#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g1u h GLN 5 N 0.00 0.00 -0.17 0.00 4.20 -2.03 -2.70 115.11 114.41 2g1u h GLN 5 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2g1u h GLN 5 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2g1u h GLN 5 CO 0.00 0.08 0.00 1.63 -0.67 0.00 0.00 178.83 179.87 2g1u n LYS 6 N -3.51 1.81 -2.20 1.46 5.02 -1.26 -4.94 118.16 114.55 2g1u n LYS 6 Ca -0.02 -1.21 -0.42 0.00 -2.02 0.00 0.00 58.31 54.64 2g1u n LYS 6 Cb 0.22 -1.41 -0.03 0.00 -0.02 0.00 0.00 35.03 33.78 2g1u n LYS 6 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2g1u s SER 7 N -1.60 6.86 0.27 4.39 0.15 -1.02 -4.97 113.70 117.78 2g1u s SER 7 Ca 0.33 2.32 0.09 0.00 0.70 0.00 0.00 55.95 59.40 2g1u s SER 7 Cb 0.18 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.86 2g1u s SER 7 CO 0.27 -0.61 0.02 -0.54 1.20 0.00 0.00 173.24 173.58 2g1u s LYS 8 N 0.83 2.33 -0.31 5.44 -0.14 -1.26 -4.92 119.74 121.72 2g1u s LYS 8 Ca 0.62 -1.42 -0.13 0.00 -1.36 0.00 0.00 55.97 53.69 2g1u s LYS 8 Cb -0.36 -2.18 -0.03 0.00 -1.68 0.00 0.00 37.83 33.58 2g1u s LYS 8 CO 0.32 0.34 0.27 -0.47 -0.76 0.00 0.00 175.35 175.05 2g1u s TYR 9 N -2.33 3.22 -0.11 3.18 6.14 -1.26 -0.54 117.35 125.66 2g1u s TYR 9 Ca 0.32 0.02 0.02 0.00 0.64 0.00 0.00 57.07 58.07 2g1u s TYR 9 Cb -0.06 -2.50 0.01 0.00 0.42 0.00 0.00 41.96 39.83 2g1u s TYR 9 CO 0.20 -0.30 -0.17 0.42 0.64 0.00 0.00 175.55 176.35 2g1u s ILE 10 N 1.85 1.63 -0.17 3.14 1.01 0.20 -0.27 121.20 128.59 2g1u s ILE 10 Ca 0.09 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 59.97 2g1u s ILE 10 Cb -0.17 -1.46 -0.02 0.00 0.01 0.00 0.00 42.46 40.82 2g1u s ILE 10 CO 0.11 0.47 -0.05 -0.69 0.00 0.00 0.00 174.94 174.78 2g1u s VAL 11 N 0.80 3.69 -0.17 2.92 1.01 -0.93 -1.26 120.40 126.46 2g1u s VAL 11 Ca -0.10 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.47 2g1u s VAL 11 Cb -0.16 -2.63 0.01 0.00 0.00 0.00 0.00 36.38 33.60 2g1u s VAL 11 CO 0.01 0.47 -0.17 -0.63 0.00 0.00 0.00 175.10 174.78 2g1u s ILE 12 N 0.66 2.40 -0.22 2.22 1.01 0.03 -0.82 121.20 126.48 2g1u s ILE 12 Ca -0.03 -0.84 -0.10 0.00 0.00 0.00 0.00 60.65 59.68 2g1u s ILE 12 Cb -0.15 -2.02 -0.05 0.00 0.01 0.00 0.00 42.46 40.26 2g1u s ILE 12 CO 0.02 0.52 0.13 -0.36 0.00 0.00 0.00 174.94 175.26 2g1u s PHE 13 N 1.08 3.32 0.00 3.97 0.40 0.19 -0.67 117.98 126.27 2g1u s PHE 13 Ca -0.00 0.19 0.00 0.00 -0.60 0.00 0.00 56.93 56.52 2g1u s PHE 13 Cb -0.14 -2.21 0.00 0.00 0.51 0.00 0.00 43.02 41.17 2g1u s PHE 13 CO -0.06 0.11 0.00 0.41 0.70 0.00 0.00 175.22 176.38 2g1u n GLY 14 N 4.03 0.23 2.77 4.36 0.00 0.55 -0.52 105.19 116.61 2g1u n GLY 14 Ca -0.16 -0.93 -0.36 0.00 0.00 0.00 0.00 46.02 44.58 2g1u n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g1u n GLY 16 N -0.54 1.64 0.10 0.00 0.00 -1.26 -4.49 105.19 100.63 2g1u n GLY 16 Ca 0.50 -1.86 -0.09 0.00 0.00 0.00 0.00 46.02 44.58 2g1u n GLY 16 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2g1u h ARG 17 N 0.00 -0.00 0.07 1.61 3.08 -1.95 -0.72 114.38 116.47 2g1u h ARG 17 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2g1u h ARG 17 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2g1u h ARG 17 CO 0.00 -0.00 -0.04 1.25 -1.07 0.00 0.00 179.97 180.11 2g1u h LEU 18 N -0.00 -0.08 -0.90 3.04 5.85 -1.92 -3.01 115.31 118.28 2g1u h LEU 18 Ca 0.09 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 58.29 2g1u h LEU 18 Cb 0.14 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 2g1u h LEU 18 CO -0.20 0.52 0.54 1.23 -0.34 0.00 0.00 178.44 180.20 2g1u h GLY 19 N -0.76 1.31 1.33 3.75 0.00 -1.68 -2.16 103.07 104.86 2g1u h GLY 19 Ca -0.01 -0.55 -0.08 0.00 0.00 0.00 0.00 47.33 46.69 2g1u h GLY 19 CO 0.02 0.53 -0.05 1.48 0.00 0.00 0.00 176.54 178.52 2g1u h SER 20 N 1.24 0.79 -0.23 0.19 4.64 -1.23 0.46 113.55 119.41 2g1u h SER 20 Ca 0.32 -0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2g1u h SER 20 Cb -0.05 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 61.82 2g1u h SER 20 CO -0.06 0.88 0.13 0.25 -0.87 0.00 0.00 176.83 177.16 2g1u h LEU 21 N 0.75 0.28 -0.54 5.97 5.85 -1.30 -0.60 115.31 125.71 2g1u h LEU 21 Ca 0.14 -0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.67 2g1u h LEU 21 Cb 0.52 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2g1u h LEU 21 CO 0.03 0.26 -0.11 0.40 -0.34 0.00 0.00 178.44 178.68 2g1u h ILE 22 N 0.27 1.27 -0.25 4.05 1.08 -1.24 -2.43 117.51 120.25 2g1u h ILE 22 Ca 0.08 -1.27 0.01 0.00 -0.39 0.00 0.00 64.86 63.28 2g1u h ILE 22 Cb 0.04 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 34.76 2g1u h ILE 22 CO -0.01 0.45 0.15 0.00 -0.69 0.00 0.00 178.15 178.05 