#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2guc s LEU 2 N 0.00 4.36 0.08 -3.43 2.96 -1.26 -4.99 118.68 116.40 2guc s LEU 2 Ca 0.00 2.45 -0.10 0.00 -0.22 0.00 0.00 54.13 56.26 2guc s LEU 2 Cb 0.00 -3.57 0.01 0.00 0.50 0.00 0.00 46.19 43.12 2guc s LEU 2 CO 0.00 -0.83 0.22 -0.89 -1.32 0.00 0.00 176.35 173.54 2guc s THR 3 N 2.09 0.12 -0.00 3.68 2.01 -1.26 -5.16 115.64 117.12 2guc s THR 3 Ca 0.71 -1.02 0.03 0.00 0.31 0.00 0.00 61.69 61.73 2guc s THR 3 Cb -0.39 -1.21 -0.01 0.00 0.01 0.00 0.00 72.50 70.90 2guc s THR 3 CO 0.31 -0.56 -0.11 -2.28 -0.69 0.00 0.00 174.62 171.29 2guc s HIS 4 N -3.51 1.00 -0.01 4.92 2.46 -1.26 -5.15 115.29 113.74 2guc s HIS 4 Ca 0.02 -0.21 -0.01 0.00 0.47 0.00 0.00 55.06 55.33 2guc s HIS 4 Cb 0.03 -0.64 0.00 0.00 -0.13 0.00 0.00 32.58 31.85 2guc s HIS 4 CO -0.09 -0.01 0.03 0.50 -2.47 0.00 0.00 174.74 172.69 2guc s ARG 5 N -0.36 0.03 -0.08 2.88 3.52 -1.26 -5.15 118.95 118.53 2guc s ARG 5 Ca 0.04 0.05 -0.03 0.00 -0.13 0.00 0.00 55.73 55.66 2guc s ARG 5 Cb -0.05 0.01 -0.03 0.00 -1.56 0.00 0.00 34.95 33.31 2guc s ARG 5 CO -0.00 -0.01 0.03 0.21 -0.81 0.00 0.00 175.30 174.72 2guc s LYS 6 N 0.06 3.06 0.08 5.12 2.20 -1.26 -5.12 119.74 123.88 2guc s LYS 6 Ca -0.00 -0.37 0.07 0.00 -0.36 0.00 0.00 55.97 55.31 2guc s LYS 6 Cb -0.01 -2.87 -0.03 0.00 -1.51 0.00 0.00 37.83 33.42 2guc s LYS 6 CO -0.00 0.71 -0.18 -0.06 -0.36 0.00 0.00 175.35 175.46 2guc s PHE 7 N -0.94 1.53 0.00 4.03 0.40 -1.26 -5.10 117.98 116.65 2guc s PHE 7 Ca 0.14 -0.43 0.00 0.00 -0.60 0.00 0.00 56.93 56.05 2guc s PHE 7 Cb -0.11 -0.86 0.00 0.00 0.51 0.00 0.00 43.02 42.56 2guc s PHE 7 CO 0.04 0.13 0.00 0.41 0.70 0.00 0.00 175.22 176.50 2guc n GLY 8 N 1.27 -1.80 0.00 4.36 0.00 -1.26 -5.07 105.19 102.69 2guc n GLY 8 Ca -0.20 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 43.99 2guc n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2guc n GLY 9 N 0.00 2.12 0.27 -0.02 0.00 -1.26 -5.05 105.19 101.26 2guc n GLY 9 Ca 0.00 -2.04 0.11 0.00 0.00 0.00 0.00 46.02 44.09 2guc n GLY 9 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2guc n SER 10 N 0.00 1.51 -2.60 1.61 3.41 -1.26 -5.01 113.62 111.28 2guc n SER 10 Ca 0.00 -1.22 -0.07 0.00 -0.26 0.00 0.00 58.87 57.32 2guc n SER 10 Cb 0.00 0.63 0.04 0.00 -0.26 0.00 0.00 64.21 64.62 2guc n SER 10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2guc n GLY 11 N 1.45 0.01 3.99 5.00 0.00 -1.26 -5.02 105.19 109.36 2guc n GLY 11 Ca 0.07 -1.87 0.04 0.00 0.00 0.00 0.00 46.02 44.26 2guc n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2guc n GLY 12 N 2.90 -1.87 3.72 -0.02 0.00 -1.26 -4.91 105.19 103.75 2guc n GLY 12 Ca 0.04 -1.32 -0.35 0.00 0.00 0.00 0.00 46.02 44.39 2guc n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2guc s SER 13 N -4.02 5.47 0.51 1.61 0.01 -1.26 -5.09 113.70 110.93 2guc s SER 13 Ca 0.00 0.21 -0.23 0.00 1.31 0.00 0.00 55.95 57.24 2guc s SER 13 Cb 0.00 -1.60 -0.06 0.00 0.21 0.00 0.00 66.02 64.57 2guc s SER 13 CO 0.00 0.38 1.35 -2.16 0.41 0.00 0.00 173.24 173.22 2guc s PRO 14 N -0.89 3.38 0.09 12.44 0.04 -1.26 -5.02 135.00 143.78 2guc s PRO 14 Ca 0.13 2.22 -0.02 0.00 0.04 0.00 0.00 61.00 63.37 2guc s PRO 14 Cb -0.11 -2.39 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 2guc s PRO 14 CO 0.03 -0.99 0.04 -0.59 0.04 0.00 0.00 177.00 175.52 2guc s PHE 15 N -1.30 0.62 0.02 0.56 -0.12 -1.26 -3.74 117.98 112.76 2guc s PHE 15 Ca 0.67 -1.08 0.07 0.00 -0.05 0.00 0.00 56.93 56.54 2guc s PHE 15 Cb -0.40 -0.38 -0.03 0.00 -0.63 0.00 0.00 43.02 41.58 2guc s PHE 15 CO 0.48 -0.46 -0.21 -1.54 -0.05 0.00 0.00 175.22 173.44 2guc s SER 16 N -2.97 3.57 0.38 1.98 1.04 -1.26 -4.97 113.70 111.47 2guc s SER 16 Ca 0.14 -0.45 0.06 0.00 0.48 0.00 0.00 55.95 56.18 2guc s SER 16 Cb 0.07 -0.52 0.77 0.00 0.10 0.00 0.00 66.02 66.44 2guc s SER 16 CO -0.05 0.27 1.99 1.23 0.98 0.00 0.00 173.24 177.66 2guc h GLY 17 N 4.81 0.84 -6.90 7.32 0.00 -2.01 -3.36 103.07 