#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gpl n THR 6 N 0.00 0.00 -0.15 2.61 -2.24 -1.26 -4.92 114.28 108.32 2gpl n THR 6 Ca 0.00 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 2gpl n THR 6 Cb 0.00 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 2gpl n THR 6 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gpl n GLY 7 N -0.23 0.91 0.10 3.38 0.00 -1.26 -4.91 105.19 103.18 2gpl n GLY 7 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.10 2gpl n GLY 7 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2gpl n TYR 8 N -2.00 0.44 -0.58 1.61 4.01 -1.26 -1.59 117.16 117.79 2gpl n TYR 8 Ca 0.00 0.23 0.09 0.00 -0.16 0.00 0.00 57.90 58.06 2gpl n TYR 8 Cb 0.00 -0.86 0.30 0.00 -0.31 0.00 0.00 39.34 38.46 2gpl n TYR 8 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 2gpl n ASP 9 N -1.95 4.18 -0.00 7.72 5.75 -1.26 -4.43 116.55 126.55 2gpl n ASP 9 Ca -0.01 -2.43 0.11 0.00 -0.01 0.00 0.00 54.79 52.46 2gpl n ASP 9 Cb 0.03 -0.49 -0.16 0.00 -1.03 0.00 0.00 41.12 39.46 2gpl n ASP 9 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2gpl n LEU 10 N 0.74 0.07 -4.23 -2.12 4.77 -0.62 -4.59 117.00 111.02 2gpl n LEU 10 Ca 0.22 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.88 2gpl n LEU 10 Cb 0.78 -0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.70 2gpl n LEU 10 CO 0.19 -0.00 -0.55 -0.44 -1.33 0.00 0.00 177.39 175.26 2gpl s SER 11 N -4.52 3.19 0.26 -1.43 0.01 -1.26 -5.06 113.70 104.89 2gpl s SER 11 Ca -0.07 -0.54 -0.03 0.00 1.31 0.00 0.00 55.95 56.61 2gpl s SER 11 Cb 0.14 -1.44 0.52 0.00 0.21 0.00 0.00 66.02 65.45 2gpl s SER 11 CO 0.90 0.15 1.67 -1.13 0.41 0.00 0.00 173.24 175.24 2gpl h ASN 12 N 6.82 -0.01 -0.55 2.44 -0.73 -1.82 -2.74 115.58 118.98 2gpl h ASN 12 Ca -0.22 0.16 0.00 0.00 1.87 0.00 0.00 56.30 58.11 2gpl h ASN 12 Cb 1.23 0.22 0.00 0.00 0.27 0.00 0.00 38.32 40.04 2gpl h ASN 12 CO 0.49 -0.07 0.00 -1.54 -0.37 0.00 0.00 177.43 175.94 2gpl n SER 13 N -5.19 4.36 -4.71 1.15 3.41 -1.26 -4.73 113.62 106.66 2gpl n SER 13 Ca 0.16 -2.47 -0.41 0.00 -0.26 0.00 0.00 58.87 55.89 2gpl n SER 13 Cb 0.52 -0.56 -0.04 0.00 -0.26 0.00 0.00 64.21 63.86 2gpl n SER 13 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2gpl s VAL 14 N -1.96 4.97 -0.06 -3.33 1.01 -1.03 -4.95 120.40 115.04 2gpl s VAL 14 Ca 0.45 1.72 -0.27 0.00 0.00 0.00 0.00 61.98 63.87 2gpl s VAL 14 Cb 0.30 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 2gpl s VAL 14 CO 0.20 0.21 0.88 -0.36 0.00 0.00 0.00 175.10 176.02 2gpl s PHE 15 N 0.90 3.57 0.84 5.22 0.08 -1.26 -4.47 117.98 122.86 2gpl s PHE 15 Ca 0.44 1.48 -0.12 0.00 0.12 0.00 0.00 56.93 58.85 2gpl s PHE 15 Cb -0.19 -3.02 0.09 0.00 -0.57 0.00 0.00 43.02 39.33 2gpl s PHE 15 CO 0.22 -0.05 1.12 -1.54 -0.10 0.00 0.00 175.22 174.87 2gpl s SER 16 N 0.99 4.18 0.63 1.36 1.04 0.06 -4.88 113.70 117.09 2gpl s SER 16 Ca 0.45 1.09 0.36 0.00 0.48 0.00 0.00 55.95 58.32 2gpl s SER 16 Cb -0.19 -1.73 2.00 0.00 0.10 0.00 0.00 66.02 66.20 2gpl s SER 16 CO 0.21 -2.14 2.21 -0.65 0.98 0.00 0.00 173.24 173.85 2gpl h PRO 17 N -1.21 0.00 -0.90 4.02 0.11 -1.97 -0.55 132.00 131.50 2gpl h PRO 17 Ca -0.48 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.28 2gpl h PRO 17 Cb 1.30 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 32.20 2gpl h PRO 17 CO 0.62 0.00 0.44 -0.40 -0.21 0.00 0.00 178.00 178.44 2gpl n ASP 18 N -3.37 4.12 -1.77 -2.05 3.85 -1.26 -4.93 116.55 111.15 2gpl n ASP 18 Ca -0.02 -3.30 -0.18 0.00 -0.71 0.00 0.00 54.79 50.59 2gpl n ASP 18 Cb 0.19 -0.77 -0.04 0.00 -1.35 0.00 0.00 41.12 39.15 2gpl n ASP 18 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2gpl n GLY 19 N -0.57 0.51 3.88 6.12 0.00 -0.22 -5.01 105.19 109.90 2gpl n GLY 19 Ca 0.47 -0.14 -0.22 0.00 0.00 0.00 0.00 46.02 46.13 2gpl n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gpl s ARG 20 N -4.33 2.47 -0.51 1.61 0.52 -1.26 -4.81 118.95 112.65 2gpl s ARG 20 Ca 0.00 -1.62 0.03 0.00 -0.52 0.00 0.00 55.73 53.62 2gpl s ARG 20 Cb 0.00 -2.33 0.15 0.00 0.52 0.00 0.00 34.95 33.29 2gpl s ARG 20 CO 0.00 -0.28 0.33 1.21 0.02 0.00 0.00 175.30 176.58 2gpl s ASN 21 N -4.16 3.61 0.30 0.23 3.84 -1.26 -0.76 114.94 116.74 2gpl s ASN 21 Ca 0.46 -3.06 0.05 0.00 0.21 0.00 0.00 52.86 50.53 2gpl s ASN 21 Cb -0.03 -1.13 0.76 0.00 -0.55 0.00 0.00 41.25 40.30 2gpl s ASN 21 CO 0.27 -0.20 1.72 -0.26 -2.79 0.00 0.00 177.10 175.84 2gpl h PHE 22 N 6.17 0.80 -0.14 0.43 0.04 -1.82 -0.33 116.94 122.09 2gpl h PHE 22 Ca 0.08 0.04 0.01 0.00 2.80 0.00 0.00 57.97 60.90 2gpl h PHE 22 Cb 0.88 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.81 2gpl h PHE 22 CO 0.50 0.03 0.09 1.96 -0.60 0.00 0.00 178.31 180.29 2gpl h GLN 23 N 0.50 0.13 -0.19 1.51 1.08 -1.85 0.26 115.11 116.56 2gpl h GLN 23 Ca 0.58 -0.01 -0.17 0.00 -1.45 0.00 0.00 58.65 57.60 2gpl h GLN 23 Cb 1.06 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.46 2gpl h GLN 23 CO -0.49 0.09 -0.57 0.28 -0.95 0.00 0.00 178.83 177.19 2gpl h VAL 24 N 0.13 1.32 -0.26 -0.54 2.07 -1.37 -1.97 116.25 115.64 2gpl h VAL 24 Ca 0.06 -1.83 -0.13 0.00 0.82 0.00 0.00 66.70 65.62 2gpl h VAL 24 Cb 0.06 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2gpl h VAL 24 CO -0.01 0.57 -0.36 -0.33 0.02 0.00 0.00 177.57 177.46 2gpl h GLU 25 N 0.45 0.58 -0.16 1.57 5.08 -0.73 -2.11 114.58 119.27 2gpl h GLU 25 Ca 0.00 -0.28 -0.11 0.00 -1.00 0.00 0.00 59.36 57.97 2gpl h GLU 25 Cb 1.13 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2gpl h GLU 25 CO 0.11 0.86 -0.39 1.88 -1.00 0.00 0.00 179.01 180.46 2gpl h TYR 26 N 0.49 0.40 -0.56 4.33 -1.99 -0.48 -2.52 116.97 116.64 2gpl h TYR 26 Ca 0.05 -0.11 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 2gpl h TYR 26 Cb 0.85 -0.09 -0.03 0.00 2.00 0.00 0.00 36.73 39.47 2gpl h TYR 26 CO 0.03 0.69 0.30 0.00 -0.00 0.00 0.00 178.16 179.19 2gpl h ALA 27 N 1.30 0.72 -0.84 3.88 0.00 -0.92 -1.74 119.26 121.65 2gpl h ALA 27 Ca 0.03 -0.10 0.12 0.00 0.00 0.00 0.00 54.91 54.95 2gpl h ALA 27 Cb 0.82 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 2gpl h ALA 27 CO 0.07 0.24 0.55 0.28 0.00 0.00 0.00 179.25 180.39 2gpl h VAL 28 N 0.75 0.89 -0.44 0.00 2.07 -0.96 -0.00 116.25 118.56 2gpl h VAL 28 Ca 0.20 -0.25 0.05 0.00 0.82 0.00 0.00 66.70 67.52 2gpl h VAL 28 Cb 0.06 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 29.90 2gpl h VAL 28 CO -0.03 0.13 0.19 0.11 0.02 0.00 0.00 177.57 177.99 2gpl h LYS 29 N 0.72 0.37 -0.42 1.57 1.79 -1.10 0.13 116.57 119.63 2gpl h LYS 29 Ca 0.41 -0.02 0.06 0.00 -2.18 0.00 0.00 60.65 58.91 2gpl h LYS 29 Cb 0.58 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.12 2gpl h LYS 29 CO -0.17 0.24 0.29 0.00 -1.08 0.00 0.00 179.45 178.73 2gpl h ALA 30 N 1.26 2.00 -0.19 3.86 0.00 -0.89 -0.16 119.26 125.13 2gpl h ALA 30 Ca 0.20 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 2gpl h ALA 30 Cb 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2gpl h ALA 30 CO -0.17 -0.08 -0.37 0.28 0.00 0.00 0.00 179.25 178.91 2gpl h VAL 31 N 0.31 1.33 0.00 0.00 2.07 -0.58 -3.06 116.25 116.32 2gpl h VAL 31 Ca 0.19 -1.60 -0.06 0.00 0.82 0.00 0.00 66.70 66.04 2gpl h VAL 31 Cb 0.34 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 2gpl h VAL 31 CO -0.04 0.49 -0.28 -0.33 0.02 0.00 0.00 177.57 177.43 2gpl h GLU 32 N 0.26 0.00 0.00 1.57 5.08 -0.10 -1.94 114.58 119.45 2gpl h GLU 32 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2gpl h GLU 32 Cb 0.