2g1u h ALA 23 N 0.92 0.32 -0.60 1.87 0.00 -0.75 0.11 119.26 121.12 2g1u h ALA 23 Ca 0.14 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2g1u h ALA 23 Cb 0.69 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2g1u h ALA 23 CO 0.05 -0.23 0.30 -0.91 0.00 0.00 0.00 179.25 178.46 2g1u h ASN 24 N 0.32 0.79 -0.29 0.00 2.35 -1.07 -1.03 115.58 116.64 2g1u h ASN 24 Ca 0.10 -0.13 -0.11 0.00 -0.55 0.00 0.00 56.30 55.61 2g1u h ASN 24 Cb -0.01 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 2g1u h ASN 24 CO -0.04 0.69 -0.25 -0.07 -1.65 0.00 0.00 177.43 176.11 2g1u h LEU 25 N 0.83 0.73 -0.48 1.61 3.38 -1.20 -2.13 115.31 118.04 2g1u h LEU 25 Ca 0.21 -0.46 0.03 0.00 0.09 0.00 0.00 57.88 57.75 2g1u h LEU 25 Cb 0.11 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2g1u h LEU 25 CO -0.03 1.03 0.26 0.00 0.09 0.00 0.00 178.44 179.80 2g1u h ALA 26 N 0.72 0.61 -0.62 1.53 0.00 -0.67 -1.03 119.26 119.79 2g1u h ALA 26 Ca 0.05 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2g1u h ALA 26 Cb 0.81 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2g1u h ALA 26 CO 0.06 -0.06 0.35 1.03 0.00 0.00 0.00 179.25 180.63 2g1u h SER 27 N 0.52 0.77 0.83 0.00 0.87 -1.16 -2.40 113.55 112.98 2g1u h SER 27 Ca 0.20 -0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 2g1u h SER 27 Cb 0.07 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 61.83 2g1u h SER 27 CO -0.12 0.63 -0.13 0.28 -0.53 0.00 0.00 176.83 176.96 2g1u h SER 28 N 0.85 0.00 0.14 6.23 0.02 -0.96 -1.19 113.55 118.64 2g1u h SER 28 Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2g1u h SER 28 Cb 0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2g1u h SER 28 CO -0.04 0.13 -0.02 -1.20 -1.14 0.00 0.00 176.83 174.57 2g1u n SER 29 N -3.33 0.29 0.00 3.07 7.64 -0.43 -4.93 113.62 115.93 2g1u n SER 29 Ca -0.00 -0.88 0.00 0.00 1.01 0.00 0.00 58.87 59.00 2g1u n SER 29 Cb 0.35 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 2g1u n SER 29 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2g1u n GLY 30 N 1.11 0.81 3.87 0.23 0.00 -0.45 -4.96 105.19 105.79 2g1u n GLY 30 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 2g1u n GLY 30 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2g1u s HIS 31 N -2.05 3.52 -0.30 1.61 4.02 -0.93 -4.67 115.29 116.48 2g1u s HIS 31 Ca 0.00 1.25 -0.20 0.00 1.02 0.00 0.00 55.06 57.13 2g1u s HIS 31 Cb 0.00 -2.81 -0.01 0.00 -1.02 0.00 0.00 32.58 28.74 2g1u s HIS 31 CO 0.00 -0.85 0.64 -1.12 1.02 0.00 0.00 174.74 174.43 2g1u s SER 32 N -4.18 6.52 -0.13 1.40 0.01 0.30 -4.57 113.70 113.04 2g1u s SER 32 Ca 0.56 0.48 0.03 0.00 1.31 0.00 0.00 55.95 58.33 2g1u s SER 32 Cb -0.11 -2.34 0.01 0.00 0.21 0.00 0.00 66.02 63.79 2g1u s SER 32 CO 0.54 -0.47 -0.22 -0.69 0.41 0.00 0.00 173.24 172.81 2g1u s VAL 33 N 2.61 2.11 -0.17 3.43 1.01 -1.26 -0.62 120.40 127.52 2g1u s VAL 33 Ca 0.26 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 61.23 2g1u s VAL 33 Cb -0.15 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.37 2g1u s VAL 33 CO 0.11 0.55 -0.05 -0.69 0.00 0.00 0.00 175.10 175.03 2g1u s VAL 34 N 0.68 3.70 -0.07 2.92 1.01 -0.39 -1.04 120.40 127.21 2g1u s VAL 34 Ca -0.10 -0.42 0.05 0.00 0.00 0.00 0.00 61.98 61.51 2g1u s VAL 34 Cb -0.16 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.58 2g1u s VAL 34 CO 0.01 0.48 -0.24 -0.69 0.00 0.00 0.00 175.10 174.67 2g1u s VAL 35 N 0.58 2.15 -0.09 2.92 1.01 -0.24 -0.79 120.40 125.95 2g1u s VAL 35 Ca -0.03 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 60.97 2g1u s VAL 35 Cb -0.15 -1.80 -0.00 0.00 0.00 0.00 0.00 36.38 34.43 2g1u s VAL 35 CO 0.03 0.57 -0.24 -0.69 0.00 0.00 0.00 175.10 174.76 2g1u s VAL 36 N 0.00 2.11 -0.03 2.92 1.01 0.16 -0.94 120.40 125.63 2g1u s VAL 36 Ca -0.08 -1.02 -0.14 0.00 0.00 0.00 0.00 61.98 60.75 2g1u s VAL 36 Cb -0.15 -1.79 0.02 0.00 0.00 0.00 0.00 36.38 34.46 2g1u s VAL 36 CO 0.05 0.56 0.30 -0.62 0.00 0.00 0.00 175.10 175.39 2g1u s ASP 37 N 0.17 -0.20 0.44 3.32 -1.08 -0.73 -0.33 116.67 118.26 2g1u s ASP 37 Ca -0.14 0.17 0.24 0.00 -0.52 0.00 0.00 52.55 52.31 2g1u s ASP 37 Cb -0.17 0.37 0.82 0.00 -1.46 0.00 0.00 42.92 42.48 2g1u s ASP 37 CO 0.07 -0.38 1.78 0.07 0.52 0.00 0.00 175.17 177.23 2g1u h LYS 38 N 4.24 0.00 -4.62 4.34 2.10 -1.80 -1.30 116.57 119.52 2g1u h LYS 38 Ca -0.29 0.00 -0.70 0.00 -2.00 0.00 0.00 60.65 57.66 2g1u h LYS 38 Cb 1.18 0.00 -0.29 0.00 -0.90 0.00 0.00 32.23 32.22 2g1u h LYS 38 CO 0.38 0.20 -0.58 1.21 -2.00 0.00 0.00 179.45 178.66 2g1u s ASN 39 N -6.14 5.34 0.53 7.07 2.47 -1.26 -4.62 114.94 118.33 2g1u s ASN 39 Ca 0.02 -1.31 0.22 0.00 0.42 0.00 0.00 52.86 52.21 2g1u s ASN 39 Cb 0.09 -1.87 1.38 0.00 -1.45 0.00 0.00 41.25 39.39 2g1u s ASN 39 CO 0.64 -0.38 2.06 1.05 -3.72 0.00 0.00 177.10 176.74 2g1u h GLU 40 N 8.22 0.00 0.00 0.43 4.11 -1.97 -1.78 114.58 123.59 2g1u h GLU 40 Ca -0.22 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.19 2g1u h GLU 40 Cb 1.