#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gpl s TYR 8 N 0.00 2.18 -0.15 1.61 5.04 -1.26 -4.86 117.35 119.91 2gpl s TYR 8 Ca 0.00 0.65 0.19 0.00 -2.44 0.00 0.00 57.07 55.46 2gpl s TYR 8 Cb 0.00 -4.14 0.45 0.00 0.35 0.00 0.00 41.96 38.62 2gpl s TYR 8 CO 0.00 -2.48 1.17 -0.40 -1.34 0.00 0.00 175.55 172.51 2gpl n ASP 9 N 9.05 1.83 -4.77 4.32 5.75 -1.26 -3.97 116.55 127.51 2gpl n ASP 9 Ca 0.19 -2.76 -0.41 0.00 -0.01 0.00 0.00 54.79 51.80 2gpl n ASP 9 Cb 0.47 -0.40 -0.00 0.00 -1.03 0.00 0.00 41.12 40.15 2gpl n ASP 9 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 2gpl n ARG 10 N -0.32 2.65 -2.54 0.11 0.00 -1.26 -3.60 116.66 111.70 2gpl n ARG 10 Ca 0.15 0.93 -0.41 0.00 -0.00 0.00 0.00 57.85 58.52 2gpl n ARG 10 Cb 0.93 -2.66 -0.03 0.00 0.00 0.00 0.00 32.46 30.70 2gpl n ARG 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2gpl s ALA 11 N -1.00 2.71 0.01 5.13 0.00 -1.26 0.02 121.76 127.38 2gpl s ALA 11 Ca 0.54 -1.65 -0.02 0.00 0.00 0.00 0.00 51.96 50.84 2gpl s ALA 11 Cb -0.48 -4.35 -0.27 0.00 0.00 0.00 0.00 23.12 18.01 2gpl s ALA 11 CO 0.62 -3.43 0.90 -0.07 0.00 0.00 0.00 175.76 173.78 2gpl h LEU 12 N 13.07 0.35 -8.15 0.00 3.38 -1.85 -3.42 115.31 118.69 2gpl h LEU 12 Ca -0.12 -0.47 -0.74 0.00 0.09 0.00 0.00 57.88 56.64 2gpl h LEU 12 Cb 1.04 -0.11 -0.23 0.00 0.09 0.00 0.00 40.66 41.45 2gpl h LEU 12 CO 1.33 1.39 -0.18 -0.44 0.09 0.00 0.00 178.44 180.63 2gpl s SER 13 N -6.93 6.18 0.29 -0.43 0.01 -1.26 -4.70 113.70 106.86 2gpl s SER 13 Ca -0.08 -1.62 0.02 0.00 1.31 0.00 0.00 55.95 55.59 2gpl s SER 13 Cb 0.07 -2.22 -0.05 0.00 0.21 0.00 0.00 66.02 64.03 2gpl s SER 13 CO 0.85 -0.86 0.10 0.27 0.41 0.00 0.00 173.24 174.01 2gpl s ILE 14 N 1.82 0.63 0.32 1.44 -4.36 -1.26 -4.81 121.20 114.98 2gpl s ILE 14 Ca 0.05 -2.00 -0.18 0.00 -0.26 0.00 0.00 60.65 58.26 2gpl s ILE 14 Cb -0.28 -2.63 -0.09 0.00 1.25 0.00 0.00 42.46 40.71 2gpl s ILE 14 CO 0.04 0.00 0.80 -0.36 0.24 0.00 0.00 174.94 175.66 2gpl s PHE 15 N -3.62 3.44 0.24 1.37 0.08 -1.26 -4.22 117.98 114.01 2gpl s PHE 15 Ca 0.36 1.38 0.10 0.00 0.12 0.00 0.00 56.93 58.90 2gpl s PHE 15 Cb 0.07 -2.65 -0.04 0.00 -0.57 0.00 0.00 43.02 39.83 2gpl s PHE 15 CO 0.15 0.11 -0.08 -1.54 -0.10 0.00 0.00 175.22 173.75 2gpl s SER 16 N -2.07 4.21 0.18 1.36 1.04 -0.08 -4.95 113.70 113.39 2gpl s SER 16 Ca 0.53 -0.71 -0.01 0.00 0.48 0.00 0.00 55.95 56.24 2gpl s SER 16 Cb -0.12 -0.67 0.40 0.00 0.10 0.00 0.00 66.02 65.73 2gpl s SER 16 CO 0.18 0.05 0.93 -2.65 0.98 0.00 0.00 173.24 172.73 2gpl n PRO 17 N -0.48 -0.05 0.00 4.02 -0.02 -1.26 0.58 135.00 137.79 2gpl n PRO 17 Ca -0.08 0.91 0.12 0.00 -2.02 0.00 0.00 63.50 62.43 2gpl n PRO 17 Cb 0.58 -1.41 0.70 0.00 -0.02 0.00 0.00 33.50 33.35 2gpl n PRO 17 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2gpl n ASP 18 N -4.83 0.00 0.00 2.55 5.75 -1.26 -4.87 116.55 113.89 2gpl n ASP 18 Ca 0.13 -0.89 0.00 0.00 -0.01 0.00 0.00 54.79 54.01 2gpl n ASP 18 Cb 0.41 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.50 2gpl n ASP 18 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2gpl n GLY 19 N 0.60 0.75 3.68 6.12 0.00 0.20 -5.08 105.19 111.46 2gpl n GLY 19 Ca 0.18 -0.68 -0.25 0.00 0.00 0.00 0.00 46.02 45.26 2gpl n GLY 19 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2gpl s HIS 20 N -2.00 2.84 -0.56 1.61 3.76 -1.22 -4.86 115.29 114.86 2gpl s HIS 20 Ca 0.00 -0.15 0.02 0.00 -0.15 0.00 0.00 55.06 54.78 2gpl s HIS 20 Cb 0.00 -1.34 0.14 0.00 1.11 0.00 0.00 32.58 32.49 2gpl s HIS 20 CO 0.00 0.54 0.32 0.42 -0.85 0.00 0.00 174.74 175.18 2gpl s ILE 21 N -1.92 2.96 0.29 0.60 1.01 -1.26 -0.90 121.20 121.97 2gpl s ILE 21 Ca 0.29 -3.24 0.04 0.00 0.00 0.00 0.00 60.65 57.74 2gpl s ILE 21 Cb -0.08 -3.00 0.28 0.00 0.01 0.00 0.00 42.46 39.67 2gpl s ILE 21 CO 0.20 -0.83 1.75 -0.26 0.00 0.00 0.00 174.94 175.79 2gpl h PHE 22 N 6.63 0.88 -0.25 3.97 0.04 -1.95 -0.74 116.94 125.53 2gpl h PHE 22 Ca -0.06 0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 2gpl h PHE 22 Cb 0.91 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.80 2gpl h PHE 22 CO 0.58 0.13 0.12 1.96 -0.60 0.00 0.00 178.31 180.51 2gpl h GLN 23 N 0.62 0.33 -0.03 1.51 1.08 -1.88 0.44 115.11 117.18 2gpl h GLN 23 Ca 0.55 -0.03 -0.25 0.00 -1.45 0.00 0.00 58.65 57.47 2gpl h GLN 23 Cb 0.90 -0.07 0.02 0.00 -0.05 0.00 0.00 27.48 28.28 2gpl h GLN 23 CO -0.42 0.26 -0.98 0.28 -0.95 0.00 0.00 178.83 177.03 2gpl h VAL 24 N 0.34 1.30 -0.51 -0.54 2.07 -1.56 -1.91 116.25 115.43 2gpl h VAL 24 Ca 0.09 -2.23 -0.02 0.00 0.82 0.00 0.00 66.70 65.36 2gpl h VAL 24 Cb 0.04 2.31 -0.02 0.00 -1.52 0.00 0.00 31.29 32.10 2gpl h VAL 24 CO -0.01 0.69 0.26 -0.08 0.02 0.00 0.00 177.57 178.45 2gpl h GLU 25 N 0.39 0.73 0.00 1.57 4.57 -0.51 -1.87 114.58 119.47 2gpl h GLU 25 Ca -0.11 -0.10 -0.08 0.00 -1.18 0.00 0.00 59.36 57.89 2gpl h GLU 25 Cb 1.62 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 30.06 2gpl h GLU 25 CO 0.19 0.59 -0.40 1.88 -1.18 0.00 0.00 179.01 180.09 2gpl h TYR 26 N 0.69 0.00 -0.57 0.92 0.05 -0.19 -2.32 116.97 115.55 2gpl h TYR 26 Ca 0.18 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.98 2gpl h TYR 26 Cb 0.09 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.80 2gpl h TYR 26 CO -0.01 0.40 0.36 0.00 -1.05 0.00 0.00 178.16 177.86 2gpl h ALA 27 N 1.60 0.73 -0.93 3.88 0.00 -0.55 -1.51 119.26 122.48 2gpl h ALA 27 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2gpl h ALA 27 Cb 0.79 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 2gpl h ALA 27 CO 0.05 0.11 0.58 -0.07 0.00 0.00 0.00 179.25 179.92 2gpl h LEU 28 N 0.72 1.10 -2.16 0.00 3.38 -0.90 -1.57 115.31 115.88 2gpl h LEU 28 Ca 0.22 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.17 2gpl h LEU 28 Cb -0.02 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 2gpl h LEU 28 CO -0.08 0.83 0.09 -0.33 0.09 0.00 0.00 178.44 179.05 2gpl h GLU 29 N 1.28 0.00 0.00 1.13 4.39 -0.99 0.16 114.58 120.56 2gpl h GLU 29 Ca 0.34 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.85 2gpl h GLU 29 Cb -0.08 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 2gpl h GLU 29 CO -0.07 0.00 -0.86 0.00 -1.16 0.00 0.00 179.01 176.92 2gpl h ALA 30 N 1.92 0.57 -0.25 3.43 0.00 -0.85 -3.07 119.26 121.01 2gpl h ALA 30 Ca 0.05 -0.75 -0.10 0.00 0.00 0.00 0.00 54.91 54.11 2gpl h ALA 30 Cb 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2gpl h ALA 30 CO -0.00 1.00 -0.25 0.28 0.00 0.00 0.00 179.25 180.28 2gpl h VAL 31 N 0.04 1.31 -0.28 0.00 2.07 -0.46 -2.77 116.25 116.16 2gpl h VAL 31 Ca -0.02 -1.41 0.08 0.00 0.82 0.00 0.00 66.70 66.17 2gpl h VAL 31 Cb 1.50 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.91 2gpl h VAL 31 CO 0.12 0.44 0.23 0.11 0.02 0.00 0.00 177.57 178.49 2gpl h LYS 32 N 0.33 0.00 0.00 1.57 1.57 -1.13 0.15 116.57 119.06 2gpl h LYS 32 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2gpl h LYS 32 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.12 2gpl h LYS 32 CO 0.06 0.00 -0.16 -0.09 -0.57 0.00 0.00 179.45 178.69 2gpl h ARG 33 N 0.00 0.00 -7.23 3.15 2.43 -1.40 -1.50 114.38 109.83 2gpl h ARG 33 Ca 0.13 0.00 -0.50 0.00 -0.81 0.00 0.00 59.98 58.80 2gpl h ARG 33 Cb 0.59 0.00 0.08 0.00 -0.42 0.00 0.00 29.97 30.22 2gpl h ARG 33 CO -0.00 0.00 0.37 0.20 -1.51 0.00 0.00 179.97 179.03 2gpl s GLY 34 N -3.94 2.03 0.46 2.80 0.00 0.51 -4.73 107.32 104.45 2gpl s GLY 34 Ca 0.08 0.38 -0.25 0.00 0.00 0.00 0.00 44.72 44.92 2gpl s GLY 34 CO 0.66 0.71 1.39 -1.30 0.00 0.00 0.00 173.10 174.55 2gpl n THR 35 N -2.42 2.90 -1.74 0.90 -2.24 -1.26 -1.05 114.28 109.36 2gpl n THR 35 Ca 0.09 -0.50 -0.40 0.00 -2.27 0.00 0.00 64.05 60.97 2gpl n THR 35 Cb 0.53 -1.76 0.03 0.00 -2.10 0.00 0.00 70.33 67.03 2gpl n THR 35 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gpl s ALA 37 N -1.24 0.33 0.02 0.00 0.00 0.52 -2.39 121.76 119.00 2gpl s ALA 37 Ca 0.65 -0.31 -0.10 0.00 0.00 0.00 0.00 51.96 52.20 2gpl s ALA 37 Cb -0.45 -0.03 0.01 0.00 0.00 0.00 0.00 23.12 22.65 2gpl s ALA 37 CO 0.54 0.03 0.21 0.54 0.00 0.00 0.00 175.76 177.09 2gpl s VAL 38 N -0.45 0.09 -0.10 0.00 0.11 -0.11 -0.36 120.40 119.58 2gpl s VAL 38 Ca -0.02 -0.74 -0.07 0.00 -2.93 0.00 0.00 61.98 58.22 2gpl s VAL 38 Cb -0.04 -0.73 0.04 0.00 -1.53 0.00 0.00 36.38 34.13 2gpl s VAL 