#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 0.64 6.43 3.68 -1.26 -4.86 116.67 127.68 2gpl s ASP -7 Ca 0.00 0.20 0.18 0.00 2.13 0.00 0.00 52.55 55.06 2gpl s ASP -7 Cb 0.00 -2.55 0.83 0.00 -1.45 0.00 0.00 42.92 39.74 2gpl s ASP -7 CO 0.00 -1.51 1.41 -0.65 0.13 0.00 0.00 175.17 174.55 2gpl h PRO -6 N 9.88 0.00 0.00 4.34 0.11 -2.02 0.36 132.00 144.67 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 1.18 0.00 -0.34 0.43 -0.21 0.00 0.00 178.00 179.06 2gpl n SER -5 N -2.98 0.36 -0.43 -2.05 7.64 -1.26 -3.70 113.62 111.19 2gpl n SER -5 Ca 0.08 0.02 0.08 0.00 1.01 0.00 0.00 58.87 60.06 2gpl n SER -5 Cb 0.98 -0.01 0.17 0.00 -1.01 0.00 0.00 64.21 64.34 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 -1.55 2.96 -0.06 6.43 7.64 0.13 -4.43 113.62 124.74 2gpl n SER -4 Ca 0.06 -2.87 -0.21 0.00 1.01 0.00 0.00 58.87 56.86 2gpl n SER -4 Cb 0.34 -0.42 -0.12 0.00 -1.01 0.00 0.00 64.21 63.00 2gpl n SER -4 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2gpl h ILE -3 N 0.87 0.90 0.00 0.44 2.04 -1.67 -3.43 117.51 116.66 2gpl h ILE -3 Ca 0.00 -2.25 -0.31 0.00 1.00 0.00 0.00 64.86 63.31 2gpl h ILE -3 Cb 1.10 2.39 -0.06 0.00 -0.74 0.00 0.00 36.82 39.52 2gpl h ILE -3 CO 0.09 0.50 -2.18 0.59 0.00 0.00 0.00 178.15 177.14 2gpl n ASN -2 N -4.17 0.18 -0.50 1.72 5.03 -1.26 -1.42 115.26 114.84 2gpl n ASN -2 Ca -0.30 0.09 0.06 0.00 0.87 0.00 0.00 54.58 55.30 2gpl n ASN -2 Cb 0.78 0.90 -0.02 0.00 -1.02 0.00 0.00 39.78 40.41 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 1.65 -2.13 0.00 7.41 0.00 -1.26 -1.66 105.19 109.19 2gpl n GLY -1 Ca -0.26 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.40 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 -3.04 4.03 3.17 -0.02 0.00 -1.20 -4.65 105.19 103.48 2gpl n GLY 1 Ca -0.01 -1.61 -0.08 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.28 0.16 -0.10 -0.61 -4.36 -1.26 -1.31 121.20 111.44 2gpl s ILE 2 Ca 0.00 -1.30 -0.10 0.00 -0.26 0.00 0.00 60.65 58.98 2gpl s ILE 2 Cb 0.00 -1.33 0.03 0.00 1.25 0.00 0.00 42.46 42.41 2gpl s ILE 2 CO 0.00 -0.72 0.28 -0.69 0.24 0.00 0.00 174.94 174.05 2gpl s VAL 3 N -3.72 0.01 -0.03 8.37 1.01 -0.29 -2.79 120.40 122.95 2gpl s VAL 3 Ca 0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 61.98 61.93 2gpl s VAL 3 Cb 0.05 -0.41 0.01 0.00 0.00 0.00 0.00 36.38 36.02 2gpl s VAL 3 CO -0.10 -0.03 0.10 0.54 0.00 0.00 0.00 175.10 175.61 2gpl s VAL 4 N 0.00 0.01 0.04 2.92 0.11 -0.10 -1.42 120.40 121.96 2gpl s VAL 4 Ca -0.01 -0.09 0.06 0.00 -2.93 0.00 0.00 61.98 59.00 2gpl s VAL 4 Cb -0.02 -0.18 -0.02 0.00 -1.53 0.00 0.00 36.38 34.62 2gpl s VAL 4 CO 0.01 -0.05 -0.17 0.00 -3.33 0.00 0.00 175.10 171.56 2gpl s ALA 5 N -0.12 1.42 0.03 1.54 0.00 -0.10 -0.35 121.76 124.18 2gpl s ALA 5 Ca -0.02 -0.91 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 2gpl s ALA 5 Cb -0.02 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 2gpl s ALA 5 CO 0.00 0.30 -0.02 -1.64 0.00 0.00 0.00 175.76 174.40 2gpl s MET 6 N -1.09 0.47 0.14 0.00 -1.94 0.98 -1.38 119.30 116.47 2gpl s MET 6 Ca 0.04 -0.88 0.07 0.00 -1.71 0.00 0.00 55.69 53.21 2gpl s MET 6 Cb -0.08 0.16 -0.04 0.00 2.01 0.00 0.00 34.83 36.88 2gpl s MET 6 CO 0.01 -0.09 -0.05 0.95 -0.01 0.00 0.00 175.02 175.84 2gpl s THR 7 N -2.62 3.58 0.00 2.05 -4.23 -0.70 -0.41 115.64 113.31 2gpl s THR 7 Ca -0.05 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.12 2gpl s THR 7 Cb -0.01 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 71.09 2gpl s THR 7 CO -0.05 -0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.64 2gpl n GLY 8 N 0.28 3.48 3.57 3.99 0.00 0.25 -4.66 105.19 112.09 2gpl n GLY 8 Ca -0.11 -1.43 -0.39 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.72 2.72 -1.89 1.61 2.47 0.17 -2.86 119.74 120.23 2gpl s LYS 9 Ca 0.00 1.14 0.00 0.00 -1.56 0.00 0.00 55.97 55.55 2gpl s LYS 9 Cb 0.00 -4.39 0.00 0.00 -1.46 0.00 0.00 37.83 31.98 2gpl s LYS 9 CO 0.00 -2.59 0.00 -0.25 0.16 0.00 0.00 175.35 172.67 2gpl n ASP 10 N 12.82 -5.81 -3.84 1.43 9.92 -1.26 -4.66 116.55 125.15 2gpl n ASP 10 Ca 0.26 0.12 -0.09 0.00 -0.53 0.00 0.00 54.79 54.55 2gpl n ASP 10 Cb 0.51 -4.91 -0.04 0.00 -0.64 0.00 0.00 41.12 36.04 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 -3.93 0.40 -0.03 0.00 -7.23 -0.75 -0.59 120.40 108.28 2gpl s VAL 12 Ca 0.14 -1.87 -0.02 0.00 -1.81 0.00 0.00 61.98 58.42 2gpl s VAL 12 Cb -0.01 -1.64 0.02 0.00 0.56 0.00 0.00 36.38 35.31 2gpl s VAL 12 CO 0.02 -0.90 0.08 0.00 -0.31 0.00 0.00 175.10 173.98 2gpl s ALA 13 N -3.81 -0.14 -0.03 1.32 0.00 0.45 -0.27 121.76 119.29 2gpl s ALA 13 Ca 0.11 0.33 0.04 0.00 0.00 0.00 0.00 51.96 52.44 2gpl s ALA 13 Cb 0.07 -0.22 -0.00 0.00 0.00 0.00 0.00 23.12 22.96 2gpl s ALA 13 CO -0.07 -0.08 -0.14 -1.50 0.00 0.00 0.00 175.76 173.97 2gpl s ILE 14 N 0.54 1.17 0.04 0.00 1.10 -0.75 -0.02 121.20 123.29 2gpl s ILE 14 Ca -0.04 -0.59 -0.09 0.00 -0.51 0.00 0.00 60.65 59.42 2gpl s ILE 14 Cb -0.06 -1.00 0.00 0.00 0.15 0.00 0.00 42.46 41.55 2gpl s ILE 14 CO -0.02 0.34 0.18 0.00 -2.11 0.00 0.00 174.94 173.33 2gpl s ALA 15 N -0.06 -0.29 0.18 1.50 0.00 0.52 -0.40 121.76 123.21 2gpl s ALA 15 Ca -0.00 -0.36 -0.14 0.00 0.00 0.00 0.00 51.96 51.45 2gpl s ALA 15 Cb -0.09 0.29 0.01 0.00 0.00 0.00 0.00 23.12 23.34 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 -2.92 4.31 0.00 0.00 3.84 -1.12 -1.29 116.67 119.49 2gpl s ASP 17 Ca 0.13 -0.16 0.04 0.00 -0.00 0.00 0.00 52.55 52.56 2gpl s ASP 17 Cb 0.01 -0.24 0.05 0.00 -1.38 0.00 0.00 42.92 41.35 2gpl s ASP 17 CO -0.01 -1.89 0.72 0.18 -0.00 0.00 0.00 175.17 174.17 2gpl n LEU 18 N -2.92 1.54 -4.78 2.11 4.77 0.80 -4.42 117.00 114.09 2gpl n LEU 18 Ca 0.14 -1.19 -0.36 0.00 -0.03 0.00 0.00 56.01 54.57 2gpl n LEU 18 Cb 0.60 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.66 2gpl n LEU 18 CO 0.44 0.35 0.79 -0.60 -1.33 0.00 0.00 177.39 177.04 2gpl s ARG 19 N -0.48 3.81 -0.14 3.23 3.52 -0.98 -1.22 118.95 126.69 2gpl s ARG 19 Ca 0.06 1.64 -0.04 0.00 -0.13 0.00 0.00 55.73 57.26 2gpl s ARG 19 Cb 0.04 -2.35 0.07 0.00 -1.56 0.00 0.00 34.95 31.14 2gpl s ARG 19 CO 0.05 -0.47 0.16 -1.17 -0.81 0.00 0.00 175.30 173.06 2gpl s LEU 20 N -3.08 0.03 0.00 -0.88 1.98 -0.66 -4.69 118.68 111.38 2gpl s LEU 20 Ca 0.64 -0.11 0.00 0.00 -2.89 0.00 0.00 54.13 51.77 2gpl s LEU 20 Cb -0.25 0.16 -0.00 0.00 0.66 0.00 0.00 46.19 46.76 2gpl s LEU 20 CO 0.30 -0.30 0.01 0.61 -1.89 0.00 0.00 176.35 175.09 2gpl n GLY 21 N 5.31 3.94 2.50 7.98 0.00 -0.67 -0.92 105.19 123.34 2gpl n GLY 21 Ca -0.05 -2.18 -0.24 0.00 0.00 0.00 0.00 46.02 43.54 