#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 4.92 -0.12 6.12 1.01 -1.26 -4.98 116.67 122.36 2gpl s ASP 1 Ca 0.00 0.76 -0.16 0.00 0.71 0.00 0.00 52.55 53.86 2gpl s ASP 1 Cb 0.00 -1.42 -0.04 0.00 1.01 0.00 0.00 42.92 42.47 2gpl s ASP 1 CO 0.00 -1.61 0.41 -0.63 0.21 0.00 0.00 175.17 173.56 2gpl s ILE 2 N -3.38 5.21 -0.23 0.77 -1.09 -1.26 -4.85 121.20 116.37 2gpl s ILE 2 Ca 0.60 0.82 -0.04 0.00 -2.23 0.00 0.00 60.65 59.80 2gpl s ILE 2 Cb -0.11 -3.75 0.08 0.00 -1.58 0.00 0.00 42.46 37.10 2gpl s ILE 2 CO 0.48 0.37 0.10 -0.63 -1.23 0.00 0.00 174.94 174.04 2gpl s ILE 3 N 0.39 0.01 0.16 2.92 -1.09 -1.26 -1.76 121.20 120.56 2gpl s ILE 3 Ca 0.23 -0.53 0.10 0.00 -2.23 0.00 0.00 60.65 58.22 2gpl s ILE 3 Cb -0.15 -0.85 -0.04 0.00 -1.58 0.00 0.00 42.46 39.84 2gpl s ILE 3 CO 0.09 -0.50 -0.23 -0.76 -1.23 0.00 0.00 174.94 172.30 2gpl s LEU 4 N 2.07 2.38 -0.14 2.97 1.43 0.35 -2.87 118.68 124.88 2gpl s LEU 4 Ca 0.05 -0.81 -0.11 0.00 -1.03 0.00 0.00 54.13 52.24 2gpl s LEU 4 Cb -0.16 -1.09 0.04 0.00 0.03 0.00 0.00 46.19 45.02 2gpl s LEU 4 CO -0.23 0.10 0.35 -0.83 0.23 0.00 0.00 176.35 175.98 2gpl s GLY 5 N -2.38 -0.27 -0.03 -3.19 0.00 -0.64 -1.32 107.32 99.49 2gpl s GLY 5 Ca 0.16 1.14 0.01 0.00 0.00 0.00 0.00 44.72 46.03 2gpl s GLY 5 CO 0.07 1.13 -0.05 -1.50 0.00 0.00 0.00 173.10 172.75 2gpl s ILE 6 N 0.64 0.50 -0.36 0.90 1.10 -0.21 -1.44 121.20 122.33 2gpl s ILE 6 Ca -0.04 -0.15 -0.09 0.00 -0.51 0.00 0.00 60.65 59.87 2gpl s ILE 6 Cb -0.05 -0.50 0.04 0.00 0.15 0.00 0.00 42.46 42.10 2gpl s ILE 6 CO -0.04 0.20 0.16 -0.60 -2.11 0.00 0.00 174.94 172.55 2gpl s ARG 7 N 0.62 2.71 0.00 3.50 3.52 0.30 -0.10 118.95 129.50 2gpl s ARG 7 Ca -0.08 -1.15 0.00 0.00 -0.13 0.00 0.00 55.73 54.37 2gpl s ARG 7 Cb -0.11 -3.61 0.00 0.00 -1.56 0.00 0.00 34.95 29.67 2gpl s ARG 7 CO 0.00 -0.70 0.00 1.33 -0.81 0.00 0.00 175.30 175.12 2gpl n VAL 8 N 4.91 0.00 -0.02 7.11 0.24 -0.06 -4.84 118.33 125.67 2gpl n VAL 8 Ca -0.12 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.09 2gpl n VAL 8 Cb 0.45 -1.08 -0.02 0.00 -1.47 0.00 0.00 33.84 31.72 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 -0.20 0.00 7.34 5.75 -1.21 -3.33 115.11 123.47 2gpl h GLN 9 Ca 0.00 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2gpl h GLN 9 Cb 0.00 0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.59 2gpl h GLN 9 CO 0.00 -0.13 -0.15 -0.25 -2.65 0.00 0.00 178.83 175.65 2gpl n ASP 10 N -5.32 1.56 -3.67 -0.69 8.00 -1.26 -4.64 116.55 110.52 2gpl n ASP 10 Ca -0.02 -2.64 -0.04 0.00 0.71 0.00 0.00 54.79 52.79 2gpl n ASP 10 Cb 0.24 -0.32 -0.01 0.00 -0.02 0.00 0.00 41.12 41.01 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 -2.13 -0.15 -0.06 -2.24 1.04 -1.25 -4.34 113.70 104.56 2gpl s SER 11 Ca 0.20 -0.52 0.05 0.00 0.48 0.00 0.00 55.95 56.15 2gpl s SER 11 Cb 0.17 0.55 -0.00 0.00 0.10 0.00 0.00 66.02 66.84 2gpl s SER 11 CO 0.02 -1.03 -0.20 -0.69 0.98 0.00 0.00 173.24 172.31 2gpl s VAL 12 N -3.19 1.72 -0.08 5.02 1.01 -0.29 -0.88 120.40 123.72 2gpl s VAL 12 Ca 0.13 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.26 2gpl s VAL 12 Cb -0.02 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 2gpl s VAL 12 CO 0.04 0.49 -0.10 -0.63 0.00 0.00 0.00 175.10 174.90 2gpl s ILE 13 N 0.12 3.44 -0.11 2.22 -1.09 0.86 -1.07 121.20 125.56 2gpl s ILE 13 Ca -0.08 -0.57 0.02 0.00 -2.23 0.00 0.00 60.65 57.79 2gpl s ILE 13 Cb -0.14 -2.40 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 -0.48 1.69 -0.12 2.97 1.43 -0.52 -1.04 118.68 122.61 2gpl s LEU 14 Ca 0.07 -0.42 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 2gpl s LEU 14 Cb -0.12 -1.08 -0.01 0.00 0.03 0.00 0.00 46.19 45.02 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 1.05 2.43 -0.03 4.21 0.00 -0.44 -1.31 121.76 127.67 2gpl s ALA 15 Ca -0.05 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 50.97 2gpl s ALA 15 Cb -0.15 -1.06 0.03 0.00 0.00 0.00 0.00 23.12 21.94 2gpl s ALA 15 CO -0.02 0.23 -0.00 -1.12 0.00 0.00 0.00 175.76 174.84 2gpl s SER 16 N 0.41 0.43 0.74 0.00 0.01 -0.76 -0.49 113.70 114.04 2gpl s SER 16 Ca -0.13 -0.03 -0.16 0.00 1.31 0.00 0.00 55.95 56.94 2gpl s SER 16 Cb -0.17 -0.23 0.01 0.00 0.21 0.00 0.00 66.02 65.85 2gpl s SER 16 CO 0.06 -0.10 0.94 -1.54 0.41 0.00 0.00 173.24 173.01 2gpl n SER 17 N 4.11 0.31 -0.02 2.44 3.41 -0.72 -0.97 113.62 122.17 2gpl n SER 17 Ca -0.27 0.64 0.09 0.00 -0.26 0.00 0.00 58.87 59.07 2gpl n SER 17 Cb 0.50 -1.39 -0.10 0.00 -0.26 0.00 0.00 64.21 62.96 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 -1.90 0.73 -2.53 4.33 5.02 -0.59 -4.64 118.16 118.58 2gpl n LYS 18 Ca 0.13 -0.05 -0.38 0.00 -2.02 0.00 0.00 58.31 55.99 2gpl n LYS 18 Cb 0.50 -1.40 -0.04 0.00 -0.02 0.00 0.00 35.03 34.06 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 -2.78 3.18 -0.26 7.82 0.00 -0.70 -1.16 121.76 127.87 2gpl s ALA 19 Ca 0.08 0.75 -0.02 0.00 0.00 0.00 0.00 51.96 52.77 2gpl s ALA 19 Cb 0.15 -3.29 0.08 0.00 0.00 0.00 0.00 23.12 20.06 2gpl s ALA 19 CO 0.77 -0.19 0.08 0.08 0.00 0.00 0.00 175.76 176.49 2gpl s VAL 20 N -1.51 0.63 -0.10 0.00 1.01 -0.18 -4.91 120.40 115.34 2gpl s VAL 20 Ca 0.54 -1.00 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 2gpl s VAL 20 Cb -0.25 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 2gpl s VAL 20 CO 0.31 -0.50 0.03 -0.89 0.00 0.00 0.00 175.10 174.05 2gpl s THR 21 N 1.77 4.57 -0.37 3.92 2.01 -1.26 -1.26 115.64 125.01 2gpl s THR 21 Ca 0.05 -0.15 0.01 0.00 0.31 0.00 0.00 61.69 61.91 2gpl s THR 21 Cb -0.17 -2.95 0.12 0.00 0.01 0.00 0.00 72.50 69.51 2gpl s THR 21 CO -0.20 0.59 0.17 -0.13 -0.69 0.00 0.00 174.62 174.36 2gpl s ARG 22 N -0.78 0.94 5.99 4.92 1.81 -0.21 -4.93 118.95 126.70 2gpl s ARG 22 Ca 0.12 -1.50 0.00 0.00 -1.72 0.00 0.00 55.73 52.63 2gpl s ARG 22 Cb -0.12 -2.08 0.00 0.00 -0.45 0.00 0.00 34.95 32.31 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 4.21 1.60 0.10 -3.53 0.00 -1.26 -3.23 105.19 103.08 2gpl n GLY 23 Ca 0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 0.58 -3.14 -0.61 2.10 -2.04 -3.48 117.51 110.93 2gpl h ILE 24 Ca 0.00 -2.09 -0.63 0.00 1.08 0.00 0.00 64.86 63.22 2gpl h ILE 24 Cb 0.00 2.11 -0.12 0.00 -1.09 0.00 0.00 36.82 37.72 2gpl h ILE 24 CO 0.00 0.33 -0.68 -0.44 -1.08 0.00 0.00 178.15 176.28 2gpl s SER 25 N -5.90 4.72 -0.74 2.19 0.01 -1.20 -5.07 113.70 107.72 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 -1.00 0.15 0.00 0.21 0.00 0.00 66.02 65.46 2gpl s SER 25 CO 0.80 0.13 0.80 -0.69 0.41 