#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gpl s ASP 1 N 0.00 5.05 -0.09 6.12 1.01 -1.26 -4.98 116.67 122.51 2gpl s ASP 1 Ca 0.00 0.80 -0.17 0.00 0.71 0.00 0.00 52.55 53.89 2gpl s ASP 1 Cb 0.00 -1.51 -0.05 0.00 1.01 0.00 0.00 42.92 42.38 2gpl s ASP 1 CO 0.00 -1.52 0.44 -0.63 0.21 0.00 0.00 175.17 173.67 2gpl s ILE 2 N -3.33 5.16 -0.23 0.77 -1.09 -1.26 -4.85 121.20 116.36 2gpl s ILE 2 Ca 0.59 0.89 -0.04 0.00 -2.23 0.00 0.00 60.65 59.86 2gpl s ILE 2 Cb -0.11 -3.78 0.08 0.00 -1.58 0.00 0.00 42.46 37.08 2gpl s ILE 2 CO 0.48 0.39 0.12 -0.63 -1.23 0.00 0.00 174.94 174.07 2gpl s ILE 3 N 0.23 -0.09 0.16 2.92 -1.09 -1.26 -1.79 121.20 120.28 2gpl s ILE 3 Ca 0.24 -0.47 0.11 0.00 -2.23 0.00 0.00 60.65 58.30 2gpl s ILE 3 Cb -0.15 -0.79 -0.04 0.00 -1.58 0.00 0.00 42.46 39.90 2gpl s ILE 3 CO 0.10 -0.51 -0.24 -0.76 -1.23 0.00 0.00 174.94 172.30 2gpl s LEU 4 N 2.13 2.38 -0.14 2.97 1.43 0.39 -2.80 118.68 125.04 2gpl s LEU 4 Ca 0.06 -0.81 -0.10 0.00 -1.03 0.00 0.00 54.13 52.25 2gpl s LEU 4 Cb -0.16 -1.12 0.05 0.00 0.03 0.00 0.00 46.19 44.98 2gpl s LEU 4 CO -0.24 0.12 0.36 -0.83 0.23 0.00 0.00 176.35 176.00 2gpl s GLY 5 N -2.37 -0.27 -0.05 -3.19 0.00 -0.58 -1.39 107.32 99.47 2gpl s GLY 5 Ca 0.16 1.22 0.01 0.00 0.00 0.00 0.00 44.72 46.12 2gpl s GLY 5 CO 0.08 1.27 -0.07 -1.50 0.00 0.00 0.00 173.10 172.87 2gpl s ILE 6 N 0.85 0.69 -0.39 0.90 1.10 -0.15 -1.32 121.20 122.88 2gpl s ILE 6 Ca -0.05 -0.23 -0.11 0.00 -0.51 0.00 0.00 60.65 59.75 2gpl s ILE 6 Cb -0.06 -0.68 0.04 0.00 0.15 0.00 0.00 42.46 41.91 2gpl s ILE 6 CO -0.06 0.25 0.23 -0.60 -2.11 0.00 0.00 174.94 172.65 2gpl s ARG 7 N 0.77 2.79 0.00 3.50 3.52 0.35 -0.15 118.95 129.72 2gpl s ARG 7 Ca -0.12 -1.17 0.00 0.00 -0.13 0.00 0.00 55.73 54.32 2gpl s ARG 7 Cb -0.14 -3.77 0.00 0.00 -1.56 0.00 0.00 34.95 29.47 2gpl s ARG 7 CO 0.01 -0.77 0.00 1.33 -0.81 0.00 0.00 175.30 175.06 2gpl n VAL 8 N 5.00 0.00 0.01 7.11 0.24 -0.11 -4.85 118.33 125.73 2gpl n VAL 8 Ca -0.11 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.09 2gpl n VAL 8 Cb 0.45 -1.13 -0.03 0.00 -1.47 0.00 0.00 33.84 31.66 2gpl n VAL 8 CO 0.00 0.00 0.00 -0.61 -2.14 0.00 0.00 176.83 174.08 2gpl h GLN 9 N 0.00 -0.25 0.00 7.34 5.75 -1.22 -3.33 115.11 123.40 2gpl h GLN 9 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2gpl h GLN 9 Cb 0.00 0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.61 2gpl h GLN 9 CO 0.00 -0.16 -0.14 -0.25 -2.65 0.00 0.00 178.83 175.62 2gpl n ASP 10 N -5.33 1.56 -3.72 -0.69 8.00 -1.26 -4.63 116.55 110.48 2gpl n ASP 10 Ca -0.03 -2.62 -0.05 0.00 0.71 0.00 0.00 54.79 52.80 2gpl n ASP 10 Cb 0.25 -0.32 -0.01 0.00 -0.02 0.00 0.00 41.12 41.02 2gpl n ASP 10 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2gpl s SER 11 N -2.10 -0.18 -0.06 -2.24 1.04 -1.25 -4.34 113.70 104.56 2gpl s SER 11 Ca 0.19 -0.51 0.05 0.00 0.48 0.00 0.00 55.95 56.16 2gpl s SER 11 Cb 0.17 0.57 -0.00 0.00 0.10 0.00 0.00 66.02 66.85 2gpl s SER 11 CO 0.02 -1.06 -0.22 -0.69 0.98 0.00 0.00 173.24 172.27 2gpl s VAL 12 N -3.34 1.82 -0.09 5.02 1.01 -0.21 -0.93 120.40 123.68 2gpl s VAL 12 Ca 0.13 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.20 2gpl s VAL 12 Cb -0.03 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 2gpl s VAL 12 CO 0.04 0.51 -0.10 -0.63 0.00 0.00 0.00 175.10 174.92 2gpl s ILE 13 N 0.05 3.43 -0.11 2.22 -1.09 0.78 -1.04 121.20 125.43 2gpl s ILE 13 Ca -0.08 -0.57 0.01 0.00 -2.23 0.00 0.00 60.65 57.79 2gpl s ILE 13 Cb -0.14 -2.41 0.02 0.00 -1.58 0.00 0.00 42.46 38.35 2gpl s ILE 13 CO 0.04 0.57 -0.15 -0.76 -1.23 0.00 0.00 174.94 173.42 2gpl s LEU 14 N -0.42 1.69 -0.12 2.97 1.43 -0.41 -0.97 118.68 122.85 2gpl s LEU 14 Ca 0.06 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 2gpl s LEU 14 Cb -0.12 -1.09 -0.01 0.00 0.03 0.00 0.00 46.19 45.00 2gpl s LEU 14 CO 0.02 -0.00 -0.17 0.00 0.23 0.00 0.00 176.35 176.43 2gpl s ALA 15 N 1.09 2.46 -0.03 4.21 0.00 -0.49 -1.31 121.76 127.70 2gpl s ALA 15 Ca -0.05 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 50.98 2gpl s ALA 15 Cb -0.14 -1.09 0.03 0.00 0.00 0.00 0.00 23.12 21.91 2gpl s ALA 15 CO -0.03 0.22 0.01 -1.12 0.00 0.00 0.00 175.76 174.84 2gpl s SER 16 N 0.41 0.34 0.74 0.00 0.01 -0.74 -0.46 113.70 114.00 2gpl s SER 16 Ca -0.13 -0.00 -0.16 0.00 1.31 0.00 0.00 55.95 56.97 2gpl s SER 16 Cb -0.16 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 65.89 2gpl s SER 16 CO 0.06 -0.11 0.85 -1.54 0.41 0.00 0.00 173.24 172.91 2gpl n SER 17 N 4.19 -0.00 -0.08 2.44 3.41 -0.74 -1.06 113.62 121.78 2gpl n SER 17 Ca -0.26 0.63 0.09 0.00 -0.26 0.00 0.00 58.87 59.06 2gpl n SER 17 Cb 0.50 -1.36 -0.08 0.00 -0.26 0.00 0.00 64.21 63.01 2gpl n SER 17 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2gpl n LYS 18 N -1.67 1.06 -2.59 4.33 5.02 -0.53 -4.64 118.16 119.14 2gpl n LYS 18 Ca 0.12 -0.17 -0.37 0.00 -2.02 0.00 0.00 58.31 55.86 2gpl n LYS 18 Cb 0.50 -1.36 -0.05 0.00 -0.02 0.00 0.00 35.03 34.10 2gpl n LYS 18 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2gpl s ALA 19 N -2.62 3.17 -0.26 7.82 0.00 -0.75 -1.13 121.76 127.99 2gpl s ALA 19 Ca 0.09 0.69 -0.02 0.00 0.00 0.00 0.00 51.96 52.72 2gpl s ALA 19 Cb 0.14 -3.26 0.09 0.00 0.00 0.00 0.00 23.12 20.09 2gpl s ALA 19 CO 0.70 -0.11 0.08 0.08 0.00 0.00 0.00 175.76 176.51 2gpl s VAL 20 N -1.55 0.57 -0.11 0.00 1.01 -0.18 -4.91 120.40 115.23 2gpl s VAL 20 Ca 0.53 -0.97 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 2gpl s VAL 20 Cb -0.23 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 2gpl s VAL 20 CO 0.29 -0.51 0.04 -0.89 0.00 0.00 0.00 175.10 174.03 2gpl s THR 21 N 1.80 4.63 -0.37 3.92 2.01 -1.26 -1.14 115.64 125.22 2gpl s THR 21 Ca 0.06 -0.12 0.01 0.00 0.31 0.00 0.00 61.69 61.94 2gpl s THR 21 Cb -0.17 -2.99 0.12 0.00 0.01 0.00 0.00 72.50 69.47 2gpl s THR 21 CO -0.21 0.59 0.17 -0.13 -0.69 0.00 0.00 174.62 174.34 2gpl s ARG 22 N -0.71 0.97 5.83 4.92 1.81 -0.17 -4.93 118.95 126.67 2gpl s ARG 22 Ca 0.12 -1.52 0.00 0.00 -1.72 0.00 0.00 55.73 52.61 2gpl s ARG 22 Cb -0.12 -2.11 0.00 0.00 -0.45 0.00 0.00 34.95 32.27 2gpl s ARG 22 CO 0.02 -1.08 0.00 0.41 -0.68 0.00 0.00 175.30 173.97 2gpl n GLY 23 N 4.20 1.60 0.10 -3.53 0.00 -1.26 -3.21 105.19 103.08 2gpl n GLY 23 Ca 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2gpl n GLY 23 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2gpl h ILE 24 N 0.00 0.51 -3.16 -0.61 2.10 -2.04 -3.48 117.51 110.84 2gpl h ILE 24 Ca 0.00 -1.99 -0.63 0.00 1.08 0.00 0.00 64.86 63.32 2gpl h ILE 24 Cb 0.00 2.05 -0.13 0.00 -1.09 0.00 0.00 36.82 37.65 2gpl h ILE 24 CO 0.00 0.29 -0.68 -0.44 -1.08 0.00 0.00 178.15 176.24 2gpl s SER 25 N -5.82 4.70 -0.72 2.19 0.01 -1.20 -5.07 113.70 107.79 2gpl s SER 25 Ca -0.02 -0.36 -0.17 0.00 1.31 0.00 