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 -1.90 1.65 1.57 1.61 0.15 0.24 -4.20 113.70 112.82 2gpl s SER 22 Ca 0.02 -2.45 0.00 0.00 0.70 0.00 0.00 55.95 54.22 2gpl s SER 22 Cb 0.00 -0.09 0.00 0.00 -1.71 0.00 0.00 66.02 64.22 2gpl s SER 22 CO 0.01 -0.22 0.00 0.00 1.20 0.00 0.00 173.24 174.23 2gpl n GLN 23 N 3.46 0.00 0.17 5.44 1.13 -0.51 -2.63 117.38 124.45 2gpl n GLN 23 Ca 0.20 0.00 0.01 0.00 -1.94 0.00 0.00 57.00 55.28 2gpl n GLN 23 Cb 0.45 0.00 0.29 0.00 0.11 0.00 0.00 30.24 31.09 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 0.00 -2.89 1.08 4.64 -1.95 -3.44 113.55 110.98 2gpl h SER 24 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 2gpl h SER 24 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 2gpl h SER 24 CO 0.00 0.46 0.97 -0.22 -0.87 0.00 0.00 176.83 177.18 2gpl s LEU 25 N -7.90 4.10 0.25 5.97 2.96 -1.08 -5.01 118.68 117.97 2gpl s LEU 25 Ca -0.02 1.67 -0.30 0.00 -0.22 0.00 0.00 54.13 55.26 2gpl s LEU 25 Cb 0.14 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 43.20 2gpl s LEU 25 CO 0.74 -0.92 1.11 -0.83 -1.32 0.00 0.00 176.35 175.13 2gpl s GLY 26 N 2.64 2.98 -0.01 7.98 0.00 -1.26 -0.59 107.32 119.06 2gpl s GLY 26 Ca 0.60 0.89 0.00 0.00 0.00 0.00 0.00 44.72 46.21 2gpl s GLY 26 CO 0.20 1.57 -0.01 -0.62 0.00 0.00 0.00 173.10 174.25 2gpl n VAL 27 N 1.56 0.07 -3.93 1.40 0.31 -0.09 -4.89 118.33 112.76 2gpl n VAL 27 Ca 0.00 -0.03 -0.10 0.00 -0.01 0.00 0.00 64.34 64.20 2gpl n VAL 27 Cb 0.45 -0.57 -0.12 0.00 -0.91 0.00 0.00 33.84 32.69 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 -4.07 0.14 -0.11 4.52 0.15 -0.60 -5.01 113.70 108.72 2gpl s SER 28 Ca -0.02 -0.30 0.14 0.00 0.70 0.00 0.00 55.95 56.48 2gpl s SER 28 Cb 0.00 0.08 0.30 0.00 -1.71 0.00 0.00 66.02 64.69 2gpl s SER 28 CO 0.03 -0.20 1.20 -0.46 1.20 0.00 0.00 173.24 175.01 2gpl n ASN 29 N 2.12 2.73 -0.43 5.45 2.04 -1.26 -1.66 115.26 124.25 2gpl n ASN 29 Ca -0.20 -2.76 0.05 0.00 -0.44 0.00 0.00 54.58 51.23 2gpl n ASN 29 Cb 0.57 -0.36 0.07 0.00 -2.53 0.00 0.00 39.78 37.53 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 -0.84 0.61 -2.76 -3.83 5.02 -1.17 -4.72 118.16 110.48 2gpl n LYS 30 Ca 0.14 -1.86 -0.43 0.00 -2.02 0.00 0.00 58.31 54.14 2gpl n LYS 30 Cb 0.61 -0.92 -0.02 0.00 -0.02 0.00 0.00 35.03 34.67 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 -1.34 2.87 0.29 2.13 5.36 -0.36 -4.99 117.98 121.94 2gpl s PHE 31 Ca 0.18 -1.21 -0.29 0.00 -0.96 0.00 0.00 56.93 54.65 2gpl s PHE 31 Cb 0.17 -4.48 -0.10 0.00 -0.34 0.00 0.00 43.02 38.27 2gpl s PHE 31 CO -0.01 -1.69 1.13 -1.21 -1.46 0.00 0.00 175.22 171.99 2gpl s GLU 32 N 3.67 4.58 -0.06 10.12 2.02 -1.26 -4.42 118.70 133.35 2gpl s GLU 32 Ca 0.40 1.87 0.12 0.00 0.02 0.00 0.00 54.97 57.38 2gpl s GLU 32 Cb -0.02 -3.15 0.34 0.00 0.10 0.00 0.00 34.13 31.40 2gpl s GLU 32 CO -0.08 0.13 1.28 1.63 0.02 0.00 0.00 175.26 178.24 2gpl n LYS 33 N 1.08 2.85 -4.78 1.61 5.02 -1.26 -4.95 118.16 117.73 2gpl n LYS 33 Ca -0.01 -2.25 -0.33 0.00 -2.02 0.00 0.00 58.31 53.70 2gpl n LYS 33 Cb 0.44 -1.42 -0.15 0.00 -0.02 0.00 0.00 35.03 33.88 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 -1.60 2.86 0.28 -0.18 -1.09 -1.26 -0.76 121.20 119.45 2gpl s ILE 34 Ca 0.27 -0.73 0.03 0.00 -2.23 0.00 0.00 60.65 58.00 2gpl s ILE 34 Cb 0.18 -2.19 -0.06 0.00 -1.58 0.00 0.00 42.46 38.81 2gpl s ILE 34 CO 0.12 0.53 0.04 -0.36 -1.23 0.00 0.00 174.94 174.03 2gpl s PHE 35 N 0.45 1.75 -0.08 3.97 0.40 0.88 -4.97 117.98 120.39 2gpl s PHE 35 Ca -0.11 -0.97 -0.15 0.00 -0.60 0.00 0.00 56.93 55.11 2gpl s PHE 35 Cb -0.16 -1.07 0.03 0.00 0.51 0.00 0.00 43.02 42.33 2gpl s PHE 35 CO 0.05 -0.05 0.36 -3.38 0.70 0.00 0.00 175.22 172.90 2gpl s HIS 36 N -3.40 -0.31 -0.24 0.36 -3.43 -1.26 0.26 115.29 107.26 2gpl s HIS 36 Ca 0.34 0.67 0.00 0.00 -0.80 0.00 0.00 55.06 55.27 2gpl s HIS 36 Cb 0.07 0.13 0.07 0.00 -1.43 0.00 0.00 32.58 31.42 2gpl s HIS 36 CO 0.13 -0.30 -0.01 0.71 -2.00 0.00 0.00 174.74 173.26 2gpl s TYR 38 N -0.56 2.18 0.00 0.38 2.02 0.53 -4.98 117.35 116.93 2gpl s TYR 38 Ca -0.07 -1.69 0.00 0.00 -0.37 0.00 0.00 57.07 54.95 2gpl s TYR 38 Cb -0.04 -1.59 0.00 0.00 -0.40 0.00 0.00 41.96 39.93 2gpl s TYR 38 CO 0.03 -0.77 0.00 0.41 -1.57 0.00 0.00 175.55 173.64 2gpl n GLY 39 N 4.73 1.84 0.81 0.71 0.00 -1.26 -1.78 105.19 110.23 2gpl n GLY 39 Ca -0.09 -0.50 0.10 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 13.00 0.45 -3.60 1.61 1.44 -1.26 -4.87 115.22 121.98 2gpl n HIS 40 Ca 0.00 -0.22 -0.36 0.00 -2.01 0.00 0.00 57.72 55.12 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 -1.55 5.33 -0.02 0.61 1.01 -0.74 -4.49 120.40 120.55 2gpl s VAL 41 Ca 0.33 0.38 -0.00 0.00 0.00 0.00 0.00 61.98 62.69 2gpl s VAL 41 Cb 0.18 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2gpl s VAL 41 CO 0.25 0.37 0.03 -0.36 0.00 0.00 0.00 175.10 175.40 2gpl s PHE 42 N 0.70 3.18 -0.06 5.22 0.40 -0.14 -0.35 117.98 126.93 2gpl s PHE 42 Ca 0.12 0.16 -0.01 0.00 -0.60 0.00 0.00 56.93 56.60 2gpl s PHE 42 Cb -0.13 -1.72 0.03 0.00 0.51 0.00 0.00 43.02 41.71 2gpl s PHE 42 CO 0.03 0.50 -0.01 -1.17 0.70 0.00 0.00 175.22 175.27 2gpl s LEU 43 N -1.47 0.74 -0.05 -0.37 2.96 0.14 -1.42 118.68 119.22 2gpl s LEU 43 Ca 0.19 -0.09 -0.02 0.00 -0.22 0.00 0.00 54.13 54.00 2gpl s LEU 43 Cb -0.12 -0.43 -0.04 0.00 0.50 0.00 0.00 46.19 46.11 2gpl s LEU 43 CO 0.10 -0.17 0.07 -0.83 -1.32 0.00 0.00 176.35 174.20 2gpl s GLY 44 N 1.74 1.99 -0.08 7.98 0.00 0.61 -0.08 107.32 119.48 2gpl s GLY 44 Ca 0.01 -0.82 -0.01 0.00 0.00 0.00 0.00 44.72 43.91 2gpl s GLY 44 CO -0.04 -0.64 -0.02 -0.42 0.00 0.00 0.00 173.10 171.97 2gpl s ILE 45 N -1.08 0.59 0.31 0.90 -1.09 0.06 -0.80 121.20 120.09 2gpl s ILE 45 Ca 0.19 -0.02 0.07 0.00 -2.23 0.00 0.00 60.65 58.67 2gpl s ILE 45 Cb -0.12 -0.70 -0.03 0.00 -1.58 0.00 0.00 42.46 40.03 2gpl s ILE 45 CO 0.09 0.29 0.25 0.42 -1.23 0.00 0.00 174.94 174.77 2gpl s THR 46 N 1.86 3.76 -1.33 2.92 -4.23 -1.15 -4.81 115.64 112.67 2gpl s THR 46 Ca 0.04 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.15 2gpl s THR 46 Cb -0.12 -3.23 0.00 0.00 1.34 0.00 0.00 72.50 70.49 2gpl s THR 46 CO -0.06 -0.23 0.00 0.61 -0.54 0.00 0.00 174.62 174.40 2gpl n GLY 47 N -1.30 0.49 3.66 3.99 0.00 -1.26 -0.94 105.19 109.83 2gpl n GLY 47 Ca -0.04 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.53 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 4.30 0.23 0.99 2.96 -0.53 -4.54 118.68 122.09 2gpl s LEU 48 Ca 0.00 2.18 -0.08 0.00 -0.22 0.00 0.00 54.13 56.01 2gpl s LEU 48 Cb 0.00 -3.53 0.37 0.00 0.50 0.00 0.00 46.19 43.52 2gpl s LEU 48 CO 0.00 -0.92 1.70 0.00 -1.32 