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 2g1u h GLU 40 CO 0.64 0.00 -0.08 1.88 0.07 0.00 0.00 179.01 181.51 2g1u h TYR 41 N 0.00 0.00 -0.29 2.06 0.05 -1.98 -2.80 116.97 114.01 2g1u h TYR 41 Ca 0.15 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.99 2g1u h TYR 41 Cb 0.63 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.36 2g1u h TYR 41 CO 0.00 0.08 0.20 0.00 -1.05 0.00 0.00 178.16 177.40 2g1u h ALA 42 N 1.92 2.08 0.00 3.88 0.00 -1.63 -2.08 119.26 123.42 2g1u h ALA 42 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2g1u h ALA 42 Cb 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2g1u h ALA 42 CO 0.01 -0.14 0.00 1.19 0.00 0.00 0.00 179.25 180.31 2g1u n PHE 43 N -4.48 0.28 0.24 0.00 3.72 -1.06 -1.89 117.46 114.28 2g1u n PHE 43 Ca 0.03 0.13 0.18 0.00 -0.05 0.00 0.00 57.45 57.73 2g1u n PHE 43 Cb 0.26 -0.70 0.88 0.00 -0.94 0.00 0.00 39.48 38.97 2g1u n PHE 43 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 2g1u h HIS 44 N 0.00 0.00 0.00 1.38 2.07 -1.60 -1.36 115.15 115.64 2g1u h HIS 44 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2g1u h HIS 44 Cb 0.16 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.14 2g1u h HIS 44 CO 0.00 0.00 0.00 0.54 -3.07 0.00 0.00 177.93 175.40 2g1u n ARG 45 N -3.63 0.18 -2.63 5.12 1.74 -0.79 -4.79 116.66 111.86 2g1u n ARG 45 Ca 0.00 0.31 -0.40 0.00 -0.77 0.00 0.00 57.85 57.00 2g1u n ARG 45 Cb 0.29 -1.78 -0.05 0.00 -1.02 0.00 0.00 32.46 29.90 2g1u n ARG 45 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2g1u s LEU 46 N -4.21 4.59 0.80 0.55 1.43 -0.51 -4.91 118.68 116.42 2g1u s LEU 46 Ca 0.07 2.06 -0.10 0.00 -1.03 0.00 0.00 54.13 55.14 2g1u s LEU 46 Cb 0.11 -3.61 0.11 0.00 0.03 0.00 0.00 46.19 42.83 2g1u s LEU 46 CO 0.44 0.00 1.14 0.54 0.23 0.00 0.00 176.35 178.70 2g1u s ASN 47 N -0.88 4.21 0.55 2.29 2.20 -1.26 -4.92 114.94 117.11 2g1u s ASN 47 Ca 0.43 0.37 0.28 0.00 -0.94 0.00 0.00 52.86 53.00 2g1u s ASN 47 Cb -0.28 -0.78 1.57 0.00 -2.00 0.00 0.00 41.25 39.76 2g1u s ASN 47 CO 0.35 -2.02 2.14 0.28 -2.94 0.00 0.00 177.10 174.91 2g1u h SER 48 N -0.99 0.00 0.98 3.54 0.02 -1.97 -1.81 113.55 113.33 2g1u h SER 48 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2g1u h SER 48 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2g1u h SER 48 CO 0.53 0.08 -0.18 -0.62 -1.14 0.00 0.00 176.83 175.49 2g1u n GLU 49 N -3.76 0.09 -1.71 3.45 4.71 -1.26 -4.92 120.64 117.25 2g1u n GLU 49 Ca -0.02 0.06 -0.43 0.00 -0.01 0.00 0.00 57.16 56.75 2g1u n GLU 49 Cb 0.18 -1.59 -0.02 0.00 -1.01 0.00 0.00 31.44 29.00 2g1u n GLU 49 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2g1u n PHE 50 N -1.74 2.51 -0.01 -0.32 7.35 -0.68 -4.91 117.46 119.65 2g1u n PHE 50 Ca 0.06 0.33 0.00 0.00 -0.76 0.00 0.00 57.45 57.08 2g1u n PHE 50 Cb 0.37 -2.53 0.00 0.00 0.35 0.00 0.00 39.48 37.67 2g1u n PHE 50 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 2g1u n SER 51 N 2.27 1.35 -1.43 -2.13 3.41 -1.26 -4.99 113.62 110.83 2g1u n SER 51 Ca 0.11 -1.36 0.00 0.00 -0.26 0.00 0.00 58.87 57.36 2g1u n SER 51 Cb 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 2g1u n SER 51 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2g1u n GLY 52 N -0.18 1.19 3.37 5.00 0.00 -1.26 -4.96 105.19 108.35 2g1u n GLY 52 Ca 0.00 -1.75 -0.29 0.00 0.00 0.00 0.00 46.02 43.98 2g1u n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2g1u s PHE 53 N 1.41 2.27 0.09 1.61 0.08 -0.20 -5.02 117.98 118.22 2g1u s PHE 53 Ca 0.00 -0.39 0.06 0.00 0.12 0.00 0.00 56.93 56.72 2g1u s PHE 53 Cb 0.00 -1.28 -0.04 0.00 -0.57 0.00 0.00 43.02 41.14 2g1u s PHE 53 CO 0.00 0.26 -0.07 0.95 -0.10 0.00 0.00 175.22 176.26 2g1u s THR 54 N -0.98 3.57 -0.07 0.64 -4.23 -1.26 -1.08 115.64 112.23 2g1u s THR 54 Ca 0.13 -1.13 -0.00 0.00 -1.18 0.00 0.00 61.69 59.51 2g1u s THR 54 Cb -0.10 -2.66 0.02 0.00 1.34 0.00 0.00 72.50 71.10 2g1u s THR 54 CO 0.05 0.15 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.56 2g1u s VAL 55 N -1.21 0.59 -0.21 2.29 1.01 -0.11 -4.92 120.40 117.83 2g1u s VAL 55 Ca 0.22 -0.05 -0.19 0.00 0.00 0.00 0.00 61.98 61.96 2g1u s VAL 55 Cb -0.11 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 2g1u s VAL 55 CO 0.14 0.28 0.54 -0.69 0.00 0.00 0.00 175.10 175.37 2g1u s VAL 56 N 1.58 5.08 0.00 2.92 1.01 -1.26 -1.77 120.40 127.97 2g1u s VAL 56 Ca -0.00 