103.77 2guc h GLY 17 Ca -0.47 -0.28 -0.56 0.00 0.00 0.00 0.00 47.33 46.02 2guc h GLY 17 CO 0.47 0.23 0.90 -2.27 0.00 0.00 0.00 176.54 175.87 2guc s LEU 18 N -9.63 3.60 -0.18 3.11 2.96 -1.26 -4.87 118.68 112.41 2guc s LEU 18 Ca -0.09 0.17 0.03 0.00 -0.22 0.00 0.00 54.13 54.02 2guc s LEU 18 Cb 0.19 -3.25 -0.13 0.00 0.50 0.00 0.00 46.19 43.49 2guc s LEU 18 CO 0.76 -1.36 -0.13 -1.54 -1.32 0.00 0.00 176.35 172.76 2guc n SER 19 N 8.09 2.35 -3.89 3.68 3.41 -1.26 -4.81 113.62 121.20 2guc n SER 19 Ca 0.09 -0.08 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 2guc n SER 19 Cb 0.49 -0.09 -0.09 0.00 -0.26 0.00 0.00 64.21 64.25 2guc n SER 19 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2guc s SER 20 N -5.63 0.09 -0.01 4.04 1.04 -1.26 -0.61 113.70 111.36 2guc s SER 20 Ca -0.22 -0.39 -0.00 0.00 0.48 0.00 0.00 55.95 55.82 2guc s SER 20 Cb 0.06 0.24 0.02 0.00 0.10 0.00 0.00 66.02 66.44 2guc s SER 20 CO 0.46 -0.49 0.02 -0.63 0.98 0.00 0.00 173.24 173.58 2guc s ILE 21 N -2.28 -0.03 0.17 -1.02 1.01 -0.06 -1.12 121.20 117.88 2guc s ILE 21 Ca -0.07 0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.68 2guc s ILE 21 Cb -0.03 -0.05 -0.04 0.00 0.01 0.00 0.00 42.46 42.35 2guc s ILE 21 CO -0.03 0.04 0.09 0.00 0.00 0.00 0.00 174.94 175.05 2guc s ALA 22 N 0.54 1.09 0.07 9.38 0.00 -0.38 -0.61 121.76 131.85 2guc s ALA 22 Ca -0.04 -1.61 0.02 0.00 0.00 0.00 0.00 51.96 50.32 2guc s ALA 22 Cb -0.06 1.11 -0.03 0.00 0.00 0.00 0.00 23.12 24.13 2guc s ALA 22 CO -0.02 -0.52 -0.07 0.14 0.00 0.00 0.00 175.76 175.29 2guc s VAL 23 N -4.06 0.62 -0.17 0.00 -7.23 -1.26 -0.39 120.40 107.92 2guc s VAL 23 Ca 0.32 -1.58 -0.08 0.00 -1.81 0.00 0.00 61.98 58.83 2guc s VAL 23 Cb 0.07 -1.24 -0.04 0.00 0.56 0.00 0.00 36.38 35.73 2guc s VAL 23 CO 0.08 -0.68 0.09 -0.13 -0.31 0.00 0.00 175.10 174.15 2guc s ARG 24 N -2.92 3.84 0.01 4.82 0.52 -0.52 0.12 118.95 124.82 2guc s ARG 24 Ca 0.03 -0.27 -0.07 0.00 -0.52 0.00 0.00 55.73 54.91 2guc s ARG 24 Cb -0.01 -3.24 -0.00 0.00 0.52 0.00 0.00 34.95 32.22 2guc s ARG 24 CO -0.03 0.43 0.12 -1.54 0.02 0.00 0.00 175.30 174.30 2guc s SER 25 N -0.04 0.07 0.00 0.23 1.04 -0.32 -0.31 113.70 114.38 2guc s SER 25 Ca 0.08 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2guc s SER 25 Cb -0.12 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.21 2guc s SER 25 CO 0.00 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 174.44 2guc n GLY 26 N 1.31 2.48 0.25 7.32 0.00 -1.26 -0.41 105.19 114.87 2guc n GLY 26 Ca -0.22 -0.24 -0.08 0.00 0.00 0.00 0.00 46.02 45.47 2guc n GLY 26 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2guc h SER 27 N 0.00 0.72 -5.01 1.61 0.02 -1.92 -3.19 113.55 105.79 2guc h SER 27 Ca 0.00 -0.30 -0.65 0.00 -0.84 0.00 0.00 61.79 60.00 2guc h SER 27 Cb 0.00 -0.20 -0.12 0.00 0.14 0.00 0.00 62.40 62.22 2guc h SER 27 CO 0.00 1.00 -0.48 -1.22 -1.14 0.00 0.00 176.83 174.99 2guc n TYR 28 N -4.06 1.02 -2.67 3.45 4.01 -1.26 -1.05 117.16 116.60 2guc n TYR 28 Ca -0.01 -2.52 -0.43 0.00 -0.16 0.00 0.00 57.90 54.78 2guc n TYR 28 Cb 0.49 -0.28 -0.03 0.00 -0.31 0.00 0.00 39.34 39.21 2guc n TYR 28 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2guc s LEU 29 N 0.00 3.70 0.32 7.72 1.43 0.04 -4.38 118.68 127.52 2guc s LEU 29 Ca 0.03 0.11 0.10 0.00 -1.03 0.00 0.00 54.13 53.34 2guc s LEU 29 Cb 0.00 -3.20 0.54 0.00 0.03 0.00 0.00 46.19 43.56 2guc s LEU 29 CO 0.02 -1.31 1.73 0.44 0.23 0.00 0.00 176.35 177.46 2guc h ASP 30 N 9.35 0.10 -4.89 2.29 5.19 -0.97 0.81 116.42 128.30 2guc h ASP 30 Ca -0.25 -0.04 -0.02 0.00 -0.62 0.00 0.00 57.03 56.10 2guc h ASP 30 Cb 1.06 -0.03 -0.17 0.00 0.18 0.00 0.00 39.33 40.38 2guc h ASP 30 CO 1.13 0.53 0.25 0.00 -3.12 0.00 0.00 179.24 178.03 2guc s ALA 31 N -4.05 -1.73 0.02 3.45 0.00 -0.88 -0.99 121.76 117.58 2guc s ALA 31 Ca -0.03 1.04 0.08 0.00 0.00 0.00 0.00 51.96 53.05 2guc s ALA 31 Cb 0.14 0.27 -0.03 0.00 0.00 0.00 0.00 23.12 23.50 2guc s ALA 31 CO 0.75 -0.52 -0.23 -1.50 0.00 0.00 0.00 175.76 174.25 2guc s ILE 32 N -2.20 2.34 -0.25 0.00 2.07 -0.23 -1.44 121.20 121.48 2guc s ILE 32 Ca -0.05 -1.20 0.02 0.00 -1.41 0.00 0.00 60.65 58.02 2guc s ILE 32 Cb -0.00 -1.90 0.06 0.00 0.13 0.00 0.00 42.46 40.75 2guc s ILE 32 CO -0.00 0.45 -0.10 -0.63 -1.91 0.00 0.00 174.94 172.75 2guc s ILE 33 N -0.76 2.03 -0.27 2.00 1.09 0.48 -0.87 121.20 124.90 2guc s ILE 33 Ca 0.12 -1.52 -0.05 0.00 -1.10 0.00 0.00 60.65 58.09 2guc s ILE 33 Cb -0.10 -2.16 0.01 0.00 -1.06 0.00 0.00 42.46 39.15 2guc s ILE 33 CO 0.02 -0.02 0.02 -0.63 -0.10 0.00 0.00 174.94 174.22 2guc s ILE 34 N 1.17 3.57 -1.58 2.92 -1.09 -0.39 -1.25 121.20 124.55 2guc s ILE 34 Ca -0.08 -0.74 -0.13 0.00 -2.23 0.00 0.00 60.65 57.47 2guc s ILE 34 Cb -0.19 -2.80 0.10 0.00 -1.58 0.00 0.00 42.46 37.99 2guc s ILE 34 CO -0.06 0.17 0.80 0.47 -1.23 0.00 0.00 174.94 175.09 2guc n ASP 35 N 4.80 -3.25 0.00 3.58 8.00 -0.27 -1.30 116.55 128.11 2guc n ASP 35 Ca -0.16 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.43 2guc n ASP 35 Cb 0.48 -3.27 0.00 0.00 -0.02 0.00 0.00 41.12 38.31 2guc n ASP 35 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2guc n GLY 36 N -1.60 2.32 3.64 0.44 0.00 -1.26 -5.00 105.19 103.72 2guc n GLY 36 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 2guc n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2guc s VAL 37 N -2.99 5.11 0.06 1.61 1.01 -0.42 -5.04 120.40 119.74 2guc s VAL 37 Ca 0.00 0.87 -0.30 0.00 0.00 0.00 0.00 61.98 62.56 2guc s VAL 37 Cb 0.00 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 2guc s VAL 37 CO 0.00 0.15 0.95 -2.28 0.00 0.00 0.00 175.10 173.92 2guc s HIS 38 N 1.89 3.75 -0.24 5.22 2.46 -1.26 -1.26 115.29 125.83 2guc s HIS 38 Ca 0.22 1.73 -0.02 0.00 0.47 0.00 0.00 55.06 57.46 2guc s HIS 38 Cb -0.15 -3.06 0.07 0.00 -0.13 0.00 0.00 32.58 29.31 2guc s HIS 38 CO 0.09 0.13 0.05 -1.01 -2.47 0.00 0.00 174.74 171.53 2guc s HIS 39 N 0.39 1.35 -1.65 3.88 3.76 -0.05 -5.00 115.29 117.97 2guc s HIS 39 Ca 0.48 -1.23 0.00 0.00 -0.15 0.00 0.00 55.06 54.16 2guc s HIS 39 Cb -0.22 -1.30 0.00 0.00 1.11 0.00 0.00 32.58 32.17 2guc s HIS 39 CO 0.28 -0.72 0.00 0.41 -0.85 0.00 0.00 174.74 173.86 2guc n GLY 40 N 4.96 0.67 0.95 -2.22 0.00 -1.26 -1.07 105.19 107.22 2guc n GLY 40 Ca -0.07 -2.13 -0.05 0.00 0.00 0.00 0.00 46.02 43.77 2guc n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2guc n GLY 41 N 0.00 1.25 0.89 -0.02 0.00 -0.16 -4.82 105.19 102.33 2guc n GLY 41 Ca 0.00 -2.05 0.09 0.00 0.00 0.00 0.00 46.02 44.06 2guc n GLY 41 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2guc n SER 42 N -2.92 3.06 -2.67 1.61 3.41 -1.26 -4.60 113.62 110.26 2guc n SER 42 Ca 0.04 -1.89 -0.10 0.00 -0.26 0.00 0.00 58.87 56.66 2guc n SER 42 Cb 0.15 -0.22 0.07 0.00 -0.26 0.00 0.00 64.21 63.95 2guc n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2guc n GLY 43 N 1.07 -1.04 7.00 5.00 0.00 -1.26 -4.90 105.19 111.06 2guc n GLY 43 Ca 0.15 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2guc n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2guc n GLY 44 N 2.09 0.89 3.16 -0.02 0.00 -1.26 -4.53 105.19 105.52 2guc n GLY 44 Ca 0.06 -0.83 -0.22 0.00 0.00 0.00 0.00 46.02 45.02 2guc n GLY 44 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2guc s ASN 45 N -4.00 1.86 -0.09 1.61 -0.87 0.45 -4.79 114.94 109.11 2guc s ASN 45 Ca 0.00 -0.43 -0.30 0.00 -1.57 0.00 0.00 52.86 50.56 2guc s ASN 45 Cb 0.00 -0.15 -0.02 0.00 -0.02 0.00 0.00 41.25 41.07 2guc s ASN 45 CO 0.00 0.09 1.07 -0.22 -2.57 0.00 0.00 177.10 175.47 2guc s LEU 46 N -0.98 4.25 0.78 0.60 2.96 -1.26 -1.17 118.68 123.86 2guc s LEU 46 Ca 0.04 1.62 -0.11 0.00 -0.22 0.00 0.00 54.13 55.45 2guc s LEU 46 Cb -0.08 -3.56 0.06 0.00 0.50 0.00 0.00 46.19 43.11 2guc s LEU 46 CO 0.01 -0.49 1.09 -0.94 -1.32 0.00 0.00 176.35 174.70 2guc s SER 47 N 1.21 4.70 0.93 3.68 1.04 0.12 -4.99 113.70 120.39 2guc s SER 47 Ca 0.51 1.30 -0.11 0.00 0.48 