0.00 0.00 176.35 175.81 2gpl h ALA 49 N 9.48 0.82 -0.50 5.97 0.00 -1.90 -0.94 119.26 132.19 2gpl h ALA 49 Ca -0.38 0.14 0.09 0.00 0.00 0.00 0.00 54.91 54.76 2gpl h ALA 49 Cb 1.17 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2gpl h ALA 49 CO 0.96 -0.31 0.34 0.00 0.00 0.00 0.00 179.25 180.24 2gpl h THR 50 N 0.28 0.90 0.12 0.00 1.03 -1.99 -0.23 112.91 113.03 2gpl h THR 50 Ca 0.36 -0.11 -0.28 0.00 -0.01 0.00 0.00 66.41 66.37 2gpl h THR 50 Cb 0.56 0.57 0.00 0.00 -1.07 0.00 0.00 68.15 68.21 2gpl h THR 50 CO -0.44 0.06 -1.32 0.44 -0.01 0.00 0.00 175.52 174.25 2gpl h ASP 51 N 0.31 0.41 -0.36 0.00 3.45 -1.58 -1.06 116.42 117.58 2gpl h ASP 51 Ca 0.23 -0.47 0.00 0.00 0.43 0.00 0.00 57.03 57.22 2gpl h ASP 51 Cb 0.49 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 39.11 2gpl h ASP 51 CO -0.05 1.37 0.24 0.58 -1.57 0.00 0.00 179.24 179.81 2gpl h VAL 52 N 0.07 1.09 0.29 -1.35 2.07 -0.33 0.21 116.25 118.31 2gpl h VAL 52 Ca -0.16 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 2gpl h VAL 52 Cb 1.98 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 2gpl h VAL 52 CO 0.19 0.09 -0.14 0.74 0.02 0.00 0.00 177.57 178.47 2gpl h THR 53 N 0.49 0.74 -0.63 2.57 2.02 -1.11 -2.05 112.91 114.94 2gpl h THR 53 Ca 0.13 -0.24 0.09 0.00 0.77 0.00 0.00 66.41 67.17 2gpl h THR 53 Cb -0.06 0.87 -0.07 0.00 -1.74 0.00 0.00 68.15 67.15 2gpl h THR 53 CO -0.03 0.05 0.27 0.74 0.37 0.00 0.00 175.52 176.92 2gpl h THR 54 N -0.52 0.81 -0.56 3.16 2.02 -0.93 -1.84 112.91 115.04 2gpl h THR 54 Ca -0.04 -0.16 -0.09 0.00 0.77 0.00 0.00 66.41 66.89 2gpl h THR 54 Cb 0.39 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 2gpl h THR 54 CO 0.07 0.09 0.01 -0.07 0.37 0.00 0.00 175.52 175.98 2gpl h LEU 55 N 0.48 0.93 -0.79 2.58 3.38 -0.54 -0.08 115.31 121.26 2gpl h LEU 55 Ca 0.31 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2gpl h LEU 55 Cb 0.35 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 2gpl h LEU 55 CO -0.28 0.98 0.33 -1.13 0.09 0.00 0.00 178.44 178.43 2gpl h ASN 56 N 0.88 1.09 -0.46 -0.43 -1.24 -0.86 -0.26 115.58 114.30 2gpl h ASN 56 Ca 0.17 -0.17 -0.08 0.00 0.71 0.00 0.00 56.30 56.93 2gpl h ASN 56 Cb 0.50 -0.28 -0.02 0.00 0.73 0.00 0.00 38.32 39.25 2gpl h ASN 56 CO 0.02 0.96 -0.01 -0.33 -1.29 0.00 0.00 177.43 176.78 2gpl h GLU 57 N 1.15 0.88 -0.14 6.67 5.08 -0.93 -1.79 114.58 125.50 2gpl h GLU 57 Ca 0.27 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2gpl h GLU 57 Cb 0.20 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2gpl h GLU 57 CO -0.02 0.89 0.02 1.98 -1.00 0.00 0.00 179.01 180.88 2gpl h MET 58 N 0.81 0.23 0.00 2.33 4.05 -0.43 -2.34 114.93 119.58 2gpl h MET 58 Ca 0.15 -0.06 -0.09 0.00 -0.28 0.00 0.00 59.70 59.42 2gpl h MET 58 Cb 0.50 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.26 2gpl h MET 58 CO 0.03 0.41 -0.43 0.74 0.23 0.00 0.00 176.91 177.89 2gpl h PHE 59 N 0.01 0.00 -0.30 1.39 0.05 -0.98 -0.23 116.94 116.88 2gpl h PHE 59 Ca 0.04 0.00 -0.05 0.00 3.82 0.00 0.00 57.97 61.78 2gpl h PHE 59 Cb 0.29 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.23 2gpl h PHE 59 CO 0.02 0.43 -0.01 -0.09 -0.18 0.00 0.00 178.31 178.47 2gpl h ARG 60 N 0.00 0.54 -0.15 1.51 2.43 -1.28 0.14 114.38 117.58 2gpl h ARG 60 Ca -0.00 -0.18 0.03 0.00 -0.81 0.00 0.00 59.98 59.02 2gpl h ARG 60 Cb 0.82 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.29 2gpl h ARG 60 CO 0.06 0.69 -0.06 -0.92 -1.51 0.00 0.00 179.97 178.23 2gpl h TYR 61 N 0.33 -0.14 -0.27 2.20 5.03 -1.00 -0.51 116.97 122.61 2gpl h TYR 61 Ca 0.08 0.02 -0.10 0.00 2.58 0.00 0.00 58.73 61.31 2gpl h TYR 61 Cb 0.45 0.08 -0.00 0.00 1.55 0.00 0.00 36.73 38.81 2gpl h TYR 61 CO 0.04 -0.10 -0.23 0.87 -1.32 0.00 0.00 178.16 177.42 2gpl h LYS 62 N -0.04 0.63 0.00 1.82 1.57 -0.92 -2.70 116.57 116.93 2gpl h LYS 62 Ca 0.08 -0.32 -0.05 0.00 -1.87 0.00 0.00 60.65 58.49 2gpl h LYS 62 Cb 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2gpl h LYS 62 CO -0.17 0.92 -0.25 1.79 -0.57 0.00 0.00 179.45 181.16 2gpl h THR 63 N 0.36 0.86 0.39 -0.16 1.35 -0.62 -0.78 112.91 114.31 2gpl h THR 63 Ca 0.05 -0.98 -0.02 0.00 -0.55 0.00 0.00 66.41 64.91 2gpl h THR 63 Cb 0.78 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 2gpl h THR 63 CO 0.06 0.25 -0.19 0.78 -0.25 0.00 0.00 175.52 176.17 2gpl h ASN 64 N 0.00 -0.44 -0.17 5.36 2.35 -0.97 -1.61 115.58 120.10 2gpl h ASN 64 Ca -0.00 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.62 2gpl h ASN 64 Cb 0.56 0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.04 2gpl h ASN 64 CO 0.03 -0.08 0.10 -0.07 -1.65 0.00 0.00 177.43 175.75 2gpl h LEU 65 N -0.83 0.22 -0.58 1.61 3.38 -1.33 -1.84 115.31 115.93 2gpl h LEU 65 Ca -0.05 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 2gpl h LEU 65 Cb 0.54 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2gpl h LEU 65 CO 0.09 0.19 0.16 0.22 0.09 0.00 0.00 178.44 179.18 2gpl h TYR 66 N 0.26 0.97 -0.51 1.13 5.03 -1.00 -2.11 116.97 120.73 2gpl h TYR 66 Ca 0.07 -0.11 -0.11 0.00 2.58 0.00 0.00 58.73 61.15 2gpl h TYR 66 Cb 0.02 -0.28 -0.02 0.00 1.55 0.00 0.00 36.73 38.01 2gpl h TYR 66 CO 0.00 0.82 -0.14 -0.22 -1.32 0.00 0.00 178.16 177.30 2gpl h LYS 67 N 0.84 0.97 -0.26 1.82 3.64 -0.51 0.14 116.57 123.20 2gpl h LYS 67 Ca 0.18 -0.36 -0.06 0.00 -1.27 0.00 0.00 60.65 59.14 2gpl h LYS 67 Cb 0.33 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2gpl h LYS 67 CO -0.00 1.03 -0.10 -0.07 -2.27 0.00 0.00 179.45 178.04 2gpl h LEU 68 N 0.86 0.41 0.00 5.20 3.38 -1.15 0.14 115.31 124.15 2gpl h LEU 68 Ca 0.13 -0.09 -0.19 0.00 0.09 0.00 0.00 57.88 57.81 2gpl h LEU 68 Cb 0.69 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2gpl h LEU 68 CO 0.05 0.55 -1.06 0.11 0.09 0.00 0.00 178.44 178.19 2gpl h LYS 69 N 0.40 0.01 0.00 1.13 1.57 -1.21 -3.37 116.57 115.10 2gpl h LYS 69 Ca 0.08 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2gpl h LYS 69 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2gpl h LYS 69 CO 0.02 1.00 0.00 0.93 -0.57 0.00 0.00 179.45 180.84 2gpl h GLU 70 N -0.98 0.00 -4.20 3.15 4.39 -0.79 -3.47 114.58 112.68 2gpl h GLU 70 Ca -0.29 0.00 -0.39 0.00 0.34 0.00 0.00 59.36 59.02 2gpl h GLU 70 Cb 1.27 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.93 2gpl h GLU 70 CO -0.17 0.00 -0.56 0.39 -1.16 0.00 0.00 179.01 177.51 2gpl n GLU 71 N -2.76 -3.68 -3.44 2.33 1.02 0.49 -4.95 120.64 109.66 2gpl n GLU 71 Ca 0.02 0.84 -0.12 0.00 -0.02 0.00 0.00 57.16 57.89 2gpl n GLU 71 Cb 0.35 -5.62 -0.02 0.00 -0.02 0.00 0.00 31.44 26.14 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 -5.53 