0.04 2.90 0.02 -1.26 -2.96 135.00 136.61 2gpl s PRO 99 Ca 0.27 1.62 -0.01 0.00 0.02 0.00 0.00 61.00 62.90 2gpl s PRO 99 Cb -0.06 -1.95 0.03 0.00 0.02 0.00 0.00 34.50 32.54 2gpl s PRO 99 CO -0.13 -1.15 0.07 0.08 -0.33 0.00 0.00 177.00 175.54 2gpl s VAL 100 N -1.91 -0.07 -0.09 3.83 1.01 0.10 -2.42 120.40 120.87 2gpl s VAL 100 Ca 0.72 0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.96 2gpl s VAL 100 Cb -0.25 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 2gpl s VAL 100 CO 0.34 0.10 -0.14 -0.69 0.00 0.00 0.00 175.10 174.71 2gpl s VAL 101 N 1.27 3.07 -0.01 2.92 1.01 0.13 -0.47 120.40 128.33 2gpl s VAL 101 Ca -0.07 -0.69 -0.03 0.00 0.00 0.00 0.00 61.98 61.19 2gpl s VAL 101 Cb -0.12 -2.24 -0.00 0.00 0.00 0.00 0.00 36.38 34.01 2gpl s VAL 101 CO -0.04 0.56 0.07 0.00 0.00 0.00 0.00 175.10 175.69 2gpl s ALA 102 N -0.23 -0.15 0.00 5.51 0.00 -0.50 -0.42 121.76 125.97 2gpl s ALA 102 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 51.89 2gpl s ALA 102 Cb -0.13 0.00 0.00 0.00 0.00 0.00 0.00 23.12 22.99 2gpl s ALA 102 CO 0.03 -0.11 0.00 0.41 0.00 0.00 0.00 175.76 176.09 2gpl n GLY 103 N 2.26 0.39 3.41 0.00 0.00 -0.34 -0.84 105.19 110.05 2gpl n GLY 103 Ca -0.18 -1.06 -0.33 0.00 0.00 0.00 0.00 46.02 44.46 2gpl n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gpl s ILE 104 N -2.00 2.91 -0.16 -0.61 -1.09 -1.26 -0.48 121.20 118.51 2gpl s ILE 104 Ca 0.00 -0.75 -0.29 0.00 -2.23 0.00 0.00 60.65 57.38 2gpl s ILE 104 Cb 0.00 -2.16 -0.03 0.00 -1.58 0.00 0.00 42.46 38.69 2gpl s ILE 104 CO 0.00 0.56 1.43 0.21 -1.23 0.00 0.00 174.94 175.91 2gpl s ASN 105 N -0.25 6.75 0.46 3.58 3.84 -0.32 -4.81 114.94 124.19 2gpl s ASN 105 Ca 0.01 1.77 0.20 0.00 0.21 0.00 0.00 52.86 55.05 2gpl s ASN 105 Cb -0.13 -2.54 1.18 0.00 -0.55 0.00 0.00 41.25 39.22 2gpl s ASN 105 CO 0.03 -0.92 1.94 0.77 -2.79 0.00 0.00 177.10 176.13 2gpl h SER 10 N 9.08 0.25 0.29 -4.21 4.64 -1.96 0.74 113.55 122.37 2gpl h SER 10 Ca -0.31 0.02 -0.33 0.00 -0.47 0.00 0.00 61.79 60.69 2gpl h SER 10 Cb 1.13 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.16 2gpl h SER 10 CO 0.98 0.13 -1.83 0.50 -0.87 0.00 0.00 176.83 175.73 2gpl h LYS 10 N 0.27 0.19 0.00 4.77 3.64 -1.99 -3.39 116.57 120.06 2gpl h LYS 10 Ca 0.35 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2gpl h LYS 10 Cb 0.97 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 2gpl h LYS 10 CO -0.08 0.99 -1.41 -1.13 -2.27 0.00 0.00 179.45 175.55 2gpl n SER 10 N -3.35 0.52 0.00 4.20 3.41 -1.09 -4.96 113.62 112.35 2gpl n SER 10 Ca -0.25 -0.43 0.00 0.00 -0.26 0.00 0.00 58.87 57.94 2gpl n SER 10 Cb 1.05 1.36 0.00 0.00 -0.26 0.00 0.00 64.21 66.36 2gpl n SER 10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gpl n GLY 106 N 1.37 0.25 3.73 5.00 0.00 0.25 -4.98 105.19 110.83 2gpl n GLY 106 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2gpl n GLY 106 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2gpl s LYS 107 N -1.03 4.54 0.42 1.61 2.20 -1.25 -4.72 119.74 121.51 2gpl s LYS 107 Ca 0.00 1.17 -0.25 0.00 -0.36 0.00 0.00 55.97 56.54 2gpl s LYS 107 Cb 0.00 -3.39 -0.08 0.00 -1.51 0.00 0.00 37.83 32.85 2gpl s LYS 107 CO 0.00 0.21 1.16 -2.14 -0.36 0.00 0.00 175.35 174.22 2gpl s PRO 108 N 0.16 3.99 -0.07 4.03 0.02 -1.26 -1.18 135.00 140.68 2gpl s PRO 108 Ca 0.42 1.80 -0.05 0.00 0.02 0.00 0.00 61.00 