0.98 0.00 0.00 0.00 0.00 0.00 61.98 62.96 2g1u s VAL 56 Cb -0.13 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.39 2g1u s VAL 56 CO -0.04 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.81 2g1u n GLY 57 N 3.97 0.93 3.60 4.51 0.00 -0.49 -4.96 105.19 112.75 2g1u n GLY 57 Ca -0.04 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.82 2g1u n GLY 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2g1u s ASP 58 N 0.00 6.63 0.00 1.61 -1.08 -1.26 -2.59 116.67 119.97 2g1u s ASP 58 Ca 0.00 0.48 0.20 0.00 -0.52 0.00 0.00 52.55 52.70 2g1u s ASP 58 Cb 0.00 -2.44 0.99 0.00 -1.46 0.00 0.00 42.92 40.00 2g1u s ASP 58 CO 0.00 -0.84 1.62 0.00 0.52 0.00 0.00 175.17 176.47 2g1u n ALA 59 N 6.71 2.03 1.90 3.66 0.00 -1.26 -1.57 120.51 131.98 2g1u n ALA 59 Ca 0.06 -0.09 0.15 0.00 0.00 0.00 0.00 53.44 53.55 2g1u n ALA 59 Cb 0.48 -1.32 0.81 0.00 0.00 0.00 0.00 19.45 19.42 2g1u n ALA 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g1u n ALA 60 N -1.30 2.66 -2.86 0.00 0.00 -1.26 -4.65 120.51 113.09 2g1u n ALA 60 Ca 0.09 -0.24 -0.34 0.00 0.00 0.00 0.00 53.44 52.95 2g1u n ALA 60 Cb 0.16 -1.42 -0.10 0.00 0.00 0.00 0.00 19.45 18.09 2g1u n ALA 60 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2g1u s GLU 61 N -1.99 3.85 0.29 0.00 0.41 -0.61 -5.01 118.70 115.64 2g1u s GLU 61 Ca 0.43 -0.40 -0.02 0.00 -0.41 0.00 0.00 54.97 54.57 2g1u s GLU 61 Cb 0.20 -3.10 0.44 0.00 -1.78 0.00 0.00 34.13 29.89 2g1u s GLU 61 CO 0.34 0.28 1.93 0.35 -0.49 0.00 0.00 175.26 177.66 2g1u h PHE 62 N 6.64 1.11 -0.52 1.61 3.57 -1.86 -0.97 116.94 126.52 2g1u h PHE 62 Ca -0.35 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.26 2g1u h PHE 62 Cb 1.18 -0.37 -0.03 0.00 2.79 0.00 0.00 35.95 39.52 2g1u h PHE 62 CO 0.55 0.63 0.35 0.93 -2.23 0.00 0.00 178.31 178.55 2g1u h GLU 63 N 1.14 0.35 -0.38 1.11 4.39 -1.95 -0.61 114.58 118.63 2g1u h GLU 63 Ca 0.37 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.99 2g1u h GLU 63 Cb 0.04 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 2g1u h GLU 63 CO -0.12 0.23 -0.00 1.15 -1.16 0.00 0.00 179.01 179.11 2g1u h THR 64 N 0.36 1.26 -0.33 1.13 2.02 -1.41 -2.89 112.91 113.05 2g1u h THR 64 Ca 0.24 -1.01 0.01 0.00 0.77 0.00 0.00 66.41 66.42 2g1u h THR 64 Cb 0.46 1.15 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 2g1u h THR 64 CO -0.06 0.34 0.22 -0.07 0.37 0.00 0.00 175.52 176.32 2g1u h LEU 65 N 0.50 0.35 -1.50 2.58 3.38 -1.05 -1.87 115.31 117.70 2g1u h LEU 65 Ca 0.11 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 2g1u h LEU 65 Cb 0.47 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 2g1u h LEU 65 CO 0.02 0.25 -0.09 0.11 0.09 0.00 0.00 178.44 178.82 2g1u h LYS 66 N 0.41 0.00 -0.11 1.13 1.57 -1.07 -3.18 116.57 115.31 2g1u h LYS 66 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2g1u h LYS 66 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2g1u h LYS 66 CO -0.03 0.09 0.00 0.39 -0.57 0.00 0.00 179.45 179.33 2g1u n GLU 67 N -3.26 1.50 -0.08 3.15 1.02 -0.70 -4.03 120.64 118.22 2g1u n GLU 67 Ca -0.00 -0.74 0.03 0.00 -0.02 0.00 0.00 57.16 56.42 2g1u n GLU 67 Cb 0.32 -1.36 0.07 0.00 -0.02 0.00 0.00 31.44 30.45 2g1u n GLU 67 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2g1u n GLY 69 N -0.02 -0.21 0.26 0.00 0.00 -1.26 -4.89 105.19 99.07 2g1u n GLY 69 Ca 0.05 0.03 0.10 0.00 0.00 0.00 0.00 46.02 46.20 2g1u n GLY 69 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2g1u h MET 70 N -1.95 0.00 0.00 1.61 4.05 -1.88 -0.45 114.93 116.32 2g1u h MET 70 Ca -0.44 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.98 2g1u h MET 70 Cb 1.29 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.09 2g1u h MET 70 CO 0.43 0.09 0.00 -0.85 0.23 0.00 0.00 176.91 176.81 2g1u n GLU 71 N -4.08 0.18 0.00 0.39 0.00 -1.26 -1.23 120.64 114.64 2g1u n GLU 71 Ca -0.03 0.46 0.12 0.00 0.00 0.00 0.00 57.16 57.71 2g1u n GLU 71 Cb 0.17 -1.88 0.31 0.00 0.00 0.00 0.00 31.44 30.04 2g1u n GLU 71 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2g1u n LYS 72 N -2.23 0.44 -2.46 3.44 5.02 -0.18 -4.97 118.16 117.22 2g1u n LYS 72 Ca 0.02 -0.26 -0.40 0.00 -2.02 0.00 0.00 58.31 55.65 2g1u n LYS 72 Cb 0.20 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.67 2g1u n LYS 72 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2g1u s ALA 73 N -2.74 3.40 0.09 7.82 0.00 -0.37 -4.74 121.76 125.23 2g1u s ALA 73 Ca 0.18 0.91 0.06 0.00 0.00 0.00 0.00 51.96 53.11 2g1u s ALA 73 Cb 0.18 -3.33 -0.22 0.00 0.00 0.00 0.00 23.12 19.75 2g1u s ALA 73 CO 0.61 -0.19 1.18 -0.44 0.00 0.00 0.00 175.76 176.92 2g1u h ASP 74 N 3.76 0.06 -4.43 0.00 3.32 -0.96 -3.45 116.42 