0.00 0.00 55.95 58.13 2guc s SER 47 Cb -0.20 -2.06 0.15 0.00 0.10 0.00 0.00 66.02 64.02 2guc s SER 47 CO 0.19 -1.84 1.10 -2.16 0.98 0.00 0.00 173.24 171.52 2guc s PRO 48 N -5.18 0.91 -0.11 4.02 0.04 -1.26 -4.62 135.00 128.80 2guc s PRO 48 Ca 0.60 1.22 -0.18 0.00 0.04 0.00 0.00 61.00 62.69 2guc s PRO 48 Cb -0.14 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 2guc s PRO 48 CO 0.54 -2.60 0.46 0.99 0.04 0.00 0.00 177.00 176.43 2guc s THR 49 N -2.71 5.18 -0.23 1.26 2.01 -1.26 -4.58 115.64 115.31 2guc s THR 49 Ca 0.65 0.93 -0.12 0.00 0.31 0.00 0.00 61.69 63.47 2guc s THR 49 Cb -0.21 -3.80 -0.05 0.00 0.01 0.00 0.00 72.50 68.45 2guc s THR 49 CO 0.59 0.35 0.21 0.12 -0.69 0.00 0.00 174.62 175.20 2guc s PHE 50 N 0.46 3.33 -0.14 4.92 2.19 0.22 -4.95 117.98 124.01 2guc s PHE 50 Ca 0.25 0.31 0.02 0.00 0.33 0.00 0.00 56.93 57.84 2guc s PHE 50 Cb -0.15 -2.32 0.01 0.00 -1.31 0.00 0.00 43.02 39.24 2guc s PHE 50 CO 0.10 0.06 -0.20 0.99 1.83 0.00 0.00 175.22 177.99 2guc s THR 51 N 1.09 2.23 0.31 0.12 2.01 -1.26 -0.88 115.64 119.27 2guc s THR 51 Ca 0.10 -0.93 -0.28 0.00 0.31 0.00 0.00 61.69 60.89 2guc s THR 51 Cb -0.14 -1.90 -0.09 0.00 0.01 0.00 0.00 72.50 70.38 2guc s THR 51 CO 0.05 0.54 1.07 -0.36 -0.69 0.00 0.00 174.62 175.23 2guc s PHE 52 N 0.74 3.53 0.64 4.92 0.08 0.22 -5.02 117.98 123.09 2guc s PHE 52 Ca -0.08 1.71 -0.03 0.00 0.12 0.00 0.00 56.93 58.64 2guc s PHE 52 Cb -0.16 -3.21 0.05 0.00 -0.57 0.00 0.00 43.02 39.14 2guc s PHE 52 CO 0.00 -0.47 0.91 0.20 -0.10 0.00 0.00 175.22 175.77 2guc s GLY 53 N -1.11 1.75 0.14 4.36 0.00 -1.26 -4.98 107.32 106.23 2guc s GLY 53 Ca 0.48 -1.13 -0.33 0.00 0.00 0.00 0.00 44.72 43.74 2guc s GLY 53 CO 0.36 -0.77 1.71 -1.26 0.00 0.00 0.00 173.10 173.14 2guc n SER 54 N -2.68 3.62 0.00 1.64 2.88 -1.26 -1.86 113.62 115.96 2guc n SER 54 Ca 0.08 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.67 2guc n SER 54 Cb 0.60 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.57 2guc n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2guc n GLY 55 N 3.86 0.83 3.84 0.46 0.00 -1.24 -4.98 105.19 107.95 2guc n GLY 55 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 2guc n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2guc s GLU 56 N -0.15 3.74 0.12 1.61 2.12 -0.78 -4.97 118.70 120.39 2guc s GLU 56 Ca 0.00 0.08 -0.13 0.00 0.36 0.00 0.00 54.97 55.29 2guc s GLU 56 Cb 0.00 -3.24 0.02 0.00 0.26 0.00 0.00 34.13 31.17 2guc s GLU 56 CO 0.00 0.66 0.32 1.52 -0.54 0.00 0.00 175.26 177.22 2guc s TYR 57 N -0.79 -0.03 -0.04 5.30 -0.85 -1.26 -4.71 117.35 114.97 2guc s TYR 57 Ca 0.18 -0.34 -0.30 0.00 -0.52 0.00 0.00 57.07 56.09 2guc s TYR 57 Cb -0.14 0.12 -0.05 0.00 0.38 0.00 0.00 41.96 42.28 2guc s TYR 57 CO 0.07 -0.65 1.48 0.42 -1.52 0.00 0.00 175.55 175.34 2guc s ILE 58 N -3.84 3.72 -0.11 -3.49 1.01 -1.26 -1.38 121.20 115.84 2guc s ILE 58 Ca 0.05 1.00 0.15 0.00 0.00 0.00 0.00 60.65 61.85 2guc s ILE 58 Cb 0.03 -3.65 -0.22 0.00 0.01 0.00 0.00 42.46 38.63 2guc s ILE 58 CO -0.10 -0.04 0.37 -1.54 0.00 0.00 0.00 174.94 173.62 2guc n SER 59 N 6.16 1.43 -3.71 3.58 3.41 0.13 -1.53 113.62 123.09 2guc n SER 59 Ca 0.15 -0.12 -0.12 0.00 -0.26 0.00 0.00 58.87 58.52 2guc n SER 59 Cb 0.43 1.59 -0.10 0.00 -0.26 0.00 0.00 64.21 65.88 2guc n SER 59 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2guc s ASN 60 N -3.55 -0.51 -0.07 4.04 3.84 -1.11 -1.46 114.94 116.12 2guc s ASN 60 Ca -0.04 0.93 -0.04 0.00 0.21 0.00 0.00 52.86 53.92 2guc s ASN 60 Cb 0.10 0.88 0.03 0.00 -0.55 0.00 0.00 41.25 41.71 2guc s ASN 60 CO 0.62 -0.18 0.16 -0.32 -2.79 0.00 0.00 177.10 174.60 2guc s MET 61 N 0.77 0.15 -0.14 0.43 -2.45 -0.11 -0.89 119.30 117.07 2guc s MET 61 Ca -0.04 0.31 0.02 0.00 -1.25 0.00 0.00 55.69 54.72 2guc s MET 61 Cb -0.05 -0.03 0.00 0.00 1.25 0.00 0.00 34.83 36.00 2guc s MET 61 CO -0.06 -0.09 -0.19 0.99 1.05 0.00 0.00 175.02 176.72 2guc s THR 62 N 0.61 2.35 -0.12 10.11 2.01 0.01 -0.58 115.64 