1.18 0.22 3.49 1.70 -1.22 -5.06 118.95 113.73 2gpl s ARG 72 Ca 0.22 -0.41 -0.30 0.00 -0.47 0.00 0.00 55.73 54.77 2gpl s ARG 72 Cb -0.10 0.54 -0.09 0.00 -0.57 0.00 0.00 34.95 34.74 2gpl s ARG 72 CO 0.27 -0.51 0.93 0.00 -1.08 0.00 0.00 175.30 174.90 2gpl s ALA 73 N -3.52 3.34 0.54 7.88 0.00 -1.26 -4.22 121.76 124.53 2gpl s ALA 73 Ca 0.01 0.59 -0.21 0.00 0.00 0.00 0.00 51.96 52.35 2gpl s ALA 73 Cb -0.01 -3.19 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 2gpl s ALA 73 CO -0.11 0.20 1.32 -1.50 0.00 0.00 0.00 175.76 175.66 2gpl s ILE 74 N -1.09 2.25 0.18 0.00 2.07 -1.26 -5.02 121.20 118.32 2gpl s ILE 74 Ca 0.41 0.18 0.02 0.00 -1.41 0.00 0.00 60.65 59.85 2gpl s ILE 74 Cb -0.26 -3.09 -0.04 0.00 0.13 0.00 0.00 42.46 39.21 2gpl s ILE 74 CO 0.31 -0.01 0.33 -1.61 -1.91 0.00 0.00 174.94 172.06 2gpl s GLU 75 N -2.94 3.47 0.22 3.50 0.41 -1.26 -4.72 118.70 117.37 2gpl s GLU 75 Ca 0.72 -0.53 -0.17 0.00 -0.41 0.00 0.00 54.97 54.58 2gpl s GLU 75 Cb -0.38 -2.91 0.23 0.00 -1.78 0.00 0.00 34.13 29.29 2gpl s GLU 75 CO 0.44 0.46 1.58 -1.35 -0.49 0.00 0.00 175.26 175.91 2gpl h PRO 76 N 1.94 -0.07 -0.35 0.39 0.11 -1.94 0.46 132.00 132.55 2gpl h PRO 76 Ca -0.49 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2gpl h PRO 76 Cb 1.20 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2gpl h PRO 76 CO 0.67 -0.04 0.19 0.93 -0.21 0.00 0.00 178.00 179.54 2gpl h GLU 77 N -0.07 0.49 -0.42 1.05 3.07 -1.97 -1.10 114.58 115.62 2gpl h GLU 77 Ca 0.31 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 59.09 2gpl h GLU 77 Cb 0.58 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.37 2gpl h GLU 77 CO -0.81 0.41 0.19 1.15 -1.40 0.00 0.00 179.01 178.55 2gpl h THR 78 N 0.44 1.19 -0.55 1.13 2.02 -1.77 -2.72 112.91 112.65 2gpl h THR 78 Ca 0.12 -0.56 0.01 0.00 0.77 0.00 0.00 66.41 66.75 2gpl h THR 78 Cb 0.07 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 2gpl h THR 78 CO -0.02 0.21 0.35 0.15 0.37 0.00 0.00 175.52 176.58 2gpl h PHE 79 N 0.54 0.66 -0.67 3.16 3.57 -0.77 -1.67 116.94 121.77 2gpl h PHE 79 Ca 0.14 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.78 2gpl h PHE 79 Cb 0.16 -0.22 -0.09 0.00 2.79 0.00 0.00 35.95 38.59 2gpl h PHE 79 CO -0.01 0.40 0.23 1.15 -2.23 0.00 0.00 178.31 177.86 2gpl h THR 80 N 0.71 0.68 -0.76 4.41 2.02 -0.96 0.21 112.91 119.22 2gpl h THR 80 Ca 0.21 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 2gpl h THR 80 Cb -0.05 0.27 -0.04 0.00 -1.74 0.00 0.00 68.15 66.59 2gpl h THR 80 CO -0.06 0.07 0.43 1.56 0.37 0.00 0.00 175.52 177.89 2gpl h GLN 81 N 0.38 1.05 -0.60 6.66 1.08 -1.07 -1.10 115.11 121.50 2gpl h GLN 81 Ca 0.36 -0.11 -0.03 0.00 -1.45 0.00 0.00 58.65 57.41 2gpl h GLN 81 Cb 0.52 -0.21 -0.03 0.00 -0.05 0.00 0.00 27.48 27.71 2gpl h GLN 81 CO -0.38 0.76 0.26 1.25 -0.95 0.00 0.00 178.83 179.77 2gpl h LEU 82 N 1.04 0.81 -0.20 1.46 5.85 0.09 -0.63 115.31 123.73 2gpl h LEU 82 Ca 0.27 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 2gpl h LEU 82 Cb 0.01 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 2gpl h LEU 82 CO -0.05 0.74 0.11 0.58 -0.34 0.00 0.00 178.44 179.49 2gpl h VAL 83 N 0.83 1.10 0.29 1.05 2.07 -0.35 -0.25 116.25 120.98 2gpl h VAL 83 Ca 0.20 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2gpl h VAL 83 Cb 0.17 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2gpl h VAL 83 CO -0.02 0.10 -0.19 -1.28 0.02 0.00 0.00 177.57 176.20 2gpl h SER 84 N 0.23 -0.47 -0.53 0.57 0.87 -0.96 -0.02 113.55 113.24 2gpl h SER 84 Ca 0.07 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.64 2gpl h SER 84 Cb 0.05 0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.13 2gpl h SER 84 CO -0.01 -0.30 0.25 0.77 -0.53 0.00 0.00 176.83 177.01 2gpl h SER 85 N -0.46 0.74 -0.65 6.23 4.64 -1.07 -1.22 113.55 121.74 2gpl h SER 85 Ca -0.03 -0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.14 2gpl h SER 85 Cb 0.39 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.27 2gpl h SER 85 CO 0.02 0.65 0.11 0.28 -0.87 0.00 0.00 176.83 177.02 2gpl h SER 86 N 0.81 1.04 -0.19 4.97 0.02 -0.67 -2.35 113.55 117.19 2gpl h SER 86 Ca 0.20 -0.24 -0.07 0.00 -0.84 0.00 0.00 61.79 60.83 2gpl h SER 86 Cb 0.12 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.38 2gpl h SER 86 CO -0.02 1.03 -0.18 -0.07 -1.14 0.00 0.00 176.83 176.45 2gpl h LEU 87 N 1.02 0.47 -2.18 5.07 3.38 -0.52 -3.11 115.31 119.45 2gpl h LEU 87 Ca 0.20 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2gpl h LEU 87 Cb 0.43 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 2gpl h LEU 87 CO 0.01 0.85 -0.07 0.22 0.09 0.00 0.00 178.44 179.55 2gpl h TYR 88 N 0.11 0.00 0.00 1.13 3.20 -1.08 -1.58 116.97 118.75 2gpl h TYR 88 Ca 0.03 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 2gpl h TYR 88 Cb 0.71 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.98 2gpl h TYR 88 CO 0.08 0.07 -0.02 1.49 -1.64 0.00 0.00 178.16 178.13 2gpl h GLU 89 N 0.00 0.00 -0.64 1.82 4.81 -1.35 0.11 114.58 119.34 2gpl h GLU 89 Ca -0.00 0.00 -0.39 0.00 -0.13 0.00 0.00 59.36 58.84 2gpl h GLU 89 Cb 0.22 0.00 -0.23 0.00 0.63 0.00 0.00 28.75 29.37 2gpl h GLU 89 CO 0.01 0.02 0.07 0.54 -0.73 0.00 0.00 179.01 178.92 2gpl n ARG 90 N -3.42 2.35 -0.32 1.92 5.12 -0.59 -4.81 116.66 116.91 2gpl n ARG 90 Ca -0.02 -3.36 0.21 0.00 -1.93 0.00 0.00 57.85 52.75 2gpl n ARG 90 Cb 0.12 -2.04 0.43 0.00 -1.16 0.00 0.00 32.46 29.81 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 0.22 -0.54 5.56 9.65 -0.85 0.13 114.38 129.94 2gpl h ARG 91 Ca 0.38 -0.01 -0.18 0.00 -1.10 0.00 0.00 59.98 59.07 2gpl h ARG 91 Cb 1.68 -0.05 -0.11 0.00 -1.39 0.00 0.00 29.97 30.10 2gpl h ARG 91 CO 0.78 0.15 0.15 1.19 2.80 0.00 0.00 179.97 185.04 2gpl n PHE 92 N -5.16 1.77 -2.68 2.20 3.01 -1.26 -4.38 117.46 110.97 2gpl n PHE 92 Ca 0.29 -1.29 -0.05 0.00 1.01 0.00 0.00 57.45 57.41 2gpl n PHE 92 Cb 0.93 -0.57 0.05 0.00 -0.01 0.00 0.00 39.48 39.88 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 -0.61 -0.23 3.65 1.37 0.00 -0.27 -5.17 105.19 103.93 2gpl n GLY 93 Ca 0.36 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.28 -0.45 -3.05 1.61 -0.04 0.31 -4.85 135.00 128.26 2gpl n PRO 94 Ca -0.14 -0.07 -0.40 0.00 -0.04 0.00 0.00 63.50 62.85 2gpl n PRO 94 Cb 0.72 -2.34 -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 -2.61 3.72 -1.21 0.54 1.51 -1.26 -4.97 117.35 113.06 2gpl s TYR 95 Ca 0.66 1.39 -0.14 0.00 -1.01 0.00 0.00 57.07 57.97 2gpl s TYR 95 Cb -0.23 -2.75 0.16 0.00 -0.11 0.00 0.00 41.96 39.02 2gpl s TYR 95 CO 0.59 0.30 1.46 -0.06 -1.11 0.00 0.00 175.55 176.73 2gpl s PHE 96 N -0.13 