0.00 0.00 173.24 174.69 2gpl s VAL 26 N -1.52 5.10 0.44 3.43 1.01 -1.26 -1.05 120.40 126.55 2gpl s VAL 26 Ca 0.26 -1.66 0.11 0.00 0.00 0.00 0.00 61.98 60.68 2gpl s VAL 26 Cb -0.10 -4.53 0.24 0.00 0.00 0.00 0.00 36.38 31.98 2gpl s VAL 26 CO 0.17 -1.16 2.05 -0.07 0.00 0.00 0.00 175.10 176.10 2gpl h LEU 27 N 9.25 0.25 -7.51 3.92 3.38 -1.54 -3.45 115.31 119.61 2gpl h LEU 27 Ca -0.06 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 2gpl h LEU 27 Cb 1.06 -0.06 -0.20 0.00 0.09 0.00 0.00 40.66 41.55 2gpl h LEU 27 CO 0.98 0.24 -0.27 -0.75 0.09 0.00 0.00 178.44 178.73 2gpl s LYS 28 N -5.16 0.68 -0.06 1.13 2.20 -1.08 -5.00 119.74 112.45 2gpl s LYS 28 Ca -0.06 -0.21 0.08 0.00 -0.36 0.00 0.00 55.97 55.42 2gpl s LYS 28 Cb 0.17 0.30 0.12 0.00 -1.51 0.00 0.00 37.83 36.91 2gpl s LYS 28 CO 0.71 -0.19 1.04 -0.40 -0.36 0.00 0.00 175.35 176.15 2gpl n ASP 29 N 1.23 1.10 -2.77 1.43 3.85 -1.25 -1.01 116.55 119.12 2gpl n ASP 29 Ca -0.21 -2.41 -0.03 0.00 -0.71 0.00 0.00 54.79 51.43 2gpl n ASP 29 Cb 0.56 -0.28 0.05 0.00 -1.35 0.00 0.00 41.12 40.10 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 -0.64 1.77 -4.74 -1.12 3.41 -1.10 -4.58 113.62 106.63 2gpl n SER 30 Ca 0.07 -2.22 -0.39 0.00 -0.26 0.00 0.00 58.87 56.07 2gpl n SER 30 Cb 0.64 -0.48 -0.06 0.00 -0.26 0.00 0.00 64.21 64.06 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 -3.71 6.84 -0.54 4.04 -1.08 -0.30 -5.03 116.67 116.89 2gpl s ASP 31 Ca 0.29 1.01 -0.14 0.00 -0.52 0.00 0.00 52.55 53.18 2gpl s ASP 31 Cb 0.34 -2.33 0.13 0.00 -1.46 0.00 0.00 42.92 39.60 2gpl s ASP 31 CO -0.03 0.02 0.47 -0.62 0.52 0.00 0.00 175.17 175.54 2gpl s ASP 32 N 0.33 6.09 -0.44 -0.34 3.68 -1.26 -4.27 116.67 120.45 2gpl s ASP 32 Ca 0.30 -1.87 -0.06 0.00 2.13 0.00 0.00 52.55 53.05 2gpl s ASP 32 Cb -0.17 -2.16 -0.12 0.00 -1.45 0.00 0.00 42.92 39.03 2gpl s ASP 32 CO 0.14 -0.80 3.19 0.29 0.13 0.00 0.00 175.17 178.12 2gpl n LYS 33 N 5.09 2.53 -3.83 4.34 5.02 -1.26 -4.84 118.16 125.21 2gpl n LYS 33 Ca -0.11 -1.75 -0.11 0.00 -2.02 0.00 0.00 58.31 54.32 2gpl n LYS 33 Cb 0.40 -2.19 -0.08 0.00 -0.02 0.00 0.00 35.03 33.14 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 -0.02 0.10 0.00 -0.18 -1.32 -1.26 -2.10 115.64 110.87 2gpl s THR 34 Ca 0.64 -0.81 0.00 0.00 -1.21 0.00 0.00 61.69 60.31 2gpl s THR 34 Cb 0.31 -0.86 -0.00 0.00 -1.51 0.00 0.00 72.50 70.44 2gpl s THR 34 CO -0.08 -0.45 -0.01 -0.13 -2.21 0.00 0.00 174.62 171.74 2gpl s ARG 35 N -2.39 0.08 -0.29 7.08 1.81 -0.47 -5.01 118.95 119.76 2gpl s ARG 35 Ca -0.06 -0.13 -0.18 0.00 -1.72 0.00 0.00 55.73 53.63 2gpl s ARG 35 Cb -0.02 -0.00 -0.02 0.00 -0.45 0.00 0.00 34.95 34.46 2gpl s ARG 35 CO -0.03 -0.00 0.53 -1.14 -0.68 0.00 0.00 175.30 173.98 2gpl s GLN 36 N -0.29 3.94 0.04 3.54 0.74 -1.26 -1.58 119.66 124.80 2gpl s GLN 36 Ca -0.03 0.21 -0.09 0.00 0.05 0.00 0.00 55.36 55.50 2gpl s GLN 36 Cb -0.02 -3.70 -0.31 0.00 1.10 0.00 0.00 33.01 30.08 2gpl s GLN 36 CO -0.00 -0.45 1.02 -0.07 -0.55 0.00 0.00 175.29 175.24 2gpl h LEU 37 N 8.91 0.58 -7.81 3.68 3.38 -1.44 -3.48 115.31 119.13 2gpl h LEU 37 Ca -0.28 -0.65 -0.01 0.00 0.09 0.00 0.00 57.88 57.03 2gpl h LEU 37 Cb 1.13 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 41.61 2gpl h LEU 37 CO 0.74 1.52 0.06 -0.94 0.09 0.00 0.00 178.44 179.90 2gpl s SER 38 N -7.29 -0.24 0.56 -0.43 1.04 -1.14 -4.31 113.70 101.88 2gpl s SER 38 Ca -0.07 -0.56 0.38 0.00 0.48 0.00 0.00 55.95 56.17 2gpl s SER 38 Cb 0.06 0.61 1.53 0.00 0.10 0.00 0.00 66.02 68.32 2gpl s SER 38 CO 0.90 -1.13 1.74 1.55 0.98 0.00 0.00 173.24 177.28 2gpl h PRO 39 N 2.16 0.00 -0.05 4.02 0.13 -2.01 -1.35 132.00 134.90 2gpl h PRO 39 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 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 0.34 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.83 2gpl n HIS 40 N -4.02 0.17 -3.86 1.56 8.25 -1.26 -3.70 115.22 112.36 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 1.34 -0.16 -0.17 0.00 1.12 0.00 0.00 29.99 32.12 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 0.26 0.04 1.59 2.01 -0.51 -1.05 115.64 115.37 2gpl s THR 41 Ca 0.30 0.12 0.09 0.00 0.31 0.00 0.00 61.69 62.51 2gpl s THR 41 Cb 0.25 -0.40 -0.03 0.00 0.01 0.00 0.00 72.50 72.34 2gpl s THR 41 CO 0.04 0.21 -0.26 -0.22 -0.69 0.00 0.00 174.62 173.69 2gpl s LEU 42 N 1.55 2.15 -0.08 4.42 2.96 0.22 -1.02 118.68 128.89 2gpl s LEU 42 Ca -0.02 -0.57 0.01 0.00 -0.22 0.00 0.00 54.13 53.33 2gpl s LEU 42 Cb -0.13 -1.28 0.02 0.00 0.50 0.00 0.00 46.19 45.30 2gpl s LEU 42 CO -0.03 0.26 -0.08 -0.32 -1.32 0.00 0.00 176.35 174.86 2gpl s MET 43 N -1.15 1.34 0.19 1.98 -2.45 -0.61 0.24 119.30 118.84 2gpl s MET 43 Ca 0.11 -0.24 0.05 0.00 -1.25 0.00 0.00 55.69 54.36 2gpl s MET 43 Cb -0.10 -1.29 -0.03 0.00 1.25 0.00 0.00 34.83 34.66 2gpl s MET 43 CO 0.02 -0.12 0.25 -1.54 1.05 0.00 0.00 175.02 174.67 2gpl s SER 44 N 1.17 5.97 0.04 1.11 1.04 -0.16 -1.37 113.70 121.50 2gpl s SER 44 Ca -0.06 -0.01 -0.19 0.00 0.48 0.00 0.00 55.95 56.17 2gpl s SER 44 Cb -0.14 -1.68 0.04 0.00 0.10 0.00 0.00 66.02 64.34 2gpl s SER 44 CO -0.02 0.01 0.44 0.72 0.98 0.00 0.00 173.24 175.38 2gpl s PHE 45 N -1.87 -0.32 -0.02 5.02 -0.12 -0.89 -1.62 117.98 118.15 2gpl s PHE 45 Ca 0.33 0.33 -0.18 0.00 -0.05 0.00 0.00 56.93 57.36 2gpl s PHE 45 Cb -0.10 0.25 0.03 0.00 -0.63 0.00 0.00 43.02 42.57 2gpl s PHE 45 CO 0.27 -0.58 0.39 0.00 -0.05 0.00 0.00 175.22 175.25 2gpl s ALA 46 N -2.33 -1.00 0.00 1.99 0.00 -0.46 -4.87 121.76 115.10 2gpl s ALA 46 Ca -0.06 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.45 2gpl s ALA 46 Cb -0.01 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.16 2gpl s ALA 46 CO -0.01 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 175.88 2gpl n GLY 47 N 1.21 0.09 3.66 0.00 0.00 -1.26 -0.41 105.19 108.48 2gpl n GLY 47 Ca -0.21 -1.18 -0.45 0.00 0.00 0.00 0.00 46.02 44.18 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 1.91 0.00 1.61 4.07 0.25 -4.85 120.64 123.64 2gpl n GLU 48 Ca 0.00 0.68 0.00 0.00 -0.06 0.00 0.00 57.16 57.78 2gpl n GLU 48 Cb 0.00 -2.32 0.00 0.00 -0.06 0.00 0.00 31.44 29.06 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 1.95 0.00 0.07 4.31 0.00 -1.26 -2.07 120.51 123.51 2gpl n ALA 49 Ca 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.43 2gpl n ALA 49 Cb 0.30 0.18 -0.14 0.00 0.00 0.00 0.00 19.45 19.80 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 0.20 1.59 0.00 0.00 -1.99 -3.35 103.07 99.52 2gpl h GLY 50 Ca 0.00 -0.50 0.04 