130.03 2guc s THR 62 Ca -0.04 -0.89 0.02 0.00 0.31 0.00 0.00 61.69 61.09 2guc s THR 62 Cb -0.06 -1.96 0.01 0.00 0.01 0.00 0.00 72.50 70.51 2guc s THR 62 CO -0.03 0.54 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.61 2guc s ILE 63 N 0.70 1.80 -0.13 1.82 1.01 -0.07 -1.49 121.20 124.84 2guc s ILE 63 Ca -0.09 -0.83 -0.11 0.00 0.00 0.00 0.00 60.65 59.62 2guc s ILE 63 Cb -0.16 -1.60 -0.05 0.00 0.01 0.00 0.00 42.46 40.66 2guc s ILE 63 CO 0.01 0.50 0.23 -0.13 0.00 0.00 0.00 174.94 175.55 2guc s ARG 64 N 0.79 3.92 0.13 2.79 0.52 -0.63 -0.71 118.95 125.75 2guc s ARG 64 Ca -0.09 0.01 -0.13 0.00 -0.52 0.00 0.00 55.73 55.00 2guc s ARG 64 Cb -0.16 -3.31 0.01 0.00 0.52 0.00 0.00 34.95 32.01 2guc s ARG 64 CO 0.00 0.50 0.33 -1.54 0.02 0.00 0.00 175.30 174.62 2guc s SER 65 N -0.30 -0.07 0.00 0.23 1.04 -0.37 0.39 113.70 114.61 2guc s SER 65 Ca 0.15 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.04 2guc s SER 65 Cb -0.13 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.43 2guc s SER 65 CO 0.04 -0.84 0.00 0.61 0.98 0.00 0.00 173.24 174.03 2guc n GLY 66 N -0.18 3.25 0.23 7.32 0.00 -1.26 -0.82 105.19 113.73 2guc n GLY 66 Ca -0.13 -0.13 0.05 0.00 0.00 0.00 0.00 46.02 45.80 2guc n GLY 66 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2guc h ASP 67 N 0.00 0.07 -4.37 1.61 3.32 -2.00 -3.46 116.42 111.59 2guc h ASP 67 Ca 0.00 -0.01 -0.45 0.00 0.02 0.00 0.00 57.03 56.59 2guc h ASP 67 Cb 0.00 -0.02 -0.09 0.00 0.22 0.00 0.00 39.33 39.44 2guc h ASP 67 CO 0.00 0.22 -0.35 -1.22 -1.72 0.00 0.00 179.24 176.17 2guc n TYR 68 N -4.34 0.41 -2.90 4.55 4.01 -1.26 -4.82 117.16 112.81 2guc n TYR 68 Ca -0.02 -1.93 -0.42 0.00 -0.16 0.00 0.00 57.90 55.38 2guc n TYR 68 Cb 0.23 -0.10 -0.04 0.00 -0.31 0.00 0.00 39.34 39.12 2guc n TYR 68 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2guc s ILE 69 N -2.57 4.85 0.01 -0.72 -1.09 0.27 -4.39 121.20 117.56 2guc s ILE 69 Ca 0.09 1.56 0.01 0.00 -2.23 0.00 0.00 60.65 60.08 2guc s ILE 69 Cb 0.00 -4.11 -0.26 0.00 -1.58 0.00 0.00 42.46 36.51 2guc s ILE 69 CO 0.07 -0.06 0.87 0.44 -1.23 0.00 0.00 174.94 175.02 2guc h ASP 70 N 7.65 0.27 -4.70 3.58 5.19 -0.39 0.16 116.42 128.19 2guc h ASP 70 Ca -0.24 -0.39 -0.06 0.00 -0.62 0.00 0.00 57.03 55.72 2guc h ASP 70 Cb 1.10 -0.09 -0.20 0.00 0.18 0.00 0.00 39.33 40.32 2guc h ASP 70 CO 0.87 1.33 0.16 0.21 -3.12 0.00 0.00 179.24 178.68 2guc s ASN 71 N -6.80 -0.67 0.02 6.45 3.84 -0.97 -1.19 114.94 115.62 2guc s ASN 71 Ca -0.07 0.92 0.02 0.00 0.21 0.00 0.00 52.86 53.93 2guc s ASN 71 Cb 0.07 0.80 -0.02 0.00 -0.55 0.00 0.00 41.25 41.56 2guc s ASN 71 CO 0.84 -0.50 -0.07 -0.51 -2.79 0.00 0.00 177.10 174.07 2guc s ILE 72 N -0.73 0.53 0.02 -5.21 2.07 -0.41 -1.61 121.20 115.86 2guc s ILE 72 Ca -0.08 -0.76 -0.09 0.00 -1.41 0.00 0.00 60.65 58.31 2guc s ILE 72 Cb -0.02 -0.54 0.01 0.00 0.13 0.00 0.00 42.46 42.04 2guc s ILE 72 CO 0.07 -0.17 0.19 -0.94 -1.91 0.00 0.00 174.94 172.18 2guc s SER 73 N -1.01 0.01 0.21 4.50 1.04 -0.56 -1.53 113.70 116.36 2guc s SER 73 Ca -0.05 -0.26 -0.11 0.00 0.48 0.00 0.00 55.95 56.01 2guc s SER 73 Cb -0.07 0.26 -0.01 0.00 0.10 0.00 0.00 66.02 66.31 2guc s SER 73 CO 0.00 -0.48 0.39 0.72 0.98 0.00 0.00 173.24 174.85 2guc s PHE 74 N -2.02 0.39 0.06 5.02 -0.12 -0.20 -0.81 117.98 120.31 2guc s PHE 74 Ca -0.09 -0.74 0.05 0.00 -0.05 0.00 0.00 56.93 56.10 2guc s PHE 74 Cb -0.04 0.07 -0.03 0.00 -0.63 0.00 0.00 43.02 42.40 2guc s PHE 74 CO -0.01 -0.87 -0.15 -1.21 -0.05 0.00 0.00 175.22 172.93 2guc s GLU 75 N -4.00 0.91 0.40 1.99 2.02 -0.07 -1.35 118.70 118.61 2guc s GLU 75 Ca 0.21 -0.91 0.08 0.00 0.02 0.00 0.00 54.97 54.37 2guc s GLU 75 Cb 0.01 -0.95 -0.02 0.00 0.10 0.00 0.00 34.13 33.27 2guc s GLU 75 CO 0.05 0.22 0.34 0.95 0.02 0.00 0.00 175.26 176.85 2guc s THR 76 N -1.10 2.77 -0.68 3.63 -4.23 -0.09 -0.70 115.64 115.23 2guc s THR 76 Ca 0.00 -1.39 0.17 0.00 -1.18 0.00 0.00 61.69 59.30 2guc s THR 76 Cb -0.09 -3.02 0.16 