3.40 0.20 2.71 0.08 -1.26 -4.79 117.98 118.19 2gpl s PHE 96 Ca 0.36 -2.05 -0.01 0.00 0.12 0.00 0.00 56.93 55.35 2gpl s PHE 96 Cb -0.20 -4.37 -0.04 0.00 -0.57 0.00 0.00 43.02 37.84 2gpl s PHE 96 CO 0.21 -1.45 0.12 0.14 -0.10 0.00 0.00 175.22 174.14 2gpl s VAL 97 N 1.94 0.06 -0.45 -0.44 -7.23 -1.26 -1.45 120.40 111.58 2gpl s VAL 97 Ca 0.44 -1.99 0.03 0.00 -1.81 0.00 0.00 61.98 58.64 2gpl s VAL 97 Cb -0.02 -2.47 0.16 0.00 0.56 0.00 0.00 36.38 34.60 2gpl s VAL 97 CO 0.01 -0.04 0.32 -0.83 -0.31 0.00 0.00 175.10 174.24 2gpl s GLY 98 N -3.17 1.48 0.60 2.32 0.00 -0.11 -3.70 107.32 104.74 2gpl s GLY 98 Ca 0.38 -2.56 -0.18 0.00 0.00 0.00 0.00 44.72 42.36 2gpl s GLY 98 CO 0.11 1.85 1.14 -4.14 0.00 0.00 0.00 173.10 172.06 2gpl s PRO 99 N 0.10 3.06 -0.04 2.90 0.02 -1.26 -2.91 135.00 136.88 2gpl s PRO 99 Ca 0.26 1.57 -0.01 0.00 0.02 0.00 0.00 61.00 62.83 2gpl s PRO 99 Cb -0.09 -1.97 0.03 0.00 0.02 0.00 0.00 34.50 32.50 2gpl s PRO 99 CO -0.11 -1.08 0.07 0.08 -0.33 0.00 0.00 177.00 175.64 2gpl s VAL 100 N -1.96 -0.07 -0.09 3.83 1.01 0.02 -2.42 120.40 120.72 2gpl s VAL 100 Ca 0.71 0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.95 2gpl s VAL 100 Cb -0.24 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.98 2gpl s VAL 100 CO 0.34 0.10 -0.13 -0.69 0.00 0.00 0.00 175.10 174.71 2gpl s VAL 101 N 1.30 3.13 -0.02 2.92 1.01 0.11 -0.28 120.40 128.57 2gpl s VAL 101 Ca -0.07 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.20 2gpl s VAL 101 Cb -0.12 -2.27 0.00 0.00 0.00 0.00 0.00 36.38 33.99 2gpl s VAL 101 CO -0.04 0.56 0.09 0.00 0.00 0.00 0.00 175.10 175.72 2gpl s ALA 102 N -0.28 -0.22 0.00 5.51 0.00 -0.51 -0.43 121.76 125.84 2gpl s ALA 102 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 51.96 51.98 2gpl s ALA 102 Cb -0.13 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.97 2gpl s ALA 102 CO 0.03 -0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.07 2gpl n GLY 103 N 2.24 0.51 3.41 0.00 0.00 -0.24 -0.97 105.19 110.14 2gpl n GLY 103 Ca -0.18 -1.05 -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 2.95 -0.13 -0.61 -1.09 -1.26 -0.39 121.20 118.66 2gpl s ILE 104 Ca 0.00 -0.73 -0.29 0.00 -2.23 0.00 0.00 60.65 57.39 2gpl s ILE 104 Cb 0.00 -2.19 -0.03 0.00 -1.58 0.00 0.00 42.46 38.66 2gpl s ILE 104 CO 0.00 0.56 1.48 0.21 -1.23 0.00 0.00 174.94 175.96 2gpl s ASN 105 N -0.17 6.73 0.46 3.58 3.84 -0.34 -4.82 114.94 124.22 2gpl s ASN 105 Ca -0.01 1.89 0.18 0.00 0.21 0.00 0.00 52.86 55.13 2gpl s ASN 105 Cb -0.13 -2.54 1.14 0.00 -0.55 0.00 0.00 41.25 39.17 2gpl s ASN 105 CO 0.03 -0.92 1.96 0.77 -2.79 0.00 0.00 177.10 176.15 2gpl h SER 10 N 9.18 0.27 0.25 -4.21 4.64 -1.96 0.73 113.55 122.46 2gpl h SER 10 Ca -0.33 0.01 -0.34 0.00 -0.47 0.00 0.00 61.79 60.66 2gpl h SER 10 Cb 1.14 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 2gpl h SER 10 CO 0.97 0.15 -1.82 0.50 -0.87 0.00 0.00 176.83 175.76 2gpl h LYS 10 N 0.30 0.26 0.00 4.77 3.64 -1.99 -3.38 116.57 120.16 2gpl h LYS 10 Ca 0.31 -0.45 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 2gpl h LYS 10 Cb 0.81 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 2gpl h LYS 10 CO -0.07 1.13 -1.35 -1.13 -2.27 0.00 0.00 179.45 175.75 2gpl n SER 10 N -3.45 0.52 0.00 4.20 3.41 -1.11 -4.96 113.62 112.23 2gpl n SER 10 Ca -0.25 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.02 2gpl n SER 10 Cb 1.05 1.26 0.00 0.00 -0.26 0.00 0.00 64.21 66.26 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 1.36 0.26 3.73 5.00 0.00 0.25 -4.98 105.19 110.82 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 -1.00 4.55 0.41 1.61 2.20 -1.25 -4.72 119.74 121.53 2gpl s LYS 107 Ca 0.00 1.18 -0.25 0.00 -0.36 0.00 0.00 55.97 56.55 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 -0.08 4.03 0.02 -1.26 -1.20 135.00 140.66 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 -0.36 0.20 0.12 -0.33 0.00 0.00 177.00 176.87 2gpl s PHE 109 N -1.46 -0.24 0.01 6.54 5.36 0.47 -4.92 117.98 123.74 2gpl s PHE 109 Ca 0.59 0.59 -0.03 0.00 -0.96 0.00 0.00 56.93 57.12 2gpl s PHE 109 Cb -0.30 0.03 -0.01 0.00 -0.34 0.00 0.00 43.02 42.41 2gpl s PHE 109 CO 0.37 -0.16 0.04 0.96 -1.46 0.00 0.00 175.22 174.97 2gpl s ILE 110 N 0.67 0.10 0.02 3.12 -4.36 -1.26 -1.08 121.20 118.41 2gpl s ILE 110 Ca -0.05 -0.81 -0.24 0.00 -0.26 0.00 0.00 60.65 59.29 2gpl s ILE 110 Cb -0.06 -0.33 0.05 0.00 1.25 0.00 0.00 42.46 43.37 2gpl s ILE 110 CO -0.04 -0.45 0.55 0.00 0.24 0.00 0.00 174.94 175.24 2gpl s ALA 111 N -1.42 -1.41 0.18 2.27 0.00 0.43 -4.29 121.76 117.53 2gpl s ALA 111 Ca -0.15 0.75 0.07 0.00 0.00 0.00 0.00 51.96 52.62 2gpl s ALA 111 Cb -0.09 0.29 -0.05 0.00 0.00 0.00 0.00 23.12 23.27 2gpl s ALA 111 CO 0.00 -0.46 -0.13 0.20 0.00 0.00 0.00 175.76 175.36 2gpl s GLY 112 N -1.76 1.30 0.06 0.00 0.00 0.28 0.05 107.32 107.26 2gpl s GLY 112 Ca -0.07 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.07 2gpl s GLY 112 CO 0.01 -1.67 -0.04 -1.36 0.00 0.00 0.00 173.10 170.04 2gpl s PHE 113 N -2.97 0.63 0.59 1.90 0.08 -1.02 0.38 117.98 117.57 2gpl s PHE 113 Ca 0.20 -0.96 0.04 0.00 0.12 0.00 0.00 56.93 56.33 2gpl s PHE 113 Cb -0.00 -0.42 0.08 0.00 -0.57 0.00 0.00 43.02 42.11 2gpl s PHE 113 CO 0.05 -0.28 0.82 0.16 -0.10 0.00 0.00 175.22 175.86 2gpl s ASP 114 N -2.81 4.99 0.47 1.36 3.84 -0.94 -4.13 116.67 119.45 2gpl s ASP 114 Ca 0.06 -0.45 0.31 0.00 -0.00 0.00 0.00 52.55 52.48 2gpl s ASP 114 Cb 0.05 -0.21 1.71 0.00 -1.38 0.00 0.00 42.92 43.10 2gpl s ASP 114 CO -0.07 -1.37 1.96 0.17 -0.00 0.00 0.00 175.17 175.86 2gpl h LEU 115 N 0.00 0.00 -3.15 2.11 -0.00 -1.87 -2.11 115.31 110.29 2gpl h LEU 115 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.52 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 -2.61 1.93 0.00 0.15 -5.35 -1.26 -4.38 119.36 107.84 2gpl n ILE 116 Ca -0.02 -1.65 0.00 0.00 -0.27 0.00 0.00 62.75 60.81 2gpl n ILE 116 Cb 0.06 -0.05 0.00 0.00 -1.74 0.00 0.00 39.64 37.91 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 0.26 3.67 3.28 0.00 -0.79 -2.83 105.19 108.52 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 3.80 5.03 -0.27 0.00 1.01 -1.26 -2.22 121.20 127.29 2gpl s ILE 119 Ca 0.89 1.25 -0.06 0.00 0.00 0.00 0.00 60.65 62.73 2gpl s ILE 119 Cb -0.57 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 37.94 2gpl s ILE 119 CO 0.45 0.15 0.04 -0.62 0.00 0.00 0.00 174.94 174.96 2gpl s ASP 120 N 1.06 4.88 -0.80 3.58 3.68 0.16 -4.98 116.67 124.26 2gpl s ASP 120 Ca 0.31 -0.63 0.02 0.00 2.13 0.00 0.00 52.55 54.38 2gpl s ASP 120 Cb -0.16 -1.83 0.21 0.00 -1.45 0.00 0.00 42.92 39.69 2gpl