0.00 0.00 0.00 0.00 47.33 46.87 2gpl h GLY 50 CO 0.00 0.44 0.19 -0.55 0.00 0.00 0.00 176.54 176.62 2gpl h ASP 51 N 0.05 0.17 0.31 0.19 3.32 -1.91 -2.79 116.42 115.75 2gpl h ASP 51 Ca -0.16 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.89 2gpl h ASP 51 Cb 1.95 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 41.43 2gpl h ASP 51 CO 0.16 0.12 -0.38 0.00 -1.72 0.00 0.00 179.24 177.41 2gpl h THR 52 N 0.20 0.22 -0.03 0.35 1.03 -1.55 0.44 112.91 113.57 2gpl h THR 52 Ca 0.12 0.00 -0.26 0.00 -0.01 0.00 0.00 66.41 66.26 2gpl h THR 52 Cb 0.22 0.22 0.02 0.00 -1.07 0.00 0.00 68.15 67.54 2gpl h THR 52 CO -0.02 0.00 -0.98 0.58 -0.01 0.00 0.00 175.52 175.09 2gpl h VAL 53 N -0.74 1.28 -0.74 0.00 2.07 -1.78 -2.78 116.25 113.56 2gpl h VAL 53 Ca -0.01 -2.18 0.10 0.00 0.82 0.00 0.00 66.70 65.43 2gpl h VAL 53 Cb 0.69 2.31 -0.08 0.00 -1.52 0.00 0.00 31.29 32.69 2gpl h VAL 53 CO -0.11 0.68 0.37 1.56 0.02 0.00 0.00 177.57 180.09 2gpl h GLN 54 N 0.41 0.59 -0.04 1.57 1.08 -1.44 0.21 115.11 117.49 2gpl h GLN 54 Ca -0.11 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.04 2gpl h GLN 54 Cb 1.63 -0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 28.92 2gpl h GLN 54 CO 0.19 0.39 -0.01 0.35 -0.95 0.00 0.00 178.83 178.80 2gpl h PHE 55 N 0.61 0.09 -0.40 2.96 3.04 -0.93 -1.83 116.94 120.49 2gpl h PHE 55 Ca 0.37 -0.02 0.04 0.00 3.98 0.00 0.00 57.97 62.34 2gpl h PHE 55 Cb 0.42 -0.02 -0.04 0.00 2.56 0.00 0.00 35.95 38.87 2gpl h PHE 55 CO -0.11 0.45 0.17 0.00 -2.02 0.00 0.00 178.31 176.81 2gpl h ALA 56 N 0.63 0.48 -0.21 2.41 0.00 -1.15 0.14 119.26 121.55 2gpl h ALA 56 Ca 0.01 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 2gpl h ALA 56 Cb 0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2gpl h ALA 56 CO 0.00 -0.20 -0.20 0.93 0.00 0.00 0.00 179.25 179.78 2gpl h GLU 57 N 0.36 0.38 -0.39 0.00 5.08 -1.00 -0.22 114.58 118.79 2gpl h GLU 57 Ca 0.17 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 2gpl h GLU 57 Cb 0.11 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2gpl h GLU 57 CO -0.15 0.57 0.06 -0.92 -1.00 0.00 0.00 179.01 177.58 2gpl h TYR 58 N 0.34 0.69 -0.56 4.33 3.20 -0.56 -0.92 116.97 123.50 2gpl h TYR 58 Ca 0.06 -0.10 -0.07 0.00 3.14 0.00 0.00 58.73 61.76 2gpl h TYR 58 Cb 0.56 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 2gpl h TYR 58 CO 0.01 0.69 0.08 0.82 -1.64 0.00 0.00 178.16 178.13 2gpl h ILE 59 N 0.49 1.26 0.16 1.81 1.08 -0.57 -2.65 117.51 119.09 2gpl h ILE 59 Ca 0.12 -0.98 0.01 0.00 -0.39 0.00 0.00 64.86 63.61 2gpl h ILE 59 Cb 0.37 0.81 -0.02 0.00 -3.07 0.00 0.00 36.82 34.91 2gpl h ILE 59 CO 0.01 0.36 -0.18 -0.61 -0.69 0.00 0.00 178.15 177.03 2gpl h GLN 60 N 0.82 -0.37 -0.64 2.37 4.15 -0.86 -1.54 115.11 119.04 2gpl h GLN 60 Ca 0.17 0.03 0.13 0.00 0.77 0.00 0.00 58.65 59.74 2gpl h GLN 60 Cb 0.42 0.08 -0.09 0.00 0.21 0.00 0.00 27.48 28.10 2gpl h GLN 60 CO 0.01 -0.25 0.14 0.00 -1.93 0.00 0.00 178.83 176.81 2gpl h ALA 61 N 0.40 0.78 -0.40 3.38 0.00 -1.08 -0.78 119.26 121.55 2gpl h ALA 61 Ca 0.01 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2gpl h ALA 61 Cb 0.37 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2gpl h ALA 61 CO -0.06 -0.31 0.19 -0.91 0.00 0.00 0.00 179.25 178.16 2gpl h ASN 62 N 0.26 0.53 -0.34 0.00 4.21 -1.09 -0.76 115.58 118.39 2gpl h ASN 62 Ca 0.34 -0.13 -0.08 0.00 1.21 0.00 0.00 56.30 57.65 2gpl h ASN 62 Cb 0.54 -0.14 -0.02 0.00 -1.12 0.00 0.00 38.32 37.58 2gpl h ASN 62 CO -0.44 0.52 -0.04 0.40 -1.29 0.00 0.00 177.43 176.58 2gpl h ILE 63 N 0.51 1.24 -0.44 2.81 1.08 -0.67 -1.61 117.51 120.44 2gpl h ILE 63 Ca 0.14 -1.03 -0.04 0.00 -0.39 0.00 0.00 64.86 63.54 2gpl h ILE 63 Cb 0.13 0.95 -0.02 0.00 -3.07 0.00 0.00 36.82 34.82 2gpl h ILE 63 CO -0.02 0.36 0.11 1.56 -0.69 0.00 0.00 178.15 179.47 2gpl h GLN 64 N 0.68 0.70 -0.90 2.37 4.20 -0.88 -1.08 115.11 120.20 2gpl h GLN 64 Ca 0.13 -0.17 0.02 0.00 0.06 0.00 0.00 58.65 58.70 2gpl h GLN 64 Cb 0.48 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.12 2gpl h GLN 64 CO 0.02 0.70 0.59 1.25 -0.67 0.00 0.00 178.83 180.73 2gpl h LEU 65 N 0.58 0.99 -0.39 1.46 5.85 -0.87 -1.58 115.31 121.35 2gpl h LEU 65 Ca 0.14 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 2gpl h LEU 65 Cb 0.31 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2gpl h LEU 65 CO 0.00 0.70 0.06 0.22 -0.34 0.00 0.00 178.44 179.09 2gpl h TYR 66 N 1.16 0.69 -0.59 1.25 3.20 -0.86 -1.55 116.97 120.27 2gpl h TYR 66 Ca 0.34 -0.10 0.05 0.00 3.14 0.00 0.00 58.73 62.17 2gpl h TYR 66 Cb -0.05 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 37.98 2gpl h TYR 66 CO -0.00 0.69 0.32 0.77 -1.64 0.00 0.00 178.16 178.30 2gpl h SER 67 N 0.50 0.47 -0.07 -2.11 0.02 -0.59 -1.11 113.55 110.66 2gpl h SER 67 Ca 0.12 0.03 -0.18 0.00 -0.84 0.00 0.00 61.79 60.92 2gpl h SER 67 Cb 0.37 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.84 2gpl h SER 67 CO 0.01 0.31 -0.59 0.40 -1.14 0.00 0.00 176.83 175.83 2gpl h ILE 68 N 0.61 1.31 -0.46 3.27 2.04 -1.17 0.80 117.51 123.91 2gpl h ILE 68 Ca 0.26 -1.82 -0.08 0.00 1.00 0.00 0.00 64.86 64.22 2gpl h ILE 68 Cb 0.15 1.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 2gpl h ILE 68 CO -0.17 0.57 -0.04 -0.09 0.00 0.00 0.00 178.15 178.43 2gpl h ARG 69 N 0.50 0.84 -0.01 2.37 2.43 -1.02 -3.25 114.38 116.25 2gpl h ARG 69 Ca 0.00 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 2gpl h ARG 69 Cb 1.16 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 2gpl h ARG 69 CO 0.12 0.91 -0.68 0.39 -1.51 0.00 0.00 179.97 179.19 2gpl n GLU 70 N -4.33 0.60 -3.94 0.20 4.71 -0.44 -4.97 120.64 112.47 2gpl n GLU 70 Ca 0.00 -0.48 -0.27 0.00 -0.01 0.00 0.00 57.16 56.40 2gpl n GLU 70 Cb 0.33 -1.49 -0.02 0.00 -1.01 0.00 0.00 31.44 29.26 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 -0.78 -0.92 -3.52 1.62 4.64 0.28 -4.94 116.55 112.92 2gpl n ASP 71 Ca 0.07 -1.03 -0.13 0.00 -1.38 0.00 0.00 54.79 52.33 2gpl n ASP 71 Cb 0.39 -3.00 -0.04 0.00 -1.04 0.00 0.00 41.12 37.44 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 -3.91 -0.43 -0.27 -0.67 5.04 -1.09 -5.05 117.35 110.96 2gpl s TYR 72 Ca 0.07 0.31 -0.05 0.00 -2.44 0.00 0.00 57.07 54.96 2gpl s TYR 72 Cb -0.03 0.41 0.01 0.00 0.35 0.00 0.00 41.96 42.71 2gpl s TYR 72 CO 0.89 -0.74 0.02 -2.00 -1.34 0.00 0.00 175.55 172.39 2gpl s GLU 73 N -3.23 3.06 0.53 4.97 2.12 -1.26 -4.13 118.70 120.76 2gpl s GLU 73 Ca -0.01 -0.86 -0.21 0.00 0.36 0.00 0.00 54.97 54.25 2gpl s GLU 73 Cb -0.00 -3.22 -0.06 