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.22 2gpl h GLU 32 CO 0.08 0.28 0.00 -1.71 -1.00 0.00 0.00 179.01 176.66 2gpl n ASN 33 N -3.90 0.00 -5.02 1.42 2.85 -0.17 -2.82 115.26 107.61 2gpl n ASN 33 Ca -0.02 -1.02 -0.19 0.00 -0.11 0.00 0.00 54.58 53.24 2gpl n ASN 33 Cb 0.36 0.00 0.04 0.00 1.24 0.00 0.00 39.78 41.42 2gpl n ASN 33 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 2gpl s GLY 34 N -1.89 1.82 0.68 8.20 0.00 -0.73 -4.86 107.32 110.55 2gpl s GLY 34 Ca 0.39 -1.95 -0.17 0.00 0.00 0.00 0.00 44.72 42.99 2gpl s GLY 34 CO 0.30 -1.62 0.81 2.41 0.00 0.00 0.00 173.10 175.00 2gpl n THR 35 N -2.08 2.74 -3.34 0.90 -1.04 -1.26 0.21 114.28 110.41 2gpl n THR 35 Ca 0.12 -0.42 -0.37 0.00 -2.04 0.00 0.00 64.05 61.34 2gpl n THR 35 Cb 0.61 -0.97 -0.06 0.00 -1.82 0.00 0.00 70.33 68.08 2gpl n THR 35 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2gpl s THR 36 N -1.76 4.83 0.04 12.58 -1.32 -1.26 -4.12 115.64 124.62 2gpl s THR 36 Ca 0.72 1.00 -0.07 0.00 -1.21 0.00 0.00 61.69 62.12 2gpl s THR 36 Cb -0.37 -3.80 -0.00 0.00 -1.51 0.00 0.00 72.50 66.81 2gpl s THR 36 CO 0.52 0.42 0.14 -0.94 -2.21 0.00 0.00 174.62 172.55 2gpl s SER 37 N -1.37 0.11 0.31 8.08 1.04 -0.65 -1.50 113.70 119.72 2gpl s SER 37 Ca 0.32 -0.45 0.03 0.00 0.48 0.00 0.00 55.95 56.33 2gpl s SER 37 Cb -0.17 0.25 -0.02 0.00 0.10 0.00 0.00 66.02 66.18 2gpl s SER 37 CO 0.18 -0.53 0.32 0.27 0.98 0.00 0.00 173.24 174.47 2gpl s ILE 38 N -2.56 0.00 -0.13 -1.02 -4.36 0.06 -1.78 121.20 111.40 2gpl s ILE 38 Ca -0.05 -1.87 -0.08 0.00 -0.26 0.00 0.00 60.65 58.39 2gpl s ILE 38 Cb -0.01 -2.53 0.05 0.00 1.25 0.00 0.00 42.46 41.21 2gpl s ILE 38 CO -0.04 0.00 0.32 -0.83 0.24 0.00 0.00 174.94 174.63 2gpl s GLY 39 N -3.29 -0.23 -0.16 6.27 0.00 0.11 -2.79 107.32 107.23 2gpl s GLY 39 Ca 0.37 1.21 0.00 0.00 0.00 0.00 0.00 44.72 46.30 2gpl s GLY 39 CO 0.23 1.38 -0.13 -0.42 0.00 0.00 0.00 173.10 174.16 2gpl s ILE 40 N 1.19 1.53 -0.15 0.90 1.01 -0.39 -0.34 121.20 124.96 2gpl s ILE 40 Ca -0.08 -0.69 -0.24 0.00 0.00 0.00 0.00 60.65 59.64 2gpl s ILE 40 Cb -0.09 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.87 2gpl s ILE 40 CO -0.09 0.38 0.74 -0.75 0.00 0.00 0.00 174.94 175.22 2gpl s LYS 41 N 1.49 4.31 0.18 2.79 2.20 -0.71 -0.52 119.74 129.48 2gpl s LYS 41 Ca 0.03 0.87 0.02 0.00 -0.36 0.00 0.00 55.97 56.53 2gpl s LYS 41 Cb -0.14 -3.54 0.02 0.00 -1.51 0.00 0.00 37.83 32.66 2gpl s LYS 41 CO -0.10 -0.20 0.16 0.00 -0.36 0.00 0.00 175.35 174.85 2gpl h ASN 43 N 0.18 0.00 0.00 0.00 -0.00 -1.55 -3.28 115.58 110.93 2gpl h ASN 43 Ca -0.11 0.00 -0.14 0.00 -0.00 0.00 0.00 56.30 56.05 2gpl h ASN 43 Cb 0.42 0.00 -0.23 0.00 -0.00 0.00 0.00 38.32 38.50 2gpl h ASN 43 CO 0.17 0.00 -0.61 -0.90 -0.00 0.00 0.00 177.43 176.08 2gpl n ASP 44 N -3.67 -0.05 0.00 6.14 3.85 -1.26 -4.94 116.55 116.61 2gpl n ASP 44 Ca -0.01 -1.96 0.00 0.00 -0.71 0.00 0.00 54.79 52.11 2gpl n ASP 44 Cb 0.18 0.01 0.00 0.00 -1.35 0.00 0.00 41.12 39.96 2gpl n ASP 44 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2gpl n GLY 45 N 0.22 0.93 3.22 6.12 0.00 -1.24 -0.97 105.19 113.47 2gpl n GLY 45 Ca -0.11 -0.55 -0.11 0.00 0.00 0.00 0.00 46.02 45.25 2gpl n GLY 45 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gpl s VAL 46 N -1.91 0.09 -0.00 1.61 -7.23 -0.49 -1.26 120.40 111.21 2gpl s VAL 46 Ca 0.00 -0.74 0.06 0.00 -1.81 0.00 0.00 61.98 59.49 2gpl s VAL 46 Cb 0.00 -0.90 -0.02 0.00 0.56 0.00 0.00 36.38 36.03 2gpl s VAL 46 CO 0.00 -0.41 -0.19 -0.69 -0.31 0.00 0.00 175.10 173.50 2gpl s VAL 47 N -2.46 1.49 -0.01 1.32 1.01 0.32 -1.30 120.40 120.78 2gpl s VAL 47 Ca -0.06 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 61.10 2gpl s VAL 47 Cb -0.01 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 2gpl s VAL 47 CO -0.03 0.35 -0.21 -0.36 0.00 0.00 0.00 175.10 174.86 2gpl s PHE 48 N -0.53 1.84 0.00 5.22 0.40 0.73 -1.26 117.98 124.38 2gpl s PHE 48 Ca 0.07 -0.35 -0.14 0.00 -0.60 0.00 0.00 56.93 55.91 2gpl s PHE 48 Cb -0.08 -1.17 0.02 0.00 0.51 0.00 0.00 43.02 42.30 2gpl s PHE 48 CO -0.00 -0.02 0.30 0.00 0.70 0.00 0.00 175.22 176.20 2gpl s ALA 49 N -0.52 -0.74 0.01 5.36 0.00 -1.12 -0.37 121.76 124.38 2gpl s ALA 49 Ca 0.08 0.23 -0.16 0.00 0.00 0.00 0.00 51.96 52.11 2gpl s ALA 49 Cb -0.08 0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.20 2gpl s ALA 49 CO -0.00 -0.29 0.35 0.54 0.00 0.00 0.00 175.76 176.35 2gpl s VAL 50 N -1.62 0.06 -0.02 0.00 0.11 -0.63 -0.77 120.40 117.53 2gpl s VAL 50 Ca -0.12 -0.51 -0.21 0.00 -2.93 0.00 0.00 61.98 58.21 2gpl s VAL 50 Cb -0.04 -0.82 -0.05 0.00 -1.53 0.00 0.00 36.38 33.94 2gpl s VAL 50 CO 0.02 -0.28 0.61 -0.70 -3.33 0.00 0.00 175.10 171.42 2gpl s GLU 51 N -1.96 4.34 -0.30 1.54 2.12 -0.56 -2.67 118.70 121.21 2gpl s GLU 51 Ca -0.09 0.74 0.03 0.00 0.36 0.00 0.00 54.97 56.01 2gpl s GLU 51 Cb -0.03 -3.37 0.08 0.00 0.26 0.00 0.00 34.13 31.08 2gpl s GLU 51 CO 0.01 0.30 -0.01 0.15 -0.54 0.00 0.00 175.26 175.17 2gpl s LYS 52 N 0.03 1.69 0.02 4.30 1.02 -0.43 -4.68 119.74 121.70 2gpl s LYS 52 Ca 0.32 -1.57 -0.30 0.00 0.02 0.00 0.00 55.97 54.43 2gpl s LYS 52 Cb -0.18 -2.97 -0.07 0.00 -0.52 0.00 0.00 37.83 34.09 2gpl s LYS 52 CO 0.17 -0.79 1.60 -0.51 -0.92 0.00 0.00 175.35 174.89 2gpl s LEU 53 N 1.06 4.34 -0.94 3.17 1.43 -1.26 0.28 118.68 126.76 2gpl s LEU 53 Ca 0.03 2.34 -0.23 0.00 -1.03 0.00 0.00 54.13 55.24 2gpl s LEU 53 Cb -0.19 -3.56 0.06 0.00 0.03 0.00 0.00 46.19 42.54 2gpl s LEU 53 CO -0.08 -0.86 1.34 -0.63 0.23 0.00 0.00 176.35 176.35 2gpl s ILE 54 N 2.92 4.07 0.35 -0.59 -1.09 0.29 -4.83 121.20 122.33 2gpl s ILE 54 Ca 0.71 -0.74 0.03 0.00 -2.23 0.00 0.00 60.65 58.43 2gpl s ILE 54 Cb -0.36 -4.96 0.27 0.00 -1.58 0.00 0.00 42.46 35.82 2gpl s ILE 54 CO 0.30 -1.82 2.00 0.74 -1.23 0.00 0.00 174.94 174.93 2gpl h THR 55 N 6.46 1.13 -2.96 2.92 2.02 -1.92 -3.39 112.91 117.16 2gpl h THR 55 Ca 0.10 -0.29 0.03 0.00 0.77 0.00 0.00 66.41 67.02 2gpl h THR 55 Cb 1.02 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 2gpl h THR 55 CO 1.33 0.15 0.27 -0.55 0.37 0.00 0.00 175.52 177.10 2gpl s SER 56 N -6.39 -0.10 0.46 4.18 0.15 -1.26 -5.01 113.70 105.73 2gpl s SER 56 Ca -0.10 -0.90 0.28 0.00 0.70 0.00 0.00 55.95 55.93 2gpl s SER 56 Cb 0.18 0.78 0.86 0.00 -1.71 0.00 0.00 66.02 66.14 2gpl s SER 56 CO 0.77 -1.51 1.79 0.11 1.20 0.00 0.00 173.24 175.60 2gpl h LYS 57 N 2.00 0.00 0.00 5.44 1.79 -2.03 -3.15 116.57 120.62 2gpl h LYS 57 Ca -0.27 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.19 2gpl h LYS 57 Cb 1.25 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.90 2gpl h LYS 57 CO 0.33 0.00 -0.04 -0.07 -1.08 0.00 0.00 179.45 178.59 2gpl h LEU 58 N 0.00 0.00 -9.40 2.94 3.38 -2.00 -3.43 115.31 106.81 2gpl h LEU 58 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 2gpl h LEU 58 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2gpl h LEU 58 CO 0.00 0.04 0.87 -0.76 0.09 0.00 0.00 178.44 178.68 2gpl s LEU 59 N -6.39 4.33 -0.01 1.67 1.02 -1.19 -4.94 118.68 113.17 2gpl s LEU 59 Ca -0.01 2.20 -0.30 0.00 0.02 0.00 0.00 54.13 56.05 2gpl s LEU 59 Cb 0.10 -3.56 -0.06 0.00 0.02 0.00 0.00 46.19 42.69 2gpl s LEU 59 CO 0.54 -0.76 1.60 -0.69 0.02 0.00 0.00 176.35 177.06 2gpl s VAL 60 N 2.42 3.45 0.48 -1.59 1.01 -1.26 -4.94 120.40 119.97 2gpl s VAL 60 Ca 0.66 0.73 -0.24 0.00 0.00 0.00 0.00 61.98 63.13 2gpl s VAL 60 Cb -0.33 -3.47 -0.07 0.00 0.00 0.00 0.00 36.38 32.51 2gpl s VAL 60 CO 0.28 -0.03 1.34 -2.84 0.00 0.00 0.00 175.10 173.84 2gpl s PRO 61 N 3.29 3.54 0.00 2.72 0.02 -1.26 -2.99 135.00 140.32 2gpl s PRO 61 Ca 0.71 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.94 2gpl s PRO 61 Cb -0.35 -2.49 0.00 0.00 0.02 0.00 0.00 34.50 31.69 2gpl s PRO 61 CO 0.30 -0.86 0.00 1.04 -0.33 0.00 0.00 177.00 177.14 2gpl n GLN 62 N -0.49 0.00 -0.06 5.54 1.13 -1.26 -4.88 117.38 117.36 2gpl n GLN 62 Ca 0.07 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 55.11 2gpl n GLN 62 Cb 0.44 -3.45 -0.01 0.00 0.11 0.00 0.00 30.24 27.34 2gpl n GLN 62 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 2gpl h LYS 63 N 1.37 0.00 -4.97 -1.09 1.79 -1.94 -3.41 116.57 108.32 2gpl h LYS 63 Ca 0.00 0.00 -0.43 0.00 -2.18 0.00 0.00 60.65 58.04 2gpl h LYS 63 Cb 0.00 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 30.71 2gpl h LYS 63 CO 0.00 0.00 1.26 0.09 -1.08 0.00 0.00 179.45 179.72 2gpl n ASN 64 N -4.51 1.81 -4.77 0.86 3.02 -1.26 -4.91 115.26 105.50 2gpl n ASN 64 Ca -0.03 -2.58 -0.39 0.00 -0.03 0.00 0.00 54.58 51.54 2gpl n ASN 64 Cb 0.13 -1.14 -0.00 0.00 -0.61 0.00 0.00 39.78 38.16 2gpl n ASN 64 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2gpl s VAL 65 N 9.50 2.61 -0.07 2.41 1.01 -1.26 -4.97 120.40 129.62 2gpl s VAL 65 Ca 0.69 0.54 0.03 0.00 0.00 0.00 0.00 61.98 63.24 2gpl s VAL 65 Cb 0.08 -3.32 -0.06 0.00 0.00 0.00 0.00 36.38 33.07 2gpl s VAL 65 CO 0.22 0.08 -0.02 0.29 0.00 0.00 0.00 175.10 175.67 2gpl n LYS 66 N 0.13 1.62 -2.28 2.72 5.02 -1.26 -5.00 118.16 119.11 2gpl n LYS 66 Ca 0.04 0.02 -0.41 0.00 -2.02 0.00 0.00 58.31 55.93 2gpl n LYS 66 Cb 0.43 -1.16 -0.03 0.00 -0.02 0.00 0.00 35.03 34.26 2gpl n LYS 66 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2gpl s ILE 67 N -2.15 3.36 0.13 -0.18 1.01 -1.26 -4.84 121.20 117.27 2gpl s ILE 67 Ca -0.07 1.13 0.11 0.00 0.00 0.00 0.00 60.65 61.82 2gpl s ILE 67 Cb 0.02 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 2gpl s ILE 67 CO 0.22 0.18 -0.26 -1.10 0.00 0.00 0.00 174.94 173.97 2gpl s GLN 68 N -0.21 1.45 0.04 2.79 -0.21 0.46 -4.96 119.66 119.02 2gpl s GLN 68 Ca 0.55 -1.33 0.02 0.00 0.02 0.00 0.00 55.36 54.62 2gpl s GLN 68 Cb -0.35 -1.93 -0.04 0.00 1.00 0.00 0.00 33.01 31.70 2gpl s GLN 68 CO 0.38 0.45 0.06 0.54 -2.12 0.00 0.00 175.29 174.60 2gpl s VAL 69 N -1.07 4.51 -0.10 1.09 0.11 -1.26 0.16 120.40 123.83 2gpl s VAL 69 Ca 0.15 -0.64 0.03 0.00 -2.93 0.00 0.00 61.98 58.58 2gpl s VAL 69 Cb -0.10 -3.11 0.01 0.00 -1.53 0.00 0.00 36.38 31.65 2gpl s VAL 69 CO 0.07 0.23 -0.18 -0.69 -3.33 0.00 0.00 175.10 171.20 2gpl s VAL 70 N -1.28 1.63 0.00 2.04 1.01 -0.30 -4.96 120.40 118.54 2gpl s VAL 70 Ca 0.26 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2gpl s VAL 70 Cb -0.12 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.81 2gpl s VAL 70 CO 0.17 0.47 0.00 -0.67 0.00 0.00 0.00 175.10 175.07 2gpl n ASP 71 N 3.90 0.00 0.00 3.32 2.03 -1.26 -2.28 116.55 122.26 2gpl n ASP 71 Ca -0.20 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.11 2gpl n ASP 71 Cb 0.52 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 2gpl n ASP 71 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2gpl n ARG 72 N 13.83 3.13 0.00 -0.67 1.74 -1.26 -4.79 116.66 128.64 2gpl n ARG 72 Ca 0.00 -0.20 0.00 0.00 -0.77 0.00 0.00 57.85 56.88 2gpl n ARG 72 Cb 0.00 -0.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 2gpl n ARG 72 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 2gpl n HIS 73 N -0.50 0.00 -5.06 -1.55 1.44 -1.23 -2.19 115.22 106.12 2gpl n HIS 73 Ca 0.00 -0.36 -0.29 0.00 -2.01 0.00 0.00 57.72 55.06 2gpl n HIS 73 Cb 0.01 -0.04 -0.15 0.00 0.12 0.00 0.00 29.99 29.93 2gpl n HIS 73 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2gpl s ILE 74 N -0.72 1.85 0.02 0.61 1.01 -0.96 -3.88 121.20 119.13 2gpl s ILE 74 Ca 0.00 -1.06 0.08 0.00 0.00 0.00 0.00 60.65 59.67 2gpl s ILE 74 Cb 0.00 -1.55 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 2gpl s ILE 74 CO 0.00 0.46 -0.25 -0.83 0.00 0.00 0.00 174.94 174.33 2gpl s GLY 75 N -0.70 1.40 -0.02 6.18 0.00 -0.43 -1.14 107.32 112.60 2gpl s GLY 75 Ca 0.09 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.61 2gpl s GLY 75 CO -0.00 -1.07 -0.01 0.00 0.00 0.00 0.00 173.10 172.02 2gpl s VAL 77 N 0.59 0.17 0.13 0.00 0.11 0.21 -0.40 120.40 121.21 2gpl s VAL 77 Ca -0.06 -0.89 -0.14 0.00 -2.93 0.00 0.00 61.98 57.96 2gpl s VAL 77 Cb -0.08 -0.30 0.02 0.00 -1.53 0.00 0.00 36.38 34.49 2gpl s VAL 77 CO -0.01 -0.46 0.36 -0.72 -3.33 0.00 0.00 175.10 170.95 2gpl s TYR 78 N -1.37 -0.09 0.00 1.54 -0.85 -1.26 0.28 117.35 115.60 2gpl s TYR 78 Ca -0.14 -0.26 0.06 0.00 -0.52 0.00 0.00 57.07 56.21 2gpl s TYR 78 Cb -0.10 0.19 -0.02 0.00 0.38 0.00 0.00 41.96 42.42 2gpl s TYR 78 CO -0.01 -0.69 -0.19 -1.12 -1.52 0.00 0.00 175.55 172.02 2gpl s SER 79 N -2.83 2.23 0.00 -0.18 0.01 -0.92 -4.94 113.70 107.07 2gpl s SER 79 Ca 0.05 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.92 2gpl s SER 79 Cb 0.02 -0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.02 2gpl s SER 79 CO -0.10 0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.36 2gpl n GLY 80 N 2.42 0.29 3.60 3.44 0.00 -1.26 -2.22 105.19 111.46 2gpl n GLY 80 Ca -0.16 -1.70 -0.43 0.00 0.00 0.00 0.00 46.02 43.73 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 3.58 0.11 0.99 1.43 0.17 -4.85 118.68 120.12 2gpl s LEU 81 Ca 0.00 1.11 -0.28 0.00 -1.03 0.00 0.00 54.13 53.93 2gpl s LEU 81 Cb 0.00 -3.53 -0.08 0.00 0.03 0.00 0.00 46.19 42.61 2gpl s LEU 81 CO 0.00 -1.53 1.63 0.40 0.23 0.00 0.00 176.35 177.07 2gpl h ILE 82 N 6.58 0.36 -1.01 -0.59 1.08 -1.94 -2.35 117.51 119.64 2gpl h ILE 82 Ca -0.31 0.00 0.23 0.00 -0.39 0.00 0.00 64.86 64.39 2gpl h ILE 82 Cb 1.14 0.36 -0.11 0.00 -3.07 0.00 0.00 36.82 35.14 2gpl h ILE 82 CO 1.05 0.00 0.62 -0.65 -0.69 0.00 0.00 178.15 178.48 2gpl h PRO 83 N -0.51 0.58 -0.20 2.37 0.11 -1.99 0.65 132.00 133.02 2gpl h PRO 83 Ca 0.03 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 2gpl h PRO 83 Cb 0.54 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 2gpl h PRO 83 CO -0.18 0.38 0.05 -0.44 -0.21 0.00 0.00 178.00 177.60 2gpl h ASP 84 N 0.59 0.25 -0.17 -2.05 3.45 -1.81 -1.06 116.42 115.62 2gpl h ASP 84 Ca 0.60 -0.02 -0.03 0.00 0.43 0.00 0.00 57.03 58.00 2gpl h ASP 84 Cb 1.17 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 39.87 2gpl h ASP 84 CO -0.38 0.25 -0.03 1.23 -1.57 0.00 0.00 179.24 178.74 2gpl h GLY 85 N 0.45 0.35 0.92 2.75 0.00 0.53 -2.02 103.07 106.03 2gpl h GLY 85 Ca 0.07 -0.28 0.01 0.00 0.00 0.00 0.00 47.33 47.14 2gpl h GLY 85 CO -0.00 0.25 0.18 3.21 0.00 0.00 0.00 176.54 180.18 2gpl h ARG 86 N 0.04 0.37 -0.64 4.80 3.08 -0.77 -1.48 114.38 119.77 2gpl h ARG 86 Ca 0.04 -0.02 0.13 0.00 0.07 0.00 0.00 59.98 60.21 2gpl h ARG 86 Cb 0.45 -0.08 -0.10 0.00 0.08 0.00 0.00 29.97 30.31 2gpl h ARG 86 CO 0.01 0.24 0.06 1.25 -1.07 0.00 0.00 179.97 180.46 2gpl h HIS 87 N 0.38 0.06 -0.18 3.04 2.76 -1.13 0.12 115.15 120.19 2gpl h HIS 87 Ca 0.13 0.04 -0.08 0.00 -2.20 0.00 0.00 60.37 58.26 2gpl h HIS 87 Cb 0.01 0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 2gpl h HIS 87 CO -0.08 -0.13 -0.22 1.25 -1.30 0.00 0.00 177.93 177.45 2gpl h LEU 88 N 0.17 0.32 -0.17 0.26 5.85 -0.76 -2.30 115.31 118.68 2gpl h LEU 88 Ca 0.34 -0.09 -0.18 0.00 0.84 0.00 0.00 57.88 58.79 2gpl h LEU 88 Cb 0.55 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 41.50 2gpl h LEU 88 CO -0.50 0.55 -0.60 0.58 -0.34 0.00 0.00 178.44 178.13 2gpl h VAL 89 N 0.29 1.31 -0.73 1.05 2.07 -0.06 -1.20 116.25 118.98 2gpl h VAL 89 Ca 0.05 -1.84 0.07 0.00 0.82 0.00 0.00 66.70 65.80 2gpl h VAL 89 Cb 0.56 1.97 -0.06 0.00 -1.52 0.00 0.00 31.29 32.25 2gpl h VAL 89 CO 0.04 0.57 0.42 0.78 0.02 0.00 0.00 177.57 179.40 2gpl h ASN 90 N 0.40 0.63 -0.28 0.57 -0.26 -0.67 0.31 115.58 116.28 2gpl h ASN 90 Ca -0.03 0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.73 2gpl h ASN 90 Cb 1.23 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 38.38 2gpl h ASN 90 CO 0.13 0.40 0.12 -0.09 -1.06 0.00 0.00 177.43 176.93 2gpl h ARG 91 N 0.76 0.41 -0.95 0.81 9.65 -1.31 -2.12 114.38 121.64 2gpl h ARG 91 Ca 0.33 -0.07 0.08 0.00 -1.10 0.00 0.00 59.98 59.22 2gpl h ARG 91 Cb 0.22 -0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 28.66 2gpl h ARG 91 CO -0.19 0.42 0.61 0.78 2.80 0.00 0.00 179.97 184.39 2gpl h GLY 92 N 0.31 1.42 0.94 2.80 0.00 0.16 0.23 103.07 108.92 2gpl h GLY 92 Ca 0.10 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 2gpl h GLY 92 CO -0.01 0.28 0.15 3.21 0.00 0.00 0.00 176.54 180.17 2gpl h ARG 93 N 1.05 0.58 -0.53 4.80 3.08 -0.10 0.40 114.38 123.66 2gpl h ARG 93 Ca 0.42 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 60.31 2gpl h ARG 93 Cb 0.25 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 2gpl h ARG 93 CO -0.17 0.55 0.13 0.93 -1.07 0.00 0.00 179.97 180.34 2gpl h GLU 94 N 0.47 0.84 -0.40 0.04 5.08 -0.71 0.71 114.58 120.62 2gpl h GLU 94 Ca 0.13 -0.20 0.04 0.00 -1.00 0.00 0.00 59.36 58.33 2gpl h GLU 94 Cb 0.19 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 2gpl h GLU 94 CO -0.01 0.79 0.16 1.49 -1.00 0.00 0.00 179.01 180.45 2gpl h GLU 95 N 0.73 0.33 0.09 2.33 4.57 -0.23 -0.30 114.58 122.11 2gpl h GLU 95 Ca 0.17 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.32 2gpl h GLU 95 Cb 0.33 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.84 2gpl h GLU 95 CO 0.00 0.22 -0.04 0.00 -1.18 0.00 0.00 179.01 178.01 2gpl h ALA 96 N 1.24 -0.12 -0.62 2.92 0.00 0.20 -2.43 119.26 120.45 2gpl h ALA 96 Ca 0.18 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.04 2gpl h ALA 96 Cb 0.13 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.89 2gpl h ALA 96 CO -0.16 -0.42 0.22 0.00 0.00 0.00 0.00 179.25 178.88 2gpl h ALA 97 N 0.46 0.80 -0.34 0.00 0.00 -0.70 -0.75 119.26 118.74 2gpl h ALA 97 Ca -0.01 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2gpl h ALA 97 Cb 0.35 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2gpl h ALA 97 CO 0.02 -0.21 0.14 1.03 0.00 0.00 0.00 179.25 180.23 2gpl h SER 98 N 0.39 0.18 -0.33 0.00 0.87 -0.99 0.25 