0.00 55.95 56.71 2gpl s SER 25 Cb 0.09 -0.99 0.14 0.00 0.21 0.00 0.00 66.02 65.47 2gpl s SER 25 CO 0.81 0.13 0.79 -0.69 0.41 0.00 0.00 173.24 174.68 2gpl s VAL 26 N -1.51 5.07 0.42 3.43 1.01 -1.26 -1.00 120.40 126.56 2gpl s VAL 26 Ca 0.25 -1.59 0.10 0.00 0.00 0.00 0.00 61.98 60.75 2gpl s VAL 26 Cb -0.10 -4.53 0.21 0.00 0.00 0.00 0.00 36.38 31.96 2gpl s VAL 26 CO 0.17 -1.15 2.00 -0.07 0.00 0.00 0.00 175.10 176.05 2gpl h LEU 27 N 9.33 0.26 -7.53 3.92 3.38 -1.49 -3.45 115.31 119.72 2gpl h LEU 27 Ca -0.09 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 2gpl h LEU 27 Cb 1.06 -0.07 -0.20 0.00 0.09 0.00 0.00 40.66 41.54 2gpl h LEU 27 CO 1.00 0.30 -0.29 -0.75 0.09 0.00 0.00 178.44 178.78 2gpl s LYS 28 N -5.03 0.65 -0.05 1.13 2.20 -1.08 -5.00 119.74 112.56 2gpl s LYS 28 Ca -0.06 -0.21 0.08 0.00 -0.36 0.00 0.00 55.97 55.41 2gpl s LYS 28 Cb 0.16 0.29 0.12 0.00 -1.51 0.00 0.00 37.83 36.89 2gpl s LYS 28 CO 0.72 -0.18 1.03 -0.40 -0.36 0.00 0.00 175.35 176.16 2gpl n ASP 29 N 1.28 1.12 -2.75 1.43 3.85 -1.25 -1.01 116.55 119.21 2gpl n ASP 29 Ca -0.22 -2.38 -0.03 0.00 -0.71 0.00 0.00 54.79 51.45 2gpl n ASP 29 Cb 0.56 -0.27 0.05 0.00 -1.35 0.00 0.00 41.12 40.11 2gpl n ASP 29 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 2gpl n SER 30 N -0.63 1.84 -4.74 -1.12 3.41 -1.06 -4.57 113.62 106.75 2gpl n SER 30 Ca 0.07 -2.24 -0.39 0.00 -0.26 0.00 0.00 58.87 56.05 2gpl n SER 30 Cb 0.63 -0.47 -0.05 0.00 -0.26 0.00 0.00 64.21 64.05 2gpl n SER 30 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gpl s ASP 31 N -3.72 6.89 -0.56 4.04 -1.08 -0.28 -5.03 116.67 116.92 2gpl s ASP 31 Ca 0.29 1.06 -0.14 0.00 -0.52 0.00 0.00 52.55 53.24 2gpl s ASP 31 Cb 0.34 -2.35 0.14 0.00 -1.46 0.00 0.00 42.92 39.59 2gpl s ASP 31 CO -0.03 0.01 0.50 -0.62 0.52 0.00 0.00 175.17 175.55 2gpl s ASP 32 N 0.32 6.14 -0.32 -0.34 3.68 -1.26 -4.29 116.67 120.60 2gpl s ASP 32 Ca 0.31 -1.93 -0.06 0.00 2.13 0.00 0.00 52.55 53.00 2gpl s ASP 32 Cb -0.17 -2.16 -0.16 0.00 -1.45 0.00 0.00 42.92 38.98 2gpl s ASP 32 CO 0.15 -0.79 3.32 0.29 0.13 0.00 0.00 175.17 178.27 2gpl n LYS 33 N 5.01 2.37 -3.83 4.34 5.02 -1.26 -4.84 118.16 124.97 2gpl n LYS 33 Ca -0.09 -1.53 -0.11 0.00 -2.02 0.00 0.00 58.31 54.56 2gpl n LYS 33 Cb 0.41 -2.14 -0.08 0.00 -0.02 0.00 0.00 35.03 33.20 2gpl n LYS 33 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2gpl s THR 34 N 0.28 0.10 0.01 -0.18 -1.32 -1.26 -2.01 115.64 111.26 2gpl s THR 34 Ca 0.65 -0.82 0.00 0.00 -1.21 0.00 0.00 61.69 60.31 2gpl s THR 34 Cb 0.32 -0.86 -0.01 0.00 -1.51 0.00 0.00 72.50 70.44 2gpl s THR 34 CO -0.06 -0.45 -0.01 -0.13 -2.21 0.00 0.00 174.62 171.75 2gpl s ARG 35 N -2.40 0.11 -0.31 7.08 1.81 -0.40 -5.01 118.95 119.83 2gpl s ARG 35 Ca -0.06 -0.18 -0.18 0.00 -1.72 0.00 0.00 55.73 53.59 2gpl s ARG 35 Cb -0.02 0.00 -0.02 0.00 -0.45 0.00 0.00 34.95 34.47 2gpl s ARG 35 CO -0.03 -0.01 0.51 -1.14 -0.68 0.00 0.00 175.30 173.96 2gpl s GLN 36 N -0.40 3.85 0.05 3.54 0.74 -1.26 -1.55 119.66 124.62 2gpl s GLN 36 Ca -0.04 0.07 -0.12 0.00 0.05 0.00 0.00 55.36 55.33 2gpl s GLN 36 Cb -0.03 -3.73 -0.32 0.00 1.10 0.00 0.00 33.01 30.03 2gpl s GLN 36 CO -0.00 -0.50 1.06 -0.07 -0.55 0.00 0.00 175.29 175.23 2gpl h LEU 37 N 8.94 0.70 -7.83 3.68 3.38 -1.50 -3.48 115.31 119.21 2gpl h LEU 37 Ca -0.28 -0.74 -0.01 0.00 0.09 0.00 0.00 57.88 56.93 2gpl h LEU 37 Cb 1.13 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.56 2gpl h LEU 37 CO 0.74 1.58 0.03 -0.94 0.09 0.00 0.00 178.44 179.94 2gpl s SER 38 N -7.42 -0.23 0.56 -0.43 1.04 -1.13 -4.30 113.70 101.79 2gpl s SER 38 Ca -0.07 -0.59 0.37 0.00 0.48 0.00 0.00 55.95 56.14 2gpl s SER 38 Cb 0.05 0.60 1.52 0.00 0.10 0.00 0.00 66.02 68.30 2gpl s SER 38 CO 0.92 -1.11 1.73 1.55 0.98 0.00 0.00 173.24 177.31 2gpl h PRO 39 N 2.18 0.00 -0.04 4.02 0.13 -2.01 -1.18 132.00 135.10 2gpl h PRO 39 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2gpl h PRO 39 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2gpl h PRO 39 CO 0.35 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.84 2gpl n HIS 40 N -3.99 0.12 -3.91 1.56 8.25 -1.26 -3.71 115.22 112.28 2gpl n HIS 40 Ca 0.27 -0.91 -0.20 0.00 -0.26 0.00 0.00 57.72 56.62 2gpl n HIS 40 Cb 1.35 -0.15 -0.17 0.00 1.12 0.00 0.00 29.99 32.14 2gpl n HIS 40 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2gpl s THR 41 N -2.60 0.32 0.05 1.59 2.01 -0.45 -1.09 115.64 115.47 2gpl s THR 41 Ca 0.29 0.07 0.09 0.00 0.31 0.00 0.00 61.69 62.45 2gpl s THR 41 Cb 0.25 -0.43 -0.03 0.00 0.01 0.00 0.00 72.50 72.30 2gpl s THR 41 CO 0.04 0.21 -0.25 -0.22 -0.69 0.00 0.00 174.62 173.70 2gpl s LEU 42 N 1.41 2.17 -0.06 4.42 2.96 0.20 -1.15 118.68 128.63 2gpl s LEU 42 Ca -0.04 -0.58 0.01 0.00 -0.22 0.00 0.00 54.13 53.30 2gpl s LEU 42 Cb -0.13 -1.23 0.02 0.00 0.50 0.00 0.00 46.19 45.35 2gpl s LEU 42 CO -0.03 0.24 -0.06 -0.32 -1.32 0.00 0.00 176.35 174.86 2gpl s MET 43 N -1.24 1.14 0.17 1.98 -2.45 -0.60 0.05 119.30 118.36 2gpl s MET 43 Ca 0.11 -0.18 0.05 0.00 -1.25 0.00 0.00 55.69 54.41 2gpl s MET 43 Cb -0.10 -1.12 -0.04 0.00 1.25 0.00 0.00 34.83 34.83 2gpl s MET 43 CO 0.02 -0.11 0.18 -1.54 1.05 0.00 0.00 175.02 174.63 2gpl s SER 44 N 1.09 5.71 0.04 1.11 1.04 -0.11 -1.27 113.70 121.31 2gpl s SER 44 Ca -0.08 -0.08 -0.18 0.00 0.48 0.00 0.00 55.95 56.10 2gpl s SER 44 Cb -0.14 -1.55 0.04 0.00 0.10 0.00 0.00 66.02 64.47 2gpl s SER 44 CO -0.01 0.05 0.41 0.72 0.98 0.00 0.00 173.24 175.39 2gpl s PHE 45 N -1.80 -0.27 -0.01 5.02 -0.12 -0.85 -1.56 117.98 118.39 2gpl s PHE 45 Ca 0.32 0.25 -0.17 0.00 -0.05 0.00 0.00 56.93 57.28 2gpl s PHE 45 Cb -0.10 0.21 0.03 0.00 -0.63 0.00 0.00 43.02 42.53 2gpl s PHE 45 CO 0.25 -0.56 0.36 0.00 -0.05 0.00 0.00 175.22 175.22 2gpl s ALA 46 N -2.35 -0.91 0.00 1.99 0.00 -0.41 -4.87 121.76 115.22 2gpl s ALA 46 Ca -0.06 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.32 2gpl s ALA 46 Cb -0.01 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.21 2gpl s ALA 46 CO -0.01 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 175.86 2gpl n GLY 47 N 1.13 0.14 3.64 0.00 0.00 -1.26 -0.35 105.19 108.50 2gpl n GLY 47 Ca -0.21 -1.22 -0.46 0.00 0.00 0.00 0.00 46.02 44.13 2gpl n GLY 47 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2gpl n GLU 48 N 0.00 1.78 0.00 1.61 4.07 0.38 -4.84 120.64 123.65 2gpl n GLU 48 Ca 0.00 0.64 0.00 0.00 -0.06 0.00 0.00 57.16 57.74 2gpl n GLU 48 Cb 0.00 -2.27 0.00 0.00 -0.06 0.00 0.00 31.44 29.11 2gpl n GLU 48 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2gpl n ALA 49 N 2.02 0.00 0.04 4.31 0.00 -1.26 -2.05 120.51 123.58 2gpl n ALA 49 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.45 2gpl n ALA 49 Cb 0.29 0.19 -0.14 0.00 0.00 0.00 0.00 19.45 19.79 2gpl n ALA 49 