0.00 0.26 0.00 0.00 34.13 31.11 2gpl s GLU 73 CO -0.08 -0.40 1.15 1.28 -0.54 0.00 0.00 175.26 176.68 2gpl n LEU 74 N 4.80 4.23 -4.74 2.70 4.77 -1.26 -4.95 117.00 122.54 2gpl n LEU 74 Ca -0.16 0.94 -0.32 0.00 -0.03 0.00 0.00 56.01 56.45 2gpl n LEU 74 Cb 0.48 -1.47 0.09 0.00 -2.33 0.00 0.00 43.42 40.19 2gpl n LEU 74 CO 0.30 -1.18 0.73 -0.94 -1.33 0.00 0.00 177.39 174.97 2gpl s SER 75 N -0.95 4.37 0.37 -1.43 1.04 -1.26 -4.76 113.70 111.09 2gpl s SER 75 Ca 0.70 2.06 0.06 0.00 0.48 0.00 0.00 55.95 59.26 2gpl s SER 75 Cb -0.45 -2.55 0.76 0.00 0.10 0.00 0.00 66.02 63.87 2gpl s SER 75 CO 0.51 -2.13 1.99 -0.65 0.98 0.00 0.00 173.24 173.94 2gpl h PRO 76 N -0.67 0.70 -0.44 4.02 0.11 -1.92 0.58 132.00 134.38 2gpl h PRO 76 Ca -0.45 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 2gpl h PRO 76 Cb 1.26 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2gpl h PRO 76 CO 0.50 0.46 0.16 0.37 -0.21 0.00 0.00 178.00 179.28 2gpl h GLN 77 N 0.72 0.67 -0.36 1.05 -0.00 -1.99 0.11 115.11 115.31 2gpl h GLN 77 Ca 0.26 -0.13 -0.02 0.00 -0.00 0.00 0.00 58.65 58.76 2gpl h GLN 77 Cb 0.13 -0.10 -0.02 0.00 0.00 0.00 0.00 27.48 27.49 2gpl h GLN 77 CO -0.07 0.63 0.14 0.00 0.00 0.00 0.00 178.83 179.53 2gpl h ALA 78 N 1.00 0.47 -0.82 3.38 0.00 -1.59 -1.57 119.26 120.13 2gpl h ALA 78 Ca 0.14 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2gpl h ALA 78 Cb 0.23 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2gpl h ALA 78 CO -0.01 0.07 0.40 0.28 0.00 0.00 0.00 179.25 179.99 2gpl h VAL 79 N 0.43 1.25 -0.17 0.00 2.07 -0.67 -1.46 116.25 117.70 2gpl h VAL 79 Ca 0.12 -0.70 -0.12 0.00 0.82 0.00 0.00 66.70 66.82 2gpl h VAL 79 Cb 0.18 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 2gpl h VAL 79 CO -0.01 0.30 -0.42 0.77 0.02 0.00 0.00 177.57 178.23 2gpl h SER 80 N 1.16 0.43 -0.51 0.57 4.64 -0.78 -1.60 113.55 117.47 2gpl h SER 80 Ca 0.28 -0.19 -0.08 0.00 -0.47 0.00 0.00 61.79 61.33 2gpl h SER 80 Cb 0.10 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 2gpl h SER 80 CO -0.04 0.81 0.00 0.28 -0.87 0.00 0.00 176.83 177.01 2gpl h SER 81 N 0.34 0.88 -0.42 4.97 0.02 -0.93 0.14 113.55 118.54 2gpl h SER 81 Ca 0.03 -0.30 0.01 0.00 -0.84 0.00 0.00 61.79 60.68 2gpl h SER 81 Cb 0.89 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 2gpl h SER 81 CO 0.07 0.97 0.27 0.15 -1.14 0.00 0.00 176.83 177.15 2gpl h PHE 82 N 0.76 0.51 -0.61 3.45 3.04 -1.01 -1.42 116.94 121.66 2gpl h PHE 82 Ca 0.14 0.01 -0.10 0.00 3.98 0.00 0.00 57.97 62.01 2gpl h PHE 82 Cb 0.52 -0.17 -0.02 0.00 2.56 0.00 0.00 35.95 38.83 2gpl h PHE 82 CO 0.04 0.32 0.00 0.28 -2.02 0.00 0.00 178.31 176.93 2gpl h VAL 83 N 0.55 1.27 -0.13 1.41 2.07 -1.01 -2.19 116.25 118.23 2gpl h VAL 83 Ca 0.16 -1.15 0.01 0.00 0.82 0.00 0.00 66.70 66.53 2gpl h VAL 83 Cb -0.05 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2gpl h VAL 83 CO -0.05 0.42 0.07 -0.09 0.02 0.00 0.00 177.57 177.94 2gpl h ARG 84 N 0.98 0.14 -0.75 1.57 2.43 -0.34 -2.24 114.38 116.17 2gpl h ARG 84 Ca 0.17 -0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.42 2gpl h ARG 84 Cb 0.56 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 30.01 2gpl h ARG 84 CO 0.03 0.09 0.41 0.37 -1.51 0.00 0.00 179.97 179.36 2gpl h GLN 85 N 0.14 0.69 -0.46 0.20 4.15 -1.12 -0.09 115.11 118.62 2gpl h GLN 85 Ca 0.05 -0.04 0.04 0.00 0.77 0.00 0.00 58.65 59.47 2gpl h GLN 85 Cb 0.00 -0.15 -0.04 0.00 0.21 0.00 0.00 27.48 27.49 2gpl h GLN 85 CO -0.03 0.45 0.21 0.93 -1.93 0.00 0.00 178.83 178.47 2gpl h GLU 86 N 0.71 0.41 -0.44 1.69 4.39 -0.90 -1.90 114.58 118.53 2gpl h GLU 86 Ca 0.36 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.91 2gpl h GLU 86 Cb 0.32 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2gpl h GLU 86 CO -0.24 0.27 -0.20 -0.07 -1.16 0.00 0.00 179.01 177.61 2gpl h LEU 87 N 0.42 0.89 -1.92 1.33 3.38 -0.76 -2.00 115.31 116.65 2gpl h LEU 87 Ca 0.20 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 2gpl h LEU 87 Cb 0.14 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 2gpl h LEU 87 CO -0.16 1.06 -0.12 0.00 0.09 0.00 0.00 178.44 179.32 2gpl h ALA 88 N 1.00 1.52 0.02 1.53 0.00 -0.63 0.06 119.26 122.76 2gpl h ALA 88 Ca 0.11 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2gpl h ALA 88 Cb 0.74 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2gpl h ALA 88 CO 0.06 0.14 -0.01 0.87 0.00 0.00 0.00 179.25 180.31 2gpl h LYS 89 N 0.00 -0.03 -0.90 0.00 1.57 -0.99 -3.30 116.57 112.93 2gpl h LYS 89 Ca -0.00 0.00 0.17 0.00 -1.87 0.00 0.00 60.65 58.95 2gpl h LYS 89 Cb 0.25 0.01 -0.10 0.00 0.08 0.00 0.00 32.23 32.47 2gpl h LYS 89 CO 0.01 0.63 0.48 1.03 -0.57 0.00 0.00 179.45 181.03 2gpl h SER 90 N -0.74 0.57 -0.40 0.86 0.87 -0.70 -2.06 113.55 111.96 2gpl h SER 90 Ca -0.00 0.10 0.08 0.00 -1.23 0.00 0.00 61.79 60.74 2gpl h SER 90 Cb 0.67 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.62 2gpl h SER 90 CO 0.01 0.21 0.27 -0.29 -0.53 0.00 0.00 176.83 176.50 2gpl h ILE 90 N 0.64 0.89 -0.48 2.23 -0.00 -1.08 -1.90 117.51 117.80 2gpl h ILE 90 Ca 0.51 -0.06 0.00 0.00 -0.00 0.00 0.00 64.86 65.31 2gpl h ILE 90 Cb 0.77 0.70 0.00 0.00 -0.00 0.00 0.00 36.82 38.28 2gpl h ILE 90 CO -0.39 0.03 0.00 0.54 -0.00 0.00 0.00 178.15 178.33 2gpl n ARG 90 N -4.46 3.54 -2.71 2.19 1.74 -0.79 -4.85 116.66 111.33 2gpl n ARG 90 Ca 0.06 -2.78 -0.23 0.00 -0.77 0.00 0.00 57.85 54.13 2gpl n ARG 90 Cb 0.35 -1.83 0.11 0.00 -1.02 0.00 0.00 32.46 30.06 2gpl n ARG 90 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2gpl s SER 91 N -1.20 4.38 0.11 0.55 1.04 -0.71 -5.03 113.70 112.84 2gpl s SER 91 Ca 0.45 -0.59 -0.27 0.00 0.48 0.00 0.00 55.95 56.02 2gpl s SER 91 Cb 0.31 0.26 -0.09 0.00 0.10 0.00 0.00 66.02 66.60 2gpl s SER 91 CO 0.18 -1.86 1.64 -0.09 0.98 0.00 0.00 173.24 174.09 2gpl h ARG 92 N -0.44 -0.43 -3.02 4.02 2.43 -1.94 -3.37 114.38 111.64 2gpl h ARG 92 Ca -0.33 0.03 -0.60 0.00 -0.81 0.00 0.00 59.98 58.27 2gpl h ARG 92 Cb 1.27 0.10 -0.40 0.00 -0.42 0.00 0.00 29.97 30.52 2gpl h ARG 92 CO 0.38 -0.29 -0.77 0.50 -1.51 0.00 0.00 179.97 178.28 2gpl s ARG 93 N -6.07 0.95 0.73 0.20 3.52 -1.26 -5.13 118.95 111.89 2gpl s ARG 93 Ca -0.15 -1.59 -0.16 0.00 -0.13 0.00 0.00 55.73 53.70 2gpl s ARG 93 Cb 0.08 -1.98 0.01 0.00 -1.56 0.00 0.00 34.95 31.50 2gpl s ARG 93 CO 0.65 -1.13 1.01 -2.30 -0.81 0.00 0.00 175.30 172.72 2gpl n PRO 94 N 4.01 0.51 -2.67 5.12 -0.02 -1.25 -4.96 135.00 135.73 2gpl n PRO 94 Ca 0.07 0.23 -0.43 0.00 -2.02 0.00 0.00 63.50 61.35 2gpl n PRO 94 