114.72 2g1u h ASP 74 Ca -0.47 -0.07 -0.11 0.00 0.02 0.00 0.00 57.03 56.40 2g1u h ASP 74 Cb 1.21 -0.02 -0.22 0.00 0.22 0.00 0.00 39.33 40.52 2g1u h ASP 74 CO 0.67 1.06 -0.21 -0.04 -1.72 0.00 0.00 179.24 178.99 2g1u s MET 75 N -2.69 0.61 -0.06 3.56 -1.94 -1.12 -4.09 119.30 113.57 2g1u s MET 75 Ca -0.01 0.24 0.03 0.00 -1.71 0.00 0.00 55.69 54.24 2g1u s MET 75 Cb 0.09 0.28 0.01 0.00 2.01 0.00 0.00 34.83 37.22 2g1u s MET 75 CO 0.83 -0.13 -0.15 0.08 -0.01 0.00 0.00 175.02 175.63 2g1u s VAL 76 N -0.53 1.33 -0.23 -6.03 1.01 -0.75 -2.19 120.40 113.01 2g1u s VAL 76 Ca -0.06 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.27 2g1u s VAL 76 Cb -0.04 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 35.18 2g1u s VAL 76 CO 0.03 0.39 -0.06 -0.36 0.00 0.00 0.00 175.10 175.10 2g1u s PHE 77 N 0.38 2.98 -0.85 5.22 0.08 -0.00 -1.33 117.98 124.45 2g1u s PHE 77 Ca -0.11 -1.22 -0.13 0.00 0.12 0.00 0.00 56.93 55.59 2g1u s PHE 77 Cb -0.14 -2.08 0.22 0.00 -0.57 0.00 0.00 43.02 40.46 2g1u s PHE 77 CO 0.04 -0.64 0.80 0.00 -0.10 0.00 0.00 175.22 175.31 2g1u s ALA 78 N 1.41 4.15 -0.26 5.36 0.00 0.18 -0.64 121.76 131.96 2g1u s ALA 78 Ca 0.04 -3.39 0.09 0.00 0.00 0.00 0.00 51.96 48.70 2g1u s ALA 78 Cb -0.15 -3.49 0.44 0.00 0.00 0.00 0.00 23.12 19.92 2g1u s ALA 78 CO -0.05 -2.27 1.25 1.19 0.00 0.00 0.00 175.76 175.88 2g1u n PHE 79 N 3.79 1.28 -1.56 0.00 3.72 0.32 -1.04 117.46 123.97 2g1u n PHE 79 Ca 0.15 -1.84 -0.29 0.00 -0.05 0.00 0.00 57.45 55.42 2g1u n PHE 79 Cb 0.46 -0.33 0.17 0.00 -0.94 0.00 0.00 39.48 38.83 2g1u n PHE 79 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2g1u s THR 80 N -3.83 1.92 -0.72 4.37 -4.23 -1.09 -4.50 115.64 107.56 2g1u s THR 80 Ca 0.44 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 61.05 2g1u s THR 80 Cb 0.39 -2.77 0.49 0.00 1.34 0.00 0.00 72.50 71.95 2g1u s THR 80 CO -0.02 0.00 1.27 -0.46 -0.54 0.00 0.00 174.62 174.87 2g1u n ASN 81 N -3.95 3.71 -3.91 3.99 0.23 -1.26 -4.82 115.26 109.25 2g1u n ASN 81 Ca 0.10 -2.50 -0.28 0.00 -0.53 0.00 0.00 54.58 51.38 2g1u n ASN 81 Cb 0.59 -0.58 -0.17 0.00 -2.08 0.00 0.00 39.78 37.55 2g1u n ASN 81 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2g1u s ASP 82 N -0.53 2.47 0.22 0.53 2.15 -1.26 -5.03 116.67 115.21 2g1u s ASP 82 Ca 0.33 -0.45 -0.08 0.00 0.43 0.00 0.00 52.55 52.77 2g1u s ASP 82 Cb 0.24 -0.90 0.17 0.00 -0.30 0.00 0.00 42.92 42.13 2g1u s ASP 82 CO 0.11 -0.14 1.83 0.44 -0.17 0.00 0.00 175.17 177.24 2g1u h ASP 83 N 8.14 1.02 -0.59 -0.34 3.32 -1.88 -0.97 116.42 125.13 2g1u h ASP 83 Ca -0.28 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 56.63 2g1u h ASP 83 Cb 1.12 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.39 2g1u h ASP 83 CO 0.42 0.83 0.25 0.28 -1.72 0.00 0.00 179.24 179.30 2g1u h SER 84 N 1.13 0.80 -0.41 6.45 0.02 -1.96 0.16 113.55 119.75 2g1u h SER 84 Ca 0.29 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2g1u h SER 84 Cb 0.04 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 2g1u h SER 84 CO -0.04 0.74 0.21 0.74 -1.14 0.00 0.00 176.83 177.34 2g1u h THR 85 N 0.81 1.16 -0.38 -2.27 2.02 -1.91 -1.04 112.91 111.29 2g1u h THR 85 Ca 0.20 -0.44 -0.03 0.00 0.77 0.00 0.00 66.41 66.91 2g1u h THR 85 Cb 0.18 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2g1u h THR 85 CO -0.02 0.17 0.09 0.78 0.37 0.00 0.00 175.52 176.91 2g1u h ASN 86 N 0.52 0.51 -0.25 4.18 2.35 -0.84 -0.35 115.58 121.69 2g1u h ASN 86 Ca 0.14 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 2g1u h ASN 86 Cb 0.08 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 2g1u h ASN 86 CO -0.02 0.51 0.08 0.15 -1.65 0.00 0.00 177.43 176.50 2g1u h PHE 87 N 0.54 0.41 -0.02 1.19 3.57 -0.66 -0.95 116.94 121.02 2g1u h PHE 87 Ca 0.13 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.61 2g1u h PHE 87 Cb 0.21 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 2g1u h PHE 87 CO 0.01 0.46 -0.13 0.35 -2.23 0.00 0.00 178.31 176.76 2g1u h PHE 88 N 0.24 -0.33 -0.29 0.41 3.57 -0.71 -0.27 116.94 119.56 2g1u h PHE 88 Ca 0.08 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.63 2g1u h PHE 88 Cb 0.24 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.10 2g1u h PHE 88 CO 0.00 -0.19 0.07 0.82 -2.23 0.00 0.00 178.31 176.78 2g1u h ILE 89 N -0.21 0.89 -0.33 1.41 2.04 -1.03 -2.18 117.51 118.11 2g1u h ILE 89 Ca 0.05 -0.06 -0.16 0.00 1.00 0.00 0.00 64.86 65.69 2g1u h ILE 89 Cb 0.28 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.04 2g1u h ILE 89 CO -0.14 0.03 -0.42 0.28 0.00 0.00 0.00 178.15 177.91 2g1u h SER 90 N 0.19 0.93 -0.39 1.72 0.02 -0.88 0.34 113.55 115.48 2g1u h SER 90 Ca 0.13 -0.49 -0.03 