113.55 113.92 2gpl h SER 98 Ca 0.32 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.89 2gpl h SER 98 Cb 0.42 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.36 2gpl h SER 98 CO -0.33 0.14 0.14 0.15 -0.53 0.00 0.00 176.83 176.40 2gpl h PHE 99 N 0.30 0.50 -0.65 2.24 3.04 -0.83 -2.77 116.94 118.77 2gpl h PHE 99 Ca 0.15 -0.03 -0.08 0.00 3.98 0.00 0.00 57.97 61.99 2gpl h PHE 99 Cb 0.09 -0.15 -0.03 0.00 2.56 0.00 0.00 35.95 38.43 2gpl h PHE 99 CO -0.12 0.46 0.10 -0.22 -2.02 0.00 0.00 178.31 176.51 2gpl h LYS 100 N 0.39 1.08 -0.75 1.11 3.64 -0.96 -0.40 116.57 120.68 2gpl h LYS 100 Ca 0.11 -0.29 0.06 0.00 -1.27 0.00 0.00 60.65 59.26 2gpl h LYS 100 Cb 0.16 -0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 31.80 2gpl h LYS 100 CO -0.01 0.99 0.45 -0.22 -2.27 0.00 0.00 179.45 178.39 2gpl h LYS 101 N 1.01 0.79 0.18 1.90 3.64 -0.75 0.70 116.57 124.03 2gpl h LYS 101 Ca 0.20 -0.05 -0.34 0.00 -1.27 0.00 0.00 60.65 59.19 2gpl h LYS 101 Cb 0.44 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 32.09 2gpl h LYS 101 CO 0.01 0.53 -1.71 1.25 -2.27 0.00 0.00 179.45 177.26 2gpl h LEU 102 N 0.82 0.58 -1.05 5.20 5.85 -1.37 -3.38 115.31 121.96 2gpl h LEU 102 Ca 0.33 -0.93 0.00 0.00 0.84 0.00 0.00 57.88 58.12 2gpl h LEU 102 Cb 0.17 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.02 2gpl h LEU 102 CO -0.18 1.77 -0.39 -1.22 -0.34 0.00 0.00 178.44 178.09 2gpl n TYR 103 N -3.64 0.00 0.00 1.25 4.01 -0.17 -4.99 117.16 113.62 2gpl n TYR 103 Ca -0.25 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.49 2gpl n TYR 103 Cb 1.05 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 40.06 2gpl n TYR 103 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2gpl n LYS 104 N 0.06 0.00 -2.25 -0.72 3.00 0.24 -4.93 118.16 113.57 2gpl n LYS 104 Ca 0.10 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 58.01 2gpl n LYS 104 Cb 0.47 -0.01 -0.03 0.00 0.00 0.00 0.00 35.03 35.46 2gpl n LYS 104 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 2gpl s THR 105 N 0.00 3.03 0.58 3.15 -1.32 -1.26 -4.87 115.64 114.95 2gpl s THR 105 Ca 0.00 1.01 -0.20 0.00 -1.21 0.00 0.00 61.69 61.30 2gpl s THR 105 Cb 0.00 -3.65 -0.03 0.00 -1.51 0.00 0.00 72.50 67.31 2gpl s THR 105 CO 0.00 0.23 1.29 -2.16 -2.21 0.00 0.00 174.62 171.77 2gpl s PRO 106 N -1.52 2.95 0.17 7.08 0.04 -1.26 -4.31 135.00 138.16 2gpl s PRO 106 Ca 0.48 2.05 -0.32 0.00 0.04 0.00 0.00 61.00 63.25 2gpl s PRO 106 Cb -0.37 -2.05 -0.11 0.00 0.04 0.00 0.00 34.50 32.01 2gpl s PRO 106 CO 0.48 -1.28 1.71 -1.50 0.04 0.00 0.00 177.00 176.45 2gpl s ILE 107 N -1.42 2.30 0.46 0.56 2.07 -1.26 -4.97 121.20 118.94 2gpl s ILE 107 Ca 0.76 0.13 -0.24 0.00 -1.41 0.00 0.00 60.65 59.89 2gpl s ILE 107 Cb -0.36 -3.08 -0.08 0.00 0.13 0.00 0.00 42.46 39.07 2gpl s ILE 107 CO 0.41 0.01 1.35 -2.84 -1.91 0.00 0.00 174.94 171.95 2gpl s PRO 108 N 1.58 3.66 0.23 3.50 0.02 -1.26 -4.83 135.00 137.91 2gpl s PRO 108 Ca 0.75 2.23 -0.07 0.00 0.02 0.00 0.00 61.00 63.94 2gpl s PRO 108 Cb -0.47 -2.57 0.28 0.00 0.02 0.00 0.00 34.50 31.75 2gpl s PRO 108 CO 0.33 -0.77 1.87 0.82 -0.33 0.00 0.00 177.00 178.91 2gpl h ILE 109 N 2.12 1.11 -0.38 2.83 1.08 -1.91 -0.55 117.51 121.80 2gpl h ILE 109 Ca -0.50 -0.36 -0.01 0.00 -0.39 0.00 0.00 64.86 63.60 2gpl h ILE 109 Cb 1.27 -0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 34.98 2gpl h ILE 109 CO 0.61 0.19 0.21 -0.65 -0.69 0.00 0.00 178.15 177.81 2gpl h PRO 110 N 1.04 0.54 -0.85 2.37 0.11 -1.98 -0.38 132.00 132.84 2gpl h PRO 110 Ca 0.35 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.41 2gpl h PRO 110 Cb 0.06 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 31.02 2gpl h PRO 110 CO -0.13 0.44 0.56 0.00 -0.21 0.00 0.00 178.00 178.65 2gpl h ALA 111 N 1.07 1.07 -0.73 -0.75 0.00 -1.81 -2.19 119.26 115.92 2gpl h ALA 111 Ca 0.13 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2gpl h ALA 111 Cb 0.06 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 2gpl h ALA 111 CO -0.02 0.48 0.21 0.35 0.00 0.00 0.00 179.25 180.27 2gpl h PHE 112 N 1.15 1.18 -0.37 0.00 3.57 -0.75 -2.18 116.94 119.55 2gpl h PHE 112 Ca 0.31 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2gpl h PHE 112 Cb -0.13 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 38.25 2gpl h PHE 112 CO -0.01 0.94 0.24 0.00 -2.23 0.00 0.00 178.31 177.25 2gpl h ALA 113 N 1.13 0.47 -0.28 2.41 0.00 -0.49 -2.03 119.26 120.47 2gpl h ALA 113 Ca 0.23 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 2gpl h ALA 113 Cb 0.33 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2gpl h ALA 113 CO -0.00 -0.07 -0.10 0.22 0.00 0.00 0.00 179.25 179.30 2gpl h ASP 114 N 0.50 0.44 0.06 0.00 1.82 -1.23 0.22 116.42 118.23 2gpl h ASP 114 Ca 0.13 -0.10 0.01 0.00 -0.39 0.00 0.00 57.03 56.68 2gpl h ASP 114 Cb -0.05 -0.12 -0.02 0.00 0.68 0.00 0.00 39.33 39.83 2gpl h ASP 114 CO -0.03 0.58 -0.12 0.03 -1.61 0.00 0.00 179.24 178.09 2gpl h ARG 115 N 0.43 -0.22 -0.56 0.28 2.47 -0.78 0.27 114.38 116.27 2gpl h ARG 115 Ca 0.08 0.02 -0.06 0.00 -1.26 0.00 0.00 59.98 58.76 2gpl h ARG 115 Cb 0.44 0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.78 2gpl h ARG 115 CO 0.02 -0.15 0.12 -0.07 0.56 0.00 0.00 179.97 180.46 2gpl h LEU 116 N -0.23 0.82 0.39 3.04 3.38 -1.02 -2.67 115.31 119.02 2gpl h LEU 116 Ca 0.02 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 2gpl h LEU 116 Cb 0.25 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2gpl h LEU 116 CO -0.07 0.81 -0.19 1.23 0.09 0.00 0.00 178.44 180.31 2gpl h GLY 117 N 0.99 -0.56 1.21 0.83 0.00 0.31 -0.85 103.07 105.00 2gpl h GLY 117 Ca 0.18 0.21 0.01 0.00 0.00 0.00 0.00 47.33 47.73 2gpl h GLY 117 CO 0.00 -0.20 0.54 1.46 0.00 0.00 0.00 176.54 178.33 2gpl h GLN 118 N -0.53 1.07 -0.19 4.80 1.08 -0.48 0.02 115.11 120.87 2gpl h GLN 118 Ca -0.05 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.06 2gpl h GLN 118 Cb 0.41 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 2gpl h GLN 118 CO 0.08 0.71 0.01 -0.92 -0.95 0.00 0.00 178.83 177.76 2gpl h TYR 119 N 1.10 0.35 -0.61 2.96 3.20 -1.30 -0.91 116.97 121.76 2gpl h TYR 119 Ca 0.30 -0.06 -0.10 0.00 3.14 0.00 0.00 58.73 62.01 2gpl h TYR 119 Cb -0.13 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 2gpl h TYR 119 CO 0.00 0.51 -0.00 0.28 -1.64 0.00 0.00 178.16 177.31 2gpl h VAL 120 N 0.09 1.27 -0.06 1.81 2.07 -0.89 -2.33 116.25 118.21 2gpl h VAL 120 Ca 0.05 -1.16 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 2gpl h VAL 120 Cb 0.37 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 2gpl h VAL 120 CO 0.01 0.42 -0.09 -0.61 0.02 0.00 0.00 177.57 177.32 2gpl h GLN 121 N 0.99 0.08 -0.66 1.57 -0.00 -0.87 -1.36 115.11 114.86 2gpl h GLN 121 Ca 0.17 -0.01 -0.02 0.00 -0.00 0.00 0.00 58.65 58.80 2gpl h GLN 121 Cb 0.57 -0.01 -0.03 0.00 0.00 0.00 0.00 27.48 28.00 2gpl h GLN 121 CO 0.03 0.18 0.35 0.00 0.00 0.00 0.00 178.83 179.39 2gpl h ALA 122 N 1.83 1.37 0.00 3.38 0.00 -0.59 -2.20 119.26 123.05 2gpl h ALA 122 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2gpl h ALA 122 Cb 0.22 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2gpl h ALA 122 CO 0.01 0.51 0.00 0.72 0.00 0.00 0.00 179.25 180.49 2gpl n HIS 123 N -4.37 0.00 -1.24 0.00 8.25 -0.51 -2.21 115.22 115.14 2gpl n HIS 123 Ca 0.06 -0.14 0.01 0.00 -0.26 0.00 0.00 57.72 57.40 2gpl n HIS 123 Cb 0.11 -0.13 0.02 0.00 1.12 0.00 0.00 29.99 31.10 2gpl n HIS 123 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2gpl n THR 124 N 0.22 0.41 0.31 1.59 -2.24 -0.83 -3.69 114.28 110.06 2gpl n THR 124 Ca 0.00 -0.46 0.08 0.00 -2.27 0.00 0.00 64.05 61.39 2gpl n THR 124 Cb 0.29 0.57 -0.10 0.00 -2.10 0.00 0.00 70.33 68.98 2gpl n THR 124 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2gpl n LEU 125 N -0.28 0.32 -4.09 3.22 4.77 -0.94 -4.59 117.00 115.41 2gpl n LEU 125 Ca 0.02 -0.22 -0.15 0.00 -0.03 0.00 0.00 56.01 55.63 2gpl n LEU 125 Cb 0.56 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.53 2gpl n LEU 125 CO 0.00 0.08 -0.42 -0.31 -1.33 0.00 0.00 177.39 175.41 2gpl s TYR 126 N -2.79 0.84 -2.26 -1.77 2.02 -1.26 -4.81 117.35 107.32 2gpl s TYR 126 Ca -0.01 -0.47 0.24 0.00 -0.37 0.00 0.00 57.07 56.46 2gpl s TYR 126 Cb 0.11 -0.49 1.03 0.00 -0.40 0.00 0.00 41.96 42.21 2gpl s TYR 126 CO 0.63 -0.04 1.71 0.27 -1.57 0.00 0.00 175.55 176.56 2gpl