Cb 0.37 -2.26 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 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 -1.83 3.36 -1.16 6.00 2.02 -1.26 -4.95 117.35 119.53 2gpl s TYR 95 Ca 0.74 1.47 -0.09 0.00 -0.37 0.00 0.00 57.07 58.82 2gpl s TYR 95 Cb -0.34 -3.25 0.25 0.00 -0.40 0.00 0.00 41.96 38.22 2gpl s TYR 95 CO 0.50 -0.45 1.43 1.04 -1.57 0.00 0.00 175.55 176.50 2gpl n GLN 96 N 6.16 3.81 -4.35 -0.62 6.02 -1.26 -4.83 117.38 122.30 2gpl n GLN 96 Ca 0.11 -4.20 -0.20 0.00 -0.01 0.00 0.00 57.00 52.71 2gpl n GLN 96 Cb 0.46 -2.71 -0.16 0.00 1.02 0.00 0.00 30.24 28.86 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 -0.86 0.73 0.01 5.09 1.01 -1.26 -0.58 120.40 124.53 2gpl s VAL 97 Ca 0.35 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 62.05 2gpl s VAL 97 Cb -0.01 -0.66 -0.03 0.00 0.00 0.00 0.00 36.38 35.68 2gpl s VAL 97 CO 0.01 0.24 -0.10 0.20 0.00 0.00 0.00 175.10 175.44 2gpl s ASN 98 N 0.27 4.38 0.04 3.32 0.01 0.45 -2.53 114.94 120.89 2gpl s ASN 98 Ca -0.04 -0.22 -0.01 0.00 -0.71 0.00 0.00 52.86 51.88 2gpl s ASN 98 Cb -0.09 -0.95 -0.04 0.00 0.41 0.00 0.00 41.25 40.58 2gpl s ASN 98 CO 0.00 0.28 -0.03 0.68 -1.51 0.00 0.00 177.10 176.53 2gpl s VAL 99 N -0.96 0.20 -0.08 1.60 -7.23 0.12 -1.35 120.40 112.69 2gpl s VAL 99 Ca 0.16 -1.62 0.04 0.00 -1.81 0.00 0.00 61.98 58.74 2gpl s VAL 99 Cb -0.11 -1.27 0.00 0.00 0.56 0.00 0.00 36.38 35.56 2gpl s VAL 99 CO 0.06 -0.90 -0.20 -0.76 -0.31 0.00 0.00 175.10 173.00 2gpl s LEU 100 N -2.64 1.94 -0.21 1.32 1.43 -0.64 -1.40 118.68 118.48 2gpl s LEU 100 Ca 0.03 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.66 2gpl s LEU 100 Cb 0.04 -1.20 0.02 0.00 0.03 0.00 0.00 46.19 45.09 2gpl s LEU 100 CO -0.08 0.13 -0.14 -0.63 0.23 0.00 0.00 176.35 175.85 2gpl s ILE 101 N 0.38 2.38 -0.13 -0.59 1.01 0.96 -0.99 121.20 124.22 2gpl s ILE 101 Ca -0.16 -1.03 0.00 0.00 0.00 0.00 0.00 60.65 59.47 2gpl s ILE 101 Cb -0.17 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.17 2gpl s ILE 101 CO 0.07 0.37 -0.13 -0.83 0.00 0.00 0.00 174.94 174.41 2gpl s GLY 102 N 1.29 1.54 0.08 6.18 0.00 0.14 -0.29 107.32 116.25 2gpl s GLY 102 Ca 0.02 -0.89 -0.16 0.00 0.00 0.00 0.00 44.72 43.69 2gpl s GLY 102 CO -0.09 -0.21 0.38 -0.32 0.00 0.00 0.00 173.10 172.86 2gpl s GLY 103 N 0.31 -0.23 -0.27 0.20 0.00 -0.28 0.73 107.32 107.79 2gpl s GLY 103 Ca -0.10 0.05 -0.06 0.00 0.00 0.00 0.00 44.72 44.61 2gpl s GLY 103 CO 0.06 -0.19 0.05 -0.47 0.00 0.00 0.00 173.10 172.54 2gpl s TYR 104 N -3.13 3.09 0.00 1.90 6.14 -0.22 -0.02 117.35 125.11 2gpl s TYR 104 Ca -0.01 -0.82 0.00 0.00 0.64 0.00 0.00 57.07 56.87 2gpl s TYR 104 Cb 0.01 -2.21 0.00 0.00 0.42 0.00 0.00 41.96 40.17 2gpl s TYR 104 CO -0.07 -0.51 0.00 -3.47 0.64 0.00 0.00 175.55 172.14 2gpl n ASP 105 N 4.86 0.00 0.00 4.32 4.64 -0.52 -4.87 116.55 124.98 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 0.50 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.58 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 -3.40 -0.67 5.02 -1.26 -2.90 118.16 114.96 2gpl n LYS 10 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 2gpl n LYS 10 Cb 0.00 -2.14 0.07 0.00 -0.02 0.00 0.00 35.03 32.94 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 -4.56 -3.71 4.39 3.02 -1.26 -5.03 115.26 108.11 2gpl n ASN 106 Ca 0.00 -0.73 -0.14 0.00 -0.03 0.00 0.00 54.58 53.68 2gpl n ASN 106 Cb 0.00 -4.88 -0.09 0.00 -0.61 0.00 0.00 39.78 34.20 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 -5.01 0.64 0.48 3.52 1.02 -1.14 -5.09 119.74 114.16 2gpl s LYS 107 Ca 0.28 0.29 -0.13 0.00 0.02 0.00 0.00 55.97 56.42 2gpl s LYS 107 Cb -0.05 0.30 -0.07 0.00 -0.52 0.00 0.00 37.83 37.50 2gpl s LYS 107 CO 0.76 -0.14 0.90 -1.25 -0.92 0.00 0.00 175.35 174.70 2gpl s PRO 108 N -0.50 3.83 -0.05 -1.68 0.04 -1.26 -1.43 135.00 133.94 2gpl s PRO 108 Ca -0.06 0.71 -0.04 0.00 0.04 0.00 0.00 61.00 61.65 2gpl s PRO 108 Cb -0.03 -2.24 0.02 0.00 0.04 0.00 0.00 34.50 32.29 2gpl s PRO 108 CO 0.03 -0.21 0.13 -1.21 0.04 0.00 0.00 177.00 175.79 2gpl s GLU 109 N -4.12 0.14 -0.11 4.56 2.02 0.97 -4.91 118.70 117.25 2gpl s GLU 109 Ca 0.55 0.23 0.03 0.00 0.02 0.00 0.00 54.97 55.80 2gpl s GLU 109 Cb -0.10 0.01 0.01 0.00 0.10 0.00 0.00 34.13 34.14 2gpl s GLU 109 CO 0.34 -0.06 -0.21 -1.17 0.02 0.00 0.00 175.26 174.18 2gpl s LEU 110 N 0.35 2.00 -0.06 1.80 2.96 -1.26 -1.12 118.68 123.35 2gpl s LEU 110 Ca -0.02 -0.52 0.04 0.00 -0.22 0.00 0.00 54.13 53.41 2gpl s LEU 110 Cb -0.04 -1.31 -0.00 0.00 0.50 0.00 0.00 46.19 45.34 2gpl s LEU 110 CO -0.01 0.11 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.62 2gpl s TYR 111 N 0.56 1.99 -0.16 5.38 2.02 0.60 -2.16 117.35 125.58 2gpl s TYR 111 Ca -0.14 -0.64 -0.03 0.00 -0.37 0.00 0.00 57.07 55.89 2gpl s TYR 111 Cb -0.17 -1.34 -0.02 0.00 -0.40 0.00 0.00 41.96 40.03 2gpl s TYR 111 CO 0.05 -0.23 -0.06 -1.14 -1.57 0.00 0.00 175.55 172.59 2gpl s GLN 112 N 0.12 3.55 -0.04 -0.62 0.74 -0.52 -0.03 119.66 122.86 2gpl s GLN 112 Ca -0.08 -0.58 -0.01 0.00 0.05 0.00 0.00 55.36 54.74 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 0.17 0.04 0.42 -0.55 0.00 0.00 175.29 175.41 2gpl s ILE 113 N 0.51 -0.02 0.62 -2.34 1.01 -0.50 -1.63 121.20 118.85 2gpl s ILE 113 Ca -0.05 0.30 -0.01 0.00 0.00 0.00 0.00 60.65 60.89 2gpl s ILE 113 Cb -0.15 -0.17 0.06 0.00 0.01 0.00 0.00 42.46 42.21 2gpl s ILE 113 CO 0.03 0.15 0.87 1.51 0.00 0.00 0.00 174.94 177.51 2gpl s ASP 114 N 1.68 4.95 0.33 3.58 3.84 -0.77 -0.70 116.67 129.58 2gpl s ASP 114 Ca -0.01 -0.01 0.23 0.00 -0.00 0.00 0.00 52.55 52.76 2gpl s ASP 114 Cb -0.13 -0.71 1.20 0.00 -1.38 0.00 0.00 42.92 41.91 2gpl s ASP 114 CO -0.03 -1.41 1.70 0.10 -0.00 0.00 0.00 175.17 175.53 2gpl h TYR 115 N -0.21 0.00 0.00 2.11 -0.00 -1.81 -0.64 116.97 116.42 2gpl h TYR 115 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.32 2gpl h TYR 115 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.02 2gpl h TYR 115 CO 0.22 0.00 -0.08 1.28 -0.00 0.00 0.00 178.16 179.58 2gpl n LEU 116 N -2.29 0.41 0.00 0.10 4.77 -1.26 -4.54 117.00 114.19 2gpl n LEU 116 Ca -0.01 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 2gpl n LEU 116 Cb 0.06 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 2gpl n LEU 116 CO 0.11 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 2gpl n GLY 117 N 1.41 1.27 3.57 -0.72 0.00 -0.25 -4.29 105.19 106.19 2gpl n GLY 117 Ca 0.06 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 4.82 0.09 2.61 2.01 -1.24 -4.81 115.64 117.12 