38 CO -0.00 -0.41 0.25 -0.83 -3.33 0.00 0.00 175.10 170.78 2gpl s GLY 39 N -1.74 -0.16 -0.04 6.54 0.00 0.17 -0.32 107.32 111.77 2gpl s GLY 39 Ca -0.09 0.91 0.03 0.00 0.00 0.00 0.00 44.72 45.57 2gpl s GLY 39 CO -0.01 1.04 -0.12 -1.34 0.00 0.00 0.00 173.10 172.68 2gpl s VAL 40 N 0.87 1.01 -0.20 1.40 -7.23 -0.50 -1.15 120.40 114.60 2gpl s VAL 40 Ca -0.06 -0.47 -0.13 0.00 -1.81 0.00 0.00 61.98 59.51 2gpl s VAL 40 Cb -0.07 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.92 2gpl s VAL 40 CO -0.06 0.31 0.28 -1.59 -0.31 0.00 0.00 175.10 173.74 2gpl s LYS 41 N 0.28 4.18 0.00 4.82 -2.85 -0.04 -0.91 119.74 125.22 2gpl s LYS 41 Ca -0.06 0.01 0.00 0.00 -1.00 0.00 0.00 55.97 54.93 2gpl s LYS 41 Cb -0.11 -3.49 0.00 0.00 -2.06 0.00 0.00 37.83 32.17 2gpl s LYS 41 CO 0.02 0.10 0.00 0.41 0.10 0.00 0.00 175.35 175.98 2gpl n GLY 42 N 3.82 -0.09 0.11 0.59 0.00 0.33 -4.59 105.19 105.36 2gpl n GLY 42 Ca -0.12 -1.70 0.01 0.00 0.00 0.00 0.00 46.02 44.21 2gpl n GLY 42 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2gpl h LYS 43 N 0.00 0.00 -0.28 1.61 3.64 -1.74 -3.38 116.57 116.42 2gpl h LYS 43 Ca 0.00 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.17 2gpl h LYS 43 Cb 0.00 0.00 -0.33 0.00 -0.41 0.00 0.00 32.23 31.49 2gpl h LYS 43 CO 0.00 0.38 -0.89 0.27 -2.27 0.00 0.00 179.45 176.94 2gpl n ASN 44 N -3.03 0.73 -3.58 4.20 6.94 -1.26 -4.71 115.26 114.56 2gpl n ASN 44 Ca -0.05 -2.06 0.02 0.00 -0.02 0.00 0.00 54.58 52.47 2gpl n ASN 44 Cb 0.79 -0.17 -0.00 0.00 -2.36 0.00 0.00 39.78 38.04 2gpl n ASN 44 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2gpl s VAL 46 N -2.09 0.46 -0.02 0.00 1.01 -0.80 0.12 120.40 119.07 2gpl s VAL 46 Ca 0.14 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 61.73 2gpl s VAL 46 Cb 0.06 -0.42 -0.01 0.00 0.00 0.00 0.00 36.38 36.00 2gpl s VAL 46 CO -0.06 -0.00 -0.18 -0.69 0.00 0.00 0.00 175.10 174.17 2gpl s VAL 47 N -0.44 1.43 -0.11 2.92 1.01 -0.09 -1.78 120.40 123.35 2gpl s VAL 47 Ca -0.01 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.25 2gpl s VAL 47 Cb -0.04 -1.20 0.00 0.00 0.00 0.00 0.00 36.38 35.14 2gpl s VAL 47 CO -0.00 0.41 -0.23 -0.76 0.00 0.00 0.00 175.10 174.51 2gpl s LEU 48 N -0.28 2.09 0.04 3.92 1.43 -0.59 -1.40 118.68 123.89 2gpl s LEU 48 Ca 0.04 -0.57 0.08 0.00 -1.03 0.00 0.00 54.13 52.64 2gpl s LEU 48 Cb -0.08 -1.42 -0.02 0.00 0.03 0.00 0.00 46.19 44.70 2gpl s LEU 48 CO 0.00 0.14 -0.22 -0.83 0.23 0.00 0.00 176.35 175.67 2gpl s GLY 49 N 0.45 1.18 -0.02 -3.19 0.00 0.57 -1.09 107.32 105.22 2gpl s GLY 49 Ca -0.16 -1.09 -0.02 0.00 0.00 0.00 0.00 44.72 43.45 2gpl s GLY 49 CO 0.06 -1.00 0.04 0.00 0.00 0.00 0.00 173.10 172.21 2gpl s GLU 51 N 0.02 3.75 -0.22 0.00 -1.05 -1.00 -1.52 118.70 118.67 2gpl s GLU 51 Ca -0.00 0.22 -0.04 0.00 -0.15 0.00 0.00 54.97 55.00 2gpl s GLU 51 Cb -0.00 -2.62 -0.01 0.00 -0.44 0.00 0.00 34.13 31.06 2gpl s GLU 51 CO 0.00 0.25 -0.03 1.03 0.95 0.00 0.00 175.26 177.46 2gpl s ARG 52 N -3.15 3.43 1.24 -4.83 0.52 -0.68 -4.70 118.95 110.78 2gpl s ARG 52 Ca 0.47 -0.60 -0.18 0.00 -0.52 0.00 0.00 55.73 54.90 2gpl s ARG 52 Cb -0.11 -3.05 0.27 0.00 0.52 0.00 0.00 34.95 32.57 2gpl s ARG 52 CO 0.25 -0.18 0.63 -2.13 0.02 0.00 0.00 175.30 173.88 2gpl n ARG 53 N 4.78 -3.09 -2.55 3.54 0.63 -1.26 -4.69 116.66 114.01 2gpl n ARG 53 Ca -0.18 -0.90 -0.02 0.00 -0.92 0.00 0.00 57.85 55.83 2gpl n ARG 53 Cb 0.51 -1.86 0.09 0.00 0.45 0.00 0.00 32.46 31.65 2gpl n ARG 53 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2gpl n SER 54 N -3.89 -0.48 0.27 6.15 7.64 -1.26 -4.90 113.62 117.14 2gpl n SER 54 Ca 0.06 -2.14 0.15 0.00 1.01 0.00 0.00 58.87 57.96 2gpl n SER 54 Cb 0.54 0.29 0.65 0.00 -1.01 0.00 0.00 64.21 64.69 2gpl n SER 54 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2gpl h THR 55 N 4.64 0.18 -2.03 0.44 2.02 -2.07 -3.41 112.91 112.68 2gpl h THR 55 Ca -0.36 -0.65 0.04 0.00 0.77 0.00 0.00 66.41 66.21 2gpl h THR 55 Cb 1.32 1.54 -0.21 0.00 -1.74 0.00 0.00 68.15 69.07 2gpl h THR 55 CO -0.08 0.06 -0.07 -0.76 0.37 0.00 0.00 175.52 175.04 2gpl s LEU 56 N -6.41 -1.03 -0.14 2.58 2.01 -1.26 -5.15 118.68 109.28 2gpl s LEU 56 Ca 0.00 1.52 -0.01 0.00 0.01 0.00 0.00 54.13 55.66 2gpl s LEU 56 Cb 0.10 2.30 0.04 0.00 0.01 0.00 0.00 46.19 48.64 2gpl s LEU 56 CO 0.56 -0.23 -0.04 -0.75 1.01 0.00 0.00 176.35 176.91 2gpl s LYS 57 N 2.30 1.23 0.00 1.70 2.36 -1.26 -4.78 119.74 121.28 2gpl s LYS 57 Ca -0.08 -0.35 0.00 0.00 -2.55 0.00 0.00 55.97 52.99 2gpl s LYS 57 Cb -0.09 -1.76 0.00 0.00 -1.05 0.00 0.00 37.83 34.93 2gpl s LYS 57 CO -0.19 -0.40 0.00 -0.11 1.55 0.00 0.00 175.35 176.20 2gpl n LEU 58 N 4.95 0.00 0.00 5.43 7.94 -1.26 -5.16 117.00 128.90 2gpl n LEU 58 Ca -0.11 0.00 -0.24 0.00 -1.11 0.00 0.00 56.01 54.55 2gpl n LEU 58 Cb 0.48 0.00 0.19 0.00 0.53 0.00 0.00 43.42 44.62 2gpl n LEU 58 CO 0.15 0.00 0.58 0.00 -1.11 0.00 0.00 177.39 177.01 2gpl n GLN 59 N 0.00 -2.03 -3.78 1.96 6.02 -1.26 -5.04 117.38 113.25 2gpl n GLN 59 Ca 0.00 -1.50 -0.29 0.00 -0.01 0.00 0.00 57.00 55.20 2gpl n GLN 59 Cb 0.00 -1.22 -0.12 0.00 1.02 0.00 0.00 30.24 29.91 2gpl n GLN 59 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2gpl s ASP 60 N -4.29 3.88 0.55 1.08 3.68 -1.26 -4.99 116.67 115.33 2gpl s ASP 60 Ca 0.58 -3.25 0.32 0.00 2.13 0.00 0.00 52.55 52.33 2gpl s ASP 60 Cb -0.04 -1.29 1.47 0.00 -1.45 0.00 0.00 42.92 41.62 2gpl s ASP 60 CO 0.43 -0.17 1.86 0.71 0.13 0.00 0.00 175.17 178.12 2gpl h THR 61 N 4.86 0.46 0.22 1.71 1.35 -1.96 -2.19 112.91 117.36 2gpl h THR 61 Ca 0.08 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.95 2gpl h THR 61 Cb 0.85 0.52 -0.04 0.00 -1.73 0.00 0.00 68.15 67.75 2gpl h THR 61 CO 0.59 0.00 -0.45 0.03 -0.25 0.00 0.00 175.52 175.45 2gpl h ARG 62 N 0.00 -0.72 0.03 4.72 3.08 -2.03 -3.32 114.38 116.14 2gpl h ARG 62 Ca 0.40 0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.38 2gpl h ARG 62 Cb 1.71 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.92 2gpl h ARG 62 CO -0.00 -0.48 -0.61 -0.84 -1.07 0.00 0.00 179.97 176.96 2gpl h ILE 62 N -0.75 1.44 -0.86 2.04 3.07 -1.94 -3.47 117.51 117.04 2gpl h ILE 62 Ca -0.00 -2.34 -0.74 0.00 1.55 0.00 0.00 64.86 63.33 2gpl h ILE 62 Cb 0.73 2.99 0.02 0.00 -0.27 0.00 0.00 36.82 40.28 2gpl h ILE 62 CO -0.20 0.56 0.48 0.41 -1.05 0.00 0.00 178.15 178.35 2gpl n THR 63 N -4.41 0.00 -1.60 0.16 -1.04 -0.85 -4.70 114.28 101.84 2gpl n THR 63 Ca -0.18 0.00 -0.57 0.00 -2.04 0.00 0.00 64.05 61.26 2gpl n THR 63 Cb 0.63 -0.34 -0.07 0.00 -1.82 0.00 0.00 70.33 68.73 2gpl n THR 63 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2gpl n PRO 64 N 2.99 0.68 -2.67 -2.82 -0.04 -1.26 -4.92 135.00 126.96 2gpl n PRO 64 Ca 0.25 0.25 -0.31 0.00 -0.04 0.00 0.00 63.50 63.64 2gpl n PRO 64 Cb -0.03 -1.84 -0.03 0.00 -0.04 0.00 0.00 33.50 31.56 2gpl n PRO 64 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2gpl s SER 65 N 1.04 6.58 0.26 3.54 1.04 -1.26 -5.01 113.70 119.89 2gpl s SER 65 Ca 0.91 1.34 0.08 0.00 0.48 0.00 0.00 55.95 58.76 2gpl s SER 65 Cb -1.12 -2.41 0.32 0.00 0.10 0.00 0.00 66.02 62.91 2gpl s SER 65 CO 0.56 -0.47 1.60 0.50 0.98 0.00 0.00 173.24 176.41 2gpl h LYS 66 N 1.17 0.10 -5.47 4.02 1.63 -1.96 -3.43 116.57 112.62 2gpl h LYS 66 Ca -0.47 -0.07 -0.60 0.00 -0.85 0.00 0.00 60.65 58.67 2gpl h LYS 66 Cb 1.19 0.01 -0.11 0.00 -0.60 0.00 0.00 32.23 32.72 2gpl h LYS 66 CO 0.63 0.67 -0.22 0.08 -3.45 0.00 0.00 179.45 177.16 2gpl s VAL 67 N -3.69 5.22 -0.02 2.00 1.01 -1.26 -4.33 120.40 119.34 2gpl s VAL 67 Ca -0.02 0.70 0.07 0.00 0.00 0.00 0.00 61.98 62.73 2gpl s VAL 67 Cb 0.12 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.77 2gpl s VAL 67 CO 0.78 0.29 -0.24 -0.44 0.00 0.00 0.00 175.10 175.48 2gpl s SER 68 N 0.88 3.19 -0.11 3.32 0.01 0.49 -4.94 113.70 116.54 2gpl s SER 68 Ca 0.19 -0.44 -0.24 0.00 1.31 0.00 0.00 55.95 56.78 2gpl s SER 68 Cb -0.14 -0.41 -0.03 0.00 0.21 0.00 0.00 66.02 65.65 2gpl s SER 68 CO 0.07 0.32 0.75 -0.54 0.41 0.00 0.00 173.24 174.26 2gpl s LYS 69 N -0.65 4.37 -0.14 12.44 1.02 -1.26 0.78 119.74 136.30 2gpl s LYS 69 Ca 0.10 0.92 -0.12 0.00 0.02 0.00 0.00 55.97 56.89 2gpl s LYS 69 Cb -0.10 -3.51 -0.24 0.00 -0.52 0.00 0.00 37.83 33.46 2gpl s LYS 69 CO -0.01 -0.12 0.35 0.82 -0.92 0.00 0.00 175.35 175.47 2gpl h ILE 