0.00 -0.84 0.00 0.00 61.79 60.56 2g1u h SER 90 Cb 0.12 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 2g1u h SER 90 CO -0.16 1.24 0.14 0.24 -1.14 0.00 0.00 176.83 177.15 2g1u h MET 91 N 0.64 0.59 -0.59 3.45 2.86 -1.05 -0.60 114.93 120.24 2g1u h MET 91 Ca 0.04 -0.12 0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2g1u h MET 91 Cb 1.01 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.55 2g1u h MET 91 CO 0.10 0.58 0.39 -0.91 1.06 0.00 0.00 176.91 178.13 2g1u h ASN 92 N 0.48 0.68 -0.19 1.22 2.35 -1.23 -1.49 115.58 117.40 2g1u h ASN 92 Ca 0.13 -0.02 0.03 0.00 -0.55 0.00 0.00 56.30 55.89 2g1u h ASN 92 Cb 0.22 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 2g1u h ASN 92 CO -0.01 0.49 -0.02 0.00 -1.65 0.00 0.00 177.43 176.25 2g1u h ALA 93 N 1.22 0.15 -0.01 -0.83 0.00 -0.66 0.51 119.26 119.64 2g1u h ALA 93 Ca 0.22 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2g1u h ALA 93 Cb -0.09 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2g1u h ALA 93 CO -0.05 -0.45 0.01 0.00 0.00 0.00 0.00 179.25 178.76 2g1u h ARG 94 N 0.04 0.02 0.00 0.00 2.47 -1.01 0.47 114.38 116.37 2g1u h ARG 94 Ca 0.09 -0.00 -0.26 0.00 -1.26 0.00 0.00 59.98 58.54 2g1u h ARG 94 Cb 0.12 -0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.39 2g1u h ARG 94 CO -0.17 0.09 -2.00 0.66 0.56 0.00 0.00 179.97 179.12 2g1u n TYR 95 N -5.04 0.00 -0.00 3.04 4.01 -0.57 -3.02 117.16 115.57 2g1u n TYR 95 Ca -0.07 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.50 2g1u n TYR 95 Cb 0.07 -0.70 -0.14 0.00 -0.31 0.00 0.00 39.34 38.26 2g1u n TYR 95 CO 0.00 0.00 0.00 1.98 -0.46 0.00 0.00 176.86 178.38 2g1u h MET 96 N 0.00 0.18 -0.02 -0.72 4.05 -1.08 -3.39 114.93 113.94 2g1u h MET 96 Ca -0.39 -0.29 0.00 0.00 -0.28 0.00 0.00 59.70 58.74 2g1u h MET 96 Cb 1.75 0.11 0.00 0.00 -0.80 0.00 0.00 31.60 32.66 2g1u h MET 96 CO -0.02 1.12 -0.17 1.19 0.23 0.00 0.00 176.91 179.26 2g1u n PHE 97 N -4.34 0.00 -3.52 1.39 3.72 -0.55 -5.00 117.46 109.16 2g1u n PHE 97 Ca -0.12 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.06 2g1u n PHE 97 Cb 0.66 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.28 2g1u n PHE 97 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2g1u n ASN 98 N 0.75 -5.95 -4.66 4.37 4.13 -0.87 -4.33 115.26 108.70 2g1u n ASN 98 Ca 0.11 -0.51 -0.41 0.00 1.68 0.00 0.00 54.58 55.46 2g1u n ASN 98 Cb 0.51 -4.75 -0.05 0.00 -1.54 0.00 0.00 39.78 33.95 2g1u n ASN 98 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2g1u s VAL 99 N -3.30 4.96 0.04 2.41 1.01 0.10 -4.98 120.40 120.64 2g1u s VAL 99 Ca 0.53 1.39 -0.19 0.00 0.00 0.00 0.00 61.98 63.71 2g1u s VAL 99 Cb -0.23 -4.03 -0.15 0.00 0.00 0.00 0.00 36.38 31.97 2g1u s VAL 99 CO 0.68 0.07 1.31 1.05 0.00 0.00 0.00 175.10 178.21 2g1u h GLU 100 N 7.40 0.45 -4.31 2.72 9.09 -1.87 -3.38 114.58 124.68 2g1u h GLU 100 Ca -0.31 -0.28 -0.74 0.00 0.05 0.00 0.00 59.36 58.09 2g1u h GLU 100 Cb 1.14 0.03 -0.24 0.00 -1.65 0.00 0.00 28.75 28.03 2g1u h GLU 100 CO 0.80 0.88 -0.35 1.21 0.05 0.00 0.00 179.01 181.60 2g1u s ASN 101 N -6.35 6.05 -0.08 3.06 2.47 -1.26 -4.99 114.94 113.84 2g1u s ASN 101 Ca -0.14 -1.42 0.01 0.00 0.42 0.00 0.00 52.86 51.73 2g1u s ASN 101 Cb 0.06 -2.15 0.02 0.00 -1.45 0.00 0.00 41.25 37.73 2g1u s ASN 101 CO 0.78 -0.65 -0.08 -0.69 -3.72 0.00 0.00 177.10 172.74 2g1u s VAL 102 N 1.59 0.93 -0.09 -5.21 1.01 -1.26 -1.81 120.40 115.56 2g1u s VAL 102 Ca 0.04 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.74 2g1u s VAL 102 Cb -0.25 -0.91 0.01 0.00 0.00 0.00 0.00 36.38 35.23 2g1u s VAL 102 CO 0.05 0.33 -0.19 -0.63 0.00 0.00 0.00 175.10 174.66 2g1u s ILE 103 N 1.15 1.70 0.06 2.22 1.01 -0.44 -1.22 121.20 125.67 2g1u s ILE 103 Ca -0.06 -0.80 0.08 0.00 0.00 0.00 0.00 60.65 59.87 2g1u s ILE 103 Cb -0.14 -1.50 -0.03 0.00 0.01 0.00 0.00 42.46 40.80 2g1u s ILE 103 CO -0.02 0.48 -0.21 0.00 0.00 0.00 0.00 174.94 175.20 2g1u s ALA 104 N 0.58 1.77 -0.06 9.38 0.00 0.20 -0.64 121.76 132.98 2g1u s ALA 104 Ca -0.15 -1.11 -0.27 0.00 0.00 0.00 0.00 51.96 50.43 2g1u s ALA 104 Cb -0.17 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 2g1u s ALA 104 CO 0.05 0.38 0.87 0.50 0.00 0.00 0.00 175.76 177.56 2g1u s ARG 105 N -1.38 4.47 -0.18 0.00 3.52 -0.21 -0.75 118.95 124.42 2g1u s ARG 105 Ca 0.07 1.18 -0.01 0.00 -0.13 0.00 0.00 55.73 56.84 2g1u s ARG 105 Cb -0.09 -3.48 0.05 0.00 -1.56 0.00 0.00 34.95 29.87 2g1u s ARG 105 CO 0.02 -0.08 -0.01 0.08 -0.81 0.00 0.00 175.30 174.50 2g1u s VAL 106 N 1.22 0.84 -0.00 7.11 1.01 -0.45 -4.78 120.40 125.35 2g1u s VAL 106 Ca 0.45 -0.59 -0.22 0.00 0.00 0.00 0.00 61.98 61.62 2g1u s VAL 106 Cb -0.19 -1.16 -0.20 0.00 0.00 0.00 0.00 36.38 34.83 2g1u s VAL 106 CO 0.21 -0.03 1.16 0.22 0.00 0.00 0.00 175.10 176.67 2g1u h TYR 107 N 8.17 0.42 -3.56 5.22 3.20 -1.97 -3.36 116.97 125.10 2g1u h TYR 107 Ca -0.19 -0.19 -0.61 0.00 3.14 0.00 0.00 58.73 60.88 2g1u h TYR 107 Cb 1.11 -0.06 -0.11 0.00 1.54 0.00 0.00 36.73 39.21 2g1u h TYR 107 CO 0.39 0.93 0.45 0.34 -1.64 0.00 0.00 178.16 178.63 2g1u s ASP 108 N -6.37 6.55 0.56 -2.11 -1.08 -1.26 -4.75 116.67 108.21 2g1u s ASP 108 Ca -0.14 0.29 0.26 0.00 -0.52 0.00 0.00 52.55 52.44 2g1u s ASP 108 Cb 0.03 -2.42 1.53 0.00 -1.46 0.00 0.00 42.92 40.60 2g1u s ASP 108 CO 0.77 -0.83 2.06 -0.65 0.52 0.00 0.00 175.17 177.04 2g1u h PRO 109 N 8.64 0.00 0.00 4.34 0.11 -2.00 0.01 132.00 143.10 2g1u h PRO 109 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2g1u h PRO 109 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2g1u h PRO 109 CO 0.95 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.67 2g1u h GLU 110 N 0.00 0.00 -0.00 1.05 5.08 -1.98 -2.73 114.58 116.00 2g1u h GLU 110 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2g1u h GLU 110 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2g1u h GLU 110 CO -0.00 0.00 -0.45 1.63 -1.00 0.00 0.00 179.01 179.19 2g1u n LYS 111 N -2.43 0.17 -0.21 2.33 5.02 -0.01 -4.37 118.16 118.66 2g1u n LYS 111 Ca 0.02 -0.10 -0.04 0.00 -2.02 0.00 0.00 58.31 56.17 2g1u n LYS 111 Cb 0.26 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.83 2g1u n LYS 111 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2g1u h ILE 112 N 0.24 1.08 -0.62 -0.18 2.04 -1.56 -3.15 117.51 115.36 2g1u h ILE 112 Ca 0.00 -0.26 0.08 0.00 1.00 0.00 0.00 64.86 65.68 2g1u h ILE 112 Cb 0.50 0.26 -0.06 0.00 -0.74 0.00 0.00 36.82 36.78 2g1u h ILE 112 CO 0.00 0.14 0.28 0.50 0.00 0.00 0.00 178.15 179.07 2g1u h LYS 113 N 0.75 0.49 -0.18 2.37 3.64 -1.79 -1.57 116.57 120.28 2g1u h LYS 113 Ca 0.25 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.50 2g1u h LYS 113 Cb 0.01 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2g1u h LYS 113 CO -0.10 0.32 -0.33 0.97 -2.27 0.00 0.00 179.45 178.05 2g1u h ILE 114 N 0.50 1.28 0.04 2.00 6.09 -1.85 0.13 117.51 125.70 2g1u h ILE 114 Ca 0.30 -1.36 -0.00 0.00 -1.37 0.00 0.00 64.86 62.43 2g1u h ILE 114 Cb 0.31 1.51 0.00 0.00 0.47 0.00 0.00 36.82 39.10 2g1u h ILE 114 CO -0.25 0.42 -0.02 -0.26 -3.07 0.00 0.00 178.15 174.96 2g1u h PHE 115 N 0.31 -0.05 -0.10 2.19 -1.00 -1.46 -3.20 116.94 113.62 2g1u h PHE 115 Ca 0.04 -0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.75 2g1u h PHE 115 Cb 0.73 0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.29 2g1u h PHE 115 CO 0.02 0.28 -0.26 0.93 -1.61 0.00 0.00 178.31 177.67 2g1u h GLU 116 N -0.39 0.17 0.00 1.51 5.08 -0.82 -1.37 114.58 118.76 2g1u h GLU 116 Ca -0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2g1u h GLU 116 Cb 0.35 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2g1u h GLU 116 CO 0.01 0.42 0.00 0.93 -1.00 0.00 0.00 179.01 179.37 2g1u h GLU 117 N 0.16 0.00 -0.55 2.33 5.08 -0.82 -1.64 114.58 119.14 2g1u h GLU 117 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2g1u h GLU 117 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2g1u h GLU 117 CO 0.04 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.14 2g1u n ASN 118 N -2.74 4.48 -0.38 1.42 3.02 -0.58 -4.96 115.26 115.51 2g1u n ASN 118 Ca 0.01 -2.50 -0.05 0.00 -0.03 0.00 0.00 54.58 52.00 2g1u n ASN 118 Cb 0.24 -0.54 -0.02 0.00 -0.61 0.00 0.00 39.78 38.85 2g1u n ASN 118 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2g1u n GLY 119 N 0.79 0.77 3.66 7.41 0.00 -0.62 -5.01 105.19 112.19 2g1u n GLY 119 Ca 0.24 -0.78 -0.37 0.00 0.00 0.00 0.00 46.02 45.11 2g1u n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2g1u s ILE 120 N -2.17 5.35 0.39 -0.61 1.01 -0.85 -4.71 121.20 119.61 2g1u s ILE 120 Ca 0.00 0.22 -0.24 0.00 0.00 0.00 0.00 60.65 60.63 2g1u s ILE 120 Cb 0.00 -3.52 -0.09 0.00 0.01 0.00 0.00 42.46 38.86 2g1u s ILE 120 CO 0.00 0.34 1.05 -0.54 0.00 0.00 0.00 174.94 175.79 2g1u s LYS 121 N 1.04 4.19 0.04 2.79 1.02 -0.36 -3.59 119.74 124.88 2g1u s LYS 121 Ca 0.08 1.52 0.08 0.00 0.02 0.00 0.00 55.97 57.68 2g1u s LYS 121 Cb -0.13 -2.57 -0.03 0.00 -0.52 0.00 0.00 37.83 34.58 2g1u s LYS 121 CO 0.04 -0.12 -0.24 0.95 -0.92 0.00 0.00 175.35 175.06 2g1u s THR 122 N -1.64 1.95 -0.26 2.17 -4.23 -1.26 -0.63 115.64 111.75 2g1u s THR 122 Ca 0.57 -1.31 0.03 0.00 -1.18 0.00 0.00 61.69 59.80 2g1u s THR 122 Cb -0.22 -1.67 0.06 0.00 1.34 0.00 0.00 72.50 72.00 2g1u s THR 122 CO 0.28 0.30 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.93 2g1u s