2gpl s THR 118 Ca 0.00 0.67 0.08 0.00 0.31 0.00 0.00 61.69 62.75 2gpl s THR 118 Cb 0.00 -4.14 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 2gpl s THR 118 CO 0.00 -0.38 -0.17 -0.75 -0.69 0.00 0.00 174.62 172.62 2gpl s LYS 119 N 2.88 1.92 -0.02 4.92 2.20 -1.26 -1.85 119.74 128.53 2gpl s LYS 119 Ca 0.27 -1.09 -0.25 0.00 -0.36 0.00 0.00 55.97 54.54 2gpl s LYS 119 Cb -0.14 -2.16 0.05 0.00 -1.51 0.00 0.00 37.83 34.08 2gpl s LYS 119 CO 0.16 0.51 0.55 0.54 -0.36 0.00 0.00 175.35 176.75 2gpl s VAL 120 N -1.07 0.02 -0.12 4.02 0.11 -0.65 -5.01 120.40 117.71 2gpl s VAL 120 Ca 0.17 -0.17 -0.05 0.00 -2.93 0.00 0.00 61.98 59.00 2gpl s VAL 120 Cb -0.11 -0.90 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 2gpl s VAL 120 CO 0.09 -0.09 0.08 -0.70 -3.33 0.00 0.00 175.10 171.14 2gpl s GLU 121 N -1.50 3.37 0.09 1.54 2.12 -1.26 -1.44 118.70 121.61 2gpl s GLU 121 Ca -0.10 -0.26 -0.06 0.00 0.36 0.00 0.00 54.97 54.90 2gpl s GLU 121 Cb -0.01 -3.05 -0.01 0.00 0.26 0.00 0.00 34.13 31.31 2gpl s GLU 121 CO 0.06 0.67 0.13 -0.51 -0.54 0.00 0.00 175.26 175.06 2gpl s LEU 122 N -0.74 1.71 0.23 2.70 1.43 -0.92 -5.00 118.68 118.09 2gpl s LEU 122 Ca 0.12 -0.79 0.04 0.00 -1.03 0.00 0.00 54.13 52.47 2gpl s LEU 122 Cb -0.12 0.78 0.23 0.00 0.03 0.00 0.00 46.19 47.11 2gpl s LEU 122 CO 0.03 -0.70 1.54 -0.65 0.23 0.00 0.00 176.35 176.80 2gpl h PRO 123 N 2.85 0.24 -2.01 1.29 0.11 -1.90 -3.38 132.00 129.20 2gpl h PRO 123 Ca -0.34 -0.17 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 2gpl h PRO 123 Cb 1.18 0.03 -0.19 0.00 0.11 0.00 0.00 31.00 32.13 2gpl h PRO 123 CO 0.59 0.79 0.24 1.52 -0.21 0.00 0.00 178.00 180.92 2gpl s TYR 124 N -3.71 -0.61 0.33 0.65 1.13 -1.26 0.11 117.35 113.98 2gpl s TYR 124 Ca -0.04 1.01 -0.16 0.00 -1.41 0.00 0.00 57.07 56.47 2gpl s TYR 124 Cb 0.12 0.43 0.03 0.00 -1.10 0.00 0.00 41.96 41.43 2gpl s TYR 124 CO 0.80 -0.59 0.70 0.20 -2.51 0.00 0.00 175.55 174.15 2gpl s GLY 125 N -1.29 0.34 0.38 5.49 0.00 -0.52 -5.00 107.32 106.71 2gpl s GLY 125 Ca -0.09 -0.69 -0.09 0.00 0.00 0.00 0.00 44.72 43.85 2gpl s GLY 125 CO 0.07 -0.34 0.66 0.00 0.00 0.00 0.00 173.10 173.49 2gpl s ALA 126 N -3.15 -0.03 0.02 3.20 0.00 -1.26 -1.62 121.76 118.92 2gpl s ALA 126 Ca 0.16 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 51.01 2gpl s ALA 126 Cb -0.04 0.88 -0.01 0.00 0.00 0.00 0.00 23.12 23.94 2gpl s ALA 126 CO 0.10 -0.90 -0.05 -1.01 0.00 0.00 0.00 175.76 173.90 2gpl s HIS 127 N -2.52 0.45 0.00 0.00 3.76 -1.14 -4.86 115.29 110.99 2gpl s HIS 127 Ca 0.22 -0.31 0.00 0.00 -0.15 0.00 0.00 55.06 54.82 2gpl s HIS 127 Cb -0.03 -0.28 0.00 0.00 1.11 0.00 0.00 32.58 33.38 2gpl s HIS 127 CO 0.16 -0.07 0.00 0.41 -0.85 0.00 0.00 174.74 174.39 2gpl n GLY 128 N 2.16 0.42 0.14 -2.22 0.00 -1.26 -3.62 105.19 100.80 2gpl n GLY 128 Ca -0.18 -0.92 0.12 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.75 1.61 0.05 -1.93 -3.37 116.97 112.58 2gpl h TYR 129 Ca 0.00 0.00 0.16 0.00 0.05 0.00 0.00 58.73 58.94 2gpl h TYR 129 Cb 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 36.73 37.61 2gpl h TYR 129 CO 0.00 0.00 -0.06 0.77 -1.05 0.00 0.00 178.16 177.82 2gpl h SER 130 N 0.00 -0.46 -0.88 3.88 0.02 -1.89 0.98 113.55 115.21 2gpl h SER 130 Ca 0.00 0.20 0.10 0.00 -0.84 0.00 0.00 61.79 61.26 2gpl h SER 130 Cb 0.88 0.38 -0.06 0.00 0.14 0.00 0.00 62.40 63.74 2gpl h SER 130 CO 0.00 -0.20 0.57 1.23 -1.14 0.00 0.00 176.83 177.29 2gpl h GLY 131 N 0.07 1.26 1.46 -3.77 0.00 -1.80 -1.85 103.07 98.43 2gpl h GLY 131 Ca 0.39 -0.35 0.07 0.00 0.00 0.00 0.00 47.33 47.44 2gpl h GLY 131 CO -0.70 0.19 0.20 0.74 0.00 0.00 0.00 176.54 176.97 2gpl h PHE 132 N 0.85 0.00 0.00 5.60 0.04 -1.06 -0.24 116.94 122.14 2gpl h PHE 132 Ca 0.41 0.00 -0.36 0.00 2.80 0.00 0.00 57.97 60.83 2gpl h PHE 132 Cb 0.45 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.53 2gpl h PHE 132 CO -0.00 0.00 -2.35 0.66 -0.60 0.00 0.00 178.31 176.02 2gpl n TYR 133 N -4.25 0.00 -0.00 -0.55 4.01 -0.80 -4.70 117.16 110.87 2gpl n TYR 133 Ca 0.03 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.77 2gpl n TYR 133 Cb 0.35 -0.94 -0.11 0.00 -0.31 0.00 0.00 39.34 38.33 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 -2.96 1.06 0.28 -0.72 -2.24 -0.76 -4.42 114.28 104.51 2gpl n THR 134 Ca -0.37 -0.70 0.11 0.00 -2.27 0.00 0.00 64.05 60.82 2gpl n THR 134 Cb 1.04 -0.58 0.76 0.00 -2.10 0.00 0.00 70.33 69.46 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 -0.02 4.78 0.04 -1.26 -1.38 116.94 119.10 2gpl h PHE 135 Ca -0.22 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.38 2gpl h PHE 135 Cb 1.63 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.77 2gpl h PHE 135 CO 0.00 0.02 -0.76 0.66 -0.60 0.00 0.00 178.31 177.63 2gpl h SER 136 N 0.00 0.23 -0.08 2.17 4.64 -1.80 -0.34 113.55 118.37 2gpl h SER 136 Ca -0.00 -0.16 -0.04 0.00 -0.47 0.00 0.00 61.79 61.12 2gpl h SER 136 Cb 0.03 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2gpl h SER 136 CO 0.00 0.90 -0.10 -0.07 -0.87 0.00 0.00 176.83 176.68 2gpl h LEU 137 N 0.12 0.22 -0.45 5.97 3.38 -1.53 -2.92 115.31 120.10 2gpl h LEU 137 Ca -0.02 -0.52 -0.04 0.00 0.09 0.00 0.00 57.88 57.38 2gpl h LEU 137 Cb 1.33 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 2gpl h LEU 137 CO 0.11 0.70 0.10 -0.07 0.09 0.00 0.00 178.44 179.38 2gpl h LEU 138 N -0.25 0.68 -1.93 1.67 3.38 -1.32 -0.15 115.31 117.40 2gpl h LEU 138 Ca 0.01 -0.24 0.19 0.00 0.09 0.00 0.00 57.88 57.93 2gpl h LEU 138 Cb 0.65 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2gpl h LEU 138 CO 0.02 0.74 0.49 0.44 0.09 0.00 0.00 178.44 180.22 2gpl h ASP 139 N 0.59 0.06 0.00 -0.43 3.32 -1.10 0.19 116.42 119.06 2gpl h ASP 139 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2gpl h ASP 139 Cb 0.33 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2gpl h ASP 139 CO 0.00 0.03 -0.10 -0.74 -1.72 0.00 0.00 179.24 176.72 2gpl h HIS 140 N 0.07 0.00 -0.00 4.55 2.76 -1.15 -3.40 115.15 117.97 2gpl h HIS 140 Ca 0.33 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.50 2gpl h HIS 140 Cb 1.21 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.17 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 -3.65 0.00 -2.33 5.26 8.25 -0.15 -4.92 115.22 117.68 2gpl n HIS 141 Ca -0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.04 2gpl n HIS 141 Cb 0.05 -0.27 -0.03 0.00 1.12 0.00 0.00 29.99 30.85 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 -2.61 3.38 -0.02 4.41 5.04 0.05 -5.03 117.35 122.57 