70 N 4.96 0.76 -2.04 2.17 1.08 -1.31 -3.48 117.51 119.65 2gpl h ILE 70 Ca -0.36 -2.30 0.00 0.00 -0.39 0.00 0.00 64.86 61.81 2gpl h ILE 70 Cb 1.17 2.44 0.00 0.00 -3.07 0.00 0.00 36.82 37.36 2gpl h ILE 70 CO 0.78 0.70 0.00 -0.67 -0.69 0.00 0.00 178.15 178.27 2gpl n ASP 71 N -3.82 0.13 0.02 1.72 4.64 -1.14 -4.54 116.55 113.55 2gpl n ASP 71 Ca -0.31 -0.91 0.13 0.00 -1.38 0.00 0.00 54.79 52.32 2gpl n ASP 71 Cb 0.92 0.00 0.55 0.00 -1.04 0.00 0.00 41.12 41.55 2gpl n ASP 71 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 2gpl n SER 72 N -2.62 0.13 0.00 1.67 3.41 -1.26 -3.56 113.62 111.38 2gpl n SER 72 Ca 0.00 0.51 0.00 0.00 -0.26 0.00 0.00 58.87 59.12 2gpl n SER 72 Cb 0.00 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 63.40 2gpl n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gpl n HIS 73 N -1.62 0.00 -3.92 7.33 1.44 -1.26 -4.16 115.22 113.03 2gpl n HIS 73 Ca 0.06 -0.24 -0.14 0.00 -2.01 0.00 0.00 57.72 55.39 2gpl n HIS 73 Cb 0.33 -0.02 -0.15 0.00 0.12 0.00 0.00 29.99 30.27 2gpl n HIS 73 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2gpl s VAL 74 N -0.49 0.10 0.23 0.61 1.01 -1.23 -2.78 120.40 117.85 2gpl s VAL 74 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.05 2gpl s VAL 74 Cb 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 36.38 36.20 2gpl s VAL 74 CO 0.00 0.06 -0.10 0.68 0.00 0.00 0.00 175.10 175.73 2gpl s VAL 75 N 0.29 1.65 -0.02 2.92 -7.23 -0.16 -0.82 120.40 117.03 2gpl s VAL 75 Ca -0.03 -2.17 -0.00 0.00 -1.81 0.00 0.00 61.98 57.98 2gpl s VAL 75 Cb -0.04 -2.21 0.02 0.00 0.56 0.00 0.00 36.38 34.71 2gpl s VAL 75 CO -0.01 -0.47 0.03 -0.22 -0.31 0.00 0.00 175.10 174.12 2gpl s LEU 76 N -3.36 1.24 0.30 1.32 0.20 0.23 -1.82 118.68 116.79 2gpl s LEU 76 Ca 0.25 0.04 0.06 0.00 0.69 0.00 0.00 54.13 55.18 2gpl s LEU 76 Cb 0.01 -0.04 -0.06 0.00 -0.43 0.00 0.00 46.19 45.68 2gpl s LEU 76 CO 0.09 -0.11 -0.04 -0.94 -0.29 0.00 0.00 176.35 175.06 2gpl s SER 77 N 0.87 2.84 0.31 3.68 1.04 -0.28 -0.38 113.70 121.78 2gpl s SER 77 Ca -0.07 -1.23 -0.15 0.00 0.48 0.00 0.00 55.95 54.98 2gpl s SER 77 Cb -0.10 -0.18 0.02 0.00 0.10 0.00 0.00 66.02 65.85 2gpl s SER 77 CO -0.03 -0.38 0.64 0.72 0.98 0.00 0.00 173.24 175.18 2gpl s PHE 78 N -3.01 0.19 -0.03 5.02 -0.12 -1.26 -1.27 117.98 117.49 2gpl s PHE 78 Ca 0.31 -0.65 -0.01 0.00 -0.05 0.00 0.00 56.93 56.54 2gpl s PHE 78 Cb 0.05 0.51 0.03 0.00 -0.63 0.00 0.00 43.02 42.98 2gpl s PHE 78 CO 0.13 -1.25 0.05 -1.12 -0.05 0.00 0.00 175.22 172.99 2gpl s SER 79 N -3.02 0.15 0.00 1.98 0.01 -0.75 -4.83 113.70 107.23 2gpl s SER 79 Ca 0.18 0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.52 2gpl s SER 79 Cb -0.04 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.16 2gpl s SER 79 CO 0.10 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.22 2gpl n GLY 80 N 4.30 0.59 3.64 3.44 0.00 -1.26 -2.26 105.19 113.64 2gpl n GLY 80 Ca -0.25 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 43.78 2gpl n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gpl s LEU 81 N 0.00 3.96 0.10 0.99 1.43 -0.01 -4.73 118.68 120.42 2gpl s LEU 81 Ca 0.00 1.58 -0.32 0.00 -1.03 0.00 0.00 54.13 54.36 2gpl s LEU 81 Cb 0.00 -3.53 -0.12 0.00 0.03 0.00 0.00 46.19 42.56 2gpl s LEU 81 CO 0.00 -1.12 1.59 0.78 0.23 0.00 0.00 176.35 177.83 2gpl h ASN 82 N 9.96 -1.17 -0.84 2.29 -0.26 -1.97 -2.05 115.58 121.54 2gpl h ASN 82 Ca -0.31 0.11 0.20 0.00 -0.56 0.00 0.00 56.30 55.74 2gpl h ASN 82 Cb 1.14 0.42 -0.12 0.00 -1.06 0.00 0.00 38.32 38.69 2gpl h ASN 82 CO 1.00 -0.53 0.28 0.00 -1.06 0.00 0.00 177.43 177.13 2gpl h ALA 83 N -0.34 1.23 -0.66 -0.83 0.00 -2.00 0.54 119.26 117.19 2gpl h ALA 83 Ca -0.01 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2gpl h ALA 83 Cb 0.71 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 2gpl h ALA 83 CO -0.15 -0.36 0.37 -0.44 0.00 0.00 0.00 179.25 178.67 2gpl h ASP 84 N 0.32 0.83 -0.62 0.00 3.45 -1.85 -2.63 116.42 115.91 2gpl h ASP 84 Ca 0.51 -0.09 0.03 0.00 0.43 0.00 0.00 57.03 57.90 2gpl h ASP 84 Cb 0.94 -0.21 -0.03 0.00 -0.56 0.00 0.00 39.33 39.46 2gpl h ASP 84 CO -0.55 0.68 0.41 0.77 -1.57 0.00 0.00 179.24 178.98 2gpl h SER 85 N 0.91 0.64 -0.67 6.45 4.64 -0.20 -2.14 113.55 123.17 2gpl h SER 85 Ca 0.23 -0.01 0.04 0.00 -0.47 0.00 0.00 61.79 61.59 2gpl h SER 85 Cb 0.04 -0.15 -0.05 0.00 -0.31 0.00 0.00 62.40 61.93 2gpl h SER 85 CO -0.04 0.44 0.40 0.03 -0.87 0.00 0.00 176.83 176.79 2gpl h ARG 86 N 0.74 0.74 -0.25 4.77 3.08 -1.06 0.15 114.38 122.55 2gpl h ARG 86 Ca 0.25 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.28 2gpl h ARG 86 Cb 0.06 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 2gpl h ARG 86 CO -0.07 0.49 0.10 0.82 -1.07 0.00 0.00 179.97 180.24 2gpl h ILE 87 N 0.76 0.95 -0.62 2.04 1.08 -1.40 -0.84 117.51 119.49 2gpl h ILE 87 Ca 0.28 -0.08 -0.05 0.00 -0.39 0.00 0.00 64.86 64.62 2gpl h ILE 87 Cb 0.10 0.71 -0.03 0.00 -3.07 0.00 0.00 36.82 34.54 2gpl h ILE 87 CO -0.14 0.04 0.17 -0.07 -0.69 0.00 0.00 178.15 177.46 2gpl h LEU 88 N 0.22 0.92 -0.52 1.44 3.38 -1.28 -2.56 115.31 116.90 2gpl h LEU 88 Ca 0.11 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2gpl h LEU 88 Cb 0.06 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2gpl h LEU 88 CO -0.10 0.90 0.26 0.40 0.09 0.00 0.00 178.44 179.99 2gpl h ILE 89 N 0.89 1.19 -0.27 1.22 2.04 -0.64 -1.27 117.51 120.67 2gpl h ILE 89 Ca 0.20 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.52 2gpl h ILE 89 Cb 0.32 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2gpl h ILE 89 CO -0.00 0.21 0.14 -0.08 0.00 0.00 0.00 178.15 178.42 2gpl h GLU 90 N 0.70 0.37 -0.41 2.37 4.57 -1.09 -0.56 114.58 120.54 2gpl h GLU 90 Ca 0.18 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.31 2gpl h GLU 90 Cb 0.10 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 2gpl h GLU 90 CO -0.02 0.33 0.22 0.87 -1.18 0.00 0.00 179.01 179.23 2gpl h LYS 91 N 0.31 0.55 -0.17 1.92 1.57 -1.28 -1.20 116.57 118.27 2gpl h LYS 91 Ca 0.09 -0.05 -0.16 0.00 -1.87 0.00 0.00 60.65 58.66 2gpl h LYS 91 Cb 0.07 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2gpl h LYS 91 CO -0.01 0.41 -0.53 0.00 -0.57 0.00 0.00 179.45 178.75 2gpl h ALA 92 N 1.68 0.29 -0.46 3.86 0.00 -0.77 -0.96 119.26 122.90 2gpl h ALA 92 Ca 0.15 -0.51 -0.05 0.00 0.00 0.00 0.00 54.91 54.50 2gpl h ALA 92 Cb 0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2gpl h ALA 92 CO -0.02 0.49 0.07 0.00 0.00 0.00 0.00 179.25 179.79 2gpl h ARG 93 N 0.34 0.71 -0.17 0.00 3.08 -0.80 -0.25 114.38 117.30 2gpl h ARG 93 Ca -0.02 -0.15 -0.08 0.00 0.07 0.00 0.00 59.98 59.80 2gpl h ARG 93 Cb 1.15 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.09 2gpl h ARG 93 CO 0.11 0.67 -0.23 0.28 -1.07 0.00 0.00 179.97 179.74 2gpl h VAL 94 N 0.68 1.35 0.00 2.04 2.07 -1.18 -2.81 116.25 118.40 2gpl h VAL 94 Ca 0.15 -1.44 -0.03 0.00 0.82 0.00 0.00 66.70 66.20 2gpl h VAL 94 Cb 0.31 1.89 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 2gpl h VAL 94 CO 0.00 0.43 -0.14 -0.08 0.02 0.00 0.00 177.57 177.80 2gpl h GLU 95 N 0.08 0.00 -0.18 1.57 4.57 -0.87 -1.48 114.58 118.27 2gpl h GLU 95 Ca 0.02 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.16 2gpl h GLU 95 Cb 0.79 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.38 2gpl h GLU 95 CO 0.05 0.14 -0.05 0.00 -1.18 0.00 0.00 179.01 177.98 2gpl h ALA 96 N 1.86 0.25 -0.49 2.92 0.00 -0.88 -1.71 119.26 121.19 2gpl h ALA 96 Ca -0.00 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 2gpl h ALA 96 Cb 0.33 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2gpl h ALA 96 CO 0.02 0.02 -0.10 1.96 0.00 0.00 0.00 179.25 181.15 2gpl h GLN 97 N 0.05 0.90 -0.49 0.00 1.08 -1.20 -2.32 115.11 113.14 2gpl h GLN 97 Ca 0.04 -0.31 -0.02 0.00 -1.45 0.00 0.00 58.65 56.92 2gpl h GLN 97 Cb 0.49 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.83 2gpl h GLN 97 CO 0.02 0.95 0.24 1.03 -0.95 0.00 0.00 178.83 180.12 2gpl h SER 98 N 0.81 0.63 -0.73 1.46 0.87 -1.24 -0.17 113.55 115.17 2gpl h SER 98 Ca 0.13 -0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 2gpl h SER 98 Cb 0.61 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.38 2gpl h SER 98 CO 0.04 0.57 0.39 -0.74 -0.53 0.00 0.00 176.83 176.55 2gpl h HIS 99 N 0.64 1.02 -0.50 2.24 -0.00 -1.12 -1.21 115.15 116.22 2gpl h HIS 99 Ca 0.17 -0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.46 2gpl h HIS 99 Cb 0.10 -0.32 -0.02 0.00 -0.00 0.00 0.00 27.41 27.16 2gpl h HIS 99 CO -0.01 0.73 0.14 0.00 -0.00 0.00 0.00 177.93 178.79 2gpl h ARG 100 N 1.02 0.80 0.00 5.26 3.08 -1.13 -0.10 114.38 123.30 2gpl h ARG 100 Ca 0.26 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 2gpl h ARG 100 Cb 0.06 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2gpl h ARG 100 CO -0.04 0.76 -0.17 1.25 -1.07 0.00 0.00 179.97 180.70 2gpl h LEU 101 N 0.69 0.00 0.00 3.04 5.85 -0.42 -1.08 115.31 123.39 2gpl h LEU 101 Ca 0.16 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.66 2gpl h LEU 101 Cb 0.31 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 2gpl h LEU 101 CO -0.00 0.17 -1.84 0.35 -0.34 0.00 0.00 178.44 176.79 2gpl n THR 102 N -4.23 0.84 0.64 1.05 -2.24 -0.51 -4.58 114.28 105.25 2gpl n THR 102 Ca -0.02 -0.41 0.12 0.00 -2.27 0.00 0.00 64.05 61.46 2gpl n THR 102 Cb 0.24 -0.88 0.11 0.00 -2.10 0.00 0.00 70.33 67.70 2gpl n THR 102 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2gpl n LEU 103 N -2.71 0.63 -3.45 3.22 7.99 -0.06 -4.97 117.00 117.65 2gpl n LEU 103 Ca -0.23 0.06 -0.18 0.00 -0.01 0.00 0.00 56.01 55.65 2gpl n LEU 103 Cb 0.83 -0.15 0.09 0.00 -0.11 0.00 0.00 43.42 44.08 2gpl n LEU 103 CO 0.20 0.02 0.11 -0.62 -1.51 0.00 0.00 177.39 175.59 2gpl n GLU 104 N -1.94 -6.59 -3.65 3.23 1.02 -0.41 -5.00 120.64 107.31 2gpl n GLU 104 Ca 0.03 0.84 -0.00 0.00 -0.02 0.00 0.00 57.16 58.00 2gpl n GLU 104 Cb 0.42 -5.83 -0.06 0.00 -0.02 0.00 0.00 31.44 25.94 2gpl n GLU 104 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2gpl s ASP 105 N -4.32 -0.23 0.92 1.62 3.68 -1.24 -5.04 116.67 112.07 2gpl s ASP 105 Ca 0.02 0.37 -0.10 0.00 2.13 0.00 0.00 52.55 54.97 2gpl s ASP 105 Cb -0.01 0.97 0.15 0.00 -1.45 0.00 0.00 42.92 42.58 2gpl s ASP 105 CO 0.73 -0.06 1.13 -2.16 0.13 0.00 0.00 175.17 174.95 2gpl s PRO 106 N 0.97 0.96 0.58 4.34 0.04 -1.26 -3.92 135.00 136.72 2gpl s PRO 106 Ca -0.06 1.46 -0.18 0.00 0.04 0.00 0.00 61.00 62.25 2gpl s PRO 106 Cb -0.03 -1.73 -0.04 0.00 0.04 0.00 0.00 34.50 32.74 2gpl s PRO 106 CO -0.12 -2.64 1.14 0.14 0.04 0.00 0.00 177.00 175.56 2gpl s VAL 107 N -2.66 3.07 0.70 -0.36 -7.23 -1.26 -4.77 120.40 107.89 2gpl s VAL 107 Ca 0.66 0.63 -0.11 0.00 -1.81 0.00 0.00 61.98 61.35 2gpl s VAL 107 Cb -0.22 -3.21 0.02 0.00 0.56 0.00 0.00 36.38 33.52 2gpl s VAL 107 CO 0.58 -0.18 1.09 0.42 -0.31 0.00 0.00 175.10 176.70 2gpl s THR 108 N -1.86 3.45 0.28 5.32 -4.23 -1.26 -4.58 115.64 112.76 2gpl s THR 108 Ca 0.72 0.44 0.07 0.00 -1.18 0.00 0.00 61.69 61.74 2gpl s THR 108 Cb -0.24 -3.46 0.01 0.00 1.34 0.00 0.00 72.50 70.15 2gpl s THR 108 CO 0.31 -0.60 1.66 0.58 -0.54 0.00 0.00 174.62 176.03 2gpl h VAL 109 N -0.64 1.35 -0.44 2.29 2.07 -1.92 -2.56 116.25 116.40 2gpl h VAL 109 Ca -0.45 -1.71 -0.14 0.00 0.82 0.00 0.00 66.70 65.22 2gpl h VAL 109 Cb 1.26 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 2gpl h VAL 109 CO 0.64 0.50 -0.29 -0.08 0.02 0.00 0.00 177.57 178.36 2gpl h GLU 110 N 0.15 0.96 0.29 1.57 4.22 -1.98 -1.67 114.58 118.12 2gpl h GLU 110 Ca 0.01 -0.45 -0.01 0.00 0.08 0.00 0.00 59.36 58.98 2gpl h GLU 110 Cb 0.92 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.16 2gpl h GLU 110 CO 0.07 1.11 -0.14 -0.92 -2.18 0.00 0.00 179.01 176.96 2gpl h TYR 111 N 0.81 -0.37 -0.54 0.92 3.20 -1.91 0.24 116.97 119.32 2gpl h TYR 111 Ca 0.09 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.01 2gpl h TYR 111 Cb 0.87 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 2gpl h TYR 111 CO 0.06 -0.16 0.36 1.25 -1.64 0.00 0.00 178.16 178.02 2gpl h LEU 112 N -0.49 0.46 -0.08 2.82 7.12 -1.45 -0.22 115.31 123.47 2gpl h LEU 112 Ca -0.04 -0.00 -0.04 0.00 0.13 0.00 0.00 57.88 57.93 2gpl h LEU 112 Cb 0.37 -0.10 -0.00 0.00 -0.53 0.00 0.00 40.66 40.40 2gpl h LEU 112 CO 0.07 0.30 -0.12 0.74 -0.13 0.00 0.00 178.44 179.30 2gpl h THR 113 N 0.52 1.39 -0.31 1.05 2.02 -0.88 -2.38 112.91 114.33 2gpl h THR 113 Ca 0.23 -1.37 0.03 0.00 0.77 0.00 0.00 66.41 66.08 2gpl h THR 113 Cb 0.25 2.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.76 2gpl h THR 113 CO -0.06 0.38 0.21 -0.09 0.37 0.00 0.00 175.52 176.33 2gpl h ARG 114 N -0.24 0.27 0.33 6.66 2.43 0.22 -0.37 114.38 123.69 2gpl h ARG 114 Ca 0.01 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2gpl h ARG 114 Cb 0.68 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 2gpl h ARG 114 CO 0.03 0.18 -0.16 -0.92 -1.51 0.00 0.00 179.97 177.59 2gpl h TYR 115 N 0.28 -0.41 -0.53 2.20 3.20 -0.90 -1.37 116.97 119.44 2gpl h TYR 115 Ca 0.13 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.04 2gpl h TYR 115 Cb 0.17 0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.53 2gpl h TYR 115 CO -0.00 -0.07 0.27 0.28 -1.64 0.00 0.00 178.16 176.99 2gpl h VAL 116 N -0.81 0.95 -0.88 1.81 2.07 -1.07 -1.53 116.25 116.77 2gpl h VAL 116 Ca -0.05 -0.18 0.07 0.00 0.82 0.00 0.00 66.70 67.36 2gpl h VAL 116 Cb 0.52 0.39 -0.06 0.00 -1.52 0.00 0.00 31.29 30.62 2gpl h VAL 116 CO 0.07 0.09 0.55 0.00 0.02 0.00 0.00 177.57 178.31 2gpl h ALA 117 N 1.29 1.22 -0.66 1.67 0.00 -1.07 -1.16 119.26 120.55 2gpl h ALA 117 Ca 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2gpl h ALA 117 Cb 0.15 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2gpl h ALA 117 CO -0.17 0.29 0.36 0.78 0.00 0.00 0.00 179.25 180.52 2gpl h GLY 118 N 0.99 0.99 1.25 0.00 0.00 -0.29 0.11 103.07 106.12 2gpl h GLY 118 Ca 0.39 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 2gpl h GLY 118 CO -0.18 0.43 0.30 -2.08 0.00 0.00 0.00 176.54 175.01 2gpl h VAL 119 N 0.91 1.22 -0.28 4.60 2.07 -0.51 -0.75 116.25 123.52 2gpl h VAL 119 Ca 0.23 -0.66 -0.13 0.00 0.82 0.00 0.00 66.70 66.96 2gpl h VAL 119 Cb 0.04 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.19 2gpl h VAL 119 CO -0.04 0.27 -0.35 1.56 0.02 0.00 0.00 177.57 179.03 2gpl h GLN 120 N 0.96 0.73 -0.62 1.57 4.20 -0.57 -2.88 115.11 118.50 2gpl h GLN 120 Ca 0.23 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.53 2gpl h GLN 120 Cb 0.13 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.91 2gpl h GLN 120 CO -0.03 1.03 0.40 0.37 -0.67 0.00 0.00 178.83 179.94 2gpl h GLN 121 N 0.47 0.82 -0.82 1.46 -0.00 -0.41 -2.66 115.11 113.97 2gpl h GLN 121 Ca 0.03 -0.06 0.06 0.00 -0.00 0.00 0.00 58.65 58.69 2gpl h GLN 121 Cb 0.94 -0.18 -0.06 0.00 0.00 0.00 0.00 27.48 28.18 2gpl h GLN 121 CO 0.08 0.56 0.50 -0.09 0.00 0.00 0.00 178.83 179.88 2gpl h ARG 122 N 0.84 0.88 0.00 1.69 2.43 -1.10 0.21 114.38 119.33 2gpl h ARG 122 Ca 0.22 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 2gpl h ARG 122 Cb -0.07 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.28 2gpl h ARG 122 CO -0.05 0.58 0.00 0.66 -1.51 0.00 0.00 179.97 179.66 2gpl n TYR 123 N -4.66 0.00 0.83 2.20 4.02 -1.00 -2.08 117.16 116.47 2gpl n TYR 123 Ca 0.12 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.09 2gpl n TYR 123 Cb 0.18 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.39 2gpl n TYR 123 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2gpl n THR 124 N -0.81 0.00 -2.76 -0.72 -2.24 0.06 -3.25 114.28 104.56 2gpl n THR 124 Ca 0.08 -0.08 -0.03 0.00 -2.27 0.00 0.00 64.05 61.75 2gpl n THR 124 Cb 0.04 0.96 0.05 0.00 -2.10 0.00 0.00 70.33 69.28 2gpl n THR 124 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gpl n GLN 125 N -1.47 1.48 -4.78 -0.78 10.64 -0.89 -4.66 117.38 116.92 2gpl n GLN 125 Ca 0.03 -3.15 -0.26 0.00 -1.83 0.00 0.00 57.00 51.79 2gpl n GLN 125 Cb 0.30 -1.24 -0.16 0.00 -0.86 0.00 0.00 30.24 28.27 2gpl n GLN 125 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 2gpl s SER 126 N -3.23 2.09 0.62 2.61 0.01 -1.16 -5.06 113.70 109.59 2gpl s SER 126 Ca 0.25 -0.35 -0.18 0.00 1.31 0.00 0.00 55.95 56.98 2gpl s SER 126 Cb 0.38 -0.72 -0.02 0.00 0.21 0.00 0.00 66.02 65.86 2gpl s SER 126 CO -0.02 0.12 1.23 -0.83 0.41 0.00 0.00 173.24 174.14 2gpl s GLY 127 N 0.25 2.72 0.00 3.44 0.00 -1.26 -3.47 107.32 108.99 2gpl s GLY 127 Ca -0.08 1.03 0.00 0.00 0.00 0.00 0.00 44.72 45.67 2gpl s GLY 127 CO 0.03 1.43 0.00 0.61 0.00 0.00 0.00 173.10 175.17 2gpl n GLY 128 N 0.56 0.63 3.08 0.20 0.00 0.10 -4.72 105.19 105.04 2gpl n GLY 128 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 2gpl n GLY 128 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gpl s VAL 129 N -2.74 0.58 0.17 1.61 -7.23 -1.23 -4.92 120.40 106.64 2gpl s VAL 129 Ca 0.00 -1.21 0.04 0.00 -1.81 0.00 0.00 61.98 59.00 2gpl s VAL 129 Cb 0.00 -0.78 -0.04 0.00 0.56 0.00 0.00 36.38 36.12 2gpl s VAL 129 CO 0.00 -0.45 0.22 0.00 -0.31 0.00 0.00 175.10 174.56 2gpl s ARG 130 N -1.92 3.18 0.95 4.82 1.70 -1.26 -4.60 118.95 121.82 2gpl s ARG 130 Ca -0.07 -0.76 -0.11 0.00 -0.47 0.00 0.00 55.73 54.32 2gpl s ARG 130 Cb -0.08 -2.80 0.16 0.00 -0.57 0.00 0.00 34.95 31.67 2gpl s ARG 130 CO -0.00 0.49 1.10 -2.14 -1.08 0.00 0.00 175.30 173.66 2gpl s PRO 131 N -3.30 0.76 0.06 3.89 0.02 -1.20 -4.89 135.00 130.35 2gpl s PRO 131 Ca 0.33 1.17 -0.30 0.00 0.02 0.00 0.00 61.00 62.21 2gpl s PRO 131 Cb -0.10 -1.73 -0.05 0.00 0.02 0.00 0.00 34.50 32.64 2gpl s PRO 131 CO 0.26 -2.68 1.12 -0.06 -0.33 0.00 0.00 177.00 175.31 2gpl s PHE 132 N -2.70 3.53 -0.95 6.54 0.40 -1.26 -4.91 117.98 118.63 2gpl s PHE 132 Ca 0.66 1.46 -0.06 0.00 -0.60 0.00 0.00 56.93 58.39 2gpl s PHE 132 Cb -0.21 -3.31 -0.00 0.00 0.51 0.00 0.00 43.02 40.00 2gpl s PHE 132 CO 0.59 -0.80 2.82 0.41 0.70 0.00 0.00 175.22 178.94 2gpl n GLY 133 N 2.94 4.42 3.10 4.36 0.00 -1.26 -4.48 105.19 114.27 2gpl n GLY 133 Ca 0.07 -1.75 -0.11 0.00 0.00 0.00 0.00 46.02 44.23 2gpl n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gpl s VAL 134 N -0.37 0.09 0.01 1.61 1.01 -1.26 -0.83 120.40 120.66 2gpl s VAL 134 Ca 0.61 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.85 2gpl s VAL 134 Cb 0.26 -0.51 -0.01 0.00 0.00 0.00 0.00 36.38 36.11 2gpl s VAL 134 CO -0.11 -0.43 -0.10 -0.55 0.00 0.00 0.00 175.10 173.92 2gpl s SER 135 N -1.54 1.13 0.20 3.32 0.15 -0.96 -2.87 113.70 113.13 2gpl s SER 135 Ca -0.13 -0.26 0.07 0.00 0.70 0.00 0.00 55.95 56.33 2gpl s SER 135 Cb -0.07 -0.09 -0.05 0.00 -1.71 0.00 0.00 66.02 64.10 2gpl s SER 135 CO 0.00 0.06 -0.13 0.42 1.20 0.00 0.00 173.24 174.79 2gpl s THR 136 N -0.47 1.64 -0.14 6.45 -4.23 -0.06 -1.81 115.64 117.02 2gpl s THR 136 Ca 0.01 -2.18 0.00 0.00 -1.18 0.00 0.00 61.69 58.34 2gpl s THR 136 Cb -0.05 -2.06 0.02 0.00 1.34 0.00 0.00 72.50 71.75 2gpl s THR 136 CO 0.00 -0.58 -0.14 -0.76 -0.54 0.00 0.00 174.62 172.60 2gpl s LEU 137 N -3.31 1.63 -0.08 4.79 1.43 -0.40 -1.11 118.68 121.63 2gpl s LEU 137 Ca 0.22 -0.46 0.05 0.00 -1.03 0.00 0.00 54.13 52.91 2gpl s LEU 137 Cb 0.00 -1.14 -0.00 0.00 0.03 0.00 0.00 46.19 45.08 2gpl s LEU 137 CO 0.06 -0.06 -0.24 -0.63 0.23 0.00 0.00 176.35 175.72 2gpl s ILE 138 N 1.48 2.03 0.03 -0.59 1.01 -0.37 -1.12 121.20 123.68 2gpl s ILE 138 Ca 0.04 -1.02 -0.07 0.00 0.00 0.00 0.00 60.65 59.60 2gpl s ILE 138 Cb -0.13 -1.74 -0.00 0.00 0.01 0.00 0.00 42.46 40.59 2gpl s ILE 138 CO -0.10 0.56 0.13 0.00 0.00 0.00 0.00 174.94 175.53 2gpl s ALA 139 N 0.17 -0.19 0.00 9.38 0.00 -0.76 -0.10 121.76 130.25 2gpl s ALA 139 Ca -0.13 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.42 2gpl s ALA 139 Cb -0.16 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.19 2gpl s ALA 139 CO 0.07 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.93 2gpl n GLY 140 N 0.86 -0.94 3.07 0.00 0.00 -0.92 -0.99 105.19 106.27 2gpl n GLY 140 Ca -0.20 -1.08 -0.26 0.00 0.00 0.00 0.00 46.02 44.49 2gpl n GLY 140 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2gpl s PHE 141 N -3.00 1.68 0.65 1.61 0.08 -1.12 -1.57 117.98 116.31 2gpl s PHE 141 Ca 0.00 -0.64 -0.18 0.00 0.12 0.00 0.00 56.93 56.24 2gpl s PHE 141 Cb 0.00 -1.20 -0.02 0.00 -0.57 0.00 0.00 43.02 41.23 2gpl s PHE 141 CO 0.00 -0.30 1.08 -0.25 -0.10 0.00 0.00 175.22 175.64 2gpl n ASP 142 N 3.73 1.13 -4.65 1.36 8.00 -1.26 -4.84 116.55 120.01 2gpl n ASP 142 Ca -0.22 0.78 -0.46 0.00 0.71 0.00 0.00 54.79 55.59 2gpl n ASP 142 Cb 0.52 -1.45 -0.04 0.00 -0.02 0.00 0.00 41.12 40.13 2gpl n ASP 142 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 2gpl n PRO 143 N -1.54 1.88 -2.02 -0.24 -0.02 -1.26 -1.28 135.00 130.51 2gpl n PRO 143 Ca 0.14 0.67 -0.20 0.00 -2.02 0.00 0.00 63.50 62.10 2gpl n PRO 143 Cb 0.48 -2.35 -0.04 0.00 -0.02 0.00 0.00 33.50 31.57 2gpl n PRO 143 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2gpl n ARG 14 N 2.55 -1.49 -4.26 -0.52 1.74 -1.26 -4.98 116.66 108.43 2gpl n ARG 14 Ca 0.15 1.07 -0.21 0.00 -0.77 0.00 0.00 57.85 58.08 2gpl n ARG 14 Cb 0.28 -5.56 -0.12 0.00 -1.02 0.00 0.00 32.46 26.04 2gpl n ARG 14 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2gpl s ASP 144 N -2.41 2.07 -0.00 0.55 3.68 -0.41 -5.05 116.67 115.11 2gpl s ASP 144 Ca 0.00 -0.62 0.10 0.00 2.13 0.00 0.00 52.55 54.16 2gpl s ASP 144 Cb 0.00 -0.10 -0.13 0.00 -1.45 0.00 0.00 42.92 41.24 2gpl s ASP 144 CO 0.00 0.00 0.37 -0.90 0.13 0.00 0.00 175.17 174.78 2gpl n ASP 14 N 1.30 1.15 -4.65 -0.34 3.85 -1.26 -4.47 116.55 112.12 2gpl n ASP 14 Ca -0.20 -0.51 -0.43 0.00 -0.71 0.00 0.00 54.79 52.95 2gpl n ASP 14 Cb 0.54 1.15 -0.02 0.00 -1.35 0.00 0.00 41.12 41.44 2gpl n ASP 14 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 2gpl s GLU 145 N -2.21 4.10 0.53 0.11 2.12 -1.26 -4.77 118.70 117.32 2gpl s GLU 145 Ca 0.01 1.87 -0.22 0.00 0.36 0.00 0.00 54.97 56.99 2gpl s GLU 145 Cb 0.07 -3.92 -0.05 0.00 0.26 0.00 0.00 34.13 30.49 2gpl s GLU 145 CO 0.43 -0.92 1.35 -1.25 -0.54 0.00 0.00 175.26 174.33 2gpl s PRO 146 N 4.02 3.23 -0.02 4.30 0.04 -1.26 -4.60 135.00 140.72 2gpl s PRO 146 Ca 0.66 2.22 0.05 0.00 0.04 0.00 0.00 61.00 63.98 2gpl s PRO 146 Cb -0.27 -2.30 -0.01 0.00 0.04 0.00 0.00 34.50 31.95 2gpl s PRO 146 CO 0.25 -1.11 -0.17 0.15 0.04 0.00 0.00 177.00 176.15 2gpl s LYS 147 N -2.85 1.43 -0.13 4.56 -0.14 -0.61 -5.02 119.74 116.97 2gpl s LYS 147 Ca 0.70 -0.61 -0.05 0.00 -1.36 0.00 0.00 55.97 54.65 2gpl s LYS 147 Cb -0.40 -1.36 0.06 0.00 -1.68 0.00 0.00 37.83 34.45 2gpl s LYS 147 CO 0.48 0.35 0.27 -1.17 -0.76 0.00 0.00 175.35 174.52 2gpl s LEU 148 N -0.35 -0.18 0.28 3.17 2.96 -1.26 -2.16 118.68 121.14 2gpl s LEU 148 Ca 0.05 0.60 0.04 0.00 -0.22 0.00 0.00 54.13 54.61 2gpl s LEU 148 Cb -0.07 0.74 -0.06 0.00 0.50 0.00 0.00 46.19 47.30 2gpl s LEU 148 CO -0.00 -0.23 0.01 -0.31 -1.32 0.00 0.00 176.35 174.51 2gpl s TYR 149 N 2.20 1.80 -0.00 5.38 2.02 0.85 -1.53 117.35 128.06 2gpl s TYR 149 Ca -0.01 -0.90 0.00 0.00 -0.37 0.00 0.00 57.07 55.79 2gpl s TYR 149 Cb -0.12 -1.09 0.00 0.00 -0.40 0.00 0.00 41.96 40.35 2gpl s TYR 149 CO -0.09 0.03 0.00 -1.14 -1.57 0.00 0.00 175.55 172.78 2gpl s GLN 150 N -3.85 0.03 0.19 -0.62 0.74 -0.46 -1.23 119.66 114.45 2gpl s GLN 150 Ca 0.32 0.01 0.07 0.00 0.05 0.00 0.00 55.36 55.82 2gpl s GLN 150 Cb 0.07 -0.06 -0.04 0.00 1.10 0.00 0.00 33.01 34.07 2gpl s GLN 150 CO 0.12 -0.01 -0.14 0.95 -0.55 0.00 0.00 175.29 175.65 2gpl s THR 151 N 0.13 1.65 0.13 -0.34 -4.23 -0.26 -2.48 115.64 110.24 2gpl s THR 151 Ca -0.01 -2.12 -0.02 0.00 -1.18 0.00 0.00 61.69 58.36 2gpl s THR 151 Cb -0.02 -1.95 -0.04 0.00 1.34 0.00 0.00 72.50 71.83 2gpl s THR 151 CO -0.00 -0.57 0.08 -1.83 -0.54 0.00 0.00 174.62 171.76 2gpl s GLU 152 N -3.47 0.95 0.41 3.99 -1.05 -1.10 -0.88 118.70 117.55 2gpl s GLU 152 Ca 0.20 -1.40 0.27 0.00 -0.15 0.00 0.00 54.97 53.88 2gpl s GLU 152 Cb -0.01 0.26 1.38 0.00 -0.44 0.00 0.00 34.13 35.32 2gpl s GLU 152 CO 0.06 -0.28 1.61 -1.35 0.95 0.00 0.00 175.26 176.25 2gpl h PRO 153 N 2.83 0.08 0.00 -4.83 0.11 -1.75 0.22 132.00 128.66 2gpl h PRO 153 Ca -0.35 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.74 2gpl h PRO 153 Cb 1.20 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2gpl h PRO 153 CO 0.58 0.05 -0.09 0.66 -0.21 0.00 0.00 178.00 178.99 2gpl h SER 154 N 0.08 0.00 0.00 -2.05 4.64 -1.87 -3.40 113.55 110.94 2gpl h SER 154 Ca 0.83 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.15 2gpl h SER 154 Cb 2.