63.19 2gpl s PRO 108 Cb -0.21 -2.60 0.03 0.00 0.02 0.00 0.00 34.50 31.74 2gpl s PRO 108 CO 0.25 -0.37 0.18 0.12 -0.33 0.00 0.00 177.00 176.85 2gpl s PHE 109 N -1.47 -0.21 0.02 6.54 5.36 0.37 -4.92 117.98 123.66 2gpl s PHE 109 Ca 0.59 0.54 -0.03 0.00 -0.96 0.00 0.00 56.93 57.07 2gpl s PHE 109 Cb -0.29 0.02 -0.01 0.00 -0.34 0.00 0.00 43.02 42.39 2gpl s PHE 109 CO 0.37 -0.15 0.03 0.96 -1.46 0.00 0.00 175.22 174.97 2gpl s ILE 110 N 0.67 0.11 -0.01 3.12 -4.36 -1.26 -1.20 121.20 118.27 2gpl s ILE 110 Ca -0.05 -0.92 -0.27 0.00 -0.26 0.00 0.00 60.65 59.15 2gpl s ILE 110 Cb -0.06 -0.44 0.06 0.00 1.25 0.00 0.00 42.46 43.27 2gpl s ILE 110 CO -0.04 -0.51 0.61 0.00 0.24 0.00 0.00 174.94 175.25 2gpl s ALA 111 N -1.69 -1.58 0.20 2.27 0.00 0.44 -4.29 121.76 117.11 2gpl s ALA 111 Ca -0.13 1.02 0.08 0.00 0.00 0.00 0.00 51.96 52.93 2gpl s ALA 111 Cb -0.07 0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.16 2gpl s ALA 111 CO -0.01 -0.42 -0.15 0.20 0.00 0.00 0.00 175.76 175.38 2gpl s GLY 112 N -1.48 1.42 0.05 0.00 0.00 0.33 0.23 107.32 107.87 2gpl s GLY 112 Ca -0.09 -1.64 -0.00 0.00 0.00 0.00 0.00 44.72 42.98 2gpl s GLY 112 CO 0.05 -1.74 -0.04 -1.36 0.00 0.00 0.00 173.10 170.02 2gpl s PHE 113 N -2.89 0.54 0.61 1.90 0.08 -1.01 0.51 117.98 117.73 2gpl s PHE 113 Ca 0.22 -0.92 0.03 0.00 0.12 0.00 0.00 56.93 56.38 2gpl s PHE 113 Cb -0.01 -0.38 0.08 0.00 -0.57 0.00 0.00 43.02 42.14 2gpl s PHE 113 CO 0.07 -0.29 0.85 0.16 -0.10 0.00 0.00 175.22 175.90 2gpl s ASP 114 N -2.61 4.89 0.42 1.36 3.84 -0.90 -4.09 116.67 119.58 2gpl s ASP 114 Ca 0.03 -0.37 0.28 0.00 -0.00 0.00 0.00 52.55 52.49 2gpl s ASP 114 Cb 0.03 -0.25 1.53 0.00 -1.38 0.00 0.00 42.92 42.85 2gpl s ASP 114 CO -0.07 -1.44 1.86 0.17 -0.00 0.00 0.00 175.17 175.69 2gpl h LEU 115 N -0.10 0.00 -3.13 2.11 -0.00 -1.87 -2.17 115.31 110.15 2gpl h LEU 115 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.51 2gpl h LEU 115 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.94 2gpl h LEU 115 CO 0.44 0.00 0.00 2.30 -0.00 0.00 0.00 178.44 181.18 2gpl n ILE 116 N -2.49 1.87 0.00 0.15 -5.35 -1.26 -4.39 119.36 107.89 2gpl n ILE 116 Ca -0.02 -1.63 0.00 0.00 -0.27 0.00 0.00 62.75 60.84 2gpl n ILE 116 Cb 0.05 -0.02 0.00 0.00 -1.74 0.00 0.00 39.64 37.93 2gpl n ILE 116 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2gpl n GLY 117 N -0.27 0.25 3.68 3.28 0.00 -0.82 -2.87 105.19 108.44 2gpl n GLY 117 Ca 0.18 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.75 2gpl n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gpl s ILE 119 N 3.65 5.05 -0.27 0.00 1.01 -1.26 -2.11 121.20 127.26 2gpl s ILE 119 Ca 0.88 1.22 -0.05 0.00 0.00 0.00 0.00 60.65 62.70 2gpl s ILE 119 Cb -0.55 -3.95 0.01 0.00 0.01 0.00 0.00 42.46 37.98 2gpl s ILE 119 CO 0.44 0.17 0.03 -0.62 0.00 0.00 0.00 174.94 174.96 2gpl s ASP 120 N 1.02 4.84 -0.81 3.58 3.68 0.18 -4.98 116.67 124.19 2gpl s ASP 120 Ca 0.30 -0.67 0.02 0.00 2.13 0.00 0.00 52.55 54.33 2gpl s ASP 120 Cb -0.16 -1.82 0.21 0.00 -1.45 0.00 0.00 42.92 39.70 2gpl s ASP 120 CO 0.12 -0.14 0.71 1.21 0.13 0.00 0.00 175.17 177.19 2gpl n GLU 121 N 4.82 2.41 -1.72 4.34 2.13 -1.26 -0.51 120.64 130.84 2gpl n GLU 121 Ca -0.15 -4.51 -0.30 0.00 0.66 0.00 0.00 57.16 52.85 2gpl n GLU 121 Cb 0.48 -2.36 0.05 0.00 0.27 0.00 0.00 31.44 29.89 2gpl n GLU 121 