ILE 123 N -0.80 2.12 -0.32 2.99 1.01 0.07 -4.93 121.20 121.34 2g1u s ILE 123 Ca 0.10 -1.58 -0.02 0.00 0.00 0.00 0.00 60.65 59.15 2g1u s ILE 123 Cb -0.09 -2.23 0.06 0.00 0.01 0.00 0.00 42.46 40.21 2g1u s ILE 123 CO 0.02 -0.01 0.04 0.00 0.00 0.00 0.00 174.94 174.99 2g1u h PRO 125 N 8.00 0.28 -0.55 0.00 0.11 -1.87 -0.53 132.00 137.43 2g1u h PRO 125 Ca -0.19 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.90 2g1u h PRO 125 Cb 1.06 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.08 2g1u h PRO 125 CO 0.56 0.18 0.35 0.00 -0.21 0.00 0.00 178.00 178.88 2g1u h ALA 126 N 1.55 0.70 -0.48 -0.75 0.00 -1.90 -1.19 119.26 117.20 2g1u h ALA 126 Ca 0.38 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 2g1u h ALA 126 Cb 0.60 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2g1u h ALA 126 CO -0.46 0.16 0.07 0.28 0.00 0.00 0.00 179.25 179.31 2g1u h VAL 127 N 0.74 1.25 -0.69 0.00 2.07 -1.75 -2.02 116.25 115.85 2g1u h VAL 127 Ca 0.20 -0.93 0.01 0.00 0.82 0.00 0.00 66.70 66.80 2g1u h VAL 127 Cb -0.05 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2g1u h VAL 127 CO -0.04 0.33 0.46 -0.07 0.02 0.00 0.00 177.57 178.26 2g1u h LEU 128 N 0.67 0.79 -0.05 2.57 3.38 -0.84 0.45 115.31 122.27 2g1u h LEU 128 Ca 0.14 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2g1u h LEU 128 Cb 0.40 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2g1u h LEU 128 CO 0.01 0.57 0.02 0.24 0.09 0.00 0.00 178.44 179.37 2g1u h MET 129 N 0.93 0.07 -0.65 1.13 2.86 -1.10 -1.77 114.93 116.39 2g1u h MET 129 Ca 0.25 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.86 2g1u h MET 129 Cb -0.10 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.51 2g1u h MET 129 CO -0.06 0.21 0.33 0.82 1.06 0.00 0.00 176.91 179.27 2g1u h ILE 130 N -0.08 1.22 -0.83 -1.22 2.04 -1.20 -0.73 117.51 116.70 2g1u h ILE 130 Ca 0.02 -0.60 0.01 0.00 1.00 0.00 0.00 64.86 65.29 2g1u h ILE 130 Cb 0.17 0.41 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 2g1u h ILE 130 CO -0.00 0.25 0.55 -0.33 0.00 0.00 0.00 178.15 178.62 2g1u h GLU 131 N 0.90 1.10 -0.31 2.37 5.08 -0.83 -0.10 114.58 122.79 2g1u h GLU 131 Ca 0.23 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.45 2g1u h GLU 131 Cb 0.10 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 2g1u h GLU 131 CO -0.03 0.73 -0.07 -0.22 -1.00 0.00 0.00 179.01 178.42 2g1u h LYS 132 N 1.13 0.59 -0.43 2.33 1.63 -0.89 -1.42 116.57 119.51 2g1u h LYS 132 Ca 0.31 -0.22 0.04 0.00 -0.85 0.00 0.00 60.65 59.92 2g1u h LYS 132 Cb -0.12 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 31.43 2g1u h LYS 132 CO -0.07 0.77 0.19 0.28 -3.45 0.00 0.00 179.45 177.18 2g1u h VAL 133 N 0.36 0.93 -0.73 2.00 2.07 -0.87 -2.31 116.25 117.70 2g1u h VAL 133 Ca 0.08 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.50 2g1u h VAL 133 Cb 0.56 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.78 2g1u h VAL 133 CO 0.03 0.07 0.45 0.11 0.02 0.00 0.00 177.57 178.26 2g1u h LYS 134 N 0.39 0.85 -0.83 1.57 1.57 -0.78 -1.68 116.57 117.67 2g1u h LYS 134 Ca 0.19 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.96 2g1u h LYS 134 Cb 0.13 -0.19 -0.05 0.00 0.08 0.00 0.00 32.23 32.20 2g1u h LYS 134 CO -0.16 0.56 0.54 0.93 -0.57 0.00 0.00 179.45 180.76 2g1u h GLU 135 N 0.88 0.96 0.00 3.15 5.08 -0.88 0.34 114.58 124.11 2g1u h GLU 135 Ca 0.30 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2g1u h GLU 135 Cb 0.04 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2g1u h GLU 135 CO -0.12 0.64 0.00 0.74 -1.00 0.00 0.00 179.01 179.27 2g1u h PHE 136 N 0.99 0.00 0.00 4.33 0.04 -0.78 -1.63 116.94 119.89 2g1u h PHE 136 Ca 0.34 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.84 2g1u h PHE 136 Cb 0.09 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.20 2g1u h PHE 136 CO -0.00 0.00 -1.82 -0.89 -0.60 0.00 0.00 178.31 175.00 2g1u n ILE 137 N -2.37 1.38 1.01 -0.55 5.41 -0.62 -4.73 119.36 118.89 2g1u n ILE 137 Ca 0.03 -0.15 0.11 0.00 1.00 0.00 0.00 62.75 63.73 2g1u n ILE 137 Cb 0.32 -1.98 -0.04 0.00 -0.71 0.00 0.00 39.64 37.22 2g1u n ILE 137 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 2g1u n ILE 138 N -4.18 0.00 0.00 1.39 -5.35 0.11 -5.10 119.36 106.23 2g1u n ILE 138 Ca -0.35 -0.13 0.00 0.00 -0.27 0.00 0.00 62.75 62.00 2g1u n ILE 138 Cb 0.70 1.09 0.00 0.00 -1.74 0.00 0.00 39.64 39.69 2g1u n ILE 138 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2g1u n GLY 139 N 1.46 0.14 3.43 3.28 0.00 -0.61 -5.01 105.19 107.88 2g1u n GLY 139 Ca 0.07 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.25 2g1u n GLY 139 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18