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2gpl h GLY 50 N 0.00 0.15 1.71 0.00 0.00 -1.99 -3.35 103.07 99.59 2gpl h GLY 50 Ca 0.00 -0.39 0.02 0.00 0.00 0.00 0.00 47.33 46.96 2gpl h GLY 50 CO 0.00 0.34 0.16 -0.55 0.00 0.00 0.00 176.54 176.48 2gpl h ASP 51 N 0.04 0.21 0.37 0.19 3.32 -1.91 -2.84 116.42 115.79 2gpl h ASP 51 Ca -0.19 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 2gpl h ASP 51 Cb 1.95 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 41.42 2gpl h ASP 51 CO 0.14 0.15 -0.51 0.00 -1.72 0.00 0.00 179.24 177.29 2gpl h THR 52 N 0.24 0.01 -0.17 0.35 1.03 -1.55 0.47 112.91 113.29 2gpl h THR 52 Ca 0.09 0.00 -0.21 0.00 -0.01 0.00 0.00 66.41 66.28 2gpl h THR 52 Cb 0.08 0.01 0.01 0.00 -1.07 0.00 0.00 68.15 67.18 2gpl h THR 52 CO -0.02 0.00 -0.73 0.58 -0.01 0.00 0.00 175.52 175.34 2gpl h VAL 53 N -0.92 1.28 -0.60 0.00 2.07 -1.78 -2.70 116.25 113.60 2gpl h VAL 53 Ca -0.04 -1.94 0.08 0.00 0.82 0.00 0.00 66.70 65.62 2gpl h VAL 53 Cb 0.84 1.92 -0.07 0.00 -1.52 0.00 0.00 31.29 32.46 2gpl h VAL 53 CO -0.14 0.62 0.25 1.56 0.02 0.00 0.00 177.57 179.87 2gpl h GLN 54 N 0.54 0.44 -0.05 1.57 1.08 -1.43 0.23 115.11 117.50 2gpl h GLN 54 Ca -0.04 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.13 2gpl h GLN 54 Cb 1.35 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 28.68 2gpl h GLN 54 CO 0.15 0.29 -0.00 0.35 -0.95 0.00 0.00 178.83 178.67 2gpl h PHE 55 N 0.46 0.10 -0.27 2.96 3.04 -0.91 -1.78 116.94 120.54 2gpl h PHE 55 Ca 0.29 -0.02 0.04 0.00 3.98 0.00 0.00 57.97 62.27 2gpl h PHE 55 Cb 0.32 -0.02 -0.04 0.00 2.56 0.00 0.00 35.95 38.77 2gpl h PHE 55 CO -0.14 0.39 0.03 0.00 -2.02 0.00 0.00 178.31 176.56 2gpl h ALA 56 N 0.70 0.26 -0.13 2.41 0.00 -1.11 -0.17 119.26 121.21 2gpl h ALA 56 Ca 0.01 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2gpl h ALA 56 Cb 0.35 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2gpl h ALA 56 CO 0.00 -0.38 -0.19 0.93 0.00 0.00 0.00 179.25 179.60 2gpl h GLU 57 N 0.12 0.21 -0.27 0.00 5.08 -0.99 0.06 114.58 118.80 2gpl h GLU 57 Ca 0.13 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.38 2gpl h GLU 57 Cb 0.14 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 2gpl h GLU 57 CO -0.19 0.41 -0.03 -0.92 -1.00 0.00 0.00 179.01 177.29 2gpl h TYR 58 N 0.20 0.54 -0.61 4.33 3.20 -0.58 -1.19 116.97 122.87 2gpl h TYR 58 Ca 0.04 -0.10 -0.05 0.00 3.14 0.00 0.00 58.73 61.75 2gpl h TYR 58 Cb 0.46 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 2gpl h TYR 58 CO 0.01 0.67 0.18 0.82 -1.64 0.00 0.00 178.16 178.19 2gpl h ILE 59 N 0.26 1.25 0.19 1.81 1.08 -0.65 -2.52 117.51 118.93 2gpl h ILE 59 Ca 0.07 -0.86 0.00 0.00 -0.39 0.00 0.00 64.86 63.69 2gpl h ILE 59 Cb 0.47 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 34.85 2gpl h ILE 59 CO 0.02 0.32 -0.19 -0.61 -0.69 0.00 0.00 178.15 177.00 2gpl h GLN 60 N 0.87 -0.40 -0.61 2.37 4.15 -0.85 -1.38 115.11 119.26 2gpl h GLN 60 Ca 0.19 0.03 0.12 0.00 0.77 0.00 0.00 58.65 59.76 2gpl h GLN 60 Cb 0.31 0.09 -0.09 0.00 0.21 0.00 0.00 27.48 28.00 2gpl h GLN 60 CO -0.00 -0.26 0.14 0.00 -1.93 0.00 0.00 178.83 176.77 2gpl h ALA 61 N 0.35 0.74 -0.46 3.38 0.00 -1.11 -0.83 119.26 121.32 2gpl h ALA 61 Ca 0.00 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2gpl h ALA 61 Cb 0.39 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2gpl h ALA 61 CO -0.05 -0.30 0.25 -0.91 0.00 0.00 0.00 179.25 178.25 2gpl h ASN 62 N 0.27 0.58 -0.62 0.00 4.21 -1.02 -0.89 115.58 118.11 2gpl h ASN 62 Ca 0.32 -0.09 -0.08 0.00 1.21 0.00 0.00 56.30 57.67 2gpl h ASN 62 Cb 0.48 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 37.51 2gpl h ASN 62 CO -0.41 0.50 0.10 0.40 -1.29 0.00 0.00 177.43 176.74 2gpl h ILE 63 N 0.61 1.26 -0.56 2.81 1.08 -0.60 -1.52 117.51 120.59 2gpl h ILE 63 Ca 0.16 -1.02 -0.02 0.00 -0.39 0.00 0.00 64.86 63.60 2gpl h ILE 63 Cb 0.05 0.66 -0.03 0.00 -3.07 0.00 0.00 36.82 34.44 2gpl h ILE 63 CO -0.03 0.38 0.28 1.56 -0.69 0.00 0.00 178.15 179.65 2gpl h GLN 64 N 0.98 0.80 -0.69 2.37 4.20 -0.93 -0.68 115.11 121.17 2gpl h GLN 64 Ca 0.20 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 2gpl h GLN 64 Cb 0.43 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 2gpl h GLN 64 CO 0.01 0.64 0.42 1.25 -0.67 0.00 0.00 178.83 180.48 2gpl h LEU 65 N 0.76 0.81 -0.31 1.46 5.85 -0.89 -1.71 115.31 121.29 2gpl h LEU 65 Ca 0.19 -0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 2gpl h LEU 65 Cb 0.10 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 2gpl h LEU 65 CO -0.03 0.62 -0.01 0.22 -0.34 0.00 0.00 178.44 178.90 2gpl h TYR 66 N 0.94 0.61 -0.51 1.25 3.20 -0.65 -1.79 116.97 120.02 2gpl h TYR 66 Ca 0.25 -0.11 0.07 0.00 3.14 0.00 0.00 58.73 62.08 2gpl h TYR 66 Cb -0.05 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.01 2gpl h TYR 66 CO 0.00 0.69 0.19 0.77 -1.64 0.00 0.00 178.16 178.18 2gpl h SER 67 N 0.35 0.21 -0.03 -2.11 0.02 -0.53 -1.13 113.55 110.32 2gpl h SER 67 Ca 0.09 0.06 -0.16 0.00 -0.84 0.00 0.00 61.79 60.93 2gpl h SER 67 Cb 0.46 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2gpl h SER 67 CO 0.02 0.14 -0.54 0.40 -1.14 0.00 0.00 176.83 175.71 2gpl h ILE 68 N 0.38 1.31 -0.43 3.27 2.04 -1.24 0.73 117.51 123.56 2gpl h ILE 68 Ca 0.25 -1.77 -0.09 0.00 1.00 0.00 0.00 64.86 64.24 2gpl h ILE 68 Cb 0.26 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 2gpl h ILE 68 CO -0.24 0.56 -0.08 -0.09 0.00 0.00 0.00 178.15 178.29 2gpl h ARG 69 N 0.48 0.82 -0.01 2.37 2.43 -0.99 -3.25 114.38 116.23 2gpl h ARG 69 Ca 0.01 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 2gpl h ARG 69 Cb 1.09 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 2gpl h ARG 69 CO 0.11 0.93 -0.61 0.39 -1.51 0.00 0.00 179.97 179.27 2gpl n GLU 70 N -4.31 0.81 -3.94 0.20 4.71 -0.46 -4.97 120.64 112.68 2gpl n GLU 70 Ca -0.01 -0.65 -0.28 0.00 -0.01 0.00 0.00 57.16 56.21 2gpl n GLU 70 Cb 0.36 -1.49 -0.01 0.00 -1.01 0.00 0.00 31.44 29.29 2gpl n GLU 70 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2gpl n ASP 71 N -0.53 -1.26 -3.51 1.62 4.64 0.25 -4.94 116.55 112.83 2gpl n ASP 71 Ca 0.08 -1.04 -0.13 0.00 -1.38 0.00 0.00 54.79 52.32 2gpl n ASP 71 Cb 0.42 -2.94 -0.04 0.00 -1.04 0.00 0.00 41.12 37.52 2gpl n ASP 71 CO 0.00 0.00 0.00 -0.47 -0.82 0.00 0.00 177.20 175.91 2gpl s TYR 72 N -3.88 -0.47 -0.28 -0.67 5.04 -1.09 -5.05 117.35 110.95 2gpl s TYR 72 Ca 0.11 0.40 -0.05 0.00 -2.44 0.00 0.00 57.07 55.09 2gpl s TYR 72 Cb -0.04 0.44 0.01 0.00 0.35 0.00 0.00 41.96 42.71 2gpl s TYR 72 CO 0.90 -0.74 0.04 -2.00 -1.34 0.00 0.00 175.55 172.40 2gpl s GLU 73 N -3.08 3.08 0.52 4.97 2.12 -1.26 -4.14 118.70 120.91 2gpl s GLU 73 Ca -0.02 -0.85 -0.22 0.00 0.36 0.00 0.00 54.97 54.24 2gpl s GLU 73 Cb -0.00 -3.25 -0.07 0.00 0.26 0.00 0.00 34.13 31.07 2gpl s