0.00 1.34 0.00 0.00 72.50 70.89 2guc s THR 76 CO 0.02 -0.03 1.52 -0.46 -0.54 0.00 0.00 174.62 175.13 2guc n ASN 77 N -1.49 0.34 -1.34 3.99 6.94 -0.48 -1.22 115.26 122.00 2guc n ASN 77 Ca 0.02 0.60 0.12 0.00 -0.02 0.00 0.00 54.58 55.30 2guc n ASN 77 Cb 0.62 -0.67 0.31 0.00 -2.36 0.00 0.00 39.78 37.68 2guc n ASN 77 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 2guc n MET 78 N -1.89 2.69 -0.99 -3.83 2.81 -1.26 -4.95 117.12 109.70 2guc n MET 78 Ca 0.02 -2.62 0.00 0.00 -1.81 0.00 0.00 57.70 53.29 2guc n MET 78 Cb 0.14 -1.57 0.00 0.00 -0.71 0.00 0.00 33.22 31.09 2guc n MET 78 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2guc n GLY 79 N 1.65 0.41 3.91 3.03 0.00 -0.36 -5.04 105.19 108.80 2guc n GLY 79 Ca 0.24 -0.88 -0.27 0.00 0.00 0.00 0.00 46.02 45.11 2guc n GLY 79 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2guc s ARG 80 N -1.61 3.56 0.13 1.61 0.52 -1.26 -4.86 118.95 117.04 2guc s ARG 80 Ca 0.00 0.07 0.05 0.00 -0.52 0.00 0.00 55.73 55.33 2guc s ARG 80 Cb 0.00 -2.47 -0.04 0.00 0.52 0.00 0.00 34.95 32.96 2guc s ARG 80 CO 0.00 -0.06 -0.11 1.03 0.02 0.00 0.00 175.30 176.18 2guc s ARG 81 N -4.43 0.99 -0.03 3.54 0.52 -1.26 -0.92 118.95 117.35 2guc s ARG 81 Ca 0.46 -1.31 0.02 0.00 -0.52 0.00 0.00 55.73 54.38 2guc s ARG 81 Cb -0.10 -0.68 0.01 0.00 0.52 0.00 0.00 34.95 34.70 2guc s ARG 81 CO 0.40 0.10 -0.08 0.12 0.02 0.00 0.00 175.30 175.87 2guc s PHE 82 N -2.73 0.89 0.00 -0.53 5.36 -0.45 -4.99 117.98 115.53 2guc s PHE 82 Ca 0.11 -0.24 0.00 0.00 -0.96 0.00 0.00 56.93 55.85 2guc s PHE 82 Cb -0.01 -0.67 0.00 0.00 -0.34 0.00 0.00 43.02 42.00 2guc s PHE 82 CO 0.01 -0.13 0.00 0.41 -1.46 0.00 0.00 175.22 174.05 2guc n GLY 83 N 3.52 -1.92 3.77 13.12 0.00 -1.26 -1.03 105.19 121.38 2guc n GLY 83 Ca -0.20 -1.39 -0.36 0.00 0.00 0.00 0.00 46.02 44.07 2guc n GLY 83 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2guc s PRO 84 N 0.00 3.37 -0.03 1.61 0.02 -1.26 -4.87 135.00 133.84 2guc s PRO 84 Ca 0.00 1.69 0.03 0.00 0.02 0.00 0.00 61.00 62.74 2guc s PRO 84 Cb 0.00 -2.07 0.00 0.00 0.02 0.00 0.00 34.50 32.45 2guc s PRO 84 CO 0.00 -0.86 -0.11 0.71 -0.33 0.00 0.00 177.00 176.42 2guc s TYR 85 N -1.69 1.11 -0.88 6.54 2.02 -0.58 -5.00 117.35 118.86 2guc s TYR 85 Ca 0.72 -0.29 0.00 0.00 -0.37 0.00 0.00 57.07 57.12 2guc s TYR 85 Cb -0.26 -0.78 0.00 0.00 -0.40 0.00 0.00 41.96 40.52 2guc s TYR 85 CO 0.30 -0.12 0.00 0.41 -1.57 0.00 0.00 175.55 174.57 2guc n GLY 86 N 3.29 0.61 0.02 0.71 0.00 -1.26 -1.28 105.19 107.28 2guc n GLY 86 Ca -0.18 -2.21 -0.00 0.00 0.00 0.00 0.00 46.02 43.63 2guc n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2guc n GLY 87 N 0.00 2.99 1.04 -0.02 0.00 -0.21 -4.83 105.19 104.17 2guc n GLY 87 Ca 0.00 -2.17 0.10 0.00 0.00 0.00 0.00 46.02 43.95 2guc n GLY 87 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2guc n SER 88 N -2.06 3.39 -3.17 1.61 3.41 -1.26 -4.44 113.62 111.10 2guc n SER 88 Ca -0.00 -1.96 -0.18 0.00 -0.26 0.00 0.00 58.87 56.47 2guc n SER 88 Cb 0.00 -0.31 0.14 0.00 -0.26 0.00 0.00 64.21 63.78 2guc n SER 88 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2guc n GLY 89 N 1.25 -1.84 7.00 5.00 0.00 -1.26 -4.91 105.19 110.42 2guc n GLY 89 Ca 0.18 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.59 2guc n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2guc n GLY 90 N -0.97 0.51 3.21 -0.02 0.00 -1.26 -4.50 105.19 102.15 2guc n GLY 90 Ca 0.10 -0.91 -0.20 0.00 0.00 0.00 0.00 46.02 45.01 2guc n GLY 90 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2guc s SER 91 N -4.00 1.96 0.08 1.61 0.01 0.00 -4.83 113.70 108.53 2guc s SER 91 Ca 0.00 -0.64 -0.20 0.00 1.31 0.00 0.00 55.95 56.42 2guc s SER 91 Cb 0.00 -0.08 -0.07 0.00 0.21 0.00 0.00 66.02 66.08 2guc s SER 91 CO 0.00 -0.03 0.58 0.00 0.41 0.00 0.00 173.24 174.20 2guc s ALA 92 N -1.26 3.58 -0.01 1.44 0.00 -1.26 -1.24 121.76 123.01 2guc s ALA 92 Ca 0.01 0.05 0.04 0.00 0.00 0.00 0.00 51.96 52.07 2guc