s ASP 120 CO 0.12 -0.14 0.71 1.21 0.13 0.00 0.00 175.17 177.20 2gpl n GLU 121 N 4.83 2.42 -1.66 4.34 2.13 -1.26 -0.55 120.64 130.88 2gpl n GLU 121 Ca -0.16 -4.52 -0.30 0.00 0.66 0.00 0.00 57.16 52.84 2gpl n GLU 121 Cb 0.49 -2.35 0.06 0.00 0.27 0.00 0.00 31.44 29.91 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 -1.66 2.61 -0.06 4.31 0.00 -1.26 -4.99 121.76 120.71 2gpl s ALA 122 Ca 0.29 -0.13 0.21 0.00 0.00 0.00 0.00 51.96 52.32 2gpl s ALA 122 Cb -0.02 -3.11 -0.32 0.00 0.00 0.00 0.00 23.12 19.68 2gpl s ALA 122 CO -0.11 -1.33 0.40 0.36 0.00 0.00 0.00 175.76 175.08 2gpl n LYS 12 N -3.17 0.67 -0.01 0.00 2.85 -1.26 -4.59 118.16 112.64 2gpl n LYS 12 Ca 0.07 -0.16 -0.01 0.00 -1.05 0.00 0.00 58.31 57.15 2gpl n LYS 12 Cb 0.55 -1.51 -0.00 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 0.34 -3.77 -5.58 5.68 -1.26 -4.55 116.55 105.08 2gpl n ASP 123 Ca -0.09 0.17 -0.11 0.00 -0.50 0.00 0.00 54.79 54.27 2gpl n ASP 123 Cb 0.66 -0.55 -0.07 0.00 -1.14 0.00 0.00 41.12 40.01 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 -1.29 -0.04 -0.04 2.11 -0.12 -1.26 -1.71 117.98 115.63 2gpl s PHE 124 Ca -0.04 -0.20 0.03 0.00 -0.05 0.00 0.00 56.93 56.66 2gpl s PHE 124 Cb 0.01 0.07 0.00 0.00 -0.63 0.00 0.00 43.02 42.47 2gpl s PHE 124 CO 0.06 -0.54 -0.11 0.42 -0.05 0.00 0.00 175.22 175.01 2gpl s ILE 125 N -3.06 0.95 0.23 -4.49 1.09 -0.48 -4.79 121.20 110.65 2gpl s ILE 125 Ca -0.01 -0.44 0.11 0.00 -1.10 0.00 0.00 60.65 59.21 2gpl s ILE 125 Cb 0.01 -0.85 -0.05 0.00 -1.06 0.00 0.00 42.46 40.52 2gpl s ILE 125 CO -0.07 0.29 -0.20 0.68 -0.10 0.00 0.00 174.94 175.55 2gpl s VAL 126 N 0.27 2.24 -0.10 2.92 -7.23 -1.26 -0.93 120.40 116.32 2gpl s VAL 126 Ca -0.05 -2.21 -0.31 0.00 -1.81 0.00 0.00 61.98 57.60 2gpl s VAL 126 Cb -0.11 -2.15 0.10 0.00 0.56 0.00 0.00 36.38 34.78 2gpl s VAL 126 CO 0.01 -0.34 0.82 -0.55 -0.31 0.00 0.00 175.10 174.73 2gpl s SER 127 N -3.13 -0.53 0.00 4.85 0.15 -0.50 -5.00 113.70 109.54 2gpl s SER 127 Ca 0.24 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.47 2gpl s SER 127 Cb -0.05 0.44 0.00 0.00 -1.71 0.00 0.00 66.02 64.69 2gpl s SER 127 CO 0.11 -0.49 0.00 0.61 1.20 0.00 0.00 173.24 174.67 2gpl n GLY 128 N 0.84 0.67 0.00 9.45 0.00 -1.26 -1.14 105.19 113.74 2gpl n GLY 128 Ca -0.15 -2.30 0.10 0.00 0.00 0.00 0.00 46.02 43.67 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 -0.54 0.34 -2.01 2.61 -2.24 -0.43 -2.66 114.28 109.35 2gpl n THR 129 Ca 0.00 0.09 0.02 0.00 -2.27 0.00 0.00 64.05 61.89 2gpl n THR 129 Cb 0.00 -0.73 0.12 0.00 -2.10 0.00 0.00 70.33 67.62 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 3.31 0.00 6.98 0.00 -1.26 -4.83 120.51 123.42 2gpl n ALA 130 Ca 0.10 -3.01 0.01 0.00 0.00 0.00 0.00 53.44 50.54 2gpl n ALA 130 Cb 0.17 -0.51 0.34 0.00 0.00 0.00 0.00 19.45 19.45 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 1.21 0.48 -0.03 0.00 4.64 -1.77 -0.41 113.55 117.67 2gpl h SER 131 Ca -0.05 -0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2gpl h SER 131 Cb 1.36 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2gpl h SER 131 CO 0.12 0.49 0.02 0.44 -0.87 0.00 0.00 176.83 177.03 2gpl h ASP 132 N 0.51 0.04 -0.58 4.97 3.45 -1.88 0.46 116.42 123.40 2gpl h ASP 132 Ca 0.12 -0.10 0.03 0.00 0.43 0.00 0.00 57.03 57.51 2gpl h ASP 132 Cb 0.22 -0.01 -0.04 0.00 -0.56 0.00 0.00 39.33 38.94 2gpl h ASP 132 CO -0.00 0.13 0.35 1.56 -1.57 0.00 0.00 179.24 179.70 2gpl h GLN 133 N -0.05 0.66 -0.77 3.56 7.50 -1.82 -1.58 115.11 122.61 2gpl h GLN 133 Ca 0.01 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.12 2gpl h GLN 133 Cb 0.09 -0.15 -0.04 0.00 0.05 0.00 0.00 27.48 27.44 2gpl h GLN 133 CO -0.00 0.44 0.49 -0.07 -1.50 0.00 0.00 178.83 178.18 2gpl h LEU 134 N 0.68 0.91 -0.75 1.46 3.38 -0.76 -0.37 115.31 119.87 2gpl h LEU 134 Ca 0.24 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.17 2gpl h LEU 134 Cb 0.05 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 2gpl h LEU 134 CO -0.11 0.69 0.49 -0.26 0.09 0.00 0.00 178.44 179.34 2gpl h PHE 135 N 1.06 0.94 0.06 1.13 0.04 -0.39 0.20 116.94 119.98 2gpl h PHE 135 Ca 0.28 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 61.07 2gpl h PHE 135 Cb -0.07 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 37.76 2gpl h PHE 135 CO -0.01 0.59 -0.03 0.78 -0.60 0.00 0.00 178.31 179.03 2gpl h GLY 136 N 1.01 -0.09 0.82 -1.45 0.00 -0.68 0.20 103.07 102.88 2gpl h GLY 136 Ca 0.28 0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.61 2gpl h GLY 136 CO -0.06 -0.03 -0.43 -0.33 0.00 0.00 0.00 176.54 175.68 2gpl h MET 137 N -0.16 -1.03 -0.11 4.80 2.86 -0.63 -3.07 114.93 117.61 2gpl h MET 137 Ca -0.01 0.07 0.04 0.00 -2.06 0.00 0.00 59.70 57.74 2gpl h MET 137 Cb 0.13 0.23 -0.05 0.00 0.06 0.00 0.00 31.60 31.98 2gpl h MET 137 CO 0.01 -0.68 -0.20 0.00 1.06 0.00 0.00 176.91 177.10 2gpl h GLU 139 N -0.26 0.00 0.00 0.00 4.57 -0.94 -1.04 114.58 116.91 2gpl h GLU 139 Ca 0.09 0.00 -0.10 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 -0.26 0.00 -1.28 0.43 -1.18 0.00 0.00 179.01 176.72 2gpl n SER 140 N -3.56 1.86 -0.03 1.04 7.64 -0.76 -4.64 113.62 115.18 2gpl n SER 140 Ca 0.09 0.31 0.09 0.00 1.01 0.00 0.00 58.87 60.37 2gpl n SER 140 Cb 0.73 -0.72 0.49 0.00 -1.01 0.00 0.00 64.21 63.70 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 -0.92 0.37-10.08 -3.43 3.38 -0.78 -3.44 115.31 100.40 2gpl h LEU 141 Ca -0.15 -0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.30 2gpl h LEU 141 Cb 1.08 -0.08 0.09 0.00 0.09 0.00 0.00 40.66 41.84 2gpl h LEU 141 CO -0.09 0.24 0.46 -0.47 0.09 0.00 0.00 178.44 178.67 2gpl s TYR 142 N -5.40 2.54 -0.12 1.13 5.04 -0.40 -5.04 117.35 115.11 2gpl s TYR 142 Ca -0.08 1.52 -0.29 0.00 -2.44 0.00 0.00 57.07 55.78 2gpl s TYR 142 Cb 0.19 -3.41 0.08 0.00 0.35 0.00 0.00 41.96 39.16 2gpl s TYR 142 CO 0.74 -1.92 0.73 -1.83 -1.34 0.00 0.00 175.55 171.93 2gpl s GLU 143 N -3.23 0.94 1.08 4.97 -1.05 -1.26 -5.00 118.70 115.15 2gpl s GLU 143 Ca 0.74 0.42 -0.12 0.00 -0.15 0.00 0.00 54.97 55.87 2gpl s GLU 143 Cb -0.28 0.45 0.23 0.00 -0.44 0.00 0.00 34.13 34.09 2gpl s GLU 143 CO 0.31 -0.25 1.05 -2.30 0.95 0.00 0.00 175.26 175.01 2gpl n PRO 144 N 1.33 -1.71 -3.94 -4.83 -0.02 -1.26 -4.23 135.00 120.33 2gpl n PRO 144 Ca -0.17 -0.46 -0.33 0.00 -2.02 0.00 0.00 63.50 60.53 2gpl n PRO 144 Cb 0.57 -2.24 -0.07 0.00 -0.02 0.00 0.00 33.50 31.74 2gpl n PRO 144 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2gpl n ASN 145 N -4.64 -1.14 -4.78 2.55 4.13 -1.26 -4.92 115.26 105.20 2gpl n ASN 145 Ca 0.06 -1.00 -0.35 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 -6.08 3.79 0.58 3.41 1.43 -1.26 -4.05 118.68 116.51 2gpl s LEU 146 Ca 0.58 2.13 -0.13 0.00 -1.03 0.00 0.00 54.13 55.67 2gpl s LEU 146 Cb -0.34 -4.55 -0.05 0.00 0.03 0.00 0.00 46.19 41.28 2gpl s LEU 146 CO 0.82 -1.09 1.02 -1.61 0.23 0.00 0.00 176.35 175.71 2gpl s GLU 147 N -3.22 3.66 0.21 1.70 0.41 -1.26 0.43 118.70 120.63 2gpl s GLU 147 Ca 0.71 0.87 -0.17 0.00 -0.41 0.00 0.00 54.97 55.97 2gpl s GLU 147 Cb -0.23 -2.09 0.21 0.00 -1.78 0.00 0.00 34.13 30.25 2gpl s GLU 147 CO 0.26 -0.52 1.58 -1.35 -0.49 0.00 0.00 175.26 174.74 2gpl h PRO 148 N 0.16 -0.07 -0.29 0.39 0.11 -1.95 0.49 132.00 130.83 2gpl h PRO 148 Ca -0.45 0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.69 2gpl h PRO 148 Cb 1.19 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2gpl h PRO 148 CO 0.61 -0.05 0.19 0.93 -0.21 0.00 0.00 178.00 179.48 2gpl h GLU 149 N -0.08 0.28 0.12 1.05 3.07 -2.00 -1.41 114.58 115.60 2gpl h GLU 149 Ca 0.30 -0.02 -0.23 0.00 -0.50 0.00 0.00 59.36 58.91 2gpl h GLU 149 Cb 0.58 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 2gpl h GLU 149 CO -0.81 0.18 -1.15 -0.44 -1.40 0.00 0.00 179.01 175.40 2gpl h ASP 150 N 0.29 0.39 -0.95 1.42 3.45 -1.30 -3.30 116.42 116.42 2gpl h ASP 150 Ca 0.12 -0.88 0.14 0.00 0.43 0.00 0.00 57.03 56.83 2gpl h ASP 150 Cb 0.12 -0.13 -0.08 0.00 -0.56 0.00 0.00 39.33 38.69 2gpl h ASP 150 CO -0.02 1.51 0.60 0.25 -1.57 0.00 0.00 179.24 180.01 2gpl h LEU 151 N -0.38 0.78 -0.26 1.55 5.85 0.16 -1.26 115.31 121.75 2gpl h LEU 151 Ca -0.24 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.57 2gpl h LEU 151 Cb 1.68 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 42.56 2gpl h LEU 151 CO 0.08 0.40 0.03 0.15 -0.34 0.00 0.00 178.44 178.76 2gpl h PHE 152 N 0.83 0.04 -0.84 1.25 3.57 -1.36 0.32 116.94 120.75 2gpl h PHE 152 Ca 0.48 0.02 0.02 0.00 3.53 0.00 0.00 57.97 62.02 2gpl h PHE 152 Cb 0.63 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.34 2gpl h PHE 152 CO -0.00 -0.00 0.55 0.93 -2.23 0.00 0.00 178.31 177.55 2gpl h GLU 153 N 0.12 1.05 0.67 1.11 4.39 -1.32 -1.52 114.58 119.08 2gpl h GLU 153 Ca 0.12 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.72 2gpl h GLU 153 Cb 0.14 -0.24 0.01 0.00 -0.10 0.00 0.00 28.75 28.56 2gpl h GLU 153 CO -0.18 0.70 -0.32 1.15 -1.16 0.00 0.00 179.01 179.20 2gpl h THR 154 N 1.08 0.00 -1.00 1.13 2.02 -0.93 -1.73 112.91 113.49 2gpl h THR 154 Ca 0.33 -0.32 0.18 0.00 0.77 0.00 0.00 66.41 67.37 2gpl h THR 154 Cb -0.04 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.26 2gpl h THR 154 CO -0.10 0.00 0.60 -0.29 0.37 0.00 0.00 175.52 176.10 2gpl h ILE 155 N -1.22 0.72 -0.14 3.11 6.09 -0.95 -0.42 117.51 124.71 2gpl h ILE 155 Ca -0.09 -0.27 -0.03 0.00 -1.37 0.00 0.00 64.86 63.11 2gpl h ILE 155 Cb 0.69 -0.12 -0.00 0.00 0.47 0.00 0.00 36.82 37.86 2gpl h ILE 155 CO 0.15 0.14 -0.01 0.28 -3.07 0.00 0.00 178.15 175.64 2gpl h SER 156 N 0.77 0.26 0.26 2.19 0.02 -1.26 -1.61 113.55 114.19 2gpl h SER 156 Ca 0.57 -0.33 -0.06 0.00 -0.84 0.00 0.00 61.79 61.12 2gpl h SER 156 Cb 0.86 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.32 2gpl h SER 156 CO -0.38 0.53 -0.28 1.56 -1.14 0.00 0.00 176.83 177.12 2gpl h GLN 157 N -0.01 0.04 -0.09 3.45 1.08 -0.75 -0.06 115.11 118.77 2gpl h GLN 157 Ca 0.04 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 2gpl h GLN 157 Cb 0.40 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.83 2gpl h GLN 157 CO 0.01 0.32 -0.04 0.00 -0.95 0.00 0.00 178.83 178.18 2gpl h ALA 158 N 1.68 0.12 0.36 3.87 0.00 -0.92 -2.61 119.26 121.76 2gpl h ALA 158 Ca 0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2gpl h ALA 158 Cb 0.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2gpl h ALA 158 CO 0.04 -0.13 -0.17 1.25 0.00 0.00 0.00 179.25 180.24 2gpl h LEU 159 N -0.18 -0.41 -0.41 0.00 5.85 -1.01 -2.92 115.31 116.24 2gpl h LEU 159 Ca 0.02 -0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.72 2gpl h LEU 159 Cb 0.47 0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.53 2gpl h LEU 159 CO 0.01 -0.12 -0.10 -0.07 -0.34 0.00 0.00 178.44 177.82 2gpl h LEU 160 N -0.69 -0.37 -0.69 2.25 4.07 -1.09 -0.51 115.31 118.27 2gpl h LEU 160 Ca -0.05 0.12 -0.07 0.00 0.08 0.00 0.00 57.88 57.97 2gpl h LEU 160 Cb 0.49 0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.47 2gpl h LEU 160 CO 0.08 -0.13 -0.31 0.78 -1.08 0.00 0.00 178.44 177.78 2gpl h ASN 161 N 0.00 0.00 0.06 -0.43 2.35 -1.56 -2.32 115.58 113.68 2gpl h ASN 161 Ca 0.20 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.80 2gpl h ASN 161 Cb 0.30 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.68 2gpl h ASN 161 CO -0.42 0.31 -0.60 0.00 -1.65 0.00 0.00 177.43 175.08 2gpl h ALA 162 N 1.69 -0.01 -0.33 -0.83 0.00 -1.28 -3.28 119.26 115.22 2gpl h ALA 162 Ca -0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 2gpl h ALA 162 Cb 0.97 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2gpl h ALA 162 CO 0.04 0.29 0.20 0.00 0.00 0.00 0.00 179.25 179.79 2gpl h ALA 163 N 0.18 1.74 0.00 0.00 0.00 -1.06 -1.36 119.26 118.75 2gpl h ALA 163 Ca -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2gpl h ALA 163 Cb 1.39 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2gpl h ALA 163 CO 0.11 0.23 0.00 -0.25 0.00 0.00 0.00 179.25 179.35 2gpl n ASP 164 N -4.47 0.00 -0.33 0.00 10.43 -0.88 -1.97 116.55 119.32 2gpl n ASP 164 Ca 0.02 -0.53 0.04 0.00 2.57 0.00 0.00 54.79 56.88 2gpl n ASP 164 Cb 0.08 -0.08 0.04 0.00 1.84 0.00 0.00 41.12 43.00 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 -1.08 0.55 -4.39 -1.24 5.12 -0.52 -4.95 116.66 110.14 2gpl n ARG 165 Ca 0.16 -1.12 -0.34 0.00 -1.93 0.00 0.00 57.85 54.62 2gpl n ARG 165 Cb 0.11 -1.16 -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 -0.71 3.90 0.49 0.55 3.68 -0.83 -5.00 116.67 118.75 2gpl s ASP 166 Ca 0.10 -0.42 0.26 0.00 2.13 0.00 0.00 52.55 54.62 2gpl s ASP 166 Cb 0.07 -1.62 1.24 0.00 -1.45 0.00 0.00 42.92 41.15 2gpl s ASP 166 CO 0.10 0.07 1.97 0.00 0.13 0.00 0.00 175.17 177.44 2gpl h ALA 167 N 7.40 1.17 -0.35 3.66 0.00 -1.92 -3.01 119.26 126.21 2gpl h ALA 167 Ca -0.34 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2gpl h ALA 167 Cb 1.