GLU 73 CO -0.07 -0.40 1.20 1.28 -0.54 0.00 0.00 175.26 176.73 2gpl n LEU 74 N 4.82 4.42 -4.74 2.70 4.77 -1.26 -4.95 117.00 122.75 2gpl n LEU 74 Ca -0.15 0.97 -0.33 0.00 -0.03 0.00 0.00 56.01 56.47 2gpl n LEU 74 Cb 0.48 -1.49 0.08 0.00 -2.33 0.00 0.00 43.42 40.17 2gpl n LEU 74 CO 0.30 -1.02 0.75 -0.94 -1.33 0.00 0.00 177.39 175.15 2gpl s SER 75 N -0.90 4.46 0.36 -1.43 1.04 -1.26 -4.74 113.70 111.23 2gpl s SER 75 Ca 0.69 2.12 0.05 0.00 0.48 0.00 0.00 55.95 59.30 2gpl s SER 75 Cb -0.45 -2.56 0.74 0.00 0.10 0.00 0.00 66.02 63.84 2gpl s SER 75 CO 0.51 -2.07 1.97 -0.65 0.98 0.00 0.00 173.24 173.98 2gpl h PRO 76 N -0.46 0.73 -0.52 4.02 0.11 -1.92 0.82 132.00 134.78 2gpl h PRO 76 Ca -0.46 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 2gpl h PRO 76 Cb 1.26 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2gpl h PRO 76 CO 0.51 0.49 0.19 0.37 -0.21 0.00 0.00 178.00 179.35 2gpl h GLN 77 N 0.76 0.79 -0.29 1.05 -0.00 -1.99 -0.05 115.11 115.38 2gpl h GLN 77 Ca 0.29 -0.15 -0.03 0.00 -0.00 0.00 0.00 58.65 58.76 2gpl h GLN 77 Cb 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 27.48 27.54 2gpl h GLN 77 CO -0.09 0.70 0.08 0.00 0.00 0.00 0.00 178.83 179.52 2gpl h ALA 78 N 1.04 0.38 -0.91 3.38 0.00 -1.53 -1.63 119.26 119.99 2gpl h ALA 78 Ca 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2gpl h ALA 78 Cb 0.22 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2gpl h ALA 78 CO -0.01 0.03 0.52 0.28 0.00 0.00 0.00 179.25 180.07 2gpl h VAL 79 N 0.31 1.26 -0.09 0.00 2.07 -0.64 -1.44 116.25 117.71 2gpl h VAL 79 Ca 0.09 -0.61 -0.12 0.00 0.82 0.00 0.00 66.70 66.87 2gpl h VAL 79 Cb 0.27 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 2gpl h VAL 79 CO -0.00 0.28 -0.50 0.77 0.02 0.00 0.00 177.57 178.14 2gpl h SER 80 N 1.27 0.25 -0.45 0.57 4.64 -0.82 -1.81 113.55 117.21 2gpl h SER 80 Ca 0.32 -0.12 -0.14 0.00 -0.47 0.00 0.00 61.79 61.38 2gpl h SER 80 Cb -0.00 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 2gpl h SER 80 CO -0.06 0.71 -0.27 0.28 -0.87 0.00 0.00 176.83 176.63 2gpl h SER 81 N 0.19 1.02 -0.45 4.97 0.02 -0.82 0.97 113.55 119.45 2gpl h SER 81 Ca 0.01 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.54 2gpl h SER 81 Cb 0.95 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 63.19 2gpl h SER 81 CO 0.08 1.21 0.25 0.15 -1.14 0.00 0.00 176.83 177.38 2gpl h PHE 82 N 0.83 0.61 -0.49 3.45 3.04 -1.07 -1.50 116.94 121.82 2gpl h PHE 82 Ca 0.09 -0.01 -0.11 0.00 3.98 0.00 0.00 57.97 61.93 2gpl h PHE 82 Cb 0.86 -0.20 -0.02 0.00 2.56 0.00 0.00 35.95 39.15 2gpl h PHE 82 CO 0.06 0.46 -0.12 0.28 -2.02 0.00 0.00 178.31 176.97 2gpl h VAL 83 N 0.59 1.26 -0.08 1.41 2.07 -1.11 -2.22 116.25 118.18 2gpl h VAL 83 Ca 0.16 -1.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 2gpl h VAL 83 Cb 0.05 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2gpl h VAL 83 CO -0.03 0.43 0.05 -0.09 0.02 0.00 0.00 177.57 177.95 2gpl h ARG 84 N 0.81 0.11 -0.80 1.57 2.43 -0.47 -2.34 114.38 115.68 2gpl h ARG 84 Ca 0.13 -0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.38 2gpl h ARG 84 Cb 0.64 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.10 2gpl h ARG 84 CO 0.04 0.13 0.45 0.37 -1.51 0.00 0.00 179.97 179.46 2gpl h GLN 85 N 0.06 0.75 -0.35 0.20 4.15 -1.17 -0.25 115.11 118.49 2gpl h GLN 85 Ca 0.03 -0.04 0.04 0.00 0.77 0.00 0.00 58.65 59.44 2gpl h GLN 85 Cb 0.05 -0.17 -0.04 0.00 0.21 0.00 0.00 27.48 27.53 2gpl h GLN 85 CO -0.01 0.49 0.12 0.93 -1.93 0.00 0.00 178.83 178.44 2gpl h GLU 86 N 0.77 0.27 -0.44 1.69 4.39 -1.02 -1.96 114.58 118.28 2gpl h GLU 86 Ca 0.38 -0.02 -0.10 0.00 0.34 0.00 0.00 59.36 59.97 2gpl h GLU 86 Cb 0.34 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 2gpl h GLU 86 CO -0.24 0.18 -0.13 -0.07 -1.16 0.00 0.00 179.01 177.59 2gpl h LEU 87 N 0.27 0.80 -1.80 1.33 3.38 -0.82 -1.98 115.31 116.49 2gpl h LEU 87 Ca 0.16 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2gpl h LEU 87 Cb 0.13 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 2gpl h LEU 87 CO -0.16 0.94 -0.15 0.00 0.09 0.00 0.00 178.44 179.16 2gpl h ALA 88 N 1.13 1.36 0.02 1.53 0.00 -0.68 -0.21 119.26 122.41 2gpl h ALA 88 Ca 0.12 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2gpl h ALA 88 Cb 0.62 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2gpl h ALA 88 CO 0.04 0.19 -0.01 0.87 0.00 0.00 0.00 179.25 180.34 2gpl h LYS 89 N 0.00 -0.03 -0.98 0.00 1.57 -0.94 -3.30 116.57 112.90 2gpl h LYS 89 Ca -0.00 0.00 0.18 0.00 -1.87 0.00 0.00 60.65 58.96 2gpl h LYS 89 Cb 0.36 0.01 -0.11 0.00 0.08 0.00 0.00 32.23 32.57 2gpl h LYS 89 CO 0.02 0.65 0.58 1.03 -0.57 0.00 0.00 179.45 181.17 2gpl h SER 90 N -0.76 0.74 -0.25 0.86 0.87 -0.76 -2.05 113.55 112.20 2gpl h SER 90 Ca -0.00 0.10 0.04 0.00 -1.23 0.00 0.00 61.79 60.69 2gpl h SER 90 Cb 0.70 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 2gpl h SER 90 CO 0.01 0.27 0.17 -0.29 -0.53 0.00 0.00 176.83 176.45 2gpl h ILE 90 N 0.74 0.97 -0.47 2.23 -0.00 -1.13 -2.16 117.51 117.70 2gpl h ILE 90 Ca 0.56 -0.06 0.00 0.00 -0.00 0.00 0.00 64.86 65.36 2gpl h ILE 90 Cb 0.86 0.78 0.00 0.00 -0.00 0.00 0.00 36.82 38.46 2gpl h ILE 90 CO -0.38 0.03 0.00 0.54 -0.00 0.00 0.00 178.15 178.34 2gpl n ARG 90 N -4.49 3.56 -2.65 2.19 1.74 -0.78 -4.84 116.66 111.38 2gpl n ARG 90 Ca 0.02 -2.79 -0.22 0.00 -0.77 0.00 0.00 57.85 54.08 2gpl n ARG 90 Cb 0.20 -1.85 0.11 0.00 -1.02 0.00 0.00 32.46 29.90 2gpl n ARG 90 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2gpl n SER 91 N 0.43 1.52 0.15 0.55 3.41 -0.81 -5.03 113.62 113.84 2gpl n SER 91 Ca 0.23 -2.23 -0.13 0.00 -0.26 0.00 0.00 58.87 56.48 2gpl n SER 91 Cb 0.87 -0.60 -0.06 0.00 -0.26 0.00 0.00 64.21 64.16 2gpl n SER 91 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2gpl h ARG 92 N 0.00 -0.46 -3.02 4.33 2.43 -1.94 -3.37 114.38 112.36 2gpl h ARG 92 Ca -0.32 0.03 -0.60 0.00 -0.81 0.00 0.00 59.98 58.29 2gpl h ARG 92 Cb 1.23 0.10 -0.40 0.00 -0.42 0.00 0.00 29.97 30.48 2gpl h ARG 92 CO 0.36 -0.31 -0.77 0.50 -1.51 0.00 0.00 179.97 178.25 2gpl s ARG 93 N -6.08 0.98 0.69 0.20 3.52 -1.26 -5.13 118.95 111.86 2gpl s ARG 93 Ca -0.16 -1.62 -0.17 0.00 -0.13 0.00 0.00 55.73 53.65 2gpl s ARG 93 Cb 0.07 -2.01 -0.00 0.00 -1.56 0.00 0.00 34.95 31.45 2gpl s ARG 93 CO 0.65 -1.13 1.09 -2.30 -0.81 0.00 0.00 175.30 172.79 2gpl n PRO 94 N 3.97 0.72 -2.61 5.12 -0.02 -1.25 -4.96 135.00 135.98 2gpl n PRO 94 Ca 0.07 0.30 -0.43 0.00 -2.02 0.00 0.00 63.50 61.42 2gpl n PRO 94 Cb 0.37 -2.33 -0.02 0.00 -0.02 0.00 0.00 33.50 31.50 2gpl n PRO 94 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2gpl s TYR 95 N -1.66 3.27 -1.14 6.00 2.02 -1.26 -4.95 117.35 119.62 2gpl s TYR 95 Ca 0.77 1.39 -0.08 0.00 -0.37 0.00 0.00 57.07 58.77 2gpl s TYR 95 Cb -0.36 -3.31 0.26 0.00 -0.40 0.00 0.00 41.96 38.14 2gpl s TYR 95 CO 0.46 -0.72 1.37 1.04 -1.57 0.00 0.00 175.55 176.14 2gpl n GLN 96 N 6.09 3.79 -4.30 -0.62 6.02 -1.26 -4.84 117.38 122.27 2gpl n GLN 96 Ca 0.12 -4.28 -0.19 0.00 -0.01 0.00 0.00 57.00 52.64 2gpl n GLN 96 Cb 0.46 -2.67 -0.15 0.00 1.02 0.00 0.00 30.24 28.90 2gpl n GLN 96 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2gpl s VAL 97 N -1.04 0.66 0.00 5.09 1.01 -1.26 -0.47 120.40 124.39 2gpl s VAL 97 Ca 0.34 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 62.08 2gpl s VAL 97 Cb -0.02 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 2gpl s VAL 97 CO -0.00 0.22 -0.11 0.20 0.00 0.00 0.00 175.10 175.41 2gpl s ASN 98 N 0.32 4.34 0.05 3.32 0.01 0.53 -2.55 114.94 120.96 2gpl s ASN 98 Ca -0.05 -0.21 -0.00 0.00 -0.71 0.00 0.00 52.86 51.89 2gpl s ASN 98 Cb -0.09 -0.94 -0.04 0.00 0.41 0.00 0.00 41.25 40.60 2gpl s ASN 98 CO 0.00 0.29 -0.04 0.68 -1.51 0.00 0.00 177.10 176.53 2gpl s VAL 99 N -0.93 0.27 -0.09 1.60 -7.23 0.13 -1.28 120.40 112.87 2gpl s VAL 99 Ca 0.15 -1.64 0.03 0.00 -1.81 0.00 0.00 61.98 58.72 2gpl s VAL 99 Cb -0.11 -1.28 0.00 0.00 0.56 0.00 0.00 36.38 35.55 2gpl s VAL 99 CO 0.06 -0.87 -0.20 -0.76 -0.31 0.00 0.00 175.10 173.01 2gpl s LEU 100 N -2.63 1.95 -0.21 1.32 1.43 -0.60 -1.38 118.68 118.55 2gpl s LEU 100 Ca 0.03 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 2gpl s LEU 100 Cb 0.04 -1.23 0.02 0.00 0.03 0.00 0.00 46.19 45.05 2gpl s LEU 100 CO -0.07 0.12 -0.14 -0.63 0.23 0.00 0.00 176.35 175.85 2gpl s ILE 101 N 0.47 2.39 -0.14 -0.59 1.01 0.94 -0.94 121.20 124.34 2gpl s ILE 101 Ca -0.17 -1.02 -0.01 0.00 0.00 0.00 0.00 60.65 59.45 2gpl s ILE 101 Cb -0.17 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.16 2gpl s ILE 101 CO 0.07 0.36 -0.12 -0.83 0.00 0.00 0.00 174.94 174.42 2gpl s GLY 102 N 1.29 1.54 0.07 6.18 0.00 0.11 -0.17 107.32 116.34 2gpl s GLY 102 Ca 0.02 -0.93 -0.15 0.00 0.00 0.00 0.00 44.72 43.66 2gpl s GLY 102 CO -0.09 -0.10 0.34 -0.32 0.00 0.00 0.00 173.10 172.93 2gpl s GLY 103 N 0.51 -0.17 -0.27 0.20 0.00 -0.33 0.58 107.32 107.85 2gpl s GLY 103 Ca -0.08 -0.03 -0.07 0.00 0.00 0.00 0.00 44.72 44.54 2gpl s GLY 103 CO 0.04 -0.26 0.06 -0.47 0.00 0.00 0.00 173.10 172.47 2gpl s TYR 104 N -3.05 3.10 0.00 1.90 6.14 -0.25 0.01 117.35 125.21 2gpl s TYR 104 Ca -0.02 -0.79 0.00 0.00 0.64 0.00 0.00 57.07 56.91 2gpl s TYR 104 Cb 0.01 -2.23 0.00 0.00 0.42 0.00 0.00 41.96 40.16 2gpl s TYR 104 CO -0.06 -0.50 0.00 -3.47 0.64 0.00 0.00 175.55 172.15 2gpl n ASP 105 N 4.88 0.00 0.00 4.32 4.64 -0.51 -4.88 116.55 125.00 2gpl n ASP 105 Ca -0.16 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.25 2gpl n ASP 105 Cb 0.49 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.57 2gpl n ASP 105 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2gpl n LYS 10 N 0.00 0.00 -3.42 -0.67 5.02 -1.26 -2.93 118.16 114.91 2gpl n LYS 10 Ca 0.00 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.10 2gpl n LYS 10 Cb 0.00 -2.21 0.06 0.00 -0.02 0.00 0.00 35.03 32.86 2gpl n LYS 10 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2gpl n ASN 106 N 0.00 -4.81 -3.70 4.39 3.02 -1.26 -5.03 115.26 107.87 2gpl n ASN 106 Ca 0.00 -0.76 -0.14 0.00 -0.03 0.00 0.00 54.58 53.65 2gpl n ASN 106 Cb 0.00 -4.74 -0.09 0.00 -0.61 0.00 0.00 39.78 34.35 2gpl n ASN 106 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2gpl s LYS 107 N -5.06 0.66 0.44 3.52 1.02 -1.15 -5.09 119.74 114.09 2gpl s LYS 107 Ca 0.31 0.28 -0.14 0.00 0.02 0.00 0.00 55.97 56.44 2gpl s LYS 107 Cb -0.06 0.31 -0.07 0.00 -0.52 0.00 0.00 37.83 37.48 2gpl s LYS 107 CO 0.77 -0.15 0.86 -1.25 -0.92 0.00 0.00 175.35 174.67 2gpl s PRO 108 N -0.54 3.89 -0.03 -1.68 0.04 -1.26 -1.42 135.00 133.99 2gpl s PRO 108 Ca -0.07 0.72 -0.02 0.00 0.04 0.00 0.00 61.00 61.67 2gpl s PRO 108 Cb -0.03 -2.28 0.01 0.00 0.04 0.00 0.00 34.50 32.24 2gpl s PRO 108 CO 0.03 -0.11 0.08 -1.21 0.04 0.00 0.00 177.00 175.83 2gpl s GLU 109 N -3.82 0.08 -0.11 4.56 2.02 0.10 -4.91 118.70 116.62 2gpl s GLU 109 Ca 0.55 0.13 0.03 0.00 0.02 0.00 0.00 54.97 55.70 2gpl s GLU 109 Cb -0.10 0.01 0.01 0.00 0.10 0.00 0.00 34.13 34.15 2gpl s GLU 109 CO 0.29 -0.03 -0.20 -1.17 0.02 0.00 0.00 175.26 174.17 2gpl s LEU 110 N 0.19 1.95 -0.06 1.80 2.96 -1.26 -1.18 118.68 123.07 2gpl s LEU 110 Ca -0.01 -0.51 0.05 0.00 -0.22 0.00 0.00 54.13 53.44 2gpl s LEU 110 Cb -0.02 -1.27 -0.00 0.00 0.50 0.00 0.00 46.19 45.40 2gpl s LEU 110 CO -0.01 0.09 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.59 2gpl s TYR 111 N 0.68 2.11 -0.16 5.38 2.02 0.77 -2.19 117.35 125.96 2gpl s TYR 111 Ca -0.12 -0.68 -0.03 0.00 -0.37 0.00 0.00 57.07 55.88 2gpl s TYR 111 Cb -0.16 -1.41 -0.02 0.00 -0.40 0.00 0.00 41.96 39.97 2gpl s TYR 111 CO 0.03 -0.24 -0.07 -1.14 -1.57 0.00 0.00 175.55 172.56 2gpl s GLN 112 N 0.05 3.51 -0.04 -0.62 0.74 -0.53 -0.04 119.66 122.73 2gpl s GLN 112 Ca -0.07 -0.60 -0.01 0.00 0.05 0.00 0.00 55.36 54.73 2gpl s GLN 112 Cb -0.14 -2.85 0.03 0.00 1.10 0.00 0.00 33.01 31.15 2gpl s GLN 112 CO 0.04 0.12 0.03 0.42 -0.55 0.00 0.00 175.29 175.36 2gpl s ILE 113 N 0.64 0.05 0.60 -2.34 1.01 -0.48 -1.67 121.20 119.01 2gpl s ILE 113 Ca -0.04 0.27 -0.01 0.00 0.00 0.00 0.00 60.65 60.87 2gpl s ILE 113 Cb -0.15 -0.24 0.05 0.00 0.01 0.00 0.00 42.46 42.14 2gpl s ILE 113 CO 0.03 0.17 0.85 1.51 0.00 0.00 0.00 174.94 177.50 2gpl s ASP 114 N 1.72 5.06 0.26 3.58 3.84 -0.64 -0.69 116.67 129.80 2gpl s ASP 114 Ca -0.00 0.03 0.18 0.00 -0.00 0.00 0.00 52.55 52.76 2gpl s ASP 114 Cb -0.13 -0.80 0.96 0.00 -1.38 0.00 0.00 42.92 41.57 2gpl s ASP 114 CO -0.03 -1.33 1.55 0.00 -0.00 0.00 0.00 175.17 175.36 2gpl n TYR 115 N -2.52 0.61 0.91 2.11 0.18 -1.06 -0.79 117.16 116.61 2gpl n TYR 115 Ca 0.09 0.31 0.13 0.00 1.88 0.00 0.00 57.90 60.31 2gpl n TYR 115 Cb 0.60 -1.00 0.48 0.00 -0.38 0.00 0.00 39.34 39.04 2gpl n TYR 115 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 2gpl n LEU 116 N -2.12 0.27 0.00 -3.48 4.77 -1.26 -4.55 117.00 110.63 2gpl n LEU 116 Ca -0.01 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 2gpl n LEU 116 Cb 0.04 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 2gpl n LEU 116 CO 0.09 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.75 2gpl n GLY 117 N 1.46 1.14 3.59 -0.72 0.00 0.03 -4.33 105.19 106.36 2gpl n GLY 117 Ca 0.06 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 2gpl n GLY 117 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gpl s THR 118 N -2.00 4.85 0.07 2.61 2.01 -1.24 -4.81 115.64 117.14 2gpl s THR 118 Ca 0.00 0.79 0.08 0.00 0.31 0.00 0.00 61.69 62.87 2gpl s THR 118 Cb 0.00 -4.10 -0.03 0.00 0.01 0.00 0.00 72.50 68.38 2gpl s THR 118 CO 0.00 -0.29 -0.20 -0.75 -0.69 0.00 0.00 174.62 172.69 2gpl s