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2gpl s ALA 122 N -1.60 2.69 -0.06 4.31 0.00 -1.26 -4.99 121.76 120.86 2gpl s ALA 122 Ca 0.28 -0.17 0.21 0.00 0.00 0.00 0.00 51.96 52.27 2gpl s ALA 122 Cb -0.03 -3.09 -0.32 0.00 0.00 0.00 0.00 23.12 19.68 2gpl s ALA 122 CO -0.12 -1.26 0.40 0.36 0.00 0.00 0.00 175.76 175.14 2gpl n LYS 12 N -3.12 0.67 -0.02 0.00 2.85 -1.26 -4.59 118.16 112.69 2gpl n LYS 12 Ca 0.07 -0.16 -0.02 0.00 -1.05 0.00 0.00 58.31 57.15 2gpl n LYS 12 Cb 0.56 -1.51 -0.01 0.00 -0.65 0.00 0.00 35.03 33.42 2gpl n LYS 12 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 2gpl n ASP 123 N -2.33 0.49 -3.74 -5.58 5.68 -1.26 -4.54 116.55 105.27 2gpl n ASP 123 Ca -0.09 0.20 -0.10 0.00 -0.50 0.00 0.00 54.79 54.30 2gpl n ASP 123 Cb 0.66 -0.58 -0.06 0.00 -1.14 0.00 0.00 41.12 40.00 2gpl n ASP 123 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 2gpl s PHE 124 N -1.42 -0.07 -0.03 2.11 -0.12 -1.26 -1.77 117.98 115.41 2gpl s PHE 124 Ca -0.06 -0.22 0.02 0.00 -0.05 0.00 0.00 56.93 56.62 2gpl s PHE 124 Cb 0.01 0.11 0.01 0.00 -0.63 0.00 0.00 43.02 42.52 2gpl s PHE 124 CO 0.09 -0.59 -0.08 0.42 -0.05 0.00 0.00 175.22 175.02 2gpl s ILE 125 N -3.38 0.70 0.23 -4.49 1.09 -0.54 -4.78 121.20 110.04 2gpl s ILE 125 Ca 0.01 -0.29 0.11 0.00 -1.10 0.00 0.00 60.65 59.38 2gpl s ILE 125 Cb 0.02 -0.65 -0.05 0.00 -1.06 0.00 0.00 42.46 40.72 2gpl s ILE 125 CO -0.09 0.23 -0.19 0.68 -0.10 0.00 0.00 174.94 175.47 2gpl s VAL 126 N 0.40 2.22 -0.13 2.92 -7.23 -1.26 -0.95 120.40 116.37 2gpl s VAL 126 Ca -0.06 -2.24 -0.30 0.00 -1.81 0.00 0.00 61.98 57.57 2gpl s VAL 126 Cb -0.10 -2.16 0.10 0.00 0.56 0.00 0.00 36.38 34.78 2gpl s VAL 126 CO 0.01 -0.38 0.86 -0.55 -0.31 0.00 0.00 175.10 174.73 2gpl s SER 127 N -3.21 -0.50 0.00 4.85 0.15 -0.58 -4.99 113.70 109.41 2gpl s SER 127 Ca 0.25 0.59 0.00 0.00 0.70 0.00 0.00 55.95 57.49 2gpl s SER 127 Cb -0.05 0.47 0.00 0.00 -1.71 0.00 0.00 66.02 64.73 2gpl s SER 127 CO 0.11 -0.44 0.00 0.61 1.20 0.00 0.00 173.24 174.73 2gpl n GLY 128 N 0.94 0.77 0.00 9.45 0.00 -1.26 -1.20 105.19 113.89 2gpl n GLY 128 Ca -0.14 -2.30 0.09 0.00 0.00 0.00 0.00 46.02 43.66 2gpl n GLY 128 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gpl n THR 129 N -0.77 0.50 -2.05 2.61 -2.24 -0.46 -2.50 114.28 109.37 2gpl n THR 129 Ca 0.00 0.12 0.01 0.00 -2.27 0.00 0.00 64.05 61.92 2gpl n THR 129 Cb 0.00 -0.84 0.11 0.00 -2.10 0.00 0.00 70.33 67.50 2gpl n THR 129 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gpl n ALA 130 N -1.29 3.32 0.04 6.98 0.00 -1.26 -4.82 120.51 123.48 2gpl n ALA 130 Ca 0.08 -3.01 0.02 0.00 0.00 0.00 0.00 53.44 50.53 2gpl n ALA 130 Cb 0.14 -0.52 0.37 0.00 0.00 0.00 0.00 19.45 19.44 2gpl n ALA 130 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2gpl h SER 131 N 1.28 0.40 0.04 0.00 4.64 -1.75 -0.32 113.55 117.83 2gpl h SER 131 Ca -0.04 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.22 2gpl h SER 131 Cb 1.38 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2gpl h SER 131 CO 0.14 0.43 -0.02 0.44 -0.87 0.00 0.00 176.83 176.95 2gpl h ASP 132 N 0.43 -0.05 -0.56 4.97 3.45 -1.87 0.49 116.42 123.28 2gpl h ASP 132 Ca 0.10 -0.12 0.04 0.00 0.43 0.00 0.00 57.03 57.48 2gpl h ASP 132 Cb 0.21 0.01 -0.04 0.00 -0.56 0.00 0.00 39.33 38.95 2gpl h ASP 132 CO 0.00 0.09 0.31 1.56 -1.57 0.00 0.00 179.24 179.62 2gpl h GLN 133 N -0.18 0.58 -0.91 3.56 7.50 -1.81 -1.41 115.11 122.43 2gpl h GLN 133 Ca -0.01 -0.03 0.01 0.00 0.50 0.00 0.00 58.65 59.12 2gpl h GLN 133 Cb 0.16 -0.13 -0.05 0.00 0.05 0.00 0.00 27.48 27.52 2gpl h GLN 133 CO 0.01 0.38 0.60 -0.07 -1.50 0.00 0.00 178.83 178.25 2gpl h LEU 134 N 0.59 1.04 -0.73 1.46 3.38 -0.77 -0.16 115.31 120.13 2gpl h LEU 134 Ca 0.24 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 2gpl h LEU 134 Cb 0.11 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2gpl h LEU 134 CO -0.14 0.75 0.42 -0.26 0.09 0.00 0.00 178.44 179.30 2gpl h PHE 135 N 1.23 0.97 0.12 1.13 0.04 -0.27 0.19 116.94 120.35 2gpl h PHE 135 Ca 0.34 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 61.09 2gpl h PHE 135 Cb -0.13 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 37.70 2gpl h PHE 135 CO -0.01 0.67 -0.06 0.78 -0.60 0.00 0.00 178.31 179.09 2gpl h GLY 136 N 0.99 -0.17 0.75 -1.45 0.00 -0.53 0.10 103.07 102.76 2gpl h GLY 136 Ca 0.26 0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.63 2gpl h GLY 136 CO -0.05 -0.06 -0.45 -0.33 0.00 0.00 0.00 176.54 175.65 2gpl h MET 137 N -0.23 -1.02 -0.14 4.80 2.86 -0.68 -3.04 114.93 117.48 2gpl h MET 137 Ca -0.02 0.07 0.05 0.00 -2.06 0.00 0.00 59.70 57.74 2gpl h MET 137 Cb 0.19 0.23 -0.05 0.00 0.06 0.00 0.00 31.60 32.02 2gpl h MET 137 CO 0.03 -0.68 -0.20 0.00 1.06 0.00 0.00 176.91 177.12 2gpl h GLU 139 N -0.24 0.00 0.00 0.00 4.57 -0.95 -1.09 114.58 116.86 2gpl h GLU 139 Ca 0.10 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.17 2gpl h GLU 139 Cb 0.40 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.97 2gpl h GLU 139 CO -0.29 0.00 -1.29 0.43 -1.18 0.00 0.00 179.01 176.68 2gpl n SER 140 N -3.47 1.82 0.00 1.04 7.64 -0.68 -4.64 113.62 115.33 2gpl n SER 140 Ca 0.06 0.31 0.09 0.00 1.01 0.00 0.00 58.87 60.34 2gpl n SER 140 Cb 0.65 -0.70 0.50 0.00 -1.01 0.00 0.00 64.21 63.65 2gpl n SER 140 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2gpl h LEU 141 N -0.89 0.33-10.07 -3.43 3.38 -0.70 -3.44 115.31 100.48 2gpl h LEU 141 Ca -0.17 -0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.29 2gpl h LEU 141 Cb 1.07 -0.07 0.09 0.00 0.09 0.00 0.00 40.66 41.83 2gpl h LEU 141 CO -0.10 0.22 0.46 -0.47 0.09 0.00 0.00 178.44 178.64 2gpl s TYR 142 N -5.36 2.59 -0.08 1.13 5.04 -0.42 -5.04 117.35 115.21 2gpl s TYR 142 Ca -0.07 1.52 -0.30 0.00 -2.44 0.00 0.00 57.07 55.78 2gpl s TYR 142 Cb 0.18 -3.40 0.07 0.00 0.35 0.00 0.00 41.96 39.17 2gpl s TYR 142 CO 0.73 -1.85 0.70 -1.83 -1.34 0.00 0.00 175.55 171.96 2gpl s GLU 143 N -3.19 1.01 1.05 4.97 -1.05 -1.26 -5.00 118.70 115.23 2gpl s GLU 143 Ca 0.73 0.35 -0.12 0.00 -0.15 0.00 0.00 54.97 55.78 2gpl s GLU 143 Cb -0.28 0.48 0.22 0.00 -0.44 0.00 0.00 34.13 34.11 2gpl s GLU 143 CO 0.31 -0.29 1.08 -2.14 0.95 0.00 0.00 175.26 175.17 2gpl s PRO 144 N -0.98 -0.06 -1.48 -4.83 0.02 -1.26 -4.25 135.00 122.16 2gpl s PRO 144 Ca -0.09 1.15 -0.17 0.00 0.02 0.00 0.00 61.00 61.91 2gpl s PRO 144 Cb -0.01 -1.63 0.17 0.00 0.02 0.00 0.00 34.50 33.05 2gpl s PRO 144 CO 0.08 -3.24 0.43 0.09 -0.33 0.00 0.00 177.00 174.04 2gpl n ASN 145 N -4.61 -1.23 -4.77 2.53 4.13 -1.26 -4.92 115.26 105.13 2gpl n ASN 145 Ca 0.07 -1.00 -0.36 0.00 1.68 0.00 0.00 54.58 54.97 2gpl n ASN 145 Cb 0.53 -1.28 -0.01 0.00 -1.54 0.00 0.00 39.78 37.49 2gpl n ASN 145 