s ALA 92 Cb -0.10 -2.66 -0.01 0.00 0.00 0.00 0.00 23.12 20.35 2guc s ALA 92 CO 0.03 0.39 -0.15 -0.80 0.00 0.00 0.00 175.76 175.23 2guc s ASN 93 N -1.08 1.75 -0.13 0.00 -0.87 0.11 -4.98 114.94 109.75 2guc s ASN 93 Ca 0.29 -0.27 0.02 0.00 -1.57 0.00 0.00 52.86 51.34 2guc s ASN 93 Cb -0.20 -0.23 0.00 0.00 -0.02 0.00 0.00 41.25 40.81 2guc s ASN 93 CO 0.19 0.18 -0.21 -0.89 -2.57 0.00 0.00 177.10 173.80 2guc s THR 94 N -0.30 2.26 -0.15 1.60 2.01 -1.26 -0.89 115.64 118.91 2guc s THR 94 Ca 0.05 -0.93 -0.20 0.00 0.31 0.00 0.00 61.69 60.91 2guc s THR 94 Cb -0.06 -1.90 -0.03 0.00 0.01 0.00 0.00 72.50 70.52 2guc s THR 94 CO -0.00 0.55 0.59 -0.76 -0.69 0.00 0.00 174.62 174.31 2guc s LEU 95 N 0.59 4.22 -0.01 4.42 1.43 0.25 -4.95 118.68 124.62 2guc s LEU 95 Ca -0.12 0.89 0.07 0.00 -1.03 0.00 0.00 54.13 53.94 2guc s LEU 95 Cb -0.16 -2.86 -0.02 0.00 0.03 0.00 0.00 46.19 43.17 2guc s LEU 95 CO 0.03 -0.16 -0.21 -0.44 0.23 0.00 0.00 176.35 175.80 2guc s SER 96 N 0.96 2.47 -1.12 2.29 0.01 -1.26 -0.93 113.70 116.11 2guc s SER 96 Ca 0.29 -0.39 -0.11 0.00 1.31 0.00 0.00 55.95 57.06 2guc s SER 96 Cb -0.16 -0.27 -0.03 0.00 0.21 0.00 0.00 66.02 65.76 2guc s SER 96 CO 0.12 0.26 0.85 -3.20 0.41 0.00 0.00 173.24 171.67 2guc n ASN 97 N 2.54 -5.24 -4.43 2.44 5.15 -0.80 -4.76 115.26 110.15 2guc n ASN 97 Ca -0.15 -0.84 -0.29 0.00 -0.60 0.00 0.00 54.58 52.70 2guc n ASN 97 Cb 0.53 -4.37 -0.08 0.00 -0.53 0.00 0.00 39.78 35.33 2guc n ASN 97 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2guc s VAL 98 N -3.45 0.90 -0.24 3.44 -7.23 -0.53 -1.30 120.40 111.99 2guc s VAL 98 Ca 0.39 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.54 2guc s VAL 98 Cb -0.09 -2.29 0.08 0.00 0.56 0.00 0.00 36.38 34.63 2guc s VAL 98 CO 0.79 0.00 0.06 -0.75 -0.31 0.00 0.00 175.10 174.90 2guc s LYS 99 N -3.79 0.65 0.11 4.82 2.20 -0.11 -4.13 119.74 119.50 2guc s LYS 99 Ca 0.16 -0.67 -0.31 0.00 -0.36 0.00 0.00 55.97 54.79 2guc s LYS 99 Cb 0.02 -1.99 -0.08 0.00 -1.51 0.00 0.00 37.83 34.28 2guc s LYS 99 CO 0.09 -0.79 1.38 0.08 -0.36 0.00 0.00 175.35 175.75 2guc s VAL 100 N 1.79 3.33 -0.26 4.02 1.01 -0.58 -1.32 120.40 128.39 2guc s VAL 100 Ca 0.03 0.96 -0.09 0.00 0.00 0.00 0.00 61.98 62.88 2guc s VAL 100 Cb -0.17 -3.61 -0.13 0.00 0.00 0.00 0.00 36.38 32.47 2guc s VAL 100 CO -0.17 0.08 -0.31 -0.38 0.00 0.00 0.00 175.10 174.32 2guc n ILE 101 N 3.92 1.46 -3.81 2.22 2.08 0.12 -4.63 119.36 120.72 2guc n ILE 101 Ca 0.11 -0.42 -0.12 0.00 0.56 0.00 0.00 62.75 62.88 2guc n ILE 101 Cb 0.42 -1.73 -0.09 0.00 -0.75 0.00 0.00 39.64 37.49 2guc n ILE 101 CO 0.00 0.00 0.00 -1.58 0.56 0.00 0.00 176.55 175.53 2guc s GLN 102 N -2.49 0.64 -0.27 0.38 2.00 -0.76 -4.53 119.66 114.62 2guc s GLN 102 Ca -0.36 -0.37 0.02 0.00 -2.00 0.00 0.00 55.36 52.64 2guc s GLN 102 Cb 0.13 0.27 0.07 0.00 0.80 0.00 0.00 33.01 34.28 2guc s GLN 102 CO 0.50 -0.18 -0.03 0.42 -0.50 0.00 0.00 175.29 175.50 2guc s ILE 103 N -1.72 1.75 0.50 -2.34 1.01 -1.26 -0.98 121.20 118.16 2guc s ILE 103 Ca -0.11 -1.55 0.05 0.00 0.00 0.00 0.00 60.65 59.04 2guc s ILE 103 Cb -0.05 -2.06 0.05 0.00 0.01 0.00 0.00 42.46 40.41 2guc s ILE 103 CO 0.01 -0.24 0.40 0.59 0.00 0.00 0.00 174.94 175.70 2guc n ASN 104 N 4.55 2.53 0.00 3.58 3.02 -0.28 -4.97 115.26 123.70 2guc n ASN 104 Ca -0.08 -2.68 0.00 0.00 -0.03 0.00 0.00 54.58 51.79 2guc n ASN 104 Cb 0.43 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.54 2guc n ASN 104 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2guc n GLY 105 N -1.00 -0.53 2.90 7.41 0.00 -1.26 -0.36 105.19 112.33 2guc n GLY 105 Ca -0.01 -0.80 -0.11 0.00 0.00 0.00 0.00 46.02 45.11 2guc n GLY 105 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2guc s SER 106 N -4.00 0.05 0.01 1.61 0.01 -0.53 -4.89 113.70 105.96 2guc s SER 106 Ca 0.00 -0.11 -0.10 0.00 1.31 0.00 0.00 55.95 57.05 2guc s SER 106 Cb 0.00 0.02 0.01 0.00 0.21 0.00 0.00 66.02 66.26 2guc s SER 106 CO 0.00 -0.07 0.20 0.00 0.41 