n ASN 127 N 1.49 1.12 -0.02 2.29 2.04 -1.26 -3.45 115.26 117.47 2gpl n ASN 127 Ca -0.22 -1.51 0.13 0.00 -0.44 0.00 0.00 54.58 52.53 2gpl n ASN 127 Cb 0.55 -0.04 0.35 0.00 -2.53 0.00 0.00 39.78 38.10 2gpl n ASN 127 CO 0.00 0.00 0.00 -1.54 -0.44 0.00 0.00 177.26 175.28 2gpl n SER 128 N -0.07 0.43 -4.43 0.53 3.41 -1.26 -4.65 113.62 107.57 2gpl n SER 128 Ca 0.17 -0.15 -0.21 0.00 -0.26 0.00 0.00 58.87 58.42 2gpl n SER 128 Cb 0.26 0.08 -0.10 0.00 -0.26 0.00 0.00 64.21 64.19 2gpl n SER 128 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2gpl s VAL 129 N -2.94 1.55 0.06 -3.33 -7.23 -1.22 -5.15 120.40 102.13 2gpl s VAL 129 Ca 0.13 -2.09 0.04 0.00 -1.81 0.00 0.00 61.98 58.24 2gpl s VAL 129 Cb 0.18 -2.52 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 2gpl s VAL 129 CO 0.64 -0.24 0.01 -0.60 -0.31 0.00 0.00 175.10 174.60 2gpl s ARG 130 N -3.76 2.67 0.92 4.82 3.52 -1.26 -4.73 118.95 121.14 2gpl s ARG 130 Ca 0.31 -0.75 -0.12 0.00 -0.13 0.00 0.00 55.73 55.04 2gpl s ARG 130 Cb 0.05 -2.61 0.14 0.00 -1.56 0.00 0.00 34.95 30.97 2gpl s ARG 130 CO 0.12 0.57 1.11 -2.14 -0.81 0.00 0.00 175.30 174.15 2gpl s PRO 131 N -2.10 1.05 0.08 5.12 0.02 -1.24 -4.90 135.00 133.02 2gpl s PRO 131 Ca 0.25 0.50 -0.30 0.00 0.02 0.00 0.00 61.00 61.46 2gpl s PRO 131 Cb -0.12 -1.81 -0.05 0.00 0.02 0.00 0.00 34.50 32.54 2gpl s PRO 131 CO 0.17 -2.31 1.06 -0.06 -0.33 0.00 0.00 177.00 175.53 2gpl s PHE 132 N -3.10 3.61 -0.28 6.54 0.40 -1.26 -4.94 117.98 118.95 2gpl s PHE 132 Ca 0.64 1.59 -0.02 0.00 -0.60 0.00 0.00 56.93 58.53 2gpl s PHE 132 Cb -0.16 -3.22 0.08 0.00 0.51 0.00 0.00 43.02 40.22 2gpl s PHE 132 CO 0.55 -0.45 2.44 0.41 0.70 0.00 0.00 175.22 178.87 2gpl n GLY 133 N 2.67 3.85 3.36 4.36 0.00 -1.26 -4.55 105.19 113.61 2gpl n GLY 133 Ca 0.05 -1.21 -0.12 0.00 0.00 0.00 0.00 46.02 44.74 2gpl n GLY 133 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2gpl s VAL 134 N -1.60 0.04 -0.07 1.61 -7.23 -1.26 0.46 120.40 112.34 2gpl s VAL 134 Ca 0.40 -0.34 0.05 0.00 -1.81 0.00 0.00 61.98 60.28 2gpl s VAL 134 Cb 0.26 -1.07 -0.01 0.00 0.56 0.00 0.00 36.38 36.13 2gpl s VAL 134 CO -0.07 -0.19 -0.24 -0.44 -0.31 0.00 0.00 175.10 173.85 2gpl s SER 135 N -2.58 3.03 -0.09 4.85 0.01 -0.94 -3.80 113.70 114.18 2gpl s SER 135 Ca 0.00 -0.52 0.03 0.00 1.31 0.00 0.00 55.95 56.77 2gpl s SER 135 Cb 0.00 -1.07 -0.02 0.00 0.21 0.00 0.00 66.02 65.15 2gpl s SER 135 CO -0.10 0.20 -0.17 -0.89 0.41 0.00 0.00 173.24 172.70 2gpl s THR 136 N 0.06 2.79 -0.16 1.44 2.01 -0.50 -2.17 115.64 119.12 2gpl s THR 136 Ca -0.10 -0.79 -0.04 0.00 0.31 0.00 0.00 61.69 61.08 2gpl s THR 136 Cb -0.15 -2.11 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 2gpl s THR 136 CO 0.06 0.56 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.87 2gpl s ILE 137 N -0.10 3.83 0.21 1.82 1.01 0.14 -0.69 121.20 127.43 2gpl s ILE 137 Ca -0.03 -0.38 -0.21 0.00 0.00 0.00 0.00 60.65 60.03 2gpl s ILE 137 Cb -0.14 -2.68 0.04 0.00 0.01 0.00 0.00 42.46 39.70 2gpl s ILE 137 CO 0.04 0.49 0.64 0.72 0.00 0.00 0.00 174.94 176.83 2gpl s PHE 138 N 0.41 -0.34 -3.77 3.97 -0.12 -0.12 -0.62 117.98 117.38 2gpl s PHE 138 Ca -0.04 0.02 0.00 0.00 -0.05 0.00 0.00 56.93 56.86 2gpl s PHE 138 Cb -0.14 0.59 0.00 0.00 -0.63 0.00 0.00 43.02 42.84 2gpl s PHE 138 CO 0.03 -1.01 0.00 0.41 -0.05 0.00 0.00 175.22 174.60 2gpl n GLY 139 N -0.41 -1.98 0.00 1.99 0.00 -0.76 -0.17 105.19 103.86 2gpl n GLY 139 Ca -0.11 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.72 2gpl n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gpl n GLY 140 N -0.41 -1.21 3.81 -0.02 0.00 -0.88 -1.32 105.19 105.16 2gpl n GLY 140 Ca 0.00 -0.88 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 2gpl n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gpl s VAL 141 N -3.00 4.93 0.17 1.61 1.01 -1.25 -1.37 120.40 122.51 2gpl s VAL 141 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 2gpl s VAL 141 Cb 0.00 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.15 2gpl s VAL 141 CO 0.00 0.41 0.24 -0.90 0.00 0.00 0.00 175.10 174.85 2gpl n ASP 142 N 1.34 -0.67 -0.48 3.32 3.85 -0.17 -4.89 116.55 118.85 2gpl n ASP 142 Ca -0.14 -1.94 0.38 0.00 -0.71 0.00 0.00 54.79 52.38 2gpl n ASP 142 Cb 0.53 1.25 0.61 0.00 -1.35 0.00 0.00 41.12 42.16 2gpl n ASP 142 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.20 177.36 2gpl n LYS 143 N -0.29 -0.02 -3.24 0.11 4.81 -1.26 -2.63 118.16 115.64 2gpl n LYS 143 Ca 0.00 0.97 -0.24 0.00 -0.87 0.00 0.00 58.31 58.17 2gpl n LYS 143 Cb 0.29 -2.04 -0.08 0.00 0.02 0.00 0.00 35.03 33.22 2gpl n LYS 143 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 2gpl n ASN 144 N -4.00 -0.37 0.00 3.14 0.23 -1.26 -5.13 115.26 107.87 2gpl n ASN 144 Ca 0.35 -2.58 0.00 0.00 -0.53 0.00 0.00 54.58 51.81 2gpl n ASN 144 Cb 1.46 -0.42 0.00 0.00 -2.08 0.00 0.00 39.78 38.74 2gpl n ASN 144 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2gpl n GLY 145 N 2.09 -4.20 3.94 4.83 0.00 -1.08 -4.99 105.19 105.78 2gpl n GLY 145 Ca 0.24 -2.11 -0.24 0.00 0.00 0.00 0.00 46.02 43.91 2gpl n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gpl s ALA 146 N -1.08 3.91 -0.06 4.61 0.00 -1.26 -1.00 121.76 126.88 2gpl s ALA 146 Ca 0.00 -1.12 -0.04 0.00 0.00 0.00 0.00 51.96 50.80 2gpl s ALA 146 Cb 0.00 -1.71 0.02 0.00 0.00 0.00 0.00 23.12 21.43 2gpl s ALA 146 CO 0.00 0.44 0.15 -1.01 0.00 0.00 0.00 175.76 175.34 2gpl s HIS 147 N -1.83 -0.17 -0.04 0.00 3.76 -0.47 -4.98 115.29 111.56 2gpl s HIS 147 Ca 0.34 0.43 0.07 0.00 -0.15 0.00 0.00 55.06 55.75 2gpl s HIS 147 Cb -0.10 0.02 -0.02 0.00 1.11 0.00 0.00 32.58 33.59 2gpl s HIS 147 CO 0.28 -0.11 -0.25 -1.17 -0.85 0.00 0.00 174.74 172.64 2gpl s LEU 148 N 0.42 2.06 0.04 0.89 2.96 -1.26 -2.07 118.68 121.71 2gpl s LEU 148 Ca -0.03 -0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 53.38 2gpl s LEU 148 Cb -0.04 -1.35 -0.03 0.00 0.50 0.00 0.00 46.19 45.27 2gpl s LEU 148 CO -0.02 0.28 -0.01 -0.31 -1.32 0.00 0.00 176.35 174.97 2gpl s TYR 149 N -0.39 0.36 -0.03 5.38 2.02 0.76 -0.94 117.35 124.52 2gpl s TYR 149 Ca 0.03 -0.76 -0.00 0.00 -0.37 0.00 0.00 57.07 55.97 2gpl s TYR 149 Cb -0.12 -0.27 0.03 0.00 -0.40 0.00 0.00 41.96 41.20 2gpl s TYR 149 CO 0.01 -0.30 0.02 1.41 -1.57 0.00 0.00 175.55 175.12 2gpl s MET 150 N -2.70 0.18 -0.14 -0.62 -2.45 -1.20 -0.95 119.30 111.41 2gpl s MET 150 Ca -0.04 0.15 0.00 0.00 -1.25 0.00 0.00 55.69 54.55 2gpl s MET 150 Cb -0.01 -0.45 -0.01 0.00 1.25 0.00 0.00 34.83 35.61 2gpl s MET 150 CO -0.05 -0.18 -0.15 -1.17 1.05 0.00 0.00 175.02 174.51 2gpl s LEU 151 N 1.24 2.52 0.46 4.11 2.96 0.13 -3.15 118.68 126.94 2gpl s LEU 151 Ca -0.07 -0.44 0.02 0.00 -0.22 0.00 0.00 54.13 53.43 2gpl s LEU 151 Cb -0.13 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 45.00 2gpl s LEU 151 CO -0.02 0.11 0.66 -1.61 -1.32 0.00 0.00 176.35 174.17 2gpl s GLU 152 N 0.65 2.91 0.59 1.98 0.41 0.99 -1.42 118.70 124.81 2gpl s GLU 152 Ca -0.08 -0.72 0.36 0.00 -0.41 0.00 0.00 54.97 54.12 2gpl s GLU 152 Cb -0.16 -2.60 1.97 0.00 -1.78 0.00 0.00 34.13 31.56 2gpl s GLU 152 CO 0.02 -0.34 2.10 -1.35 -0.49 0.00 0.00 175.26 175.21 2gpl h PRO 153 N 0.41 0.00 -0.00 0.39 0.11 -1.80 0.41 132.00 131.52 2gpl h PRO 153 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2gpl h PRO 153 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2gpl h PRO 153 CO 0.54 0.00 -0.01 -1.13 -0.21 0.00 0.00 178.00 177.19 2gpl n SER 154 N -2.85 0.05 0.00 -2.05 3.41 -1.26 -4.46 113.62 106.46 2gpl n SER 154 Ca -0.02 -0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.25 2gpl n SER 154 Cb 0.14 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 2gpl n SER 154 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gpl n GLY 155 N 1.24 0.78 3.76 5.00 0.00 0.13 -4.52 105.19 111.57 2gpl n GLY 155 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 2gpl n GLY 155 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2gpl s SER 156 N -3.00 7.45 0.07 1.61 0.15 -1.25 -4.72 113.70 114.01 2gpl s SER 156 Ca 0.00 2.01 -0.22 0.00 0.70 0.00 0.00 55.95 58.44 2gpl s SER 156 Cb 0.00 -2.61 0.05 0.00 -1.71 0.00 0.00 66.02 61.75 2gpl s SER 156 CO 0.00 0.01 0.51 -0.72 1.20 0.00 0.00 173.24 174.24 2gpl s TYR 157 N -1.28 -0.40 0.22 3.44 -0.85 -1.26 -0.01 117.35 117.21 2gpl s TYR 157 Ca 0.44 0.38 -0.11 0.00 -0.52 0.00 0.00 