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2gpl s LEU 146 N -6.06 3.86 0.58 3.41 1.43 -1.26 -4.04 118.68 116.61 2gpl s LEU 146 Ca 0.60 2.20 -0.14 0.00 -1.03 0.00 0.00 54.13 55.77 2gpl s LEU 146 Cb -0.35 -4.44 -0.05 0.00 0.03 0.00 0.00 46.19 41.38 2gpl s LEU 146 CO 0.82 -1.06 1.02 -1.61 0.23 0.00 0.00 176.35 175.75 2gpl s GLU 147 N -3.04 3.65 0.22 1.70 0.41 -1.26 0.33 118.70 120.71 2gpl s GLU 147 Ca 0.69 0.90 -0.18 0.00 -0.41 0.00 0.00 54.97 55.97 2gpl s GLU 147 Cb -0.25 -2.09 0.21 0.00 -1.78 0.00 0.00 34.13 30.22 2gpl s GLU 147 CO 0.29 -0.52 1.57 -1.35 -0.49 0.00 0.00 175.26 174.76 2gpl h PRO 148 N 0.23 -0.07 -0.32 0.39 0.11 -1.95 0.47 132.00 130.87 2gpl h PRO 148 Ca -0.45 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.69 2gpl h PRO 148 Cb 1.19 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 2gpl h PRO 148 CO 0.61 -0.04 0.21 0.93 -0.21 0.00 0.00 178.00 179.50 2gpl h GLU 149 N -0.07 0.29 0.12 1.05 3.07 -2.00 -1.47 114.58 115.57 2gpl h GLU 149 Ca 0.31 -0.02 -0.22 0.00 -0.50 0.00 0.00 59.36 58.93 2gpl h GLU 149 Cb 0.58 -0.07 0.01 0.00 -0.84 0.00 0.00 28.75 28.43 2gpl h GLU 149 CO -0.84 0.19 -1.08 -0.44 -1.40 0.00 0.00 179.01 175.44 2gpl h ASP 150 N 0.30 0.38 -0.99 1.42 3.45 -1.17 -3.29 116.42 116.52 2gpl h ASP 150 Ca 0.13 -0.89 0.13 0.00 0.43 0.00 0.00 57.03 56.84 2gpl h ASP 150 Cb 0.15 -0.12 -0.09 0.00 -0.56 0.00 0.00 39.33 38.71 2gpl h ASP 150 CO -0.03 1.48 0.62 0.25 -1.57 0.00 0.00 179.24 180.00 2gpl h LEU 151 N -0.40 0.87 -0.36 1.55 5.85 0.09 -1.27 115.31 121.63 2gpl h LEU 151 Ca -0.22 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.60 2gpl h LEU 151 Cb 1.65 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.52 2gpl h LEU 151 CO 0.08 0.43 0.10 0.15 -0.34 0.00 0.00 178.44 178.87 2gpl h PHE 152 N 0.91 0.18 -0.76 1.25 3.57 -1.37 0.51 116.94 121.23 2gpl h PHE 152 Ca 0.50 0.02 0.02 0.00 3.53 0.00 0.00 57.97 62.04 2gpl h PHE 152 Cb 0.59 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.26 2gpl h PHE 152 CO -0.00 0.06 0.50 0.93 -2.23 0.00 0.00 178.31 177.56 2gpl h GLU 153 N 0.24 0.97 0.66 1.11 4.39 -1.32 -1.53 114.58 119.11 2gpl h GLU 153 Ca 0.17 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2gpl h GLU 153 Cb 0.16 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 28.60 2gpl h GLU 153 CO -0.19 0.64 -0.32 1.15 -1.16 0.00 0.00 179.01 179.13 2gpl h THR 154 N 1.00 0.00 -1.00 1.13 2.02 -0.93 -1.67 112.91 113.46 2gpl h THR 154 Ca 0.29 -0.27 0.19 0.00 0.77 0.00 0.00 66.41 67.39 2gpl h THR 154 Cb -0.07 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.23 2gpl h THR 154 CO -0.08 0.00 0.61 -0.29 0.37 0.00 0.00 175.52 176.14 2gpl h ILE 155 N -1.16 0.70 -0.13 3.11 6.09 -0.93 -0.41 117.51 124.78 2gpl h ILE 155 Ca -0.09 -0.25 -0.03 0.00 -1.37 0.00 0.00 64.86 63.12 2gpl h ILE 155 Cb 0.68 -0.10 -0.00 0.00 0.47 0.00 0.00 36.82 37.87 2gpl h ILE 155 CO 0.15 0.14 -0.03 0.28 -3.07 0.00 0.00 178.15 175.62 2gpl h SER 156 N 0.74 0.25 0.29 2.19 0.02 -1.26 -1.67 113.55 114.12 2gpl h SER 156 Ca 0.57 -0.36 -0.06 0.00 -0.84 0.00 0.00 61.79 61.11 2gpl h SER 156 Cb 0.92 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.38 2gpl h SER 156 CO -0.37 0.55 -0.29 1.56 -1.14 0.00 0.00 176.83 177.14 2gpl h GLN 157 N -0.05 0.00 -0.09 3.45 1.08 -0.71 0.05 115.11 118.84 2gpl h GLN 157 Ca 0.03 -0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.21 2gpl h GLN 157 Cb 0.44 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.86 2gpl h GLN 157 CO 0.01 0.30 -0.05 0.00 -0.95 0.00 0.00 178.83 178.14 2gpl h ALA 158 N 1.70 0.13 0.25 3.87 0.00 -0.94 -2.60 119.26 121.67 2gpl h ALA 158 Ca -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2gpl h ALA 158 Cb 0.