0.00 0.00 173.24 173.78 2guc s ALA 107 N -0.32 -0.45 0.00 1.44 0.00 -1.26 -1.58 121.76 119.58 2guc s ALA 107 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 51.96 51.87 2guc s ALA 107 Cb -0.02 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.25 2guc s ALA 107 CO -0.00 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 175.90 2guc n GLY 108 N 1.19 3.17 0.16 0.00 0.00 -1.26 -4.83 105.19 103.62 2guc n GLY 108 Ca -0.21 -0.38 0.02 0.00 0.00 0.00 0.00 46.02 45.45 2guc n GLY 108 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2guc h ASP 109 N 0.00 0.00 -2.02 1.61 3.32 -1.90 -3.12 116.42 114.31 2guc h ASP 109 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 2guc h ASP 109 Cb 0.00 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.42 2guc h ASP 109 CO 0.00 0.49 -0.53 -0.31 -1.72 0.00 0.00 179.24 177.18 2guc s TYR 110 N -3.67 1.87 -0.73 4.55 2.02 -1.26 -1.68 117.35 118.46 2guc s TYR 110 Ca -0.01 -1.10 -0.24 0.00 -0.37 0.00 0.00 57.07 55.35 2guc s TYR 110 Cb 0.12 -1.37 0.06 0.00 -0.40 0.00 0.00 41.96 40.36 2guc s TYR 110 CO 0.73 -0.03 1.13 -1.17 -1.57 0.00 0.00 175.55 174.63 2guc s LEU 111 N -3.70 3.92 0.18 -1.29 2.96 0.28 -4.45 118.68 116.57 2guc s LEU 111 Ca 0.19 -0.90 -0.10 0.00 -0.22 0.00 0.00 54.13 53.10 2guc s LEU 111 Cb 0.03 -2.48 0.09 0.00 0.50 0.00 0.00 46.19 44.33 2guc s LEU 111 CO 0.10 -1.57 1.71 0.44 -1.32 0.00 0.00 176.35 175.72 2guc h ASP 112 N 9.71 0.95 -5.00 3.68 5.19 -1.60 0.79 116.42 130.13 2guc h ASP 112 Ca -0.22 -0.21 -0.03 0.00 -0.62 0.00 0.00 57.03 55.95 2guc h ASP 112 Cb 1.06 -0.25 -0.14 0.00 0.18 0.00 0.00 39.33 40.17 2guc h ASP 112 CO 1.23 0.91 0.19 -0.94 -3.12 0.00 0.00 179.24 177.51 2guc s SER 113 N -6.28 -0.58 -0.02 6.45 1.04 -0.96 -3.56 113.70 109.79 2guc s SER 113 Ca -0.12 0.21 0.06 0.00 0.48 0.00 0.00 55.95 56.57 2guc s SER 113 Cb 0.14 0.57 -0.01 0.00 0.10 0.00 0.00 66.02 66.81 2guc s SER 113 CO 0.82 -0.85 -0.21 -0.76 0.98 0.00 0.00 173.24 173.23 2guc s LEU 114 N -2.26 2.03 -0.31 2.42 1.43 -1.26 -1.45 118.68 119.27 2guc s LEU 114 Ca -0.03 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.73 2guc s LEU 114 Cb -0.01 -1.07 0.09 0.00 0.03 0.00 0.00 46.19 45.23 2guc s LEU 114 CO -0.06 0.25 0.00 -0.62 0.23 0.00 0.00 176.35 176.15 2guc s ASP 115 N -0.44 4.68 -0.24 2.29 -1.08 0.51 -4.90 116.67 117.49 2guc s ASP 115 Ca 0.07 -1.90 -0.13 0.00 -0.52 0.00 0.00 52.55 50.06 2guc s ASP 115 Cb -0.08 -1.61 -0.04 0.00 -1.46 0.00 0.00 42.92 39.72 2guc s ASP 115 CO -0.00 -0.32 0.29 -0.63 0.52 0.00 0.00 175.17 175.03 2guc s ILE 116 N 0.97 5.26 -0.21 4.11 -1.09 -1.26 -1.13 121.20 127.86 2guc s ILE 116 Ca 0.04 0.44 -0.09 0.00 -2.23 0.00 0.00 60.65 58.81 2guc s ILE 116 Cb -0.19 -3.62 -0.05 0.00 -1.58 0.00 0.00 42.46 37.02 2guc s ILE 116 CO -0.07 0.26 0.11 -0.31 -1.23 0.00 0.00 174.94 173.71 2guc s TYR 117 N 1.46 3.32 0.18 3.97 1.51 -0.15 -5.00 117.35 122.64 2guc s TYR 117 Ca 0.13 0.18 -0.21 0.00 -1.01 0.00 0.00 57.07 56.16 2guc s TYR 117 Cb -0.15 -2.17 0.05 0.00 -0.11 0.00 0.00 41.96 39.59 2guc s TYR 117 CO 0.08 0.15 0.59 1.52 -1.11 0.00 0.00 175.55 176.78 2guc s TYR 118 N 0.62 -0.40 -0.14 2.71 1.13 -1.26 0.13 117.35 120.14 2guc s TYR 118 Ca 0.06 0.12 -0.16 0.00 -1.41 0.00 0.00 57.07 55.68 2guc s TYR 118 Cb -0.12 0.53 -0.04 0.00 -1.10 0.00 0.00 41.96 41.22 2guc s TYR 118 CO 0.01 -0.90 0.40 -1.21 -2.51 0.00 0.00 175.55 171.34 2guc s GLU 119 N -3.80 4.31 -0.32 -3.49 2.02 -0.43 -4.93 118.70 112.05 2guc s GLU 119 Ca 0.04 0.31 -0.12 0.00 0.02 0.00 0.00 54.97 55.22 2guc s GLU 119 Cb -0.01 -3.43 -0.02 0.00 0.10 0.00 0.00 34.13 30.76 2guc s GLU 119 CO -0.08 0.19 0.21 -1.14 0.02 0.00 0.00 175.26 174.45 2guc s GLN 120 N 0.57 3.54 0.00 1.61 2.00 -1.26 -0.94 119.66 125.19 2guc s GLN 120 Ca 0.22 -0.60 0.27 0.00 -2.00 0.00 0.00 55.36 53.25 2guc s GLN 120 Cb -0.14 -3.73 0.85 0.00 0.80 0.00 0.00 33.01 30.79 2guc s GLN 120 CO 0.08 -0.39 1.63 0.66 -0.50 0.00 0.00 175.29 176.77