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.54 2gpl h SER 154 CO -0.52 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 176.13 2gpl n GLY 155 N -0.38 0.58 3.80 -0.77 0.00 0.78 -4.26 105.19 104.95 2gpl n GLY 155 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2gpl n GLY 155 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gpl s ILE 156 N -2.00 4.38 0.13 -0.61 1.01 -1.26 -4.60 121.20 118.26 2gpl s ILE 156 Ca 0.00 1.55 -0.09 0.00 0.00 0.00 0.00 60.65 62.11 2gpl s ILE 156 Cb 0.00 -3.90 -0.00 0.00 0.01 0.00 0.00 42.46 38.57 2gpl s ILE 156 CO 0.00 0.11 0.26 -0.72 0.00 0.00 0.00 174.94 174.59 2gpl s TYR 157 N -1.65 0.25 0.00 3.97 1.13 -1.26 -2.69 117.35 117.11 2gpl s TYR 157 Ca 0.49 -0.64 -0.30 0.00 -1.41 0.00 0.00 57.07 55.21 2gpl s TYR 157 Cb -0.17 -0.03 0.11 0.00 -1.10 0.00 0.00 41.96 40.77 2gpl s TYR 157 CO 0.21 -0.66 1.17 -1.54 -2.51 0.00 0.00 175.55 172.23 2gpl s SER 158 N -2.91 -0.12 0.07 -0.18 1.04 -1.03 -4.99 113.70 105.58 2gpl s SER 158 Ca 0.11 -0.17 -0.00 0.00 0.48 0.00 0.00 55.95 56.37 2gpl s SER 158 Cb 0.04 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.37 2gpl s SER 158 CO -0.05 -0.46 0.22 -0.94 0.98 0.00 0.00 173.24 172.99 2gpl s SER 159 N -2.82 6.36 0.10 7.02 1.04 -1.26 -1.35 113.70 122.79 2gpl s SER 159 Ca 0.12 0.28 0.04 0.00 0.48 0.00 0.00 55.95 56.87 2gpl s SER 159 Cb 0.02 -1.96 -0.04 0.00 0.10 0.00 0.00 66.02 64.14 2gpl s SER 159 CO -0.03 0.16 -0.10 0.26 0.98 0.00 0.00 173.24 174.50 2gpl s TRP 160 N -1.53 1.08 0.07 5.02 0.52 -0.58 -4.99 118.94 118.53 2gpl s TRP 160 Ca 0.35 -0.64 -0.09 0.00 0.02 0.00 0.00 56.10 55.74 2gpl s TRP 160 Cb -0.13 -0.59 -0.26 0.00 -1.15 0.00 0.00 33.47 31.34 2gpl s TRP 160 CO 0.28 0.01 1.14 0.77 0.02 0.00 0.00 176.95 179.17 2gpl h SER 161 N 3.60 0.65 -4.42 2.95 0.02 -1.92 -3.41 113.55 111.02 2gpl h SER 161 Ca -0.37 -0.63 -0.05 0.00 -0.84 0.00 0.00 61.79 59.90 2gpl h SER 161 Cb 1.19 -0.21 -0.20 0.00 0.14 0.00 0.00 62.40 63.32 2gpl h SER 161 CO 0.52 1.46 0.15 0.00 -1.14 0.00 0.00 176.83 177.82 2gpl s ALA 162 N -2.86 -1.77 0.15 3.77 0.00 -1.26 -0.86 121.76 118.94 2gpl s ALA 162 Ca -0.07 1.72 -0.22 0.00 0.00 0.00 0.00 51.96 53.39 2gpl s ALA 162 Cb 0.06 -0.68 0.07 0.00 0.00 0.00 0.00 23.12 22.58 2gpl s ALA 162 CO 0.91 -0.35 0.58 -1.14 0.00 0.00 0.00 175.76 175.76 2gpl s GLN 163 N -0.29 1.26 0.03 0.00 2.00 -0.30 -5.00 119.66 117.35 2gpl s GLN 163 Ca -0.05 -0.48 -0.05 0.00 -2.00 0.00 0.00 55.36 52.78 2gpl s GLN 163 Cb -0.03 0.58 -0.01 0.00 0.80 0.00 0.00 33.01 34.35 2gpl s GLN 163 CO 0.05 -0.54 0.09 -0.08 -0.50 0.00 0.00 175.29 174.30 2gpl s THR 164 N -3.72 0.12 0.06 -0.34 -1.32 -1.26 -0.65 115.64 108.53 2gpl s THR 164 Ca 0.01 -1.01 -0.06 0.00 -1.21 0.00 0.00 61.69 59.43 2gpl s THR 164 Cb -0.01 -0.75 -0.02 0.00 -1.51 0.00 0.00 72.50 70.22 2gpl s THR 164 CO -0.13 -0.55 0.10 0.27 -2.21 0.00 0.00 174.62 172.10 2gpl s ILE 165 N -2.27 0.16 0.00 5.08 -4.36 0.51 -4.94 121.20 115.39 2gpl s ILE 165 Ca -0.08 -1.33 0.00 0.00 -0.26 0.00 0.00 60.65 58.98 2gpl s ILE 165 Cb -0.03 -1.26 0.00 0.00 1.25 0.00 0.00 42.46 42.42 2gpl s ILE 165 CO -0.03 -0.74 0.00 0.61 0.24 0.00 0.00 174.94 175.02 2gpl n GLY 166 N 0.24 -1.45 3.77 6.27 0.00 -1.26 -0.36 105.19 112.40 2gpl n GLY 166 Ca -0.16 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.33 2gpl n GLY 166 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2gpl s ARG 167 N -0.11 4.10 -1.36 1.61 1.70 -0.22 -2.01 118.95 122.67 2gpl s ARG 167 Ca 0.00 2.59 0.00 0.00 -0.47 0.00 0.00 55.73 57.85 2gpl s ARG 167 Cb 0.00 -2.99 0.00 0.00 -0.57 0.00 0.00 34.95 31.39 2gpl s ARG 167 CO 0.00 -0.59 0.00 0.09 -1.08 0.00 0.00 175.30 173.72 2gpl n ASN 168 N 1.19 -5.41 0.28 -2.89 5.03 -1.26 -4.33 115.26 107.87 2gpl n ASN 168 Ca 0.04 0.32 0.15 0.00 0.87 0.00 0.00 54.58 55.96 2gpl n ASN 168 Cb 0.38 -4.03 0.78 0.00 -1.02 0.00 0.00 39.78 35.89 2gpl n ASN 168 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 2gpl h SER 169 N 0.00 0.00 -0.05 6.41 4.64 -1.70 -1.78 113.55 121.07 2gpl h SER 169 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2gpl h SER 169 Cb 1.12 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2gpl h SER 169 CO 0.38 0.08 0.03 0.50 -0.87 0.00 0.00 176.83 176.95 2gpl h LYS 170 N 0.00 0.06 0.36 4.77 1.63 -1.87 0.62 116.57 122.14 2gpl h LYS 170 Ca -0.00 -0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.78 2gpl h LYS 170 Cb 0.35 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.96 2gpl h LYS 170 CO 0.01 0.05 -0.22 1.15 -3.45 0.00 0.00 179.45 176.99 2gpl h THR 171 N 0.05 0.00 -0.06 1.00 2.02 -1.73 -2.61 112.91 111.59 2gpl h THR 171 Ca 0.02 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.21 2gpl h THR 171 Cb 0.00 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.41 2gpl h THR 171 CO -0.00 0.00 0.10 1.62 0.37 0.00 0.00 175.52 177.61 2gpl h VAL 172 N -0.53 0.32 -0.28 3.16 3.04 -1.47 0.34 116.25 120.82 2gpl h VAL 172 Ca -0.05 0.00 -0.17 0.00 -1.01 0.00 0.00 66.70 65.48 2gpl h VAL 172 Cb 0.43 0.91 -0.00 0.00 -2.01 0.00 0.00 31.29 30.62 2gpl h VAL 172 CO 0.05 0.00 -0.47 -0.09 -1.01 0.00 0.00 177.57 176.05 2gpl h ARG 173 N 0.00 0.82 -0.16 4.17 2.43 -0.73 -2.05 114.38 118.86 2gpl h ARG 173 Ca 0.03 -0.50 0.02 0.00 -0.81 0.00 0.00 59.98 58.71 2gpl h ARG 173 Cb 0.24 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 2gpl h ARG 173 CO -0.00 1.13 0.05 0.93 -1.51 0.00 0.00 179.97 180.57 2gpl h GLU 174 N 0.58 0.12 -0.11 0.20 3.07 -0.57 0.22 114.58 118.09 2gpl h GLU 174 Ca 0.02 -0.01 0.04 0.00 -0.50 0.00 0.00 59.36 58.92 2gpl h GLU 174 Cb 1.07 -0.03 -0.06 0.00 -0.84 0.00 0.00 28.75 28.89 2gpl h GLU 174 CO 0.11 0.08 -0.35 0.35 -1.40 0.00 0.00 179.01 177.79 2gpl h PHE 175 N 0.12 -0.98 -0.69 4.33 3.57 -1.30 -1.63 116.94 120.36 2gpl h PHE 175 Ca 0.07 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.64 2gpl h PHE 175 Cb 0.04 0.45 -0.04 0.00 2.79 0.00 0.00 35.95 39.19 2gpl h PHE 175 CO -0.11 -0.43 0.45 -0.07 -2.23 0.00 0.00 178.31 175.92 2gpl h LEU 176 N -0.44 0.72 -1.68 0.59 3.38 -0.87 -1.89 115.31 115.11 2gpl h LEU 176 Ca 0.09 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 2gpl h LEU 176 Cb 0.58 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 2gpl h LEU 176 CO -0.36 0.50 -0.15 -0.33 0.09 0.00 0.00 178.44 178.19 2gpl h GLU 177 N 0.83 0.00 -0.45 1.13 5.08 0.36 -0.91 114.58 120.63 2gpl h GLU 177 Ca 0.27 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.30 2gpl h GLU 177 Cb 0.06 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.04 2gpl h GLU 177 CO -0.08 0.15 -0.70 0.36 -1.00 0.00 0.00 179.01 177.74 2gpl n LYS 178 N -3.56 2.78 0.00 2.33 2.85 -0.80 -4.53 118.16 117.23 2gpl n LYS 178 Ca -0.01 -3.81 0.00 0.00 -1.05 0.00 0.00 58.31 53.44 2gpl n LYS 178 Cb 0.29 -2.00 0.00 0.00 -0.65 0.00 0.00 35.03 32.68 2gpl n LYS 178 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2gpl n ASN 179 N -0.85 0.00 -3.96 -5.58 3.02 -0.78 -5.00 115.26 102.11 2gpl n ASN 179 Ca 0.34 -1.00 -0.30 0.00 -0.03 0.00 0.00 54.58 53.59 2gpl n ASN 179 Cb 0.86 0.00 -0.16 0.00 -0.61 0.00 0.00 39.78 39.87 2gpl n ASN 179 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2gpl s TYR 180 N 0.00 2.11 -0.28 3.10 6.14 -0.37 -4.95 117.35 123.09 2gpl s TYR 180 Ca 0.00 -1.34 -0.09 0.00 0.64 0.00 0.00 57.07 56.28 2gpl s TYR 180 Cb 0.00 -1.51 -0.03 0.00 0.42 0.00 0.00 41.96 40.84 2gpl s TYR 180 CO 0.00 -0.68 0.13 0.34 0.64 0.00 0.00 175.55 175.98 2gpl s ASP 18 N 1.50 5.53 0.49 4.32 3.68 -1.26 -4.90 116.67 126.03 2gpl s ASP 18 Ca 0.01 -0.26 0.24 0.00 2.13 0.00 0.00 52.55 54.67 2gpl s ASP 18 Cb -0.15 -2.01 1.30 0.00 -1.45 0.00 0.00 42.92 40.61 2gpl s ASP 18 CO -0.08 -0.09 2.03 0.03 0.13 0.00 0.00 175.17 177.18 2gpl h ARG 18 N 8.32 0.00 -0.51 4.34 3.08 -2.00 -2.14 114.38 125.47 2gpl h ARG 18 Ca -0.35 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.67 2gpl h ARG 18 Cb 1.