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2gpl h ALA 167 CO 0.58 0.21 0.00 1.28 0.00 0.00 0.00 179.25 181.32 2gpl n LEU 168 N -3.54 3.39 -4.61 0.00 4.77 -1.26 -4.97 117.00 110.79 2gpl n LEU 168 Ca -0.01 -1.46 -0.26 0.00 -0.03 0.00 0.00 56.01 54.25 2gpl n LEU 168 Cb 0.32 -0.22 -0.10 0.00 -2.33 0.00 0.00 43.42 41.09 2gpl n LEU 168 CO 0.31 0.72 -0.31 -0.44 -1.33 0.00 0.00 177.39 176.34 2gpl s SER 169 N -1.51 3.92 0.00 -1.43 0.01 -1.14 -3.21 113.70 110.35 2gpl s SER 169 Ca 0.37 -1.23 0.00 0.00 1.31 0.00 0.00 55.95 56.40 2gpl s SER 169 Cb 0.22 -0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.04 2gpl s SER 169 CO 0.31 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2gpl n GLY 170 N -0.93 0.30 2.78 3.44 0.00 -1.26 -4.83 105.19 104.69 2gpl n GLY 170 Ca -0.04 -1.84 -0.22 0.00 0.00 0.00 0.00 46.02 43.92 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 -1.60 0.00 1.61 7.02 -1.26 -2.32 117.44 120.90 2gpl n TRP 171 Ca 0.00 0.32 0.00 0.00 -1.02 0.00 0.00 57.50 56.80 2gpl n TRP 171 Cb 0.00 -4.32 0.00 0.00 -2.42 0.00 0.00 31.31 24.57 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 -1.34 2.80 3.26 6.99 0.00 -1.26 -4.46 105.19 111.18 2gpl n GLY 172 Ca -0.17 -1.80 -0.12 0.00 0.00 0.00 0.00 46.02 43.93 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 -2.26 -0.75 -0.02 4.61 0.00 -1.26 -0.14 121.76 121.94 2gpl s ALA 173 Ca 0.00 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.11 2gpl s ALA 173 Cb 0.00 0.26 0.00 0.00 0.00 0.00 0.00 23.12 23.38 2gpl s ALA 173 CO 0.00 -0.38 -0.08 0.54 0.00 0.00 0.00 175.76 175.84 2gpl s VAL 174 N -2.24 0.69 -0.05 0.00 0.11 -0.41 -0.72 120.40 117.78 2gpl s VAL 174 Ca -0.07 -0.33 0.06 0.00 -2.93 0.00 0.00 61.98 58.71 2gpl s VAL 174 Cb -0.02 -0.60 -0.01 0.00 -1.53 0.00 0.00 36.38 34.22 2gpl s VAL 174 CO -0.01 0.21 -0.22 -0.69 -3.33 0.00 0.00 175.10 171.05 2gpl s VAL 175 N 0.06 1.83 -0.16 2.04 1.01 0.47 -1.92 120.40 123.74 2gpl s VAL 175 Ca -0.01 -0.95 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 2gpl s VAL 175 Cb -0.06 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.75 2gpl s VAL 175 CO 0.00 0.52 -0.09 -0.31 0.00 0.00 0.00 175.10 175.21 2gpl s TYR 176 N -0.19 2.89 -0.23 5.22 2.02 0.46 -1.23 117.35 126.29 2gpl s TYR 176 Ca -0.01 -0.68 -0.05 0.00 -0.37 0.00 0.00 57.07 55.96 2gpl s TYR 176 Cb -0.12 -1.93 -0.01 0.00 -0.40 0.00 0.00 41.96 39.49 2gpl s TYR 176 CO 0.02 -0.28 -0.01 0.42 -1.57 0.00 0.00 175.55 174.13 2gpl s ILE 177 N 0.66 3.64 -0.10 2.71 -1.09 -0.44 -1.80 121.20 124.77 2gpl s ILE 177 Ca -0.05 -0.40 0.01 0.00 -2.23 0.00 0.00 60.65 57.98 2gpl s ILE 177 Cb -0.15 -2.67 -0.02 0.00 -1.58 0.00 0.00 42.46 38.04 2gpl s ILE 177 CO 0.02 0.40 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.38 2gpl s ILE 178 N 1.51 3.13 0.11 2.92 1.01 0.63 -1.83 121.20 128.66 2gpl s ILE 178 Ca 0.06 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.08 2gpl s ILE 178 Cb -0.14 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 2gpl s ILE 178 CO -0.01 0.55 -0.08 -0.54 0.00 0.00 0.00 174.94 174.85 2gpl s LYS 179 N -0.05 0.87 0.26 2.79 1.02 0.17 -1.81 119.74 122.99 2gpl s LYS 179 Ca -0.03 -1.29 -0.09 0.00 0.02 0.00 0.00 55.97 54.59 2gpl s LYS 179 Cb -0.14 -0.36 0.43 0.00 -0.52 0.00 0.00 37.83 37.24 2gpl s LYS 179 CO 0.04 0.03 1.58 0.87 -0.92 0.00 0.00 175.35 176.94 2gpl h LYS 181 N 3.13 0.01 0.17 1.68 1.79 -1.95 -2.90 116.57 118.50 2gpl h LYS 181 Ca -0.36 -0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 57.79 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 -1.59 0.38 -1.08 0.00 0.00 179.45 177.77 2gpl h ASP 182 N 0.01 0.55 -4.86 0.86 2.03 -1.97 -3.49 116.42 109.55 2gpl h ASP 182 Ca 0.44 -0.91 -0.27 0.00 -0.73 0.00 0.00 57.03 55.56 2gpl h ASP 182 Cb 0.70 -0.18 -0.15 0.00 -0.83 0.00 0.00 39.33 38.88 2gpl h ASP 182 CO -0.90 1.72 -0.65 -1.83 -1.03 0.00 0.00 179.24 176.55 2gpl s GLU 183 N -2.54 1.13 -0.04 4.15 -1.05 -1.09 -5.15 118.70 114.10 2gpl s GLU 183 Ca -0.17 -1.56 -0.01 0.00 -0.15 0.00 0.00 54.97 53.08 2gpl s GLU 183 Cb 0.05 -0.08 0.03 0.00 -0.44 0.00 0.00 34.13 33.69 2gpl s GLU 183 CO 0.83 -0.22 0.02 0.08 0.95 0.00 0.00 175.26 176.92 2gpl s VAL 184 N -3.83 0.11 -0.07 1.83 1.01 -1.26 -0.65 120.40 117.53 2gpl s VAL 184 Ca 0.28 0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.51 2gpl s VAL 184 Cb 0.07 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.14 2gpl s VAL 184 CO 0.06 0.18 -0.12 -0.69 0.00 0.00 0.00 175.10 174.54 2gpl s VAL 185 N 1.68 3.28 -0.16 2.92 1.01 -0.76 -4.98 120.40 123.38 2gpl s VAL 185 Ca -0.01 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.36 2gpl s VAL 185 Cb -0.13 -2.32 0.02 0.00 0.00 0.00 0.00 36.38 33.95 2gpl s VAL 185 CO -0.03 0.58 -0.20 -0.75 0.00 0.00 0.00 175.10 174.70 2gpl s LYS 186 N -0.53 2.87 -0.02 2.72 2.20 -1.26 -1.33 119.74 124.39 2gpl s LYS 186 Ca 0.07 -0.79 0.07 0.00 -0.36 0.00 0.00 55.97 54.96 2gpl s LYS 186 Cb -0.12 -2.44 -0.02 0.00 -1.51 0.00 0.00 37.83 33.75 2gpl s LYS 186 CO 0.02 -0.16 -0.22 1.03 -0.36 0.00 0.00 175.35 175.66 2gpl s ARG 187 N 1.18 1.80 -0.00 4.03 0.52 -0.37 -4.97 118.95 121.14 2gpl s ARG 187 Ca 0.01 -0.79 -0.10 0.00 -0.52 0.00 0.00 55.73 54.33 2gpl s ARG 187 Cb -0.14 -1.74 -0.05 0.00 0.52 0.00 0.00 34.95 33.54 2gpl s ARG 187 CO -0.09 0.48 0.32 0.71 0.02 0.00 0.00 175.30 176.73 2gpl s TYR 188 N -0.51 3.64 0.25 -0.53 1.51 -1.26 -0.40 117.35 120.05 2gpl s TYR 188 Ca 0.08 0.76 0.06 0.00 -1.01 0.00 0.00 57.07 56.96 2gpl s TYR 188 Cb -0.09 -2.12 -0.03 0.00 -0.11 0.00 0.00 41.96 39.61 2gpl s TYR 188 CO -0.01 0.63 0.32 -0.51 -1.11 0.00 0.00 175.55 174.88 2gpl s LEU 189 N -1.40 4.16 -0.21 -1.29 1.43 0.10 -4.98 118.68 116.49 2gpl s LEU 189 Ca 0.25 -0.04 -0.08 0.00 -1.03 0.00 0.00 54.13 53.23 2gpl s LEU 189 Cb -0.14 -2.71 -0.04 0.00 0.03 0.00 0.00 46.19 43.33 2gpl s LEU 189 CO 0.13 -0.09 0.08 -0.75 0.23 0.00 0.00 176.35 175.95 2gpl s LYS 190 N -3.96 3.89 0.27 1.70 2.20 -1.26 -4.28 119.74 118.30 2gpl s LYS 190 Ca 0.34 -0.38 -0.10 0.00 -0.36 0.00 0.00 55.97 55.48 2gpl s LYS 190 Cb -0.09 -3.30 -0.00 0.00 -1.51 0.00 0.00 37.83 32.93 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 0.88 1.64 0.79 4.03 0.23 -1.26 -5.07 119.30 120.55 2gpl s MET 191 Ca 0.04 -1.39 -0.15 0.00 -1.03 0.00 0.00 55.69 53.16 2gpl s MET 191 Cb -0.14 0.46 0.02 0.00 -1.53 0.00 0.00 34.83 33.64 2gpl s MET 191 CO 0.03 -0.68 0.79 0.54 -2.03 0.00 0.00 175.02 173.67 2gpl n ARG 192 N -0.42 0.20 -2.16 3.16 1.74 -1.26 -4.84 116.66 113.07 2gpl n ARG 192 Ca -0.01 0.12 -0.20 0.00 -0.77 0.00 0.00 57.85 56.99 2gpl n ARG 192 Cb 0.62 -2.09 0.02 0.00 -1.02 0.00 0.00 32.46 30.00 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 -1.87 3.29 0.00 5.56 1.13 -1.26 -4.17 117.38 120.06 2gpl n GLN 193 Ca 0.11 -4.06 0.00 0.00 -1.94 0.00 0.00 57.00 51.11 2gpl n GLN 193 Cb 0.51 -2.16 0.00 0.00 0.11 0.00 0.00 30.24 28.69 2gpl n GLN 193 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22