LYS 119 N 2.80 1.88 -0.04 4.92 2.20 -1.26 -1.63 119.74 128.62 2gpl s LYS 119 Ca 0.27 -1.09 -0.25 0.00 -0.36 0.00 0.00 55.97 54.53 2gpl s LYS 119 Cb -0.14 -2.11 0.05 0.00 -1.51 0.00 0.00 37.83 34.12 2gpl s LYS 119 CO 0.14 0.51 0.55 0.54 -0.36 0.00 0.00 175.35 176.74 2gpl s VAL 120 N -0.98 0.02 -0.13 4.02 0.11 -0.67 -5.01 120.40 117.76 2gpl s VAL 120 Ca 0.15 -0.16 -0.06 0.00 -2.93 0.00 0.00 61.98 58.98 2gpl s VAL 120 Cb -0.10 -0.87 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 2gpl s VAL 120 CO 0.06 -0.09 0.10 -0.70 -3.33 0.00 0.00 175.10 171.14 2gpl s GLU 121 N -1.25 3.47 0.10 1.54 2.12 -1.26 -1.46 118.70 121.96 2gpl s GLU 121 Ca -0.12 -0.23 -0.05 0.00 0.36 0.00 0.00 54.97 54.93 2gpl s GLU 121 Cb -0.02 -3.12 -0.02 0.00 0.26 0.00 0.00 34.13 31.23 2gpl s GLU 121 CO 0.08 0.66 0.12 -0.51 -0.54 0.00 0.00 175.26 175.07 2gpl s LEU 122 N -0.70 1.71 0.22 2.70 1.43 -0.93 -5.00 118.68 118.11 2gpl s LEU 122 Ca 0.13 -0.88 0.04 0.00 -1.03 0.00 0.00 54.13 52.39 2gpl s LEU 122 Cb -0.12 0.70 0.19 0.00 0.03 0.00 0.00 46.19 46.99 2gpl s LEU 122 CO 0.03 -0.72 1.51 -0.65 0.23 0.00 0.00 176.35 176.75 2gpl h PRO 123 N 2.85 0.21 -1.99 1.29 0.11 -1.90 -3.38 132.00 129.19 2gpl h PRO 123 Ca -0.34 -0.16 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 2gpl h PRO 123 Cb 1.19 0.03 -0.19 0.00 0.11 0.00 0.00 31.00 32.14 2gpl h PRO 123 CO 0.58 0.81 0.25 1.52 -0.21 0.00 0.00 178.00 180.95 2gpl s TYR 124 N -3.60 -0.60 0.32 0.65 1.13 -1.26 0.13 117.35 114.11 2gpl s TYR 124 Ca -0.03 1.00 -0.17 0.00 -1.41 0.00 0.00 57.07 56.46 2gpl s TYR 124 Cb 0.11 0.43 0.03 0.00 -1.10 0.00 0.00 41.96 41.43 2gpl s TYR 124 CO 0.80 -0.58 0.70 0.20 -2.51 0.00 0.00 175.55 174.16 2gpl s GLY 125 N -1.27 0.26 0.37 5.49 0.00 -0.44 -5.00 107.32 106.72 2gpl s GLY 125 Ca -0.09 -0.62 -0.09 0.00 0.00 0.00 0.00 44.72 43.93 2gpl s GLY 125 CO 0.07 -0.30 0.63 0.00 0.00 0.00 0.00 173.10 173.51 2gpl s ALA 126 N -3.31 0.04 0.02 3.20 0.00 -1.26 -1.53 121.76 118.92 2gpl s ALA 126 Ca 0.15 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 50.98 2gpl s ALA 126 Cb -0.05 0.92 -0.01 0.00 0.00 0.00 0.00 23.12 23.98 2gpl s ALA 126 CO 0.10 -0.89 -0.07 -1.01 0.00 0.00 0.00 175.76 173.89 2gpl s HIS 127 N -2.65 0.57 0.00 0.00 3.76 -1.12 -4.86 115.29 110.99 2gpl s HIS 127 Ca 0.23 -0.29 0.00 0.00 -0.15 0.00 0.00 55.06 54.85 2gpl s HIS 127 Cb -0.03 -0.35 0.00 0.00 1.11 0.00 0.00 32.58 33.31 2gpl s HIS 127 CO 0.16 -0.04 0.00 0.41 -0.85 0.00 0.00 174.74 174.42 2gpl n GLY 128 N 2.23 0.33 0.15 -2.22 0.00 -1.26 -3.61 105.19 100.82 2gpl n GLY 128 Ca -0.18 -0.93 0.12 0.00 0.00 0.00 0.00 46.02 45.04 2gpl n GLY 128 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2gpl h TYR 129 N 0.00 0.00 -0.80 1.61 0.05 -1.93 -3.37 116.97 112.53 2gpl h TYR 129 Ca 0.00 0.00 0.18 0.00 0.05 0.00 0.00 58.73 58.96 2gpl h TYR 129 Cb 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 36.73 37.60 2gpl h TYR 129 CO 0.00 0.00 -0.02 0.77 -1.05 0.00 0.00 178.16 177.86 2gpl h SER 130 N 0.00 -0.42 -0.73 3.88 0.02 -1.89 0.17 113.55 114.58 2gpl h SER 130 Ca 0.00 0.21 0.08 0.00 -0.84 0.00 0.00 61.79 61.24 2gpl h SER 130 Cb 0.94 0.39 -0.05 0.00 0.14 0.00 0.00 62.40 63.82 2gpl h SER 130 CO 0.00 -0.21 0.48 1.23 -1.14 0.00 0.00 176.83 177.18 2gpl h GLY 131 N 0.08 0.94 1.62 -3.77 0.00 -1.80 -1.88 103.07 98.25 2gpl h GLY 131 Ca 0.43 -0.29 0.05 0.00 0.00 0.00 0.00 47.33 47.53 2gpl h GLY 131 CO -0.73 0.20 0.14 0.74 0.00 0.00 0.00 176.54 176.89 2gpl h PHE 132 N 0.71 0.00 0.00 5.60 0.04 -0.92 -0.64 116.94 121.74 2gpl h PHE 132 Ca 0.32 0.00 -0.38 0.00 2.80 0.00 0.00 57.97 60.71 2gpl h PHE 132 Cb 0.34 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.42 2gpl h PHE 132 CO -0.00 0.00 -2.42 0.66 -0.60 0.00 0.00 178.31 175.95 2gpl n TYR 133 N -4.42 0.03 -0.00 -0.55 4.01 -0.83 -4.69 117.16 110.71 2gpl n TYR 133 Ca 0.02 0.01 -0.01 0.00 -0.16 0.00 0.00 57.90 57.75 2gpl n TYR 133 Cb 0.28 -1.00 -0.11 0.00 -0.31 0.00 0.00 39.34 38.19 2gpl n TYR 133 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2gpl n THR 134 N -3.03 1.09 0.29 -0.72 -2.24 -0.77 -4.42 114.28 104.49 2gpl n THR 134 Ca -0.40 -0.71 0.15 0.00 -2.27 0.00 0.00 64.05 60.83 2gpl n THR 134 Cb 1.07 -0.60 0.89 0.00 -2.10 0.00 0.00 70.33 69.58 2gpl n THR 134 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2gpl h PHE 135 N 0.00 0.00 0.01 4.78 0.04 -1.33 -1.27 116.94 119.17 2gpl h PHE 135 Ca -0.23 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.35 2gpl h PHE 135 Cb 1.66 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.79 2gpl h PHE 135 CO 0.00 0.03 -0.89 0.66 -0.60 0.00 0.00 178.31 177.51 2gpl h SER 136 N 0.00 0.11 -0.07 2.17 4.64 -1.80 -0.94 113.55 117.65 2gpl h SER 136 Ca -0.00 -0.09 -0.05 0.00 -0.47 0.00 0.00 61.79 61.18 2gpl h SER 136 Cb 0.08 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2gpl h SER 136 CO 0.00 0.94 -0.13 -0.07 -0.87 0.00 0.00 176.83 176.70 2gpl h LEU 137 N 0.04 0.24 -0.50 5.97 3.38 -1.51 -2.94 115.31 119.99 2gpl h LEU 137 Ca -0.03 -0.56 -0.06 0.00 0.09 0.00 0.00 57.88 57.33 2gpl h LEU 137 Cb 1.55 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 42.21 2gpl h LEU 137 CO 0.12 0.75 0.09 -0.07 0.09 0.00 0.00 178.44 179.43 2gpl h LEU 138 N -0.26 0.79 -2.00 1.67 3.38 -1.34 -0.19 115.31 117.36 2gpl h LEU 138 Ca 0.00 -0.25 0.16 0.00 0.09 0.00 0.00 57.88 57.88 2gpl h LEU 138 Cb 0.71 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2gpl h LEU 138 CO 0.03 0.84 0.40 0.44 0.09 0.00 0.00 178.44 180.24 2gpl h ASP 139 N 0.70 0.00 0.00 -0.43 3.32 -1.21 -0.31 116.42 118.49 2gpl h ASP 139 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2gpl h ASP 139 Cb 0.38 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2gpl h ASP 139 CO 0.01 0.00 -0.12 -0.74 -1.72 0.00 0.00 179.24 176.67 2gpl h HIS 140 N 0.00 0.00 -0.00 4.55 2.76 -1.14 -3.40 115.15 117.92 2gpl h HIS 140 Ca 0.26 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.43 2gpl h HIS 140 Cb 1.05 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.01 2gpl h HIS 140 CO -0.00 0.00 -0.06 0.72 -1.30 0.00 0.00 177.93 177.29 2gpl n HIS 141 N -3.74 0.00 -2.38 5.26 8.25 -0.17 -4.93 115.22 117.51 2gpl n HIS 141 Ca -0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.03 2gpl n HIS 141 Cb 0.06 -0.23 -0.03 0.00 1.12 0.00 0.00 29.99 30.90 2gpl n HIS 141 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2gpl s TYR 142 N -2.53 3.44 -0.02 4.41 5.04 -0.13 -5.03 117.35 122.52 2gpl s TYR 142 Ca 0.29 1.46 0.00 0.00 -2.44 0.00 0.00 57.07 56.38 2gpl s TYR 142 Cb 0.20 -3.42 0.02 0.00 0.35 0.00 0.00 41.96 39.12 2gpl s TYR 142 CO 0.47 -1.13 0.01 1.03 -1.34 0.00 0.00 175.55 174.59 2gpl s ARG 143 N -0.46 0.13 0.58 4.97 1.81 -1.26 -5.01 118.95 119.71 2gpl s ARG 143 