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.20 2gpl h ARG 18 CO 0.58 0.15 0.23 0.87 -1.07 0.00 0.00 179.97 180.74 2gpl h LYS 18 N 0.00 0.74 -2.68 0.04 1.79 -2.06 -3.36 116.57 111.04 2gpl h LYS 18 Ca -0.00 -0.12 -0.60 0.00 -2.18 0.00 0.00 60.65 57.75 2gpl h LYS 18 Cb 0.38 -0.13 -0.40 0.00 -1.58 0.00 0.00 32.23 30.51 2gpl h LYS 18 CO 0.02 0.64 -0.80 -2.00 -1.08 0.00 0.00 179.45 176.23 2gpl s GLU 18 N -5.64 1.59 0.42 3.15 2.12 -0.83 -5.11 118.70 114.39 2gpl s GLU 18 Ca -0.13 -2.65 -0.26 0.00 0.36 0.00 0.00 54.97 52.30 2gpl s GLU 18 Cb 0.12 -2.30 -0.09 0.00 0.26 0.00 0.00 34.13 32.12 2gpl s GLU 18 CO 0.77 -1.34 1.33 -2.14 -0.54 0.00 0.00 175.26 173.34 2gpl s PRO 182 N -0.60 3.90 -0.53 4.30 0.02 -1.09 -4.57 135.00 136.43 2gpl s PRO 182 Ca 0.29 2.22 -0.05 0.00 0.02 0.00 0.00 61.00 63.49 2gpl s PRO 182 Cb -0.00 -2.73 -0.18 0.00 0.02 0.00 0.00 34.50 31.60 2gpl s PRO 182 CO -0.18 -0.57 1.44 -2.30 -0.33 0.00 0.00 177.00 175.05 2gpl n PRO 183 N 0.05 0.00 0.00 5.54 -0.02 -1.26 -4.36 135.00 134.95 2gpl n PRO 183 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2gpl n PRO 183 Cb 0.43 -0.83 0.00 0.00 -0.02 0.00 0.00 33.50 33.08 2gpl n PRO 183 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gpl n ALA 184 N 4.25 1.16 -2.80 3.55 0.00 -1.26 -3.10 120.51 122.31 2gpl n ALA 184 Ca 0.36 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.67 2gpl n ALA 184 Cb 0.22 -0.77 -0.11 0.00 0.00 0.00 0.00 19.45 18.79 2gpl n ALA 184 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2gpl s THR 185 N -1.76 0.54 0.27 0.00 2.01 -1.26 -4.77 115.64 110.67 2gpl s THR 185 Ca 0.00 -1.15 -0.03 0.00 0.31 0.00 0.00 61.69 60.81 2gpl s THR 185 Cb 0.00 -0.70 0.21 0.00 0.01 0.00 0.00 72.50 72.02 2gpl s THR 185 CO 0.00 -0.43 1.88 0.58 -0.69 0.00 0.00 174.62 175.96 2gpl h VAL 186 N 4.36 1.23 0.15 3.82 2.07 -1.94 -0.64 116.25 125.30 2gpl h VAL 186 Ca -0.36 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 2gpl h VAL 186 Cb 1.20 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 2gpl h VAL 186 CO 0.43 0.27 -0.07 -0.08 0.02 0.00 0.00 177.57 178.13 2gpl h GLU 187 N 1.06 -0.20 0.00 1.57 4.81 -1.95 -0.36 114.58 119.52 2gpl h GLU 187 Ca 0.27 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 2gpl h GLU 187 Cb 0.06 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2gpl h GLU 187 CO -0.04 0.18 0.00 1.05 -0.73 0.00 0.00 179.01 179.47 2gpl h GLU 188 N -0.63 0.00 0.19 1.92 4.11 -1.89 -1.15 114.58 117.14 2gpl h GLU 188 Ca -0.02 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.07 2gpl h GLU 188 Cb 0.47 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.73 2gpl h GLU 188 CO 0.03 0.00 -1.62 0.00 0.07 0.00 0.00 179.01 177.49 2gpl h VAL 190 N 0.11 1.08 0.02 0.00 2.07 -0.45 -2.58 116.25 116.50 2gpl h VAL 190 Ca -0.29 -1.31 -0.00 0.00 0.82 0.00 0.00 66.70 65.92 2gpl h VAL 190 Cb 2.10 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 33.61 2gpl h VAL 190 CO 0.20 0.35 -0.01 0.50 0.02 0.00 0.00 177.57 178.63 2gpl h LYS 191 N 0.00 -0.02 -0.77 1.57 3.64 -1.28 -1.71 116.57 117.99 2gpl h LYS 191 Ca -0.00 0.00 0.19 0.00 -1.27 0.00 0.00 60.65 59.57 2gpl h LYS 191 Cb 0.71 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.50 2gpl h LYS 191 CO 0.05 0.63 0.53 1.25 -2.27 0.00 0.00 179.45 179.64 2gpl h LEU 192 N -0.72 0.20 0.29 5.20 5.85 -1.40 0.13 115.31 124.86 2gpl h LEU 192 Ca -0.00 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 2gpl h LEU 192 Cb 0.67 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.68 2gpl h LEU 192 CO 0.00 0.09 -0.14 0.74 -0.34 0.00 0.00 178.44 178.79 2gpl h THR 193 N 0.21 0.54 -0.86 1.05 2.02 -1.36 -2.57 112.91 111.94 2gpl h THR 193 Ca 0.38 -0.81 0.12 0.00 0.77 0.00 0.00 66.41 66.87 2gpl h THR 193 Cb 1.19 0.87 -0.08 0.00 -1.74 0.00 0.00 68.15 68.39 2gpl h THR 193 CO -0.08 0.12 0.48 0.58 0.37 0.00 0.00 175.52 177.00 2gpl h VAL 194 N -0.93 0.84 -0.11 3.16 2.07 -0.44 -1.82 116.25 119.02 2gpl h VAL 194 Ca -0.04 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.25 2gpl h VAL 194 Cb 0.51 0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2gpl h VAL 194 CO 0.07 0.14 -0.08 0.03 0.02 0.00 0.00 177.57 177.75 2gpl h ARG 195 N 0.75 -0.08 -0.17 1.57 3.08 -0.80 0.29 114.38 119.02 2gpl h ARG 195 Ca 0.44 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.49 2gpl h ARG 195 Cb 0.49 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 2gpl h ARG 195 CO -0.29 -0.05 0.08 0.66 -1.07 0.00 0.00 179.97 179.30 2gpl h SER 196 N -0.08 0.21 -0.09 7.04 4.64 -0.94 -2.54 113.55 121.78 2gpl h SER 196 Ca 0.07 -0.01 -0.24 0.00 -0.47 0.00 0.00 61.79 61.14 2gpl h SER 196 Cb 0.19 -0.05 0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2gpl h SER 196 CO -0.16 0.18 -0.86 -0.07 -0.87 0.00 0.00 176.83 175.04 2gpl h LEU 197 N 0.24 0.92 -2.71 5.97 3.38 -0.53 -3.15 115.31 119.42 2gpl h LEU 197 Ca 0.06 -0.67 0.00 0.00 0.09 0.00 0.00 57.88 57.36 2gpl h LEU 197 Cb 0.03 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 2gpl h LEU 197 CO -0.01 1.45 0.03 -0.07 0.09 0.00 0.00 178.44 179.94 2gpl h LEU 198 N 0.46 0.00 -2.49 1.67 3.38 -0.54 0.36 115.31 118.15 2gpl h LEU 198 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2gpl h LEU 198 Cb 1.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.26 2gpl h LEU 198 CO 0.17 0.00 0.00 -0.33 0.09 0.00 0.00 178.44 178.37 2gpl h GLU 199 N 0.00 0.00 0.00 1.13 4.39 -1.49 -3.32 114.58 115.30 2gpl h GLU 199 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2gpl h GLU 199 Cb 0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2gpl h GLU 199 CO -0.00 0.00 -0.37 0.28 -1.16 0.00 0.00 179.01 177.76 2gpl n VAL 200 N -3.02 0.00 0.22 3.13 0.31 0.20 -4.84 118.33 114.34 2gpl n VAL 200 Ca -0.02 0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.39 2gpl n VAL 200 Cb 0.13 -0.06 0.51 0.00 -0.91 0.00 0.00 33.84 33.51 2gpl n VAL 200 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2gpl h VAL 201 N 0.00 0.81 -5.54 2.52 2.07 -0.51 -3.48 116.25 112.11 2gpl h VAL 201 Ca 0.00 -1.02 -0.08 0.00 0.82 0.00 0.00 66.70 66.42 2gpl h VAL 201 Cb 0.16 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 2gpl h VAL 201 CO 0.00 0.25 -0.71 0.00 0.02 0.00 0.00 177.57 177.13 2gpl n GLN 202 N -3.69 -2.36 -3.25 1.57 1.13 -1.25 -4.29 117.38 105.23 2gpl n GLN 202 Ca -0.01 2.03 -0.11 0.00 -1.94 0.00 0.00 57.00 56.97 2gpl n GLN 202 Cb 0.37 -4.81 0.01 0.00 0.11 0.00 0.00 30.24 25.91 2gpl n GLN 202 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 2gpl n THR 203 N -0.11 -3.02 -3.23 5.09 -1.04 -1.26 -4.96 114.28 105.74 2gpl n THR 203 Ca 0.06 0.44 -0.24 0.00 -2.04 0.00 0.00 64.05 62.27 2gpl n THR 203 Cb 0.45 -3.35 -0.06 0.00 -1.82 0.00 0.00 70.33 65.55 2gpl n THR 203 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2gpl n GLY 206 N 0.85 3.82 0.24 3.41 0.00 -1.26 -4.91 105.19 107.34 2gpl n GLY 206 Ca -0.02 -2.06 -0.06 0.00 0.00 0.00 0.00 46.02 43.88 2gpl n GLY 206 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gpl h ALA 207 N 3.81 0.10 -0.11 4.61 0.00 -1.92 0.59 119.26 126.34 2gpl h ALA 207 Ca 0.12 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2gpl h ALA 207 Cb 0.79 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2gpl h ALA 207 CO 0.61 -0.55 0.00 0.36 0.00 0.00 0.00 179.25 179.67 2gpl n LYS 208 N -5.37 1.66 -0.61 0.00 -0.00 -1.26 -3.72 118.16 108.85 2gpl n LYS 208 Ca 0.02 -0.98 0.05 0.00 -0.00 0.00 0.00 58.31 57.40 2gpl n LYS 208 Cb 0.28 -1.42 0.27 0.00 -0.00 0.00 0.00 35.03 34.16 2gpl n LYS 208 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2gpl n ASN 209 N 0.20 4.04 -3.49 -5.58 3.02 0.19 -4.70 115.26 108.94 2gpl n ASN 209 Ca 0.17 -3.13 -0.12 0.00 -0.03 0.00 0.00 54.58 51.47 2gpl n ASN 209 Cb 0.32 -0.60 -0.10 0.00 -0.61 0.00 0.00 39.78 38.79 2gpl n ASN 209 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2gpl s ILE 210 N -2.90 -0.52 0.03 2.41 1.01 -0.35 -1.68 121.20 119.20 2gpl s ILE 210 Ca 0.46 0.03 0.07 0.00 0.00 0.00 0.00 60.65 61.20 2gpl s ILE 210 Cb 0.37 -0.69 -0.03 0.00 0.01 0.00 0.00 42.46 42.12 2gpl s ILE 210 CO 0.09 -0.06 -0.19 -1.83 0.00 0.00 0.00 174.94 172.95 2gpl s GLU 211 N 2.49 2.07 -0.02 2.79 -1.05 -0.58 -4.95 118.70 119.46 2gpl s GLU 211 Ca 0.07 -0.97 0.01 0.00 -0.15 0.00 0.00 54.97 53.92 2gpl s GLU 211 Cb -0.14 -2.17 0.02 0.00 -0.44 0.00 0.00 34.13 31.39 2gpl s GLU 211 CO -0.13 0.54 -0.01 0.42 0.95 0.00 0.00 175.26 177.03 2gpl s ILE 212 N -0.89 0.21 -0.09 1.83 1.01 -1.26 -1.59 121.20 120.43 2gpl s ILE 212 Ca 0.14 -0.01 0.04 0.00 0.00 0.00 0.00 60.65 60.82 2gpl s ILE 212 Cb -0.10 -0.25 -0.01 0.00 0.01 0.00 0.00 42.46 42.10 2gpl s ILE 212 CO 0.04 0.12 -0.20 -0.89 0.00 0.00 0.00 174.94 174.01 2gpl s THR 213 N 0.58 2.44 -0.15 2.92 2.01 -0.25 -1.47 115.64 121.72 2gpl s THR 213 Ca -0.06 -0.91 -0.04 0.00 0.31 0.00 0.00 61.69 61.00 2gpl s THR 213 Cb -0.09 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.44 2gpl s THR 213 CO -0.01 0.56 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.76 2gpl s VAL 214 N 0.04 4.03 -0.14 3.82 