2gpl s TYR 142 Ca 0.26 1.41 0.00 0.00 -2.44 0.00 0.00 57.07 56.31 2gpl s TYR 142 Cb 0.20 -3.47 0.02 0.00 0.35 0.00 0.00 41.96 39.06 2gpl s TYR 142 CO 0.48 -1.32 0.01 1.03 -1.34 0.00 0.00 175.55 174.41 2gpl s ARG 143 N -0.50 0.11 0.57 4.97 1.81 -1.26 -5.02 118.95 119.64 2gpl s ARG 143 Ca 0.52 0.08 0.27 0.00 -1.72 0.00 0.00 55.73 54.89 2gpl s ARG 143 Cb -0.34 -0.28 1.58 0.00 -0.45 0.00 0.00 34.95 35.46 2gpl s ARG 143 CO 0.39 -0.10 2.08 -1.35 -0.68 0.00 0.00 175.30 175.64 2gpl h PRO 144 N 6.94 0.00 -0.58 3.54 0.11 -1.96 -2.27 132.00 137.78 2gpl h PRO 144 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2gpl h PRO 144 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2gpl h PRO 144 CO 0.49 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.88 2gpl n ASP 145 N -3.95 3.27 -4.61 -2.05 3.85 -1.26 -3.21 116.55 108.60 2gpl n ASP 145 Ca 0.03 -1.99 -0.38 0.00 -0.71 0.00 0.00 54.79 51.74 2gpl n ASP 145 Cb 0.36 -0.38 0.05 0.00 -1.35 0.00 0.00 41.12 39.80 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 1.30 0.88 -3.00 0.11 2.81 -0.86 -4.61 117.12 113.75 2gpl n MET 146 Ca 0.20 0.34 -0.24 0.00 -1.81 0.00 0.00 57.70 56.20 2gpl n MET 146 Cb 0.53 -2.13 0.00 0.00 -0.71 0.00 0.00 33.22 30.91 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 -1.52 4.42 0.50 2.03 -4.23 -1.26 -1.44 115.64 114.13 2gpl s THR 147 Ca 0.75 -0.34 0.23 0.00 -1.18 0.00 0.00 61.69 61.15 2gpl s THR 147 Cb -0.42 -3.64 0.40 0.00 1.34 0.00 0.00 72.50 70.18 2gpl s THR 147 CO 0.48 -0.49 1.94 0.74 -0.54 0.00 0.00 174.62 176.75 2gpl h THR 148 N 0.43 0.71 -0.24 3.99 2.02 -1.96 0.13 112.91 117.99 2gpl h THR 148 Ca -0.47 -0.05 -0.17 0.00 0.77 0.00 0.00 66.41 66.49 2gpl h THR 148 Cb 1.24 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 2gpl h THR 148 CO 0.59 0.03 -0.53 -0.08 0.37 0.00 0.00 175.52 175.90 2gpl h GLU 149 N 0.14 0.79 -0.41 6.66 4.57 -1.99 -1.14 114.58 123.19 2gpl h GLU 149 Ca 0.34 -0.52 -0.11 0.00 -1.18 0.00 0.00 59.36 57.88 2gpl h GLU 149 Cb 1.13 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.77 2gpl h GLU 149 CO -0.05 1.15 -0.19 0.93 -1.18 0.00 0.00 179.01 179.67 2gpl h GLU 150 N 0.53 0.80 -0.18 1.92 5.08 -1.36 -2.65 114.58 118.72 2gpl h GLU 150 Ca 0.00 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2gpl h GLU 150 Cb 1.14 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 2gpl h GLU 150 CO 0.12 0.93 0.08 0.78 -1.00 0.00 0.00 179.01 179.91 2gpl h GLY 151 N 0.96 0.29 2.00 -3.84 0.00 -0.73 -1.20 103.07 100.55 2gpl h GLY 151 Ca 0.10 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 2gpl h GLY 151 CO 0.05 0.15 -0.00 1.41 0.00 0.00 0.00 176.54 178.14 2gpl h LEU 152 N 0.15 0.00 0.13 3.11 3.38 -1.07 -0.76 115.31 120.25 2gpl h LEU 152 Ca 0.06 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.74 2gpl h LEU 152 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2gpl h LEU 152 CO -0.01 0.00 -1.40 0.44 0.09 0.00 0.00 178.44 177.57 2gpl h ASP 153 N 0.00 0.44 -0.37 -0.43 3.45 -1.04 -2.59 116.42 115.87 2gpl h ASP 153 Ca -0.00 -0.53 -0.09 0.00 0.43 0.00 0.00 57.03 56.84 2gpl h ASP 153 Cb 0.02 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 38.63 2gpl h ASP 153 CO 0.00 1.43 -0.07 0.25 -1.57 0.00 0.00 179.24 179.28 2gpl h LEU 154 N 0.08 0.77 0.17 1.55 5.85 -0.04 -2.06 115.31 121.63 2gpl h LEU 154 Ca -0.20 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 2gpl h LEU 154 Cb 2.01 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.83 2gpl h LEU 154 CO 0.19 0.88 -0.08 -0.07 -0.34 0.00 0.00 178.44 179.02 2gpl h LEU 155 N 0.73 -0.19 -0.84 2.25 3.38 -1.24 -1.42 115.31 117.97 2gpl h LEU 155 Ca 0.13 -0.19 0.21 0.00 0.09 0.00 0.00 57.88 58.12 2gpl h LEU 155 Cb 0.54 0.05 -0.13 0.00 0.09 0.00 0.00 40.66 41.21 2gpl h LEU 155 CO 0.03 0.09 0.24 0.50 0.09 0.00 0.00 178.44 179.38 2gpl h LYS 156 N -0.48 0.25 -0.10 1.13 3.64 -1.29 0.59 116.57 120.30 2gpl h LYS 156 Ca -0.02 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2gpl h LYS 156 Cb 0.37 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2gpl h LYS 156 CO 0.04 0.16 0.06 1.25 -2.27 0.00 0.00 179.45 178.69 2gpl h LEU 157 N 0.25 0.10 -0.14 5.20 5.85 -1.04 -0.76 115.31 124.78 2gpl h LEU 157 Ca 0.51 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 59.26 2gpl h LEU 157 Cb 0.97 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 2gpl h LEU 157 CO -0.60 0.07 -0.07 0.00 -0.34 0.00 0.00 178.44 177.51 2gpl h VAL 159 N -0.05 1.06 -0.25 0.00 2.07 0.17 -1.47 116.25 117.77 2gpl h VAL 159 Ca 0.08 -0.18 -0.15 0.00 0.82 0.00 0.00 66.70 67.27 2gpl h VAL 159 Cb 0.17 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2gpl h VAL 159 CO -0.17 0.07 -0.44 1.56 0.02 0.00 0.00 177.57 178.61 2gpl h GLN 160 N 0.19 0.74 -0.64 1.57 4.20 -0.43 -0.78 115.11 119.96 2gpl h GLN 160 Ca 0.05 -0.46 -0.02 0.00 0.06 0.00 0.00 58.65 58.27 2gpl h GLN 160 Cb 0.04 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 2gpl h GLN 160 CO -0.01 1.09 0.30 1.49 -0.67 0.00 0.00 178.83 181.03 2gpl h GLU 161 N 0.48 0.90 -0.38 1.46 4.57 -0.76 -1.03 114.58 119.82 2gpl h GLU 161 Ca 0.02 -0.12 -0.07 0.00 -1.18 0.00 0.00 59.36 58.01 2gpl h GLU 161 Cb 1.04 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.44 2gpl h GLU 161 CO 0.10 0.70 -0.04 -0.07 -1.18 0.00 0.00 179.01 178.52 2gpl h LEU 162 N 0.90 0.69 -1.68 1.64 3.38 -1.08 -1.63 115.31 117.53 2gpl h LEU 162 Ca 0.22 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 2gpl h LEU 162 Cb 0.10 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 2gpl h LEU 162 CO -0.03 0.86 -0.13 -0.33 0.09 0.00 0.00 178.44 178.91 2gpl h GLU 163 N 0.50 0.00 0.00 1.13 5.08 -0.58 -1.34 114.58 119.37 2gpl h GLU 163 Ca 0.10 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2gpl h GLU 163 Cb 0.53 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2gpl h GLU 163 CO 0.03 0.13 -0.09 -0.22 -1.00 0.00 0.00 179.01 177.86 2gpl h LYS 164 N 0.00 0.00 0.00 2.33 3.64 -0.91 -3.41 116.57 118.22 2gpl h LYS 164 Ca -0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2gpl h LYS 164 Cb 0.47 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2gpl h LYS 164 CO 0.02 0.56 -1.08 0.54 -2.27 0.00 0.00 179.45 177.22 2gpl n ARG 165 N -4.67 0.61 -2.74 1.90 5.12 -0.64 -4.92 116.66 111.32 2gpl n ARG 165 Ca -0.07 0.13 -0.41 0.00 -1.93 0.00 0.00 57.85 55.57 2gpl n ARG 165 Cb 0.29 -1.82 -0.04 0.00 -1.16 0.00 0.00 32.46 29.73 2gpl n ARG 165 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 2gpl s MET 166 N -3.30 4.66 0.38 5.56 -1.94 -0.51 -4.96 119.30 119.19 2gpl s MET 166 Ca -0.01 1.42 0.06 0.00 -1.71 0.00 0.00 55.69 55.45 2gpl s MET 166 Cb 0.09 -3.39 0.75 0.00 2.01 0.00 0.00 34.83 34.29 2gpl s MET 166 CO 0.80 0.16 1.97 -1.35 -0.01 0.00 0.00 175.02 176.59 2gpl h PRO 167 N 5.84 0.50 -6.64 2.03 0.11 -1.91 -3.45 132.00 128.47 2gpl h PRO 167 Ca -0.43 -0.07 -0.51 0.00 0.11 0.00 0.00 66.00 65.11 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 0.72 0.44 0.01 -1.64 -0.21 0.00 0.00 178.00 177.32 2gpl s MET 168 N -5.19 3.83 -0.49 1.05 -1.94 -1.26 -5.04 119.30 110.27 2gpl s MET 168 Ca -0.08 0.41 -0.16 0.00 -1.71 0.00 0.00 55.69 54.15 2gpl s MET 168 Cb 0.16 -2.51 0.08 0.00 2.01 0.00 0.00 34.83 34.57 2gpl s MET 168 CO 0.74 0.16 0.46 0.34 -0.01 0.00 0.00 175.02 176.71 2gpl s ASP 169 N -2.66 6.17 0.00 3.03 -1.08 -1.26 -4.92 116.67 115.95 2gpl s ASP 169 Ca 0.50 -1.29 0.13 0.00 -0.52 0.00 0.00 52.55 51.37 2gpl s ASP 169 Cb -0.11 -2.21 0.39 0.00 -1.46 0.00 0.00 42.92 39.54 2gpl s ASP 169 CO 0.24 -0.73 1.32 2.22 0.52 0.00 0.00 175.17 178.74 2gpl n PHE 170 N 5.42 0.49 -3.77 -5.34 1.16 -1.26 -4.89 117.46 109.26 2gpl n PHE 170 Ca -0.11 -0.24 -0.28 0.00 -1.87 0.00 0.00 57.45 54.94 2gpl n PHE 170 Cb 0.44 0.00 0.04 0.00 -1.61 0.00 0.00 39.48 38.35 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 0.61 -6.15 -0.35 3.97 4.76 -1.26 -1.72 118.16 118.03 2gpl n LYS 171 Ca 0.13 0.67 0.05 0.00 -2.87 0.00 0.00 58.31 56.29 2gpl n LYS 171 Cb 0.33 -5.61 -0.01 0.00 -1.84 0.00 0.00 35.03 27.90 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 -1.76 -2.04 3.32 0.72 0.00 -1.26 -4.32 105.19 99.85 2gpl n GLY 172 Ca 0.03 -1.38 -0.17 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.04 1.54 -0.16 1.61 -7.23 -1.26 -1.54 120.40 112.33 2gpl s VAL 173 Ca 0.00 -2.16 -0.04 0.00 -1.81 0.00 0.00 61.98 57.98 2gpl s VAL 173 Cb 0.00 -2.03 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 2gpl s VAL 173 CO 0.00 -0.60 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.52 2gpl s ILE 174 N -3.09 3.87 0.06 -0.62 1.01 -0.14 -4.88 121.20 117.40 2gpl s ILE 174 Ca 0.22 -0.36 0.05 0.00 0.00 0.00 0.00 60.65 60.55 2gpl s ILE 174 Cb 0.01 -2.70 -0.04 0.00 0.01 0.00 0.00 42.46 39.74 2gpl s ILE 174 CO 0.06 0.49 -0.05 -0.69 0.00 0.00 0.00 174.94 174.75 2gpl s VAL 175 N 0.41 3.75 -0.00 2.92 1.01 -1.26 -1.82 120.40 125.40 2gpl s VAL 175 Ca -0.04 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 60.95 2gpl s VAL 175 Cb -0.14 -2.72 -0.00 0.00 0.00 0.00 0.00 36.38 33.52 2gpl s VAL 175 CO 0.03 0.23 0.09 -0.54 0.00 0.00 0.00 175.10 174.91 2gpl s LYS 176 N -1.92 0.35 -0.04 2.72 1.02 -0.43 -2.23 119.74 119.22 2gpl s LYS 176 Ca 0.21 -0.32 0.05 0.00 0.02 0.00 0.00 55.97 55.94 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 0.13 -0.07 -0.19 0.42 -0.92 0.00 0.00 175.35 174.72 2gpl s ILE 177 N -1.05 2.69 -0.17 2.17 1.01 0.25 -1.43 121.20 124.68 2gpl s ILE 177 Ca -0.11 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.68 2gpl s ILE 177 Cb -0.07 -2.02 0.03 0.00 0.01 0.00 0.00 42.46 40.42 2gpl s ILE 177 CO 0.01 0.59 -0.14 -0.69 0.00 0.00 0.00 174.94 174.70 2gpl s VAL 178 N -0.68 1.68 0.15 2.92 1.01 -0.24 -1.72 120.40 123.53 2gpl s VAL 178 Ca 0.11 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.30 2gpl s VAL 178 Cb -0.10 -1.61 -0.00 0.00 0.00 0.00 0.00 36.38 34.66 2gpl s VAL 178 CO -0.00 0.38 0.17 -0.90 0.00 0.00 0.00 175.10 174.76 2gpl n ASP 179 N 4.72 -0.47 0.32 3.32 5.68 -0.34 -1.14 116.55 128.64 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 0.94 0.71 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 -0.02 0.11 2.10 -1.93 0.99 116.57 117.82 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 0.51 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 2gpl h LYS 180 CO 0.15 0.00 -0.20 -0.25 -2.00 0.00 0.00 179.45 177.15 2gpl n ASP 181 N -2.78 2.49 0.00 7.07 8.00 -1.26 -5.08 116.55 124.99 2gpl n ASP 181 Ca -0.02 -1.75 0.00 0.00 0.71 0.00 0.00 54.79 53.74 2gpl n ASP 181 Cb 0.43 0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.74 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 1.33 0.32 3.16 0.44 0.00 0.34 -5.03 105.19 105.76 2gpl n GLY 183 Ca 0.11 -1.95 -0.31 0.00 0.00 0.00 0.00 46.02 43.88 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 -0.76 1.89 0.07 -0.61 1.01 -1.24 -1.20 121.20 120.35 2gpl s ILE 184 Ca 0.00 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.77 2gpl s ILE 184 Cb 0.00 -1.66 -0.03 0.00 0.01 0.00 0.00 42.46 40.78 2gpl s ILE 184 CO 0.00 0.52 -0.08 0.00 0.00 0.00 0.00 174.94 175.38 2gpl s ARG 185 N 0.60 0.68 -0.22 2.79 1.70 -0.70 -4.98 118.95 118.84 2gpl s ARG 185 Ca -0.13 -1.02 -0.07 0.00 -0.47 0.00 0.00 55.73 54.05 2gpl s ARG 185 Cb -0.17 -0.31 -0.03 0.00 -0.57 0.00 0.00 34.95 33.87 2gpl s ARG 185 CO 0.04 0.04 0.05 -1.14 -1.08 0.00 0.00 175.30 173.20 2gpl s GLN 186 N -2.52 3.71 -0.85 3.89 0.74 -1.26 -0.58 119.66 122.78 2gpl s GLN 186 Ca -0.00 -0.46 -0.25 0.00 0.05 0.00 0.00 55.36 54.70 2gpl s GLN 186 Cb -0.04 -3.22 -0.03 0.00 1.10 0.00 0.00 33.01 30.83 2gpl s GLN 186 CO -0.01 -0.02 1.83 0.08 -0.55 0.00 0.00 175.29 176.62 2gpl s VAL 187 N 1.14 3.51 -2.00 1.34 1.01 -0.95 -4.79 120.40 119.66 2gpl s VAL 187 Ca 0.04 -0.27 0.12 0.00 0.00 0.00 0.00 61.98 61.87 2gpl s VAL 187 Cb -0.14 -4.18 0.35 0.00 0.00 0.00 0.00 36.38 32.41 2gpl s VAL 187 CO 0.03 -1.12 1.24 -0.90 0.00 0.00 0.00 175.10 174.35 2gpl n ASP 188 N 12.83 0.00 -3.39 3.32 3.85 -1.26 -4.08 116.55 127.82 2gpl n ASP 188 Ca 0.34 -0.94 -0.26 0.00 -0.71 0.00 0.00 54.79 53.22 2gpl n ASP 188 Cb 0.49 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 -0.79 2.06 0.00 -1.12 5.75 -1.26 -4.76 116.55 116.43 2gpl n ASP 189 Ca 0.09 -3.06 0.00 0.00 -0.01 0.00 0.00 54.79 51.81 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 1.34 0.00 0.61 2.11 -0.00 -1.26 -4.01 117.46 116.26 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 0.35 0.00 -0.00 0.00 0.00 39.48 40.28 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 0.11 -2.65 -4.13 3.00 -1.26 -3.94 117.38 108.10 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 0.12 0.00 0.00 0.00 0.00 30.24 28.89 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 -1.40 -3.48 1.64 -1.58 0.00 -1.26 -5.19 120.51 109.24 2gpl n ALA 192 Ca 0.05 -0.24 0.15 0.00 0.00 0.00 0.00 53.44 53.40 2gpl n ALA 192 Cb 0.15 -3.42 0.64 0.00 0.00 0.00 0.00 19.45 16.83 2gpl n ALA 192 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44