57.07 57.26 2gpl s TYR 157 Cb -0.26 0.35 -0.00 0.00 0.38 0.00 0.00 41.96 42.42 2gpl s TYR 157 CO 0.32 -0.67 0.41 -1.58 -1.52 0.00 0.00 175.55 172.52 2gpl s TRP 158 N -2.72 0.37 0.31 -3.49 0.52 -1.19 -5.02 118.94 107.72 2gpl s TRP 158 Ca -0.04 -0.72 -0.23 0.00 0.02 0.00 0.00 56.10 55.13 2gpl s TRP 158 Cb -0.00 0.10 -0.09 0.00 -1.15 0.00 0.00 33.47 32.32 2gpl s TRP 158 CO -0.04 -0.89 0.86 0.20 0.02 0.00 0.00 176.95 177.10 2gpl s GLY 159 N -3.00 2.66 0.08 0.98 0.00 -1.26 -3.25 107.32 103.53 2gpl s GLY 159 Ca 0.21 0.36 0.03 0.00 0.00 0.00 0.00 44.72 45.33 2gpl s GLY 159 CO 0.06 0.74 -0.10 -0.19 0.00 0.00 0.00 173.10 173.61 2gpl s TYR 160 N -1.69 0.99 0.02 1.90 1.51 -0.11 -4.98 117.35 114.99 2gpl s TYR 160 Ca 0.50 -0.60 -0.06 0.00 -1.01 0.00 0.00 57.07 55.91 2gpl s TYR 160 Cb -0.16 -0.55 -0.29 0.00 -0.11 0.00 0.00 41.96 40.84 2gpl s TYR 160 CO 0.21 -0.02 0.92 0.87 -1.11 0.00 0.00 175.55 176.43 2gpl h LYS 161 N 3.89 0.30 -2.25 -0.62 1.57 -1.93 -3.38 116.57 114.15 2gpl h LYS 161 Ca -0.37 -0.52 -0.07 0.00 -1.87 0.00 0.00 60.65 57.82 2gpl h LYS 161 Cb 1.19 0.19 -0.19 0.00 0.08 0.00 0.00 32.23 33.51 2gpl h LYS 161 CO 0.48 1.19 0.12 0.20 -0.57 0.00 0.00 179.45 180.88 2gpl s GLY 162 N -4.86 -0.51 0.00 3.86 0.00 -1.26 -1.74 107.32 102.81 2gpl s GLY 162 Ca -0.08 1.09 -0.13 0.00 0.00 0.00 0.00 44.72 45.59 2gpl s GLY 162 CO 0.87 0.75 0.28 0.00 0.00 0.00 0.00 173.10 175.01 2gpl s ALA 163 N -1.45 -0.68 0.02 3.20 0.00 0.54 -4.96 121.76 118.43 2gpl s ALA 163 Ca -0.10 0.15 -0.14 0.00 0.00 0.00 0.00 51.96 51.87 2gpl s ALA 163 Cb -0.01 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.28 2gpl s ALA 163 CO 0.07 -0.30 0.30 0.00 0.00 0.00 0.00 175.76 175.83 2gpl s ALA 164 N -1.71 -0.69 0.12 0.00 0.00 -1.26 0.04 121.76 118.26 2gpl s ALA 164 Ca -0.11 0.10 -0.18 0.00 0.00 0.00 0.00 51.96 51.77 2gpl s ALA 164 Cb -0.04 0.23 0.04 0.00 0.00 0.00 0.00 23.12 23.35 2gpl s ALA 164 CO 0.02 -0.35 0.45 -0.08 0.00 0.00 0.00 175.76 175.79 2gpl s THR 165 N -2.10 0.05 0.00 0.00 -1.32 -0.74 -4.93 115.64 106.62 2gpl s THR 165 Ca -0.08 -0.44 0.00 0.00 -1.21 0.00 0.00 61.69 59.96 2gpl s THR 165 Cb -0.03 -1.11 0.00 0.00 -1.51 0.00 0.00 72.50 69.86 2gpl s THR 165 CO -0.01 -0.24 0.00 0.61 -2.21 0.00 0.00 174.62 172.77 2gpl n GLY 166 N -0.17 -1.40 0.42 6.08 0.00 -1.26 -1.64 105.19 107.22 2gpl n GLY 166 Ca -0.17 -2.09 -0.10 0.00 0.00 0.00 0.00 46.02 43.66 2gpl n GLY 166 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2gpl h LYS 167 N 1.22 -0.08 -1.00 1.61 1.63 -0.07 -2.43 116.57 117.46 2gpl h LYS 167 Ca 0.00 0.01 -0.66 0.00 -0.85 0.00 0.00 60.65 59.15 2gpl h LYS 167 Cb 0.00 0.02 -0.29 0.00 -0.60 0.00 0.00 32.23 31.35 2gpl h LYS 167 CO 0.00 -0.05 0.83 0.41 -3.45 0.00 0.00 179.45 177.19 2gpl n GLY 168 N -1.30 5.73 0.23 5.01 0.00 -1.26 -4.66 105.19 108.94 2gpl n GLY 168 Ca 0.02 -2.18 0.06 0.00 0.00 0.00 0.00 46.02 43.92 2gpl n GLY 168 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2gpl h ARG 169 N 1.89 0.00 -0.19 1.61 0.11 -1.68 -2.41 114.38 113.71 2gpl h ARG 169 Ca 0.61 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.63 2gpl h ARG 169 Cb 1.05 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.12 2gpl h ARG 169 CO 1.53 0.17 -0.11 1.96 0.10 0.00 0.00 179.97 183.62 2gpl h GLN 170 N 0.00 0.40 0.45 0.08 7.50 -1.85 0.22 115.11 121.91 2gpl h GLN 170 Ca -0.00 -0.19 -0.01 0.00 0.50 0.00 0.00 58.65 58.95 2gpl h GLN 170 Cb 0.30 -0.01 -0.01 0.00 0.05 0.00 0.00 27.48 27.81 2gpl h GLN 170 CO 0.02 0.72 -0.33 0.77 -1.50 0.00 0.00 178.83 178.51 2gpl h SER 171 N 0.09 -0.85 -0.12 1.46 0.02 -1.89 0.03 113.55 112.28 2gpl h SER 171 Ca 0.04 0.06 0.04 0.00 -0.84 0.00 0.00 61.79 61.09 2gpl h SER 171 Cb 0.61 0.27 -0.05 0.00 0.14 0.00 0.00 62.40 63.36 2gpl h SER 171 CO 0.03 -0.49 -0.19 0.00 -1.14 0.00 0.00 176.83 175.04 2gpl h ALA 172 N -0.31 -0.13 -0.78 3.77 0.00 -1.43 -0.01 119.26 120.36 2gpl h ALA 172 Ca -0.05 0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.03 2gpl h ALA 172 Cb 0.65 0.37 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 2gpl h ALA 172 CO 0.01 -0.64 0.51 0.87 0.00 0.00 0.00 179.25 180.00 2gpl h LYS 173 N -0.24 0.59 0.33 0.00 1.57 -0.36 0.25 116.57 118.71 2gpl h LYS 173 Ca 0.10 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 2gpl h LYS 173 Cb 0.38 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2gpl h LYS 173 CO -0.26 0.39 -0.16 0.00 -0.57 0.00 0.00 179.45 178.85 2gpl h ALA 174 N 1.62 -0.44 -0.90 3.86 0.00 0.36 -1.35 119.26 122.41 2gpl h ALA 174 Ca 0.37 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.20 2gpl h ALA 174 Cb 0.61 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.50 2gpl h ALA 174 CO -0.14 -0.59 0.58 0.93 0.00 0.00 0.00 179.25 180.03 2gpl h GLU 175 N -0.75 0.89 -0.38 0.00 4.39 -0.29 -1.54 114.58 116.91 2gpl h GLU 175 Ca -0.04 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.56 2gpl h GLU 175 Cb 0.50 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 2gpl h GLU 175 CO 0.07 0.59 0.07 -0.07 -1.16 0.00 0.00 179.01 178.51 2gpl h LEU 176 N 0.92 0.59 -1.44 1.33 -0.00 -0.44 -2.54 115.31 113.72 2gpl h LEU 176 Ca 0.42 -0.25 -0.01 0.00 -0.00 0.00 0.00 57.88 58.04 2gpl h LEU 176 Cb 0.38 -0.16 -0.02 0.00 -0.00 0.00 0.00 40.66 40.86 2gpl h LEU 176 CO -0.18 0.69 0.28 -0.33 -0.00 0.00 0.00 178.44 178.90 2gpl h GLU 177 N 0.46 0.65 0.30 1.13 5.08 -0.27 -1.09 114.58 120.84 2gpl h GLU 177 Ca 0.12 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2gpl h GLU 177 Cb 0.35 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2gpl h GLU 177 CO 0.01 0.47 -0.15 0.87 -1.00 0.00 0.00 179.01 179.21 2gpl h LYS 178 N 0.66 -0.39 -0.77 2.33 1.57 -1.14 -1.95 116.57 116.87 2gpl h LYS 178 Ca 0.17 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 59.09 2gpl h LYS 178 Cb -0.00 0.09 -0.08 0.00 0.08 0.00 0.00 32.23 32.32 2gpl h LYS 178 CO -0.03 -0.18 0.40 -0.07 -0.57 0.00 0.00 179.45 179.00 2gpl h LEU 179 N -0.53 0.52 -0.62 2.94 3.38 -1.04 -1.55 115.31 118.40 2gpl h LEU 179 Ca -0.04 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2gpl h LEU 179 Cb 0.40 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 2gpl h LEU 179 CO 0.07 0.28 0.37 0.58 0.09 0.00 0.00 178.44 179.83 2gpl h VAL 180 N 0.64 1.04 0.00 1.22 2.07 -0.97 -2.17 116.25 118.09 2gpl h VAL 180 Ca 0.39 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.66 2gpl h VAL 180 Cb 0.44 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2gpl h VAL 180 CO -0.29 0.13 0.00 0.47 0.02 0.00 0.00 177.57 177.90 2gpl n ASP 18 N -4.75 0.90 0.00 0.57 8.00 -0.58 -3.87 116.55 116.82 2gpl n ASP 18 Ca 0.06 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.76 2gpl n ASP 18 Cb 0.11 -0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 2gpl n ASP 18 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2gpl n HIS 18 N 0.61 0.00 0.31 1.24 8.25 -0.82 -5.00 115.22 119.81 2gpl n HIS 18 Ca 0.00 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.50 2gpl n HIS 18 Cb 0.16 0.00 0.19 0.00 1.12 0.00 0.00 29.99 31.46 2gpl n HIS 18 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2gpl n PRO 18 N 0.00 0.02 0.01 -0.41 -0.04 -1.25 -1.74 135.00 131.59 2gpl n PRO 18 Ca 0.00 0.33 0.11 0.00 -0.04 0.00 0.00 63.50 63.90 2gpl n PRO 18 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 2gpl n PRO 18 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2gpl n GLU 18 N -1.47 0.18 0.00 0.54 -0.00 -1.26 -5.06 120.64 113.57 2gpl n GLU 18 Ca 0.02 -0.01 0.00 0.00 -0.00 0.00 0.00 57.16 57.17 2gpl n GLU 18 Cb 0.10 -1.55 0.00 0.00 -0.00 0.00 0.00 31.44 29.99 2gpl n GLU 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2gpl n GLY 18 N 1.42 2.06 2.54 -1.84 0.00 -0.71 -4.96 105.19 103.70 2gpl n GLY 18 Ca 0.03 -1.35 -0.22 0.00 0.00 0.00 0.00 46.02 44.48 2gpl n GLY 18 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2gpl n LEU 184 N 0.00 0.00 -4.35 0.99 7.94 -1.26 -4.71 117.00 115.61 2gpl n LEU 184 Ca 0.00 -0.82 -0.20 0.00 -1.11 0.00 0.00 56.01 53.88 2gpl n LEU 184 Cb 0.00 -0.74 -0.10 0.00 0.53 0.00 0.00 43.42 43.11 2gpl n LEU 184 CO 0.00 -1.97 -0.46 -0.94 -1.11 0.00 0.00 177.39 172.91 2gpl s SER 185 N -3.53 2.69 0.16 1.96 1.04 -1.26 -1.50 113.70 113.25 2gpl s SER 185 Ca 0.52 -0.96 -0.24 0.00 0.48 0.00 0.00 55.95 55.74 2gpl s SER 185 Cb -0.06 -0.16 0.04 