1.01 0.71 -1.54 120.40 128.34 2gpl s VAL 214 Ca -0.08 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.60 2gpl s VAL 214 Cb -0.15 -2.76 0.02 0.00 0.00 0.00 0.00 36.38 33.49 2gpl s VAL 214 CO 0.05 0.51 -0.16 0.54 0.00 0.00 0.00 175.10 176.04 2gpl s VAL 215 N 0.16 1.68 0.38 2.92 0.11 -0.73 -1.34 120.40 123.58 2gpl s VAL 215 Ca -0.01 -0.73 0.08 0.00 -2.93 0.00 0.00 61.98 58.40 2gpl s VAL 215 Cb -0.13 -1.54 -0.06 0.00 -1.53 0.00 0.00 36.38 33.12 2gpl s VAL 215 CO 0.02 0.48 0.10 -0.54 -3.33 0.00 0.00 175.10 171.83 2gpl s LYS 216 N 1.20 2.15 0.81 1.54 1.02 0.12 -1.91 119.74 124.66 2gpl s LYS 216 Ca -0.01 -1.82 -0.14 0.00 0.02 0.00 0.00 55.97 54.02 2gpl s LYS 216 Cb -0.14 -1.94 0.03 0.00 -0.52 0.00 0.00 37.83 35.26 2gpl s LYS 216 CO -0.07 0.00 0.79 -2.30 -0.92 0.00 0.00 175.35 172.85 2gpl n PRO 217 N -1.10 0.14 -3.24 -1.68 -0.02 -1.26 -2.93 135.00 124.91 2gpl n PRO 217 Ca -0.03 0.10 -0.15 0.00 -2.02 0.00 0.00 63.50 61.41 2gpl n PRO 217 Cb 0.64 -2.09 0.08 0.00 -0.02 0.00 0.00 33.50 32.10 2gpl n PRO 217 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2gpl n ASP 218 N -1.74 -3.94 -2.42 2.55 10.43 -1.26 -3.41 116.55 116.75 2gpl n ASP 218 Ca 0.11 -0.61 -0.14 0.00 2.57 0.00 0.00 54.79 56.71 2gpl n ASP 218 Cb 0.51 -4.85 -0.01 0.00 1.84 0.00 0.00 41.12 38.62 2gpl n ASP 218 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 2gpl n SER 219 N -3.04 -4.37 -4.40 -2.24 7.64 -1.26 -4.91 113.62 101.04 2gpl n SER 219 Ca -0.18 0.15 -0.45 0.00 1.01 0.00 0.00 58.87 59.40 2gpl n SER 219 Cb 0.64 -3.69 -0.03 0.00 -1.01 0.00 0.00 64.21 60.12 2gpl n SER 219 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2gpl s ASP 220 N -2.04 6.58 -0.09 6.43 3.68 -1.15 -4.84 116.67 125.24 2gpl s ASP 220 Ca 0.00 -2.10 0.03 0.00 2.13 0.00 0.00 52.55 52.61 2gpl s ASP 220 Cb 0.00 -2.33 0.01 0.00 -1.45 0.00 0.00 42.92 39.15 2gpl s ASP 220 CO 0.00 -0.94 -0.18 -0.63 0.13 0.00 0.00 175.17 173.54 2gpl s ILE 221 N 1.99 1.65 -0.05 4.11 1.01 -1.26 0.11 121.20 128.75 2gpl s ILE 221 Ca 0.24 -0.77 -0.11 0.00 0.00 0.00 0.00 60.65 60.02 2gpl s ILE 221 Cb -0.10 -1.45 0.02 0.00 0.01 0.00 0.00 42.46 40.93 2gpl s ILE 221 CO -0.06 0.47 0.25 0.54 0.00 0.00 0.00 174.94 176.14 2gpl s VAL 222 N 0.56 0.04 -0.14 2.92 0.11 -0.45 -5.02 120.40 118.42 2gpl s VAL 222 Ca -0.15 -0.31 -0.03 0.00 -2.93 0.00 0.00 61.98 58.55 2gpl s VAL 222 Cb -0.17 -0.47 -0.03 0.00 -1.53 0.00 0.00 36.38 34.19 2gpl s VAL 222 CO 0.05 -0.17 -0.04 0.00 -3.33 0.00 0.00 175.10 171.61 2gpl s ALA 223 N -0.69 3.00 0.71 1.54 0.00 -1.26 -0.21 121.76 124.85 2gpl s ALA 223 Ca -0.08 -0.83 -0.13 0.00 0.00 0.00 0.00 51.96 50.92 2gpl s ALA 223 Cb -0.04 -1.50 0.03 0.00 0.00 0.00 0.00 23.12 21.61 2gpl s ALA 223 CO 0.02 0.28 1.11 -0.51 0.00 0.00 0.00 175.76 176.66 2gpl s LEU 224 N 0.14 3.24 0.34 0.00 1.02 -0.54 -5.00 118.68 117.88 2gpl s LEU 224 Ca -0.02 1.96 0.05 0.00 0.02 0.00 0.00 54.13 56.14 2gpl s LEU 224 Cb -0.14 -4.54 -0.01 0.00 0.02 0.00 0.00 46.19 41.52 2gpl s LEU 224 CO 0.03 -1.85 0.49 -0.94 0.02 0.00 0.00 176.35 174.10 2gpl s SER 225 N -2.85 6.03 0.20 2.29 1.04 -1.26 -4.69 113.70 114.45 2gpl s SER 225 Ca 0.65 -0.04 -0.24 0.00 0.48 0.00 0.00 55.95 56.81 2gpl s SER 225 Cb -0.20 -1.43 0.09 0.00 0.10 0.00 0.00 66.02 64.58 2gpl s SER 225 CO 0.47 -0.40 1.55 0.28 0.98 0.00 0.00 173.24 176.12 2gpl h SER 226 N 0.86 -1.78 0.18 7.02 0.02 -1.93 -1.54 113.55 116.37 2gpl h SER 226 Ca -0.47 0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2gpl h SER 226 Cb 1.25 0.85 -0.02 0.00 0.14 0.00 0.00 62.40 64.62 2gpl h SER 226 CO 0.55 -0.26 -0.32 -0.33 -1.14 0.00 0.00 176.83 175.34 2gpl h GLU 227 N -0.01 -0.51 -0.97 3.45 3.07 -1.95 1.11 114.58 118.76 2gpl h GLU 227 Ca 0.26 0.03 0.30 0.00 -0.50 0.00 0.00 59.36 59.45 2gpl h GLU 227 Cb 0.51 0.12 -0.18 0.00 -0.84 0.00 0.00 28.75 28.36 2gpl h GLU 227 CO -0.96 -0.34 0.18 0.93 -1.40 0.00 0.00 179.01 177.42 2gpl h GLU 228 N -0.53 0.04 -0.00 2.33 5.08 -1.78 0.59 114.58 120.31 2gpl h GLU 228 Ca -0.02 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2gpl h GLU 228 Cb 0.49 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2gpl h GLU 228 CO -0.11 0.03 -0.04 0.82 -1.00 0.00 0.00 179.01 178.70 2gpl h ILE 229 N 0.04 1.60 -1.00 3.13 2.04 -0.84 -3.20 117.51 119.28 2gpl h ILE 229 Ca 0.65 -1.82 0.28 0.00 1.00 0.00 0.00 64.86 64.97 2gpl h ILE 229 Cb 1.45 2.82 -0.05 0.00 -0.74 0.00 0.00 36.82 40.29 2gpl h ILE 229 CO -0.84 0.48 0.71 -1.13 0.00 0.00 0.00 178.15 177.36 2gpl h ASN 230 N -0.71 0.11 -0.17 1.72 -1.24 0.46 0.65 115.58 116.40 2gpl h ASN 230 Ca -0.01 0.02 -0.13 0.00 0.71 0.00 0.00 56.30 56.89 2gpl h ASN 230 Cb 0.81 -0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.84 2gpl h ASN 230 CO 0.01 0.03 -0.35 1.56 -1.29 0.00 0.00 177.43 177.39 2gpl h GLN 231 N 0.10 0.68 -0.62 6.67 4.20 -0.01 -2.18 115.11 123.96 2gpl h GLN 231 Ca 0.50 -0.33 -0.09 0.00 0.06 0.00 0.00 58.65 58.79 2gpl h GLN 231 Cb 1.79 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.54 2gpl h GLN 231 CO -0.07 0.93 0.04 1.88 -0.67 0.00 0.00 178.83 180.95 2gpl h TYR 232 N 0.57 1.15 0.04 2.96 -1.99 0.28 -2.28 116.97 117.70 2gpl h TYR 232 Ca 0.06 -0.18 -0.00 0.00 2.00 0.00 0.00 58.73 60.60 2gpl h TYR 232 Cb 0.87 -0.31 0.00 0.00 2.00 0.00 0.00 36.73 39.30 2gpl h TYR 232 CO 0.04 1.00 -0.02 0.28 -0.00 0.00 0.00 178.16 179.46 2gpl h VAL 233 N 0.97 1.07 -0.37 -2.88 2.07 -1.27 -1.75 116.25 114.09 2gpl h VAL 233 Ca 0.18 -0.33 0.08 0.00 0.82 0.00 0.00 66.70 67.45 2gpl h VAL 233 Cb 0.51 1.29 -0.08 0.00 -1.52 0.00 0.00 31.29 31.49 2gpl h VAL 233 CO 0.02 0.08 -0.16 0.74 0.02 0.00 0.00 177.57 178.28 2gpl h THR 234 N -0.19 0.50 0.00 2.57 2.02 -1.28 0.24 112.91 116.76 2gpl h THR 234 Ca -0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 2gpl h THR 234 Cb 0.17 0.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.08 2gpl h THR 234 CO 0.01 0.00 -0.14 -0.61 0.37 0.00 0.00 175.52 175.15 2gpl h GLN 235 N -0.09 0.00 0.03 6.66 4.15 -1.34 -2.59 115.11 121.94 2gpl h GLN 235 Ca 0.19 0.00 -0.26 0.00 0.77 0.00 0.00 58.65 59.34 2gpl h GLN 235 Cb 0.37 0.00 0.02 0.00 0.21 0.00 0.00 27.48 28.08 2gpl h GLN 235 CO -0.43 0.14 -1.04 0.82 -1.93 0.00 0.00 178.83 176.38 2gpl h ILE 236 N 0.00 1.29 0.00 2.39 2.04 0.09 -2.77 117.51 120.56 2gpl h ILE 236 Ca -0.00 -2.28 -0.01 0.00 1.00 0.00 0.00 64.86 63.57 2gpl h ILE 236 Cb 0.26 2.48 -0.00 0.00 -0.74 0.00 0.00 36.82 38.81 2gpl h ILE 236 CO 0.02 0.70 -0.06 -0.33 0.00 0.00 0.00 178.15 178.48 2gpl h GLU 237 N 0.32 0.00 0.13 2.37 5.08 -0.36 -2.52 114.58 119.60 2gpl h GLU 237 Ca -0.14 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.03 2gpl h GLU 237 Cb 1.71 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.98 2gpl h GLU 237 CO 0.20 0.06 -0.84 1.96 -1.00 0.00 0.00 179.01 179.39 2gpl h GLN 238 N 0.00 0.34 -1.08 2.33 4.20 -1.45 -2.50 115.11 116.95 2gpl h GLN 238 Ca -0.00 -0.54 0.30 0.00 0.06 0.00 0.00 58.65 58.47 2gpl h GLN 238 Cb 0.39 0.20 -0.11 0.00 0.30 0.00 0.00 27.48 28.26 2gpl h GLN 238 CO 0.01 1.24 0.68 0.93 -0.67 0.00 0.00 178.83 181.02 2gpl h GLU 239 N -0.29 0.35 0.23 1.46 4.39 -1.15 0.61 114.58 120.17 2gpl h GLU 239 Ca -0.14 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 2gpl h GLU 239 Cb 1.64 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 30.22 2gpl h GLU 239 CO 0.16 0.23 -0.11 0.87 -1.16 0.00 0.00 179.01 179.00 2gpl h LYS 240 N 0.36 -0.29 -1.00 2.33 1.57 -1.54 -3.32 116.57 114.66 2gpl h LYS 240 Ca 0.65 0.02 0.24 0.00 -1.87 0.00 0.00 60.65 59.68 2gpl h LYS 240 Cb 1.66 0.07 -0.09 0.00 0.08 0.00 0.00 32.23 33.95 2gpl h LYS 240 CO -0.36 -0.20 0.64 1.96 -0.57 0.00 0.00 179.45 180.92 2gpl h GLN 241 N -0.71 0.47 -1.77 3.15 4.20 -0.86 -0.25 115.11 119.34 2gpl h GLN 241 Ca -0.03 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.65 2gpl h GLN 241 Cb 0.23 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.91 2gpl h GLN 241 CO 0.05 0.31 0.00 0.39 -0.67 0.00 0.00 178.83 178.91 2gpl n GLU 242 N -4.64 0.50 0.00 1.46 1.02 0.21 -5.09 120.64 114.09 2gpl n GLU 242 Ca 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 2gpl n GLU 242 Cb 0.77 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.94 2gpl n GLU 242 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25