Ca 0.51 0.10 0.28 0.00 -1.72 0.00 0.00 55.73 54.90 2gpl s ARG 143 Cb -0.33 -0.32 1.57 0.00 -0.45 0.00 0.00 34.95 35.42 2gpl s ARG 143 CO 0.38 -0.12 2.04 -1.35 -0.68 0.00 0.00 175.30 175.57 2gpl h PRO 144 N 7.05 0.00 -0.57 3.54 0.11 -1.96 -2.13 132.00 138.04 2gpl h PRO 144 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2gpl h PRO 144 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2gpl h PRO 144 CO 0.48 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.87 2gpl n ASP 145 N -3.88 3.32 -4.60 -2.05 3.85 -1.26 -3.21 116.55 108.72 2gpl n ASP 145 Ca 0.04 -1.98 -0.38 0.00 -0.71 0.00 0.00 54.79 51.76 2gpl n ASP 145 Cb 0.44 -0.38 0.05 0.00 -1.35 0.00 0.00 41.12 39.88 2gpl n ASP 145 CO 0.00 0.00 0.00 0.23 -1.01 0.00 0.00 177.20 176.42 2gpl n MET 146 N 1.33 0.83 -3.02 0.11 2.81 -0.80 -4.60 117.12 113.78 2gpl n MET 146 Ca 0.21 0.33 -0.24 0.00 -1.81 0.00 0.00 57.70 56.18 2gpl n MET 146 Cb 0.54 -2.11 0.00 0.00 -0.71 0.00 0.00 33.22 30.94 2gpl n MET 146 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2gpl s THR 147 N -1.54 4.49 0.50 2.03 -4.23 -1.26 -1.46 115.64 114.17 2gpl s THR 147 Ca 0.75 -0.34 0.24 0.00 -1.18 0.00 0.00 61.69 61.16 2gpl s THR 147 Cb -0.42 -3.67 0.40 0.00 1.34 0.00 0.00 72.50 70.16 2gpl s THR 147 CO 0.48 -0.50 1.95 0.74 -0.54 0.00 0.00 174.62 176.75 2gpl h THR 148 N 0.45 0.71 -0.26 3.99 2.02 -1.96 0.12 112.91 117.99 2gpl h THR 148 Ca -0.47 -0.04 -0.19 0.00 0.77 0.00 0.00 66.41 66.47 2gpl h THR 148 Cb 1.23 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 2gpl h THR 148 CO 0.60 0.02 -0.60 -0.08 0.37 0.00 0.00 175.52 175.83 2gpl h GLU 149 N 0.12 0.86 -0.43 6.66 4.57 -1.99 -1.52 114.58 122.85 2gpl h GLU 149 Ca 0.32 -0.58 -0.13 0.00 -1.18 0.00 0.00 59.36 57.80 2gpl h GLU 149 Cb 1.11 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.77 2gpl h GLU 149 CO -0.04 1.21 -0.23 0.93 -1.18 0.00 0.00 179.01 179.70 2gpl h GLU 150 N 0.64 0.88 -0.23 1.92 5.08 -1.29 -2.71 114.58 118.86 2gpl h GLU 150 Ca -0.00 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 57.98 2gpl h GLU 150 Cb 1.22 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2gpl h GLU 150 CO 0.13 1.02 0.11 0.78 -1.00 0.00 0.00 179.01 180.05 2gpl h GLY 151 N 0.92 0.36 2.00 -3.84 0.00 -0.81 -1.09 103.07 100.62 2gpl h GLY 151 Ca 0.10 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 2gpl h GLY 151 CO 0.06 0.17 -0.01 1.41 0.00 0.00 0.00 176.54 178.17 2gpl h LEU 152 N 0.25 0.00 0.11 3.11 3.38 -1.17 -0.62 115.31 120.38 2gpl h LEU 152 Ca 0.08 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.76 2gpl h LEU 152 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2gpl h LEU 152 CO -0.01 0.01 -1.45 0.44 0.09 0.00 0.00 178.44 177.52 2gpl h ASP 153 N 0.00 0.37 -0.32 -0.43 3.45 -1.05 -2.69 116.42 115.76 2gpl h ASP 153 Ca -0.00 -0.49 -0.10 0.00 0.43 0.00 0.00 57.03 56.87 2gpl h ASP 153 Cb 0.04 -0.12 -0.02 0.00 -0.56 0.00 0.00 39.33 38.67 2gpl h ASP 153 CO 0.00 1.40 -0.16 0.25 -1.57 0.00 0.00 179.24 179.16 2gpl h LEU 154 N 0.07 0.77 0.24 1.55 5.85 -0.05 -2.09 115.31 121.64 2gpl h LEU 154 Ca -0.21 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.25 2gpl h LEU 154 Cb 2.00 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.82 2gpl h LEU 154 CO 0.17 0.93 -0.11 -0.07 -0.34 0.00 0.00 178.44 179.01 2gpl h LEU 155 N 0.69 -0.27 -0.88 2.25 3.38 -1.22 -1.53 115.31 117.72 2gpl h LEU 155 Ca 0.11 -0.15 0.23 0.00 0.09 0.00 0.00 57.88 58.16 2gpl h LEU 155 Cb 0.65 0.07 -0.13 0.00 0.09 0.00 0.00 40.66 41.33 2gpl h LEU 155 CO 0.05 -0.01 0.30 0.50 0.09 0.00 0.00 178.44 179.37 2gpl h LYS 156 N -0.54 0.27 -0.17 1.13 3.64 -1.32 0.59 116.57 120.16 2gpl h LYS 156 Ca -0.03 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2gpl h LYS 156 Cb 0.40 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2gpl h LYS 156 CO 0.05 0.18 0.10 1.25 -2.27 0.00 0.00 179.45 178.77 2gpl h LEU 157 N 0.28 0.20 -0.10 5.20 5.85 -1.07 -0.85 115.31 124.83 2gpl h LEU 157 Ca 0.55 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 59.25 2gpl h LEU 157 Cb 1.09 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 2gpl h LEU 157 CO -0.60 0.19 -0.05 0.00 -0.34 0.00 0.00 178.44 177.64 2gpl h VAL 159 N -0.04 1.06 -0.26 0.00 2.07 0.07 -1.51 116.25 117.64 2gpl h VAL 159 Ca 0.06 -0.14 -0.17 0.00 0.82 0.00 0.00 66.70 67.27 2gpl h VAL 159 Cb 0.13 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2gpl h VAL 159 CO -0.13 0.06 -0.48 1.56 0.02 0.00 0.00 177.57 178.59 2gpl h GLN 160 N 0.24 0.78 -0.71 1.57 4.20 -0.56 -0.72 115.11 119.92 2gpl h GLN 160 Ca 0.06 -0.50 -0.03 0.00 0.06 0.00 0.00 58.65 58.25 2gpl h GLN 160 Cb 0.01 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 2gpl h GLN 160 CO -0.01 1.13 0.32 1.49 -0.67 0.00 0.00 178.83 181.09 2gpl h GLU 161 N 0.53 1.01 -0.44 1.46 4.57 -0.78 -1.32 114.58 119.62 2gpl h GLU 161 Ca 0.01 -0.15 -0.07 0.00 -1.18 0.00 0.00 59.36 57.98 2gpl h GLU 161 Cb 1.09 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.48 2gpl h GLU 161 CO 0.11 0.79 0.00 -0.07 -1.18 0.00 0.00 179.01 178.67 2gpl h LEU 162 N 1.01 0.76 -1.67 1.64 3.38 -1.09 -1.53 115.31 117.81 2gpl h LEU 162 Ca 0.24 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2gpl h LEU 162 Cb 0.13 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2gpl h LEU 162 CO -0.03 0.88 -0.08 -0.33 0.09 0.00 0.00 178.44 178.97 2gpl h GLU 163 N 0.62 0.00 0.00 1.13 5.08 -0.63 -1.52 114.58 119.26 2gpl h GLU 163 Ca 0.13 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 2gpl h GLU 163 Cb 0.49 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 2gpl h GLU 163 CO 0.02 0.08 -0.23 -0.22 -1.00 0.00 0.00 179.01 177.66 2gpl h LYS 164 N 0.00 0.00 0.00 2.33 3.64 -0.83 -3.41 116.57 118.29 2gpl h LYS 164 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2gpl h LYS 164 Cb 0.47 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2gpl h LYS 164 CO 0.01 0.57 -0.97 0.00 -2.27 0.00 0.00 179.45 176.78 2gpl h ARG 165 N -1.00 0.00 -6.41 1.90 2.47 -1.33 -3.47 114.38 106.53 2gpl h ARG 165 Ca -0.05 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.14 2gpl h ARG 165 Cb 0.66 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.96 2gpl h ARG 165 CO -0.03 0.00 0.29 -1.64 0.56 0.00 0.00 179.97 179.15 2gpl s MET 166 N -3.36 4.59 0.40 0.04 -1.94 -0.57 -4.96 119.30 113.50 2gpl s MET 166 Ca -0.00 1.30 0.07 0.00 -1.71 0.00 0.00 55.69 55.35 2gpl s MET 166 Cb 0.10 -3.40 0.82 0.00 2.01 0.00 0.00 34.83 34.35 2gpl s MET 166 CO 0.79 0.15 2.00 -1.35 -0.01 0.00 0.00 175.02 176.60 2gpl h PRO 167 N 6.04 0.45 -6.57 2.03 0.11 -1.91 -3.45 132.00 128.70 2gpl h PRO 167 Ca -0.42 -0.05 -0.52 0.00 0.11 0.00 0.00 66.00 65.12 2gpl h PRO 167 Cb 1.21 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2gpl