0.00 0.10 0.00 0.00 66.02 65.95 2gpl s SER 185 CO 0.40 -0.11 1.59 0.00 0.98 0.00 0.00 173.24 176.11 2gpl h ALA 186 N 2.78 -0.26 -0.26 5.32 0.00 -1.96 0.52 119.26 125.40 2gpl h ALA 186 Ca -0.40 0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.66 2gpl h ALA 186 Cb 1.22 0.76 -0.05 0.00 0.00 0.00 0.00 17.79 19.73 2gpl h ALA 186 CO 0.58 -0.77 -0.05 0.00 0.00 0.00 0.00 179.25 179.01 2gpl h ARG 187 N -0.28 0.02 0.19 0.00 -0.00 -2.01 -2.25 114.38 110.05 2gpl h ARG 187 Ca 0.16 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.63 2gpl h ARG 187 Cb 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.52 2gpl h ARG 187 CO -0.55 0.01 -0.09 0.93 0.00 0.00 0.00 179.97 180.27 2gpl h GLU 188 N 0.02 -0.24 -0.94 0.04 4.39 -1.65 -2.94 114.58 113.25 2gpl h GLU 188 Ca 0.13 0.02 0.19 0.00 0.34 0.00 0.00 59.36 60.03 2gpl h GLU 188 Cb 0.19 0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 28.81 2gpl h GLU 188 CO -0.26 -0.09 0.60 0.00 -1.16 0.00 0.00 179.01 178.11 2gpl h ALA 189 N 0.45 1.96 -0.07 3.43 0.00 0.13 0.05 119.26 125.20 2gpl h ALA 189 Ca -0.03 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2gpl h ALA 189 Cb 0.27 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2gpl h ALA 189 CO 0.04 -0.26 -0.03 0.28 0.00 0.00 0.00 179.25 179.28 2gpl h VAL 190 N 0.59 0.89 -0.07 0.00 2.07 -1.22 0.32 116.25 118.83 2gpl h VAL 190 Ca 0.50 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 68.01 2gpl h VAL 190 Cb 1.00 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 31.66 2gpl h VAL 190 CO -0.25 0.00 -0.03 0.11 0.02 0.00 0.00 177.57 177.42 2gpl h LYS 191 N -0.02 0.14 -0.78 1.57 1.57 -1.31 -2.41 116.57 115.33 2gpl h LYS 191 Ca 0.04 -0.06 0.15 0.00 -1.87 0.00 0.00 60.65 58.91 2gpl h LYS 191 Cb 0.08 -0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.29 2gpl h LYS 191 CO -0.09 0.51 0.33 0.37 -0.57 0.00 0.00 179.45 180.01 2gpl h GLN 192 N -0.23 0.47 -0.71 3.15 5.75 -0.90 0.73 115.11 123.36 2gpl h GLN 192 Ca 0.02 -0.03 -0.05 0.00 -0.15 0.00 0.00 58.65 58.44 2gpl h GLN 192 Cb 0.47 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.88 2gpl h GLN 192 CO 0.01 0.31 0.25 0.00 -2.65 0.00 0.00 178.83 176.75 2gpl h ALA 193 N 1.56 1.10 -0.13 3.38 0.00 -0.26 -1.53 119.26 123.37 2gpl h ALA 193 Ca 0.43 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 2gpl h ALA 193 Cb 0.65 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2gpl h ALA 193 CO -0.40 0.63 -0.21 0.00 0.00 0.00 0.00 179.25 179.27 2gpl h ALA 194 N 1.22 1.42 0.49 0.00 0.00 -0.39 -2.33 119.26 119.66 2gpl h ALA 194 Ca 0.24 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2gpl h ALA 194 Cb 0.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2gpl h ALA 194 CO -0.01 0.41 -0.24 -0.22 0.00 0.00 0.00 179.25 179.19 2gpl h LYS 195 N 0.20 -0.64 -0.98 0.00 3.64 -0.55 -2.10 116.57 116.15 2gpl h LYS 195 Ca 0.04 0.04 0.27 0.00 -1.27 0.00 0.00 60.65 59.73 2gpl h LYS 195 Cb 0.49 0.14 -0.14 0.00 -0.41 0.00 0.00 32.23 32.32 2gpl h LYS 195 CO 0.03 -0.36 0.53 0.82 -2.27 0.00 0.00 179.45 178.20 2gpl h ILE 196 N -1.10 0.42 -0.26 2.00 1.08 -1.21 0.30 117.51 118.74 2gpl h ILE 196 Ca -0.07 -0.15 -0.06 0.00 -0.39 0.00 0.00 64.86 64.19 2gpl h ILE 196 Cb 0.57 -0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 34.26 2gpl h ILE 196 CO 0.11 0.08 -0.07 0.40 -0.69 0.00 0.00 178.15 177.98 2gpl h ILE 197 N 0.43 1.28 -0.40 -0.67 1.08 -1.43 0.40 117.51 118.22 2gpl h ILE 197 Ca 0.66 -1.10 0.01 0.00 -0.39 0.00 0.00 64.86 64.04 2gpl h ILE 197 Cb 1.36 1.46 -0.02 0.00 -3.07 0.00 0.00 36.82 36.55 2gpl h ILE 197 CO -0.55 0.34 0.26 1.88 -0.69 0.00 0.00 178.15 179.40 2gpl h TYR 198 N 0.26 0.49 0.81 1.37 -1.99 0.17 -1.61 116.97 116.47 2gpl h TYR 198 Ca 0.07 0.01 -0.04 0.00 2.00 0.00 0.00 58.73 60.77 2gpl h TYR 198 Cb 0.55 -0.17 0.01 0.00 2.00 0.00 0.00 36.73 39.12 2gpl h TYR 198 CO 0.05 0.31 -0.39 -0.07 -0.00 0.00 0.00 178.16 178.06 2gpl h LEU 199 N 0.53 -0.92 0.00 3.88 4.07 -0.67 -2.50 115.31 119.70 2gpl h LEU 199 Ca 0.15 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.13 2gpl h LEU 199 Cb -0.06 0.24 0.00 0.00 1.08 0.00 0.00 40.66 41.92 2gpl h LEU 199 CO -0.04 -0.60 0.04 0.00 -1.08 0.00 0.00 178.44 176.77 2gpl n ALA 201 N -2.63 1.02 0.72 1.53 0.00 0.12 -1.30 120.51 119.98 2gpl n ALA 201 Ca -0.14 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.42 2gpl n ALA 201 Cb 0.44 -0.89 0.48 0.00 0.00 0.00 0.00 19.45 19.48 2gpl n ALA 201 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2gpl n HIS 202 N -1.30 0.45 -0.12 0.00 -0.00 -0.61 -3.53 115.22 110.11 2gpl n HIS 202 Ca 0.00 0.14 0.03 0.00 -0.00 0.00 0.00 57.72 57.89 2gpl n HIS 202 Cb 0.04 -0.73 0.34 0.00 -0.00 0.00 0.00 29.99 29.64 2gpl n HIS 202 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 2gpl h GLU 203 N 0.00 0.76 -0.37 1.57 3.07 -1.34 0.23 114.58 118.49 2gpl h GLU 203 Ca 0.00 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 2gpl h GLU 203 Cb 0.54 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 2gpl h GLU 203 CO 0.00 0.50 0.00 -0.25 -1.40 0.00 0.00 179.01 177.86 2gpl n ASP 204 N -4.45 0.37 -0.23 1.42 9.92 -1.23 -1.57 116.55 120.79 2gpl n ASP 204 Ca 0.07 -1.12 0.00 0.00 -0.53 0.00 0.00 54.79 53.20 2gpl n ASP 204 Cb 0.08 -0.19 0.00 0.00 -0.64 0.00 0.00 41.12 40.37 2gpl n ASP 204 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2gpl n ASN 205 N -0.02 0.00 0.03 -2.24 4.05 -0.30 -4.87 115.26 111.91 2gpl n ASN 205 Ca 0.00 -0.78 0.01 0.00 0.45 0.00 0.00 54.58 54.26 2gpl n ASN 205 Cb 0.09 0.00 0.04 0.00 1.23 0.00 0.00 39.78 41.14 2gpl n ASN 205 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 177.26 176.50 2gpl n LYS 206 N 0.00 0.01 -0.16 1.20 2.85 0.64 -1.88 118.16 120.83 2gpl n LYS 206 Ca 0.00 0.24 -0.10 0.00 -1.05 0.00 0.00 58.31 57.40 2gpl n LYS 206 Cb 0.39 -1.88 0.02 0.00 -0.65 0.00 0.00 35.03 32.91 2gpl n LYS 206 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 177.40 178.40 2gpl h GLU 20 N 0.00 0.98 -6.13 -1.58 4.11 -1.85 -3.44 114.58 106.68 2gpl h GLU 20 Ca 0.00 -0.39 -0.66 0.00 0.07 0.00 0.00 59.36 58.38 2gpl h GLU 20 Cb 0.69 -0.05 -0.12 0.00 0.50 0.00 0.00 28.75 29.77 2gpl h GLU 20 CO 0.00 1.07 -0.62 0.15 0.07 0.00 0.00 179.01 179.68 2gpl s LYS 20 N -4.73 2.86 0.45 1.06 1.02 -0.79 -5.10 119.74 114.51 2gpl s LYS 20 Ca -0.11 -0.60 -0.21 0.00 0.02 0.00 0.00 55.97 55.07 2gpl s LYS 20 Cb 0.13 -2.72 -0.10 0.00 -0.52 0.00 0.00 37.83 34.62 2gpl s LYS 20 CO 0.86 0.62 1.00 0.34 -0.92 0.00 0.00 175.35 177.26 2gpl s ASP 207 N -1.72 6.64 0.24 2.83 3.68 -1.26 -4.84 116.67 122.25 2gpl s ASP 207 Ca 0.22 1.84 0.02 0.00 2.13 0.00 0.00 52.55 56.75 2gpl s ASP 207 Cb -0.12 -2.55 -0.01 0.00 -1.45 0.00 0.00 42.92 38.79 2gpl s ASP 207 CO 0.13 -0.57 0.07 2.22 0.13 0.00 0.00 175.17 177.15 2gpl n PHE 208 N -0.72 0.19 -3.98 -5.34 1.16 -1.26 0.11 117.46 107.61 2gpl n PHE 208 Ca 0.08 -1.48 -0.18 0.00 -1.87 0.00 0.00 57.45 54.00 2gpl n PHE 208 Cb 0.53 -0.04 -0.16 0.00 -1.61 0.00 0.00 39.48 38.20 2gpl n PHE 208 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 2gpl s GLU 209 N -2.92 0.44 0.24 3.97 2.12 0.14 -4.77 118.70 117.93 2gpl s GLU 209 Ca 0.10 0.03 -0.15 0.00 0.36 0.00 0.00 54.97 55.31 2gpl s GLU 209 Cb 0.00 -0.58 -0.08 0.00 0.26 0.00 0.00 34.13 33.73 2gpl s GLU 209 CO 0.07 -0.13 0.66 -1.17 -0.54 0.00 0.00 175.26 174.15 2gpl s LEU 210 N 1.02 4.23 -0.02 2.70 2.96 -1.26 -1.31 118.68 126.99 2gpl s LEU 210 Ca -0.10 1.21 0.00 0.00 -0.22 0.00 0.00 54.13 55.02 2gpl s LEU 210 Cb -0.14 -3.68 0.03 0.00 0.50 0.00 0.00 46.19 42.90 2gpl s LEU 210 CO -0.01 -0.04 0.03 -0.70 -1.32 0.00 0.00 176.35 174.30 2gpl s GLU 211 N -2.42 -0.03 0.05 1.98 2.12 -1.09 -4.99 118.70 114.31 2gpl s GLU 211 Ca 0.46 0.18 0.02 0.00 0.36 0.00 0.00 54.97 55.98 2gpl s GLU 211 Cb -0.13 -0.24 -0.03 0.00 0.26 0.00 0.00 34.13 33.99 2gpl s GLU 211 CO 0.19 -0.16 -0.07 0.42 -0.54 0.00 0.00 175.26 175.11 2gpl s ILE 212 N 1.01 0.49 0.13 -3.70 1.01 -1.26 -1.61 121.20 117.27 2gpl s ILE 212 Ca -0.08 -1.19 -0.14 0.00 0.00 0.00 0.00 60.65 59.24 2gpl s ILE 212 Cb -0.12 -0.72 0.02 0.00 0.01 0.00 0.00 42.46 41.65 2gpl s ILE 212 CO -0.03 -0.48 0.36 -0.94 0.00 0.00 0.00 174.94 173.86 2gpl s SER 213 N -1.78 -0.13 0.24 3.58 1.04 0.50 -1.28 113.70 115.85 2gpl s SER 213 Ca -0.08 -0.48 -0.16 0.00 0.48 0.00 0.00 55.95 55.72 2gpl s