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2gpl h ALA 158 CO 0.04 -0.10 -0.12 1.25 0.00 0.00 0.00 179.25 180.31 2gpl h LEU 159 N -0.19 -0.29 -0.36 0.00 5.85 -1.01 -2.93 115.31 116.38 2gpl h LEU 159 Ca 0.02 -0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.67 2gpl h LEU 159 Cb 0.51 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.55 2gpl h LEU 159 CO 0.01 -0.02 -0.06 -0.07 -0.34 0.00 0.00 178.44 177.97 2gpl h LEU 160 N -0.57 -0.28 -0.70 2.25 4.07 -1.08 -0.28 115.31 118.72 2gpl h LEU 160 Ca -0.03 0.10 -0.06 0.00 0.08 0.00 0.00 57.88 57.96 2gpl h LEU 160 Cb 0.41 0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.35 2gpl h LEU 160 CO 0.06 -0.10 -0.30 0.78 -1.08 0.00 0.00 178.44 177.81 2gpl h ASN 161 N 0.03 0.00 0.07 -0.43 2.35 -1.55 -2.28 115.58 113.77 2gpl h ASN 161 Ca 0.18 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.79 2gpl h ASN 161 Cb 0.26 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.65 2gpl h ASN 161 CO -0.35 0.30 -0.59 0.00 -1.65 0.00 0.00 177.43 175.14 2gpl h ALA 162 N 1.70 -0.03 -0.24 -0.83 0.00 -1.30 -3.28 119.26 115.29 2gpl h ALA 162 Ca -0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 2gpl h ALA 162 Cb 0.96 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2gpl h ALA 162 CO 0.04 0.28 0.15 0.00 0.00 0.00 0.00 179.25 179.72 2gpl h ALA 163 N 0.15 1.80 0.00 0.00 0.00 -0.99 -1.39 119.26 118.83 2gpl h ALA 163 Ca -0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2gpl h ALA 163 Cb 1.40 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2gpl h ALA 163 CO 0.11 0.18 0.00 -0.25 0.00 0.00 0.00 179.25 179.29 2gpl n ASP 164 N -4.49 0.00 -0.36 0.00 10.43 -0.86 -2.07 116.55 119.20 2gpl n ASP 164 Ca 0.01 -0.46 0.04 0.00 2.57 0.00 0.00 54.79 56.95 2gpl n ASP 164 Cb 0.08 -0.12 0.05 0.00 1.84 0.00 0.00 41.12 42.98 2gpl n ASP 164 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2gpl n ARG 165 N -1.12 0.72 -4.36 -1.24 5.12 -0.53 -4.94 116.66 110.31 2gpl n ARG 165 Ca 0.15 -1.19 -0.34 0.00 -1.93 0.00 0.00 57.85 54.55 2gpl n ARG 165 Cb 0.12 -1.17 -0.15 0.00 -1.16 0.00 0.00 32.46 30.11 2gpl n ARG 165 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2gpl s ASP 166 N -0.76 3.85 0.51 0.55 3.68 -0.88 -5.00 116.67 118.63 2gpl s ASP 166 Ca 0.11 -0.44 0.28 0.00 2.13 0.00 0.00 52.55 54.64 2gpl s ASP 166 Cb 0.07 -1.61 1.35 0.00 -1.45 0.00 0.00 42.92 41.28 2gpl s ASP 166 CO 0.11 0.06 2.01 0.00 0.13 0.00 0.00 175.17 177.48 2gpl h ALA 167 N 7.48 1.15 -0.22 3.66 0.00 -1.92 -3.00 119.26 126.41 2gpl h ALA 167 Ca -0.35 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2gpl h ALA 167 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2gpl h ALA 167 CO 0.59 0.16 0.00 1.28 0.00 0.00 0.00 179.25 181.28 2gpl n LEU 168 N -3.47 3.19 -4.64 0.00 4.77 -1.26 -4.98 117.00 110.62 2gpl n LEU 168 Ca -0.01 -1.27 -0.26 0.00 -0.03 0.00 0.00 56.01 54.44 2gpl n LEU 168 Cb 0.29 -0.13 -0.09 0.00 -2.33 0.00 0.00 43.42 41.16 2gpl n LEU 168 CO 0.30 0.62 -0.27 -0.44 -1.33 