h PRO 167 CO 0.73 0.38 -0.03 -1.64 -0.21 0.00 0.00 178.00 177.22 2gpl s MET 168 N -5.23 3.83 -0.50 1.05 -1.94 -1.26 -5.05 119.30 110.21 2gpl s MET 168 Ca -0.07 0.37 -0.17 0.00 -1.71 0.00 0.00 55.69 54.11 2gpl s MET 168 Cb 0.17 -2.56 0.08 0.00 2.01 0.00 0.00 34.83 34.52 2gpl s MET 168 CO 0.73 0.22 0.49 0.34 -0.01 0.00 0.00 175.02 176.79 2gpl s ASP 169 N -2.53 6.18 -0.01 3.03 -1.08 -1.26 -4.91 116.67 116.08 2gpl s ASP 169 Ca 0.49 -1.26 0.12 0.00 -0.52 0.00 0.00 52.55 51.38 2gpl s ASP 169 Cb -0.11 -2.22 0.36 0.00 -1.46 0.00 0.00 42.92 39.49 2gpl s ASP 169 CO 0.22 -0.77 1.29 2.22 0.52 0.00 0.00 175.17 178.66 2gpl n PHE 170 N 5.55 0.57 -3.88 -5.34 1.16 -1.26 -4.89 117.46 109.38 2gpl n PHE 170 Ca -0.11 -0.27 -0.29 0.00 -1.87 0.00 0.00 57.45 54.90 2gpl n PHE 170 Cb 0.44 -0.02 0.03 0.00 -1.61 0.00 0.00 39.48 38.32 2gpl n PHE 170 CO 0.00 0.00 0.00 1.63 -1.87 0.00 0.00 176.76 176.52 2gpl n LYS 171 N 0.66 -5.83 -0.42 3.97 4.76 -1.26 -1.81 118.16 118.22 2gpl n LYS 171 Ca 0.13 0.63 0.06 0.00 -2.87 0.00 0.00 58.31 56.26 2gpl n LYS 171 Cb 0.36 -5.54 -0.01 0.00 -1.84 0.00 0.00 35.03 28.00 2gpl n LYS 171 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2gpl n GLY 172 N -1.73 -2.02 3.33 0.72 0.00 -1.26 -4.31 105.19 99.92 2gpl n GLY 172 Ca 0.03 -1.36 -0.18 0.00 0.00 0.00 0.00 46.02 44.51 2gpl n GLY 172 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gpl s VAL 173 N -1.12 1.58 -0.15 1.61 -7.23 -1.26 -1.46 120.40 112.38 2gpl s VAL 173 Ca 0.00 -2.17 -0.03 0.00 -1.81 0.00 0.00 61.98 57.97 2gpl s VAL 173 Cb 0.00 -2.06 -0.03 0.00 0.56 0.00 0.00 36.38 34.86 2gpl s VAL 173 CO 0.00 -0.59 -0.05 -0.63 -0.31 0.00 0.00 175.10 173.53 2gpl s ILE 174 N -3.07 3.80 0.06 -0.62 1.01 -0.22 -4.88 121.20 117.27 2gpl s ILE 174 Ca 0.22 -0.40 0.06 0.00 0.00 0.00 0.00 60.65 60.53 2gpl s ILE 174 Cb 0.01 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.79 2gpl s ILE 174 CO 0.06 0.51 -0.09 -0.69 0.00 0.00 0.00 174.94 174.73 2gpl s VAL 175 N 0.26 3.45 -0.01 2.92 1.01 -1.26 -1.79 120.40 124.98 2gpl s VAL 175 Ca -0.04 -1.06 -0.05 0.00 0.00 0.00 0.00 61.98 60.83 2gpl s VAL 175 Cb -0.14 -2.56 -0.00 0.00 0.00 0.00 0.00 36.38 33.68 2gpl s VAL 175 CO 0.03 0.24 0.09 -0.54 0.00 0.00 0.00 175.10 174.92 2gpl s LYS 176 N -1.84 0.34 -0.04 2.72 1.02 -0.42 -2.09 119.74 119.42 2gpl s LYS 176 Ca 0.19 -0.28 0.05 0.00 0.02 0.00 0.00 55.97 55.95 2gpl s LYS 176 Cb -0.11 0.14 -0.02 0.00 -0.52 0.00 0.00 37.83 37.32 2gpl s LYS 176 CO 0.11 -0.07 -0.18 0.42 -0.92 0.00 0.00 175.35 174.71 2gpl s ILE 177 N -0.97 2.76 -0.16 2.17 1.01 0.22 -1.28 121.20 124.94 2gpl s ILE 177 Ca -0.11 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 59.70 2gpl s ILE 177 Cb -0.06 -2.05 0.03 0.00 0.01 0.00 0.00 42.46 40.38 2gpl s ILE 177 CO 0.01 0.58 -0.14 -0.69 0.00 0.00 0.00 174.94 174.70 2gpl s VAL 178 N -0.70 1.60 0.15 2.92 1.01 -0.21 -1.74 120.40 123.43 2gpl s VAL 178 Ca 0.11 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.38 2gpl s VAL 178 Cb -0.10 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.73 2gpl s VAL 178 CO 0.00 0.40 0.17 -0.90 0.00 0.00 0.00 175.10 174.78 2gpl n ASP 179 N 4.75 -0.46 0.33 3.32 5.68 -0.39 -1.04 116.55 128.73 2gpl n ASP 179 Ca -0.17 -1.87 0.13 0.00 -0.50 0.00 0.00 54.79 52.38 2gpl n ASP 179 Cb 0.49 0.93 0.72 0.00 -1.14 0.00 0.00 41.12 42.12 2gpl n ASP 179 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2gpl h LYS 180 N 0.00 0.00 -0.03 0.11 2.10 -1.93 0.47 116.57 117.29 2gpl h LYS 180 Ca -0.11 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.54 2gpl h LYS 180 Cb 0.52 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.85 2gpl h LYS 180 CO 0.15 0.00 -0.10 -0.25 -2.00 0.00 0.00 179.45 177.25 2gpl n ASP 181 N -2.81 2.72 0.00 7.07 8.00 -1.26 -5.08 116.55 125.19 2gpl n ASP 181 Ca -0.02 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.62 2gpl n ASP 181 Cb 0.44 0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 2gpl n ASP 181 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gpl n GLY 183 N 1.32 0.30 3.18 0.44 0.00 0.15 -5.03 105.19 105.55 2gpl n GLY 183 Ca 0.12 -1.98 -0.31 0.00 0.00 0.00 0.00 46.02 43.85 2gpl n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gpl s ILE 184 N -0.54 1.95 0.08 -0.61 1.01 -1.24 -1.26 121.20 120.59 2gpl s ILE 184 Ca 0.00 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.74 2gpl s ILE 184 Cb 0.00 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.73 2gpl s ILE 184 CO 0.00 0.53 -0.08 0.00 0.00 0.00 0.00 174.94 175.39 2gpl s ARG 185 N 0.58 0.72 -0.22 2.79 1.70 -0.71 -4.98 118.95 118.84 2gpl s ARG 185 Ca -0.14 -1.06 -0.06 0.00 -0.47 0.00 0.00 55.73 54.01 2gpl s ARG 185 Cb -0.17 -0.34 -0.03 0.00 -0.57 0.00 0.00 34.95 33.85 2gpl s ARG 185 CO 0.04 0.04 0.03 -1.14 -1.08 0.00 0.00 175.30 173.18 2gpl s GLN 186 N -2.65 3.64 -0.86 3.89 0.74 -1.26 -0.61 119.66 122.54 2gpl s GLN 186 Ca 0.02 -0.50 -0.25 0.00 0.05 0.00 0.00 55.36 54.68 2gpl s GLN 186 Cb -0.03 -3.16 -0.03 0.00 1.10 0.00 0.00 33.01 30.88 2gpl s GLN 186 CO -0.01 -0.04 1.86 0.08 -0.55 0.00 0.00 175.29 176.63 2gpl s VAL 187 N 1.17 3.49 -2.00 1.34 1.01 -0.89 -4.78 120.40 119.74 2gpl s VAL 187 Ca 0.03 -0.30 0.11 0.00 0.00 0.00 0.00 61.98 61.82 2gpl s VAL 187 Cb -0.14 -4.13 0.32 0.00 0.00 0.00 0.00 36.38 32.42 2gpl s VAL 187 CO 0.02 -1.07 1.16 -0.90 0.00 0.00 0.00 175.10 174.31 2gpl n ASP 188 N 13.12 0.00 -3.40 3.32 3.85 -1.26 -4.06 116.55 128.12 2gpl n ASP 188 Ca 0.35 -0.91 -0.26 0.00 -0.71 0.00 0.00 54.79 53.26 2gpl n ASP 188 Cb 0.48 0.00 -0.08 0.00 -1.35 0.00 0.00 41.12 40.17 2gpl n ASP 188 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 2gpl n ASP 189 N -0.78 1.97 0.00 -1.12 5.75 -1.26 -4.76 116.55 116.36 2gpl n ASP 189 Ca 0.08 -3.04 0.00 0.00 -0.01 0.00 0.00 54.79 51.82 2gpl n ASP 189 Cb 0.04 -0.66 0.00 0.00 -1.03 0.00 0.00 41.12 39.47 2gpl n ASP 189 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2gpl n PHE 190 N 1.40 0.00 0.63 2.11 -0.00 -1.26 -4.03 117.46 116.31 2gpl n PHE 190 Ca 0.26 0.00 0.07 0.00 -0.00 0.00 0.00 57.45 57.78 2gpl n PHE 190 Cb 0.45 0.00 0.36 0.00 -0.00 0.00 0.00 39.48 40.29 2gpl n PHE 190 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 2gpl n GLN 191 N -0.40 0.12 -2.65 -4.13 3.00 -1.26 -3.94 117.38 108.13 2gpl n GLN 191 Ca 0.00 0.19 -0.02 0.00 -0.01 0.00 0.00 57.00 57.16 2gpl n GLN 191 Cb 0.03 -1.50 0.11 0.00 0.00 0.00 0.00 30.24 28.88 2gpl n GLN 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2gpl n ALA 192 N -1.38 -3.48 1.66 -1.58 0.00 -1.26 -5.19 120.51 109.28 2gpl n ALA 192 Ca 0.06 -0.23 0.15 0.00 0.00 0.00 0.00 53.44 53.41 2gpl n ALA 192 Cb 0.14 -3.33 0.66 0.00 0.00 0.00 0.00 19.45 16.93 2gpl n ALA 192 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44