SER 213 Cb -0.08 0.46 0.01 0.00 0.10 0.00 0.00 66.02 66.51 2gpl s SER 213 CO -0.01 -0.86 0.53 -1.66 0.98 0.00 0.00 173.24 172.22 2gpl s TRP 214 N -3.85 0.12 -0.29 5.02 1.48 -0.13 -0.19 118.94 121.10 2gpl s TRP 214 Ca 0.06 -0.49 -0.00 0.00 -1.06 0.00 0.00 56.10 54.60 2gpl s TRP 214 Cb 0.02 0.34 0.14 0.00 -1.16 0.00 0.00 33.47 32.81 2gpl s TRP 214 CO -0.09 -1.01 0.30 0.00 -4.06 0.00 0.00 176.95 172.09 2gpl s SER 216 N 2.35 2.43 0.60 0.00 0.15 -1.26 -1.39 113.70 116.58 2gpl s SER 216 Ca 0.10 -0.40 0.32 0.00 0.70 0.00 0.00 55.95 56.66 2gpl s SER 216 Cb -0.14 -0.70 1.89 0.00 -1.71 0.00 0.00 66.02 65.37 2gpl s SER 216 CO -0.32 0.18 2.25 0.25 1.20 0.00 0.00 173.24 176.80 2gpl h LEU 217 N 6.23 0.00 0.00 3.45 5.85 -1.39 0.17 115.31 129.62 2gpl h LEU 217 Ca -0.32 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.17 2gpl h LEU 217 Cb 1.18 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.16 2gpl h LEU 217 CO 0.48 0.00 -1.86 -1.54 -0.34 0.00 0.00 178.44 175.18 2gpl n SER 218 N -3.73 2.20 0.00 1.25 3.41 -1.26 -3.62 113.62 111.87 2gpl n SER 218 Ca -0.03 -0.02 -0.08 0.00 -0.26 0.00 0.00 58.87 58.48 2gpl n SER 218 Cb 0.11 0.50 -0.13 0.00 -0.26 0.00 0.00 64.21 64.43 2gpl n SER 218 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2gpl h GLU 21 N 0.00 0.00 0.00 4.33 4.39 -1.91 -3.40 114.58 117.99 2gpl h GLU 21 Ca -0.34 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.36 2gpl h GLU 21 Cb 1.70 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.35 2gpl h GLU 21 CO -0.00 0.61 0.00 0.25 -1.16 0.00 0.00 179.01 178.71 2gpl n THR 21 N -3.12 0.00 -1.22 1.13 -2.24 0.40 -4.93 114.28 104.29 2gpl n THR 21 Ca -0.12 -0.35 -0.04 0.00 -2.27 0.00 0.00 64.05 61.27 2gpl n THR 21 Cb 1.01 1.25 -0.02 0.00 -2.10 0.00 0.00 70.33 70.47 2gpl n THR 21 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2gpl n ASN 21 N -0.13 -3.30 0.00 3.42 4.13 0.04 -2.87 115.26 116.54 2gpl n ASN 21 Ca 0.00 0.09 0.00 0.00 1.68 0.00 0.00 54.58 56.35 2gpl n ASN 21 Cb 0.06 -1.33 0.00 0.00 -1.54 0.00 0.00 39.78 36.97 2gpl n ASN 21 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gpl n GLY 219 N -2.34 0.61 3.60 7.41 0.00 -0.68 -4.87 105.19 108.93 2gpl n GLY 219 Ca -0.04 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 2gpl n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gpl s LEU 220 N 0.00 3.33 -0.00 0.99 1.43 -1.14 -4.56 118.68 118.73 2gpl s LEU 220 Ca 0.00 0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 52.81 2gpl s LEU 220 Cb 0.00 -1.76 -0.05 0.00 0.03 0.00 0.00 46.19 44.41 2gpl s LEU 220 CO 0.00 0.32 1.31 -2.28 0.23 0.00 0.00 176.35 175.93 2gpl s HIS 221 N -0.53 3.06 0.03 0.29 5.65 -0.93 -4.50 115.29 118.36 2gpl s HIS 221 Ca 0.08 1.02 0.01 0.00 0.25 0.00 0.00 55.06 56.42 2gpl s HIS 221 Cb -0.12 -3.56 -0.02 0.00 -1.18 0.00 0.00 32.58 27.70 2gpl s HIS 221 CO 0.02 -1.93 -0.05 0.15 -0.65 0.00 0.00 174.74 172.28 2gpl s LYS 222 N 2.07 0.42 0.27 2.88 1.02 -0.25 -4.96 119.74 121.20 2gpl s LYS 222 Ca 0.61 -0.73 -0.19 0.00 0.02 0.00 0.00 55.97 55.68 2gpl s LYS 222 Cb -0.29 -0.02 -0.09 0.00 -0.52 0.00 0.00 37.83 36.91 2gpl s LYS 222 CO 0.26 -0.02 0.77 -0.06 -0.92 0.00 0.00 175.35 175.37 2gpl s PHE 223 N -1.70 3.55 -0.22 3.18 0.40 -1.26 -0.95 117.98 120.98 2gpl s PHE 223 Ca -0.11 1.40 -0.25 0.00 -0.60 0.00 0.00 56.93 57.36 2gpl s PHE 223 Cb -0.08 -2.64 -0.01 0.00 0.51 0.00 0.00 43.02 40.80 2gpl s PHE 223 CO -0.01 0.23 0.85 0.08 0.70 0.00 0.00 175.22 177.06 2gpl s VAL 224 N -1.71 4.84 0.29 -0.44 1.01 -0.41 -4.91 120.40 119.07 2gpl s VAL 224 Ca 0.48 1.63 0.03 0.00 0.00 0.00 0.00 61.98 64.12 2gpl s VAL 224 Cb -0.15 -4.14 -0.06 0.00 0.00 0.00 0.00 36.38 32.04 2gpl s VAL 224 CO 0.20 -0.05 0.06 -0.54 0.00 0.00 0.00 175.10 174.76 2gpl s LYS 225 N 2.67 1.52 2.44 2.72 1.02 -1.26 -4.68 119.74 124.17 2gpl s LYS 225 Ca 0.37 -1.82 0.00 0.00 0.02 0.00 0.00 55.97 54.53 2gpl s LYS 225 Cb -0.16 -0.65 0.00 0.00 -0.52 0.00 0.00 37.83 36.50 2gpl s LYS 225 CO 0.09 -0.20 0.00 0.41 -0.92 0.00 0.00 175.35 174.73 2gpl n GLY 226 N -0.57 2.69 0.45 -3.33 0.00 -1.26 -3.16 105.19 100.00 2gpl n GLY 226 Ca -0.02 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.79 2gpl n GLY 226 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2gpl h ASP 227 N 0.61 -1.82 -0.88 1.61 3.45 -1.99 0.71 116.42 118.13 2gpl h ASP 227 Ca 0.00 0.24 0.16 0.00 0.43 0.00 0.00 57.03 57.86 2gpl h ASP 227 Cb 0.00 0.74 -0.07 0.00 -0.56 0.00 0.00 39.33 39.45 2gpl h ASP 227 CO 0.00 -0.41 0.57 0.25 -1.57 0.00 0.00 179.24 178.08 2gpl h LEU 228 N -0.41 0.56 0.44 1.55 5.85 -1.98 0.25 115.31 121.58 2gpl h LEU 228 Ca 0.08 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 2gpl h LEU 228 Cb 0.60 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.57 2gpl h LEU 228 CO -0.58 0.26 -0.21 0.25 -0.34 0.00 0.00 178.44 177.82 2gpl h LEU 229 N 0.58 -0.50 -0.82 2.25 5.85 -1.18 -2.95 115.31 118.54 2gpl h LEU 229 Ca 0.45 -0.09 0.13 0.00 0.84 0.00 0.00 57.88 59.21 2gpl h LEU 229 Cb 0.86 0.13 -0.09 0.00 0.37 0.00 0.00 40.66 41.93 2gpl h LEU 229 CO -0.19 -0.10 0.41 -0.61 -0.34 0.00 0.00 178.44 177.61 2gpl h GLN 230 N -1.01 0.59 -0.85 1.25 5.75 -0.12 0.01 115.11 120.73 2gpl h GLN 230 Ca -0.06 -0.04 0.11 0.00 -0.15 0.00 0.00 58.65 58.51 2gpl h GLN 230 Cb 0.56 -0.13 -0.08 0.00 1.07 0.00 0.00 27.48 28.90 2gpl h GLN 230 CO 0.10 0.39 0.49 1.49 -2.65 0.00 0.00 178.83 178.65 2gpl h GLU 231 N 0.61 0.77 -0.02 1.69 4.81 -0.56 -0.93 114.58 120.95 2gpl h GLU 231 Ca 0.44 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.46 2gpl h GLU 231 Cb 0.59 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2gpl h GLU 231 CO -0.35 0.51 -0.73 0.00 -0.73 0.00 0.00 179.01 177.71 2gpl h ALA 232 N 1.48 0.73 -0.10 2.92 0.00 -0.87 -2.09 119.26 121.34 2gpl h ALA 232 Ca 0.42 -0.64 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2gpl h ALA 232 Cb 0.43 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2gpl h ALA 232 CO -0.27 0.84 0.06 0.82 0.00 0.00 0.00 179.25 180.71 2gpl h ILE 233 N 0.09 1.05 0.31 0.00 5.03 -0.05 -2.39 117.51 121.56 2gpl h ILE 233 Ca -0.02 -0.14 -0.02 0.00 -0.12 0.00 0.00 64.86 64.57 2gpl h ILE 233 Cb 1.29 0.96 0.00 0.00 -3.03 0.00 0.00 36.82 36.05 2gpl h ILE 233 CO 0.11 0.05 -0.15 0.44 -0.68 0.00 0.00 178.15 177.91 2gpl h ASP 234 N 0.11 -0.36 -1.21 1.72 3.32 -1.17 1.00 116.42 119.83 2gpl h ASP 234 Ca 0.04 0.01 0.35 0.00 0.02 0.00 0.00 57.03 57.44 2gpl h ASP 234 Cb 0.03 0.09 -0.08 0.00 0.22 0.00 0.00 39.33 39.58 2gpl h ASP 234 CO -0.01 -0.25 0.82 0.15 -1.72 0.00 0.00 179.24 178.23 2gpl h PHE 235 N -0.42 0.36 0.12 4.55 3.57 -1.23 0.43 116.94 124.32 2gpl h PHE 235 Ca -0.04 0.01 -0.22 0.00 3.53 0.00 0.00 57.97 61.25 2gpl h PHE 235 Cb 0.32 -0.10 0.01 0.00 2.79 0.00 0.00 35.95 38.97 2gpl h PHE 235 CO -0.05 -0.02 -1.08 0.00 -2.23 0.00 0.00 178.31 174.93 2gpl h ALA 236 N 1.50 0.04 -0.05 2.41 0.00 -0.88 -3.05 119.26 119.23 2gpl h ALA 236 Ca 0.65 -0.88 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2gpl h ALA 236 Cb 2.13 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 20.20 2gpl h ALA 236 CO -0.20 0.58 -0.00 1.96 0.00 0.00 0.00 179.25 181.59 2gpl h GLN 237 N -0.37 0.06 -0.02 0.00 1.08 0.17 -1.13 115.11 114.90 2gpl h GLN 237 Ca -0.22 -0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 56.92 2gpl h GLN 237 Cb 1.67 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 29.09 2gpl h GLN 237 CO 0.10 0.07 -0.20 -0.22 -0.95 0.00 0.00 178.83 177.62 2gpl h LYS 238 N 0.06 0.18 -0.02 1.46 3.64 -0.37 -3.27 116.57 118.25 2gpl h LYS 238 Ca 0.02 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2gpl h LYS 238 Cb 0.05 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2gpl h LYS 238 CO 0.00 0.85 0.00 0.39 -2.27 0.00 0.00 179.45 178.42 2gpl n GLU 239 N -4.55 1.14 -0.18 1.90 1.02 -1.05 -2.93 120.64 115.99 2gpl n GLU 239 Ca -0.09 -0.21 0.08 0.00 -0.02 0.00 0.00 57.16 56.92 2gpl n GLU 239 Cb 0.46 -1.38 0.23 0.00 -0.02 0.00 0.00 31.44 30.72 2gpl n GLU 239 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 2gpl n ILE 240 N -0.65 0.49 -1.24 -3.67 0.13 -0.45 -5.07 119.36 108.90 2gpl n ILE 240 Ca 0.18 -0.53 0.00 0.00 -1.10 0.00 0.00 62.75 61.30 2gpl n ILE 240 Cb 0.13 0.34 0.00 0.00 -0.84 0.00 0.00 39.64 39.27 2gpl n ILE 240 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94