0.00 0.00 177.39 176.27 2gpl s SER 169 N -1.67 4.08 0.00 -1.43 0.01 -1.13 -3.40 113.70 110.16 2gpl s SER 169 Ca 0.33 -1.17 0.00 0.00 1.31 0.00 0.00 55.95 56.41 2gpl s SER 169 Cb 0.21 -0.45 0.00 0.00 0.21 0.00 0.00 66.02 65.99 2gpl s SER 169 CO 0.30 -0.39 0.00 0.61 0.41 0.00 0.00 173.24 174.17 2gpl n GLY 170 N -1.01 0.32 2.79 3.44 0.00 -1.26 -4.83 105.19 104.62 2gpl n GLY 170 Ca -0.04 -1.82 -0.21 0.00 0.00 0.00 0.00 46.02 43.95 2gpl n GLY 170 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2gpl n TRP 171 N 0.00 -1.59 0.00 1.61 7.02 -1.26 -2.40 117.44 120.82 2gpl n TRP 171 Ca 0.00 0.30 0.00 0.00 -1.02 0.00 0.00 57.50 56.78 2gpl n TRP 171 Cb 0.00 -4.13 0.00 0.00 -2.42 0.00 0.00 31.31 24.76 2gpl n TRP 171 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2gpl n GLY 172 N -1.28 2.82 3.26 6.99 0.00 -1.26 -4.47 105.19 111.24 2gpl n GLY 172 Ca -0.16 -1.80 -0.12 0.00 0.00 0.00 0.00 46.02 43.94 2gpl n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gpl s ALA 173 N -2.27 -0.76 -0.02 4.61 0.00 -1.26 -0.41 121.76 121.65 2gpl s ALA 173 Ca 0.00 0.15 0.02 0.00 0.00 0.00 0.00 51.96 52.13 2gpl s ALA 173 Cb 0.00 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.37 2gpl s ALA 173 CO 0.00 -0.37 -0.08 0.54 0.00 0.00 0.00 175.76 175.85 2gpl s VAL 174 N -2.17 0.71 -0.03 0.00 0.11 -0.46 -0.73 120.40 117.82 2gpl s VAL 174 Ca -0.08 -0.33 0.07 0.00 -2.93 0.00 0.00 61.98 58.72 2gpl s VAL 174 Cb -0.02 -0.63 -0.02 0.00 -1.53 0.00 0.00 36.38 34.19 2gpl s VAL 174 CO -0.01 0.22 -0.24 -0.69 -3.33 0.00 0.00 175.10 171.05 2gpl s VAL 175 N 0.15 1.94 -0.15 2.04 1.01 0.59 -1.93 120.40 124.06 2gpl s VAL 175 Ca -0.02 -1.03 -0.01 0.00 0.00 0.00 0.00 61.98 60.92 2gpl s VAL 175 Cb -0.08 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 2gpl s VAL 175 CO 0.00 0.55 -0.13 -0.31 0.00 0.00 0.00 175.10 175.21 2gpl s TYR 176 N -0.42 2.82 -0.22 5.22 2.02 0.30 -1.16 117.35 125.91 2gpl s TYR 176 Ca 0.05 -0.86 -0.05 0.00 -0.37 0.00 0.00 57.07 55.85 2gpl s TYR 176 Cb -0.11 -1.90 -0.02 0.00 -0.40 0.00 0.00 41.96 39.54 2gpl s TYR 176 CO 0.01 -0.37 -0.01 0.42 -1.57 0.00 0.00 175.55 174.02 2gpl s ILE 177 N 0.71 3.67 -0.09 2.71 -1.09 -0.44 -1.80 121.20 124.86 2gpl s ILE 177 Ca -0.06 -0.40 0.02 0.00 -2.23 0.00 0.00 60.65 57.98 2gpl s ILE 177 Cb -0.15 -2.68 -0.02 0.00 -1.58 0.00 0.00 42.46 38.03 2gpl s ILE 177 CO 0.02 0.41 -0.16 -0.63 -1.23 0.00 0.00 174.94 173.35 2gpl s ILE 178 N 1.39 2.86 0.10 2.92 1.01 0.54 -1.81 121.20 128.21 2gpl s ILE 178 Ca 0.05 -0.76 0.03 0.00 0.00 0.00 0.00 60.65 59.96 2gpl s ILE 178 Cb -0.14 -2.15 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 2gpl s ILE 178 CO -0.01 0.55 -0.08 -0.54 0.00 0.00 0.00 174.94 174.87 2gpl s LYS 179 N -0.04 0.86 0.26 2.79 1.02 0.06 -1.76 119.74 122.93 2gpl s LYS 179 Ca -0.04 -1.30 -0.09 0.00 0.02 0.00 0.00 55.97 54.57 2gpl s LYS 179 Cb -0.14 -0.34 0.41 0.00 -0.52 0.00 0.00 37.83 37.24 2gpl s LYS 179 CO 0.04 0.02 1.58 0.87 -0.92 0.00 0.00 175.35 176.94 2gpl h LYS 181 N 3.11 0.00 0.17 1.68 1.79 -1.95 -2.93 116.57 118.46 2gpl h LYS 181 Ca -0.36 -0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 57.78 2gpl h LYS 181 Cb 1.18 -0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.83 2gpl h LYS 181 CO 0.61 0.00 -1.66 0.38 -1.08 0.00 0.00 179.45 177.71 2gpl h ASP 182 N 0.00 0.57 -4.91 0.86 2.03 -1.97 -3.49 116.42 109.51 2gpl h ASP 182 Ca 0.43 -0.92 -0.27 0.00 -0.73 0.00 0.00 57.03 55.54 2gpl h ASP 182 Cb 0.68 -0.18 -0.15 0.00 -0.83 0.00 0.00 39.33 38.85 2gpl h ASP 182 CO -0.90 1.75 -0.64 -1.83 -1.03 0.00 0.00 179.24 176.59 2gpl s GLU 183 N -2.55 1.16 -0.04 4.15 -1.05 -1.11 -5.15 118.70 114.12 2gpl s GLU 183 Ca -0.17 -1.59 -0.01 0.00 -0.15 0.00 0.00 54.97 53.05 2gpl s GLU 183 Cb 0.05 -0.05 0.03 0.00 -0.44 0.00 0.00 34.13 33.72 2gpl s GLU 183 CO 0.83 -0.25 0.03 0.08 0.95 0.00 0.00 175.26 176.91 2gpl s VAL 184 N -3.86 0.04 -0.07 1.83 1.01 -1.26 -0.76 120.40 117.32 2gpl s VAL 184 Ca 0.30 0.27 0.02 0.00 0.00 0.00 0.00 61.98 62.57 2gpl s VAL 184 Cb 0.07 -0.22 -0.03 0.00 0.00 0.00 0.00 36.38 36.20 2gpl s VAL 184 CO 0.07 0.17 -0.11 -0.69 0.00 0.00 0.00 175.10 174.54 2gpl s VAL 185 N 1.69 3.34 -0.16 2.92 1.01 -0.75 -4.98 120.40 123.46 2gpl s VAL 185 Ca -0.01 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.38 2gpl s VAL 185 Cb -0.13 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 33.92 2gpl s VAL 185 CO -0.03 0.58 -0.19 -0.75 0.00 0.00 0.00 175.10 174.72 2gpl s LYS 186 N -0.58 2.78 -0.02 2.72 2.20 -1.26 -1.32 119.74 124.26 2gpl s LYS 186 Ca 0.08 -0.75 0.07 0.00 -0.36 0.00 0.00 55.97 55.01 2gpl s LYS 186 Cb -0.12 -2.40 -0.02 0.00 -1.51 0.00 0.00 37.83 33.78 2gpl s LYS 186 CO 0.02 -0.18 -0.23 1.03 -0.36 0.00 0.00 175.35 175.62 2gpl s ARG 187 N 1.26 1.91 0.02 4.03 0.52 -0.31 -4.96 118.95 121.42 2gpl s ARG 187 Ca 0.03 -0.83 -0.10 0.00 -0.52 0.00 0.00 55.73 54.31 2gpl s ARG 187 Cb -0.13 -1.83 -0.05 0.00 0.52 0.00 0.00 34.95 33.45 2gpl s ARG 187 CO -0.10 0.49 0.35 0.71 0.02 0.00 0.00 175.30 176.77 2gpl s TYR 188 N -0.52 3.62 0.27 -0.53 1.51 -1.26 -0.30 117.35 120.15 2gpl s TYR 188 Ca 0.08 0.78 0.06 0.00 -1.01 0.00 0.00 57.07 56.98 2gpl s TYR 188 Cb -0.09 -2.14 -0.03 0.00 -0.11 0.00 0.00 41.96 39.59 2gpl s TYR 188 CO -0.01 0.59 0.33 -0.51 -1.11 0.00 0.00 175.55 174.84 2gpl s LEU 189 N -1.57 4.02 -0.21 -1.29 1.43 0.09 -4.97 118.68 116.18 2gpl s LEU 189 Ca 0.28 -0.14 -0.07 0.00 -1.03 0.00 0.00 54.13 53.16 2gpl s LEU 189 Cb -0.14 -2.62 -0.04 0.00 0.03 0.00 0.00 46.19 43.42 2gpl s LEU 189 CO 0.15 -0.16 0.07 -0.75 0.23 0.00 0.00 176.35 175.89 2gpl s LYS 190 N -3.98 3.86 0.27 1.70 2.20 -1.26 -4.30 119.74 118.23 2gpl s LYS 190 Ca 0.37 -0.39 -0.10 0.00 -0.36 0.00 0.00 55.97 55.48 2gpl s LYS 190 Cb -0.08 -3.27 -0.00 0.00 -1.51 0.00 0.00 37.83 32.96 2gpl s LYS 190 CO 0.28 0.09 0.47 0.00 -0.36 0.00 0.00 175.35 175.83 2gpl s MET 191 N 0.89 1.64 0.81 4.03 0.23 -1.26 -5.06 119.30 120.58 2gpl s MET 191 Ca 0.04 -1.39 -0.14 0.00 -1.03 0.00 0.00 55.69 53.17 2gpl s MET 191 Cb -0.14 0.46 0.03 0.00 -1.53 0.00 0.00 34.83 33.65 2gpl s MET 191 CO 0.03 -0.68 0.75 0.54 -2.03 0.00 0.00 175.02 173.63 2gpl n ARG 192 N -0.42 0.11 -2.23 3.16 1.74 -1.26 -4.83 116.66 112.93 2gpl n ARG 192 Ca -0.01 0.09 -0.19 0.00 -0.77 0.00 0.00 57.85 56.97 2gpl n ARG 192 Cb 0.62 -2.07 0.02 0.00 -1.02 0.00 0.00 32.46 30.02 2gpl n ARG 192 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2gpl n GLN 193 N -1.93 3.18 0.00 5.56 1.13 -1.26 -4.17 117.38 119.88 2gpl n GLN 193 Ca 0.11 -4.04 0.00 0.00 -1.94 0.00 0.00 57.00 51.12 2gpl n GLN 193 Cb 0.51 